NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | position | program | type |
17103 | 2b95 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H MET 11 H MET 11 18.707 -9.134 15.092 2 HA MET 11 HA MET 11 18.536 -8.420 12.325 3 1HB MET 11 1HB MET 11 20.619 -8.737 14.324 4 2HB MET 11 2HB MET 11 21.101 -9.416 12.776 5 1HG MET 11 1HG MET 11 19.853 -6.832 12.455 6 2HG MET 11 2HG MET 11 21.230 -6.760 13.552 7 1HE MET 11 1HE MET 11 19.802 -7.900 10.346 8 2HE MET 11 2HE MET 11 21.041 -7.585 9.131 9 3HE MET 11 3HE MET 11 21.033 -9.117 10.006 10 H ALA 12 H ALA 12 19.475 -11.379 14.066 11 HA ALA 12 HA ALA 12 20.078 -13.003 11.917 12 1HB ALA 12 1HB ALA 12 18.809 -13.692 14.559 13 2HB ALA 12 2HB ALA 12 19.366 -14.899 13.400 14 3HB ALA 12 3HB ALA 12 20.516 -13.775 14.123 15 H GLU 13 H GLU 13 16.913 -12.253 13.302 16 HA GLU 13 HA GLU 13 15.336 -14.079 11.952 17 1HB GLU 13 1HB GLU 13 14.925 -11.491 13.258 18 2HB GLU 13 2HB GLU 13 13.767 -11.816 11.976 19 1HG GLU 13 1HG GLU 13 14.024 -14.168 13.534 20 2HG GLU 13 2HG GLU 13 13.802 -12.805 14.630 21 H VAL 14 H VAL 14 16.232 -10.797 10.899 22 HA VAL 14 HA VAL 14 14.947 -10.931 8.394 23 HB VAL 14 HB VAL 14 17.377 -9.266 9.052 24 1HG1 VAL 14 1HG1 VAL 14 15.693 -9.502 6.750 25 2HG1 VAL 14 2HG1 VAL 14 15.525 -7.889 7.444 26 3HG1 VAL 14 3HG1 VAL 14 17.118 -8.492 6.987 27 1HG2 VAL 14 1HG2 VAL 14 14.567 -9.060 9.953 28 2HG2 VAL 14 2HG2 VAL 14 16.053 -8.532 10.743 29 3HG2 VAL 14 3HG2 VAL 14 15.352 -7.565 9.445 30 H GLU 15 H GLU 15 18.175 -11.835 9.461 31 HA GLU 15 HA GLU 15 19.302 -12.231 6.902 32 1HB GLU 15 1HB GLU 15 19.987 -13.308 9.630 33 2HB GLU 15 2HB GLU 15 20.907 -13.748 8.198 34 1HG GLU 15 1HG GLU 15 21.505 -11.443 7.822 35 2HG GLU 15 2HG GLU 15 20.491 -10.930 9.170 36 H GLU 16 H GLU 16 17.478 -14.323 9.067 37 HA GLU 16 HA GLU 16 17.902 -16.736 7.656 38 1HB GLU 16 1HB GLU 16 16.712 -16.059 10.029 39 2HB GLU 16 2HB GLU 16 15.322 -16.479 9.038 40 1HG GLU 16 1HG GLU 16 17.590 -18.358 8.949 41 2HG GLU 16 2HG GLU 16 16.720 -18.254 10.479 42 H THR 17 H THR 17 15.537 -14.158 7.353 43 HA THR 17 HA THR 17 13.937 -15.584 5.424 44 HB THR 17 HB THR 17 13.874 -12.676 6.254 45 HG1 THR 17 HG1 THR 17 13.278 -14.209 7.892 46 1HG2 THR 17 1HG2 THR 17 12.205 -14.283 4.359 47 2HG2 THR 17 2HG2 THR 17 12.825 -12.640 4.189 48 3HG2 THR 17 3HG2 THR 17 11.474 -12.965 5.275 49 H LEU 18 H LEU 18 16.528 -13.234 5.384 50 HA LEU 18 HA LEU 18 16.263 -12.449 2.673 51 1HB LEU 18 1HB LEU 18 18.067 -11.971 4.867 52 2HB LEU 18 2HB LEU 18 18.964 -12.230 3.372 53 HG LEU 18 HG LEU 18 17.201 -10.453 2.467 54 1HD1 LEU 18 1HD1 LEU 18 16.841 -8.720 4.192 55 2HD1 LEU 18 2HD1 LEU 18 17.442 -9.846 5.409 56 3HD1 LEU 18 3HD1 LEU 18 15.965 -10.216 4.519 57 1HD2 LEU 18 1HD2 LEU 18 19.666 -10.296 2.430 58 2HD2 LEU 18 2HD2 LEU 18 19.629 -9.692 4.087 59 3HD2 LEU 18 3HD2 LEU 18 18.886 -8.755 2.789 60 H LYS 19 H LYS 19 18.011 -15.037 4.293 61 HA LYS 19 HA LYS 19 19.619 -15.873 2.159 62 1HB LYS 19 1HB LYS 19 18.434 -17.400 4.477 63 2HB LYS 19 2HB LYS 19 19.573 -18.112 3.342 64 1HG LYS 19 1HG LYS 19 20.506 -15.585 4.437 65 2HG LYS 19 2HG LYS 19 20.209 -16.809 5.674 66 1HD LYS 19 1HD LYS 19 21.751 -17.485 3.195 67 2HD LYS 19 2HD LYS 19 22.542 -16.687 4.556 68 1HE LYS 19 1HE LYS 19 21.308 -18.637 5.889 69 2HE LYS 19 2HE LYS 19 21.458 -19.438 4.326 70 1HZ LYS 19 1HZ LYS 19 23.793 -19.222 4.387 71 2HZ LYS 19 2HZ LYS 19 23.342 -19.800 5.911 72 3HZ LYS 19 3HZ LYS 19 23.751 -18.171 5.712 73 H ARG 20 H ARG 20 16.409 -17.038 3.173 74 HA ARG 20 HA ARG 20 16.105 -18.869 1.043 75 1HB ARG 20 1HB ARG 20 14.803 -18.735 3.257 76 2HB ARG 20 2HB ARG 20 13.817 -17.519 2.456 77 1HG ARG 20 1HG ARG 20 12.552 -19.283 1.896 78 2HG ARG 20 2HG ARG 20 13.747 -19.486 0.614 79 1HD ARG 20 1HD ARG 20 14.836 -20.749 2.857 80 2HD ARG 20 2HD ARG 20 13.133 -21.207 2.842 81 HE ARG 20 HE ARG 20 15.163 -22.028 0.987 82 1HH1 ARG 20 1HH1 ARG 20 11.750 -21.502 1.431 83 2HH1 ARG 20 2HH1 ARG 20 11.284 -22.614 0.186 84 1HH2 ARG 20 1HH2 ARG 20 14.562 -23.494 -0.655 85 2HH2 ARG 20 2HH2 ARG 20 12.885 -23.746 -0.999 86 H LEU 21 H LEU 21 15.303 -15.468 1.415 87 HA LEU 21 HA LEU 21 13.706 -15.221 -0.905 88 1HB LEU 21 1HB LEU 21 14.929 -13.455 1.063 89 2HB LEU 21 2HB LEU 21 14.875 -12.752 -0.552 90 HG LEU 21 HG LEU 21 12.479 -12.954 -0.618 91 1HD1 LEU 21 1HD1 LEU 21 12.675 -14.243 2.100 92 2HD1 LEU 21 2HD1 LEU 21 12.294 -15.079 0.595 93 3HD1 LEU 21 3HD1 LEU 21 11.192 -13.856 1.226 94 1HD2 LEU 21 1HD2 LEU 21 13.759 -11.630 1.714 95 2HD2 LEU 21 2HD2 LEU 21 11.997 -11.687 1.653 96 3HD2 LEU 21 3HD2 LEU 21 12.901 -10.928 0.342 97 H GLN 22 H GLN 22 17.118 -14.359 -0.327 98 HA GLN 22 HA GLN 22 17.663 -13.695 -3.020 99 1HB GLN 22 1HB GLN 22 19.036 -13.592 -0.579 100 2HB GLN 22 2HB GLN 22 20.004 -14.638 -1.609 101 1HG GLN 22 1HG GLN 22 20.688 -12.946 -2.887 102 2HG GLN 22 2HG GLN 22 19.083 -12.219 -2.948 103 1HE2 GLN 22 1HE2 GLN 22 18.445 -11.437 -0.581 104 2HE2 GLN 22 2HE2 GLN 22 19.618 -10.389 0.133 105 H SER 23 H SER 23 17.336 -16.688 -1.413 106 HA SER 23 HA SER 23 18.980 -18.188 -3.259 107 1HB SER 23 1HB SER 23 18.729 -18.888 -0.892 108 2HB SER 23 2HB SER 23 17.015 -19.187 -1.182 109 HG SER 23 HG SER 23 18.871 -20.413 -2.872 110 H GLN 24 H GLN 24 15.695 -17.169 -3.010 111 HA GLN 24 HA GLN 24 14.821 -19.078 -5.046 112 1HB GLN 24 1HB GLN 24 12.569 -18.318 -4.563 113 2HB GLN 24 2HB GLN 24 13.389 -18.734 -3.064 114 1HG GLN 24 1HG GLN 24 13.641 -16.488 -2.447 115 2HG GLN 24 2HG GLN 24 13.268 -15.914 -4.072 116 1HE2 GLN 24 1HE2 GLN 24 11.958 -14.786 -2.033 117 2HE2 GLN 24 2HE2 GLN 24 10.313 -15.309 -1.987 118 H LYS 25 H LYS 25 13.806 -18.391 -6.983 119 HA LYS 25 HA LYS 25 15.037 -16.062 -8.138 120 1HB LYS 25 1HB LYS 25 14.116 -18.478 -9.124 121 2HB LYS 25 2HB LYS 25 12.932 -17.323 -9.723 122 1HG LYS 25 1HG LYS 25 15.460 -16.171 -10.158 123 2HG LYS 25 2HG LYS 25 15.573 -17.857 -10.668 124 1HD LYS 25 1HD LYS 25 13.983 -17.607 -12.312 125 2HD LYS 25 2HD LYS 25 13.200 -16.251 -11.497 126 1HE LYS 25 1HE LYS 25 15.430 -15.012 -11.976 127 2HE LYS 25 2HE LYS 25 15.679 -16.281 -13.175 128 1HZ LYS 25 1HZ LYS 25 14.414 -15.110 -14.543 129 2HZ LYS 25 2HZ LYS 25 14.040 -13.984 -13.339 130 3HZ LYS 25 3HZ LYS 25 13.089 -15.370 -13.524 131 H GLY 26 H GLY 26 14.149 -14.113 -8.544 132 1HA GLY 26 1HA GLY 26 12.013 -12.954 -9.176 133 2HA GLY 26 2HA GLY 26 11.317 -13.758 -7.777 134 H VAL 27 H VAL 27 13.529 -13.403 -6.018 135 HA VAL 27 HA VAL 27 12.930 -10.830 -5.006 136 HB VAL 27 HB VAL 27 15.206 -12.679 -4.278 137 1HG1 VAL 27 1HG1 VAL 27 15.180 -11.411 -2.129 138 2HG1 VAL 27 2HG1 VAL 27 15.722 -10.468 -3.518 139 3HG1 VAL 27 3HG1 VAL 27 14.090 -10.251 -2.886 140 1HG2 VAL 27 1HG2 VAL 27 13.753 -13.326 -2.396 141 2HG2 VAL 27 2HG2 VAL 27 12.463 -12.330 -3.069 142 3HG2 VAL 27 3HG2 VAL 27 13.048 -13.736 -3.959 143 H GLN 28 H GLN 28 13.807 -8.906 -5.410 144 HA GLN 28 HA GLN 28 16.124 -8.782 -7.192 145 1HB GLN 28 1HB GLN 28 13.750 -7.149 -6.765 146 2HB GLN 28 2HB GLN 28 15.222 -6.187 -6.805 147 1HG GLN 28 1HG GLN 28 15.745 -6.876 -8.983 148 2HG GLN 28 2HG GLN 28 14.593 -8.209 -8.927 149 1HE2 GLN 28 1HE2 GLN 28 12.686 -7.894 -9.831 150 2HE2 GLN 28 2HE2 GLN 28 12.001 -6.363 -10.244 151 H GLY 29 H GLY 29 15.099 -7.976 -3.961 152 1HA GLY 29 1HA GLY 29 17.584 -7.888 -2.812 153 2HA GLY 29 2HA GLY 29 17.311 -6.247 -3.377 154 H ILE 30 H ILE 30 17.571 -7.327 -0.640 155 HA ILE 30 HA ILE 30 14.970 -6.415 0.407 156 HB ILE 30 HB ILE 30 16.819 -8.332 1.821 157 1HG1 ILE 30 1HG1 ILE 30 14.712 -9.872 1.210 158 2HG1 ILE 30 2HG1 ILE 30 14.672 -8.798 -0.183 159 1HG2 ILE 30 1HG2 ILE 30 13.945 -7.567 2.320 160 2HG2 ILE 30 2HG2 ILE 30 14.881 -8.736 3.250 161 3HG2 ILE 30 3HG2 ILE 30 15.337 -7.033 3.263 162 1HD1 ILE 30 1HD1 ILE 30 16.451 -9.762 -1.112 163 2HD1 ILE 30 2HD1 ILE 30 17.329 -9.835 0.416 164 3HD1 ILE 30 3HD1 ILE 30 16.144 -11.080 0.019 165 H ILE 31 H ILE 31 15.058 -4.600 1.543 166 HA ILE 31 HA ILE 31 17.651 -3.776 2.672 167 HB ILE 31 HB ILE 31 15.328 -2.041 1.828 168 1HG1 ILE 31 1HG1 ILE 31 18.069 -1.992 0.611 169 2HG1 ILE 31 2HG1 ILE 31 16.898 -3.195 0.082 170 1HG2 ILE 31 1HG2 ILE 31 16.268 -0.819 3.531 171 2HG2 ILE 31 2HG2 ILE 31 17.882 -1.471 3.254 172 3HG2 ILE 31 3HG2 ILE 31 17.219 -0.262 2.155 173 1HD1 ILE 31 1HD1 ILE 31 17.135 -0.900 -1.148 174 2HD1 ILE 31 2HD1 ILE 31 15.553 -1.643 -0.914 175 3HD1 ILE 31 3HD1 ILE 31 16.081 -0.339 0.149 176 H VAL 32 H VAL 32 17.765 -3.016 4.764 177 HA VAL 32 HA VAL 32 15.304 -3.128 6.370 178 HB VAL 32 HB VAL 32 17.871 -4.130 7.536 179 1HG1 VAL 32 1HG1 VAL 32 15.901 -3.641 8.957 180 2HG1 VAL 32 2HG1 VAL 32 14.994 -4.863 8.064 181 3HG1 VAL 32 3HG1 VAL 32 16.402 -5.331 9.019 182 1HG2 VAL 32 1HG2 VAL 32 15.951 -5.755 5.872 183 2HG2 VAL 32 2HG2 VAL 32 17.653 -5.447 5.529 184 3HG2 VAL 32 3HG2 VAL 32 17.199 -6.435 6.917 185 H VAL 33 H VAL 33 15.002 -1.258 7.366 186 HA VAL 33 HA VAL 33 17.361 0.359 8.081 187 HB VAL 33 HB VAL 33 14.583 1.446 7.658 188 1HG1 VAL 33 1HG1 VAL 33 15.814 3.008 8.858 189 2HG1 VAL 33 2HG1 VAL 33 17.313 2.628 8.007 190 3HG1 VAL 33 3HG1 VAL 33 16.036 3.527 7.187 191 1HG2 VAL 33 1HG2 VAL 33 14.836 0.992 5.484 192 2HG2 VAL 33 2HG2 VAL 33 16.066 2.256 5.486 193 3HG2 VAL 33 3HG2 VAL 33 16.536 0.568 5.682 194 H ASN 34 H ASN 34 17.528 1.196 10.119 195 HA ASN 34 HA ASN 34 15.832 -0.014 12.138 196 1HB ASN 34 1HB ASN 34 17.458 1.042 13.732 197 2HB ASN 34 2HB ASN 34 18.195 -0.063 12.575 198 1HD2 ASN 34 1HD2 ASN 34 20.182 1.013 13.037 199 2HD2 ASN 34 2HD2 ASN 34 20.554 2.518 12.274 200 H THR 35 H THR 35 15.677 1.694 14.161 201 HA THR 35 HA THR 35 13.610 3.473 13.385 202 HB THR 35 HB THR 35 14.541 4.246 15.942 203 HG1 THR 35 HG1 THR 35 15.772 2.403 16.134 204 1HG2 THR 35 1HG2 THR 35 12.233 4.217 15.524 205 2HG2 THR 35 2HG2 THR 35 12.483 2.874 16.640 206 3HG2 THR 35 3HG2 THR 35 12.274 2.563 14.917 207 H GLU 36 H GLU 36 17.028 3.805 13.661 208 HA GLU 36 HA GLU 36 17.046 6.661 13.967 209 1HB GLU 36 1HB GLU 36 19.083 4.531 13.569 210 2HB GLU 36 2HB GLU 36 19.525 6.167 13.099 211 1HG GLU 36 1HG GLU 36 18.478 6.627 15.541 212 2HG GLU 36 2HG GLU 36 19.128 5.005 15.766 213 H GLY 37 H GLY 37 16.842 4.438 11.330 214 1HA GLY 37 1HA GLY 37 15.992 5.244 9.216 215 2HA GLY 37 2HA GLY 37 16.908 6.723 9.467 216 H ILE 38 H ILE 38 18.959 4.436 10.469 217 HA ILE 38 HA ILE 38 20.412 4.468 7.958 218 HB ILE 38 HB ILE 38 21.235 3.275 10.607 219 1HG1 ILE 38 1HG1 ILE 38 22.012 5.947 9.423 220 2HG1 ILE 38 2HG1 ILE 38 20.779 5.742 10.663 221 1HG2 ILE 38 1HG2 ILE 38 22.423 2.382 8.642 222 2HG2 ILE 38 2HG2 ILE 38 22.894 4.024 8.204 223 3HG2 ILE 38 3HG2 ILE 38 23.481 3.310 9.706 224 1HD1 ILE 38 1HD1 ILE 38 23.206 4.443 11.461 225 2HD1 ILE 38 2HD1 ILE 38 23.518 6.123 11.025 226 3HD1 ILE 38 3HD1 ILE 38 22.312 5.740 12.253 227 HA PRO 39 HA PRO 39 19.040 0.444 6.735 228 1HB PRO 39 1HB PRO 39 20.873 0.037 4.774 229 2HB PRO 39 2HB PRO 39 19.491 1.123 4.586 230 1HG PRO 39 1HG PRO 39 22.336 1.775 5.250 231 2HG PRO 39 2HG PRO 39 21.230 2.599 4.135 232 1HD PRO 39 1HD PRO 39 21.742 3.524 6.628 233 2HD PRO 39 2HD PRO 39 20.170 3.742 5.832 234 H ILE 40 H ILE 40 19.645 -0.627 8.700 235 HA ILE 40 HA ILE 40 22.160 -1.370 9.525 236 HB ILE 40 HB ILE 40 20.987 -3.479 10.434 237 1HG1 ILE 40 1HG1 ILE 40 18.446 -2.017 9.866 238 2HG1 ILE 40 2HG1 ILE 40 19.120 -3.042 8.604 239 1HG2 ILE 40 1HG2 ILE 40 19.443 -1.285 11.533 240 2HG2 ILE 40 2HG2 ILE 40 20.706 -2.264 12.279 241 3HG2 ILE 40 3HG2 ILE 40 21.139 -0.859 11.306 242 1HD1 ILE 40 1HD1 ILE 40 19.057 -4.371 11.176 243 2HD1 ILE 40 2HD1 ILE 40 17.460 -3.838 10.647 244 3HD1 ILE 40 3HD1 ILE 40 18.426 -4.890 9.613 245 H LYS 41 H LYS 41 20.177 -2.798 7.005 246 HA LYS 41 HA LYS 41 22.487 -4.146 5.917 247 1HB LYS 41 1HB LYS 41 20.571 -5.574 7.538 248 2HB LYS 41 2HB LYS 41 20.554 -6.187 5.889 249 1HG LYS 41 1HG LYS 41 23.260 -5.877 6.636 250 2HG LYS 41 2HG LYS 41 22.431 -6.689 7.967 251 1HD LYS 41 1HD LYS 41 23.061 -8.466 6.624 252 2HD LYS 41 2HD LYS 41 21.407 -8.162 6.086 253 1HE LYS 41 1HE LYS 41 23.493 -6.640 4.676 254 2HE LYS 41 2HE LYS 41 23.543 -8.385 4.433 255 1HZ LYS 41 1HZ LYS 41 21.601 -8.377 3.309 256 2HZ LYS 41 2HZ LYS 41 22.044 -6.781 2.970 257 3HZ LYS 41 3HZ LYS 41 20.936 -7.106 4.206 258 H SER 42 H SER 42 22.249 -4.701 3.744 259 HA SER 42 HA SER 42 19.748 -4.602 2.385 260 1HB SER 42 1HB SER 42 19.857 -2.236 2.610 261 2HB SER 42 2HB SER 42 21.575 -2.204 2.213 262 HG SER 42 HG SER 42 21.098 -2.637 0.107 263 H THR 43 H THR 43 19.909 -5.216 0.204 264 HA THR 43 HA THR 43 22.589 -6.147 -0.601 265 HB THR 43 HB THR 43 21.612 -8.041 -1.687 266 HG1 THR 43 HG1 THR 43 19.249 -6.596 -1.324 267 1HG2 THR 43 1HG2 THR 43 21.354 -9.218 0.203 268 2HG2 THR 43 2HG2 THR 43 19.933 -8.290 0.684 269 3HG2 THR 43 3HG2 THR 43 21.548 -7.681 1.046 270 H MET 44 H MET 44 19.937 -4.185 -1.387 271 HA MET 44 HA MET 44 20.025 -4.256 -4.204 272 1HB MET 44 1HB MET 44 19.184 -2.035 -2.335 273 2HB MET 44 2HB MET 44 18.897 -2.041 -4.070 274 1HG MET 44 1HG MET 44 17.948 -4.433 -2.673 275 2HG MET 44 2HG MET 44 17.152 -2.934 -2.196 276 1HE MET 44 1HE MET 44 17.387 -4.313 -6.589 277 2HE MET 44 2HE MET 44 18.600 -3.256 -5.867 278 3HE MET 44 3HE MET 44 18.417 -4.913 -5.289 279 H ASP 45 H ASP 45 20.449 -1.839 -5.225 280 HA ASP 45 HA ASP 45 23.279 -1.650 -5.331 281 1HB ASP 45 1HB ASP 45 21.169 -0.825 -6.934 282 2HB ASP 45 2HB ASP 45 21.872 0.686 -6.363 283 H ASN 46 H ASN 46 24.472 0.424 -5.017 284 HA ASN 46 HA ASN 46 24.313 1.264 -2.350 285 1HB ASN 46 1HB ASN 46 26.077 1.631 -4.521 286 2HB ASN 46 2HB ASN 46 25.637 3.244 -3.966 287 1HD2 ASN 46 1HD2 ASN 46 25.304 2.794 -1.274 288 2HD2 ASN 46 2HD2 ASN 46 26.826 2.373 -0.573 289 HA PRO 47 HA PRO 47 22.413 5.395 -3.990 290 1HB PRO 47 1HB PRO 47 21.566 5.434 -6.569 291 2HB PRO 47 2HB PRO 47 23.208 5.880 -6.090 292 1HG PRO 47 1HG PRO 47 22.198 3.295 -7.212 293 2HG PRO 47 2HG PRO 47 23.675 4.188 -7.616 294 1HD PRO 47 1HD PRO 47 23.676 2.037 -5.971 295 2HD PRO 47 2HD PRO 47 24.811 3.388 -5.776 296 H THR 48 H THR 48 21.175 2.322 -5.110 297 HA THR 48 HA THR 48 18.422 3.150 -5.133 298 HB THR 48 HB THR 48 19.555 0.346 -5.144 299 HG1 THR 48 HG1 THR 48 20.187 1.772 -6.934 300 1HG2 THR 48 1HG2 THR 48 17.423 -0.289 -4.978 301 2HG2 THR 48 2HG2 THR 48 17.135 0.468 -6.545 302 3HG2 THR 48 3HG2 THR 48 16.865 1.382 -5.061 303 H THR 49 H THR 49 20.613 1.673 -2.849 304 HA THR 49 HA THR 49 18.560 0.868 -1.007 305 HB THR 49 HB THR 49 21.552 1.112 -0.645 306 HG1 THR 49 HG1 THR 49 21.537 -0.768 -1.598 307 1HG2 THR 49 1HG2 THR 49 19.481 -0.140 1.163 308 2HG2 THR 49 2HG2 THR 49 20.415 1.316 1.504 309 3HG2 THR 49 3HG2 THR 49 21.228 -0.243 1.380 310 H THR 50 H THR 50 21.021 3.441 -1.039 311 HA THR 50 HA THR 50 20.377 4.663 1.366 312 HB THR 50 HB THR 50 21.132 6.356 -0.987 313 HG1 THR 50 HG1 THR 50 23.359 5.570 -0.472 314 1HG2 THR 50 1HG2 THR 50 20.978 7.490 1.115 315 2HG2 THR 50 2HG2 THR 50 22.691 7.305 0.737 316 3HG2 THR 50 3HG2 THR 50 21.929 6.242 1.920 317 H GLN 51 H GLN 51 18.923 5.077 -1.824 318 HA GLN 51 HA GLN 51 17.224 7.235 -1.049 319 1HB GLN 51 1HB GLN 51 17.788 7.012 -3.367 320 2HB GLN 51 2HB GLN 51 17.183 5.361 -3.414 321 1HG GLN 51 1HG GLN 51 15.099 7.110 -2.543 322 2HG GLN 51 2HG GLN 51 15.811 7.734 -4.029 323 1HE2 GLN 51 1HE2 GLN 51 13.559 5.660 -2.758 324 2HE2 GLN 51 2HE2 GLN 51 13.277 4.673 -4.148 325 H TYR 52 H TYR 52 16.697 3.758 -1.570 326 HA TYR 52 HA TYR 52 13.964 3.718 -0.970 327 1HB TYR 52 1HB TYR 52 16.143 1.678 -0.987 328 2HB TYR 52 2HB TYR 52 14.607 1.255 -0.239 329 HD1 TYR 52 HD1 TYR 52 15.261 3.345 -3.253 330 HD2 TYR 52 HD2 TYR 52 13.635 -0.271 -1.709 331 HE1 TYR 52 HE1 TYR 52 14.332 2.824 -5.469 332 HE2 TYR 52 HE2 TYR 52 12.703 -0.803 -3.922 333 HH TYR 52 HH TYR 52 13.635 0.732 -6.728 334 H ALA 53 H ALA 53 16.793 3.638 1.098 335 HA ALA 53 HA ALA 53 15.685 2.774 3.487 336 1HB ALA 53 1HB ALA 53 18.093 3.184 3.098 337 2HB ALA 53 2HB ALA 53 17.782 4.918 3.185 338 3HB ALA 53 3HB ALA 53 17.502 3.901 4.598 339 H SER 54 H SER 54 16.032 6.150 2.381 340 HA SER 54 HA SER 54 14.387 7.140 4.518 341 1HB SER 54 1HB SER 54 15.927 8.310 2.270 342 2HB SER 54 2HB SER 54 14.543 9.245 2.836 343 HG SER 54 HG SER 54 16.319 8.200 4.729 344 H LEU 55 H LEU 55 14.011 6.758 1.009 345 HA LEU 55 HA LEU 55 11.512 7.868 0.667 346 1HB LEU 55 1HB LEU 55 13.124 6.857 -1.053 347 2HB LEU 55 2HB LEU 55 12.321 5.327 -0.708 348 HG LEU 55 HG LEU 55 11.490 6.461 -2.750 349 1HD1 LEU 55 1HD1 LEU 55 9.406 5.653 -2.438 350 2HD1 LEU 55 2HD1 LEU 55 9.170 6.535 -0.929 351 3HD1 LEU 55 3HD1 LEU 55 10.110 5.042 -0.940 352 1HD2 LEU 55 1HD2 LEU 55 11.751 8.775 -1.877 353 2HD2 LEU 55 2HD2 LEU 55 10.354 8.496 -0.838 354 3HD2 LEU 55 3HD2 LEU 55 10.170 8.458 -2.592 355 H MET 56 H MET 56 12.193 4.415 1.269 356 HA MET 56 HA MET 56 9.521 3.635 1.584 357 1HB MET 56 1HB MET 56 12.026 2.416 2.759 358 2HB MET 56 2HB MET 56 10.452 1.634 2.720 359 1HG MET 56 1HG MET 56 12.036 2.479 0.305 360 2HG MET 56 2HG MET 56 11.940 0.841 0.947 361 1HE MET 56 1HE MET 56 10.782 1.682 -2.359 362 2HE MET 56 2HE MET 56 9.429 2.778 -2.079 363 3HE MET 56 3HE MET 56 11.023 3.159 -1.426 364 H HIS 57 H HIS 57 11.966 4.457 4.039 365 HA HIS 57 HA HIS 57 10.446 4.069 6.316 366 1HB HIS 57 1HB HIS 57 12.803 4.532 6.487 367 2HB HIS 57 2HB HIS 57 12.593 6.122 5.760 368 HD1 HIS 57 HD1 HIS 57 12.683 4.413 8.974 369 HD2 HIS 57 HD2 HIS 57 11.125 7.967 7.489 370 HE1 HIS 57 HE1 HIS 57 12.208 5.835 10.993 371 H SER 58 H SER 58 10.499 6.810 4.114 372 HA SER 58 HA SER 58 8.812 8.451 5.756 373 1HB SER 58 1HB SER 58 9.934 9.889 4.406 374 2HB SER 58 2HB SER 58 10.150 8.683 3.138 375 HG SER 58 HG SER 58 8.641 10.618 2.842 376 H PHE 59 H PHE 59 8.340 6.030 3.330 377 HA PHE 59 HA PHE 59 5.783 6.704 2.416 378 1HB PHE 59 1HB PHE 59 7.339 4.922 1.493 379 2HB PHE 59 2HB PHE 59 6.786 3.884 2.803 380 HD1 PHE 59 HD1 PHE 59 4.881 6.271 0.682 381 HD2 PHE 59 HD2 PHE 59 5.541 2.216 1.795 382 HE1 PHE 59 HE1 PHE 59 2.951 5.586 -0.682 383 HE2 PHE 59 HE2 PHE 59 3.612 1.525 0.432 384 HZ PHE 59 HZ PHE 59 2.315 3.210 -0.809 385 H ILE 60 H ILE 60 6.674 4.366 4.959 386 HA ILE 60 HA ILE 60 4.008 3.956 5.827 387 HB ILE 60 HB ILE 60 6.623 3.433 7.241 388 1HG1 ILE 60 1HG1 ILE 60 4.736 1.490 5.902 389 2HG1 ILE 60 2HG1 ILE 60 6.136 2.191 5.097 390 1HG2 ILE 60 1HG2 ILE 60 4.834 1.733 8.370 391 2HG2 ILE 60 2HG2 ILE 60 5.328 3.274 9.068 392 3HG2 ILE 60 3HG2 ILE 60 3.840 3.169 8.128 393 1HD1 ILE 60 1HD1 ILE 60 6.426 -0.116 6.067 394 2HD1 ILE 60 2HD1 ILE 60 7.634 1.082 6.532 395 3HD1 ILE 60 3HD1 ILE 60 6.350 0.642 7.657 396 H LEU 61 H LEU 61 6.403 6.347 6.553 397 HA LEU 61 HA LEU 61 5.267 7.217 9.029 398 1HB LEU 61 1HB LEU 61 7.584 7.762 7.511 399 2HB LEU 61 2HB LEU 61 6.741 9.294 7.733 400 HG LEU 61 HG LEU 61 6.848 9.054 10.133 401 1HD1 LEU 61 1HD1 LEU 61 6.624 6.805 10.617 402 2HD1 LEU 61 2HD1 LEU 61 8.323 7.102 10.980 403 3HD1 LEU 61 3HD1 LEU 61 7.869 6.325 9.464 404 1HD2 LEU 61 1HD2 LEU 61 9.443 8.794 10.312 405 2HD2 LEU 61 2HD2 LEU 61 8.742 10.159 9.442 406 3HD2 LEU 61 3HD2 LEU 61 9.361 8.768 8.551 407 H LYS 62 H LYS 62 4.978 8.194 5.656 408 HA LYS 62 HA LYS 62 3.334 10.475 6.232 409 1HB LYS 62 1HB LYS 62 4.816 9.687 4.070 410 2HB LYS 62 2HB LYS 62 3.181 9.339 3.524 411 1HG LYS 62 1HG LYS 62 3.821 11.552 2.829 412 2HG LYS 62 2HG LYS 62 2.539 11.658 4.038 413 1HD LYS 62 1HD LYS 62 3.853 13.083 5.142 414 2HD LYS 62 2HD LYS 62 4.886 11.702 5.521 415 1HE LYS 62 1HE LYS 62 6.508 12.783 4.440 416 2HE LYS 62 2HE LYS 62 5.639 12.400 2.955 417 1HZ LYS 62 1HZ LYS 62 5.988 14.701 2.911 418 2HZ LYS 62 2HZ LYS 62 5.544 14.903 4.531 419 3HZ LYS 62 3HZ LYS 62 4.369 14.527 3.373 420 H ALA 63 H ALA 63 2.716 7.297 4.742 421 HA ALA 63 HA ALA 63 -0.042 7.554 4.451 422 1HB ALA 63 1HB ALA 63 0.026 5.433 3.720 423 2HB ALA 63 2HB ALA 63 1.774 5.633 3.838 424 3HB ALA 63 3HB ALA 63 0.885 4.859 5.149 425 H ARG 64 H ARG 64 1.885 6.681 7.246 426 HA ARG 64 HA ARG 64 -0.101 5.586 8.872 427 1HB ARG 64 1HB ARG 64 2.156 5.387 9.578 428 2HB ARG 64 2HB ARG 64 2.406 7.127 9.518 429 1HG ARG 64 1HG ARG 64 1.645 7.420 11.593 430 2HG ARG 64 2HG ARG 64 0.278 6.332 11.343 431 1HD ARG 64 1HD ARG 64 1.652 5.382 13.044 432 2HD ARG 64 2HD ARG 64 1.868 4.416 11.584 433 HE ARG 64 HE ARG 64 4.067 5.049 11.536 434 1HH1 ARG 64 1HH1 ARG 64 2.319 7.164 13.678 435 2HH1 ARG 64 2HH1 ARG 64 3.742 7.954 14.271 436 1HH2 ARG 64 1HH2 ARG 64 5.948 6.081 12.309 437 2HH2 ARG 64 2HH2 ARG 64 5.806 7.338 13.491 438 H SER 65 H SER 65 1.096 8.949 8.855 439 HA SER 65 HA SER 65 -0.734 10.003 10.655 440 1HB SER 65 1HB SER 65 1.357 11.050 9.379 441 2HB SER 65 2HB SER 65 0.087 11.694 8.339 442 HG SER 65 HG SER 65 0.867 12.585 10.709 443 H THR 66 H THR 66 -1.144 9.115 7.331 444 HA THR 66 HA THR 66 -3.586 10.601 6.960 445 HB THR 66 HB THR 66 -2.544 8.340 5.248 446 HG1 THR 66 HG1 THR 66 -1.807 10.348 4.002 447 1HG2 THR 66 1HG2 THR 66 -4.117 8.903 3.727 448 2HG2 THR 66 2HG2 THR 66 -3.988 10.627 4.079 449 3HG2 THR 66 3HG2 THR 66 -4.949 9.582 5.125 450 H VAL 67 H VAL 67 -2.703 7.209 7.505 451 HA VAL 67 HA VAL 67 -5.205 6.038 7.285 452 HB VAL 67 HB VAL 67 -2.996 5.286 9.205 453 1HG1 VAL 67 1HG1 VAL 67 -4.200 2.965 8.652 454 2HG1 VAL 67 2HG1 VAL 67 -4.665 3.982 10.017 455 3HG1 VAL 67 3HG1 VAL 67 -5.591 4.041 8.517 456 1HG2 VAL 67 1HG2 VAL 67 -2.971 5.310 6.432 457 2HG2 VAL 67 2HG2 VAL 67 -1.875 4.416 7.486 458 3HG2 VAL 67 3HG2 VAL 67 -3.321 3.632 6.850 459 H ARG 68 H ARG 68 -3.800 7.841 9.948 460 HA ARG 68 HA ARG 68 -5.563 7.165 11.989 461 1HB ARG 68 1HB ARG 68 -4.255 9.842 11.473 462 2HB ARG 68 2HB ARG 68 -4.965 9.331 12.998 463 1HG ARG 68 1HG ARG 68 -2.831 7.650 11.787 464 2HG ARG 68 2HG ARG 68 -2.383 9.166 12.572 465 1HD ARG 68 1HD ARG 68 -3.487 8.448 14.620 466 2HD ARG 68 2HD ARG 68 -3.991 6.951 13.837 467 HE ARG 68 HE ARG 68 -1.910 6.102 14.230 468 1HH1 ARG 68 1HH1 ARG 68 -1.771 9.572 14.482 469 2HH1 ARG 68 2HH1 ARG 68 -0.130 9.596 15.039 470 1HH2 ARG 68 1HH2 ARG 68 0.251 6.121 14.962 471 2HH2 ARG 68 2HH2 ARG 68 1.019 7.633 15.310 472 H ASP 69 H ASP 69 -6.045 9.129 9.186 473 HA ASP 69 HA ASP 69 -8.396 10.459 10.195 474 1HB ASP 69 1HB ASP 69 -6.641 10.812 8.006 475 2HB ASP 69 2HB ASP 69 -8.238 10.509 7.327 476 H ILE 70 H ILE 70 -7.658 7.558 8.430 477 HA ILE 70 HA ILE 70 -10.176 7.077 7.271 478 HB ILE 70 HB ILE 70 -8.186 5.012 8.216 479 1HG1 ILE 70 1HG1 ILE 70 -8.413 6.350 5.512 480 2HG1 ILE 70 2HG1 ILE 70 -7.185 6.724 6.717 481 1HG2 ILE 70 1HG2 ILE 70 -9.531 4.246 5.853 482 2HG2 ILE 70 2HG2 ILE 70 -9.632 3.514 7.454 483 3HG2 ILE 70 3HG2 ILE 70 -10.752 4.798 7.000 484 1HD1 ILE 70 1HD1 ILE 70 -5.982 5.264 5.505 485 2HD1 ILE 70 2HD1 ILE 70 -6.822 4.078 6.505 486 3HD1 ILE 70 3HD1 ILE 70 -7.409 4.436 4.881 487 H ASP 71 H ASP 71 -8.989 6.684 10.507 488 HA ASP 71 HA ASP 71 -11.586 6.310 11.568 489 1HB ASP 71 1HB ASP 71 -10.020 3.903 10.940 490 2HB ASP 71 2HB ASP 71 -10.612 3.965 12.598 491 HA PRO 72 HA PRO 72 -9.612 7.715 15.222 492 1HB PRO 72 1HB PRO 72 -11.073 6.525 17.176 493 2HB PRO 72 2HB PRO 72 -11.694 7.849 16.184 494 1HG PRO 72 1HG PRO 72 -12.153 4.904 15.913 495 2HG PRO 72 2HG PRO 72 -13.315 6.235 15.766 496 1HD PRO 72 1HD PRO 72 -12.230 5.003 13.612 497 2HD PRO 72 2HD PRO 72 -12.674 6.722 13.606 498 H GLN 73 H GLN 73 -10.374 4.237 15.476 499 HA GLN 73 HA GLN 73 -7.789 3.852 16.830 500 1HB GLN 73 1HB GLN 73 -10.118 1.936 16.840 501 2HB GLN 73 2HB GLN 73 -8.697 1.904 17.874 502 1HG GLN 73 1HG GLN 73 -9.418 3.944 18.970 503 2HG GLN 73 2HG GLN 73 -10.817 4.040 17.901 504 1HE2 GLN 73 1HE2 GLN 73 -12.636 3.116 18.543 505 2HE2 GLN 73 2HE2 GLN 73 -12.792 2.000 19.853 506 H ASN 74 H ASN 74 -6.507 3.658 14.996 507 HA ASN 74 HA ASN 74 -6.848 1.133 13.545 508 1HB ASN 74 1HB ASN 74 -7.315 3.640 12.390 509 2HB ASN 74 2HB ASN 74 -5.713 3.173 11.829 510 1HD2 ASN 74 1HD2 ASN 74 -8.143 3.429 10.303 511 2HD2 ASN 74 2HD2 ASN 74 -8.454 1.881 9.602 512 H ASP 75 H ASP 75 -4.822 0.518 12.357 513 HA ASP 75 HA ASP 75 -2.363 1.691 13.340 514 1HB ASP 75 1HB ASP 75 -3.514 -0.634 14.590 515 2HB ASP 75 2HB ASP 75 -1.990 -1.064 13.818 516 H LEU 76 H LEU 76 -0.542 1.109 12.130 517 HA LEU 76 HA LEU 76 -1.184 -0.128 9.555 518 1HB LEU 76 1HB LEU 76 0.909 1.779 10.500 519 2HB LEU 76 2HB LEU 76 1.203 0.814 9.055 520 HG LEU 76 HG LEU 76 0.391 3.050 8.501 521 1HD1 LEU 76 1HD1 LEU 76 -1.911 1.294 7.837 522 2HD1 LEU 76 2HD1 LEU 76 -0.304 0.806 7.301 523 3HD1 LEU 76 3HD1 LEU 76 -0.964 2.363 6.801 524 1HD2 LEU 76 1HD2 LEU 76 -1.142 2.886 10.714 525 2HD2 LEU 76 2HD2 LEU 76 -2.338 2.514 9.472 526 3HD2 LEU 76 3HD2 LEU 76 -1.431 4.026 9.399 527 H THR 77 H THR 77 -0.291 -1.991 8.879 528 HA THR 77 HA THR 77 2.077 -3.067 10.158 529 HB THR 77 HB THR 77 0.193 -3.827 11.612 530 HG1 THR 77 HG1 THR 77 0.840 -6.096 11.452 531 1HG2 THR 77 1HG2 THR 77 -1.362 -5.494 10.779 532 2HG2 THR 77 2HG2 THR 77 -0.639 -5.403 9.173 533 3HG2 THR 77 3HG2 THR 77 -1.508 -4.016 9.830 534 H PHE 78 H PHE 78 0.937 -2.240 7.457 535 HA PHE 78 HA PHE 78 2.344 -4.060 5.871 536 1HB PHE 78 1HB PHE 78 -0.141 -5.092 6.614 537 2HB PHE 78 2HB PHE 78 -0.382 -4.497 4.975 538 HD1 PHE 78 HD1 PHE 78 1.036 -5.365 3.132 539 HD2 PHE 78 HD2 PHE 78 1.126 -7.038 7.044 540 HE1 PHE 78 HE1 PHE 78 2.107 -7.391 2.237 541 HE2 PHE 78 HE2 PHE 78 2.198 -9.066 6.156 542 HZ PHE 78 HZ PHE 78 2.691 -9.245 3.750 543 H LEU 79 H LEU 79 2.809 -3.094 3.989 544 HA LEU 79 HA LEU 79 0.934 -1.254 2.756 545 1HB LEU 79 1HB LEU 79 2.634 -0.161 4.517 546 2HB LEU 79 2HB LEU 79 3.657 -0.147 3.082 547 HG LEU 79 HG LEU 79 1.968 1.182 1.900 548 1HD1 LEU 79 1HD1 LEU 79 0.499 1.016 4.521 549 2HD1 LEU 79 2HD1 LEU 79 -0.053 0.474 2.936 550 3HD1 LEU 79 3HD1 LEU 79 0.132 2.197 3.263 551 1HD2 LEU 79 1HD2 LEU 79 2.724 3.140 2.744 552 2HD2 LEU 79 2HD2 LEU 79 3.788 2.066 3.653 553 3HD2 LEU 79 3HD2 LEU 79 2.327 2.705 4.407 554 H ARG 80 H ARG 80 0.866 -2.349 0.868 555 HA ARG 80 HA ARG 80 3.420 -2.903 -0.487 556 1HB ARG 80 1HB ARG 80 0.751 -4.112 -1.196 557 2HB ARG 80 2HB ARG 80 2.351 -4.656 -1.682 558 1HG ARG 80 1HG ARG 80 2.836 -5.294 0.628 559 2HG ARG 80 2HG ARG 80 1.227 -4.754 1.109 560 1HD ARG 80 1HD ARG 80 0.931 -6.514 -1.094 561 2HD ARG 80 2HD ARG 80 2.024 -7.276 0.060 562 HE ARG 80 HE ARG 80 -0.298 -6.194 1.321 563 1HH1 ARG 80 1HH1 ARG 80 0.913 -8.914 -0.485 564 2HH1 ARG 80 2HH1 ARG 80 -0.254 -10.024 0.155 565 1HH2 ARG 80 1HH2 ARG 80 -1.838 -7.646 2.170 566 2HH2 ARG 80 2HH2 ARG 80 -1.818 -9.302 1.664 567 H ILE 81 H ILE 81 3.587 -2.465 -2.743 568 HA ILE 81 HA ILE 81 1.534 -0.776 -3.939 569 HB ILE 81 HB ILE 81 3.418 0.822 -4.681 570 1HG1 ILE 81 1HG1 ILE 81 4.661 -0.359 -2.188 571 2HG1 ILE 81 2HG1 ILE 81 5.284 -0.527 -3.826 572 1HG2 ILE 81 1HG2 ILE 81 1.580 0.861 -2.599 573 2HG2 ILE 81 2HG2 ILE 81 3.085 1.424 -1.875 574 3HG2 ILE 81 3HG2 ILE 81 2.426 2.246 -3.289 575 1HD1 ILE 81 1HD1 ILE 81 6.571 1.208 -3.258 576 2HD1 ILE 81 2HD1 ILE 81 5.130 2.167 -3.597 577 3HD1 ILE 81 3HD1 ILE 81 5.507 1.697 -1.940 578 H ARG 82 H ARG 82 1.216 -2.403 -5.458 579 HA ARG 82 HA ARG 82 3.260 -3.680 -6.911 580 1HB ARG 82 1HB ARG 82 0.595 -4.057 -6.686 581 2HB ARG 82 2HB ARG 82 0.657 -3.277 -8.261 582 1HG ARG 82 1HG ARG 82 2.680 -5.227 -8.262 583 2HG ARG 82 2HG ARG 82 1.248 -5.981 -7.558 584 1HD ARG 82 1HD ARG 82 0.715 -6.348 -9.719 585 2HD ARG 82 2HD ARG 82 0.125 -4.688 -9.633 586 HE ARG 82 HE ARG 82 2.855 -4.706 -10.347 587 1HH1 ARG 82 1HH1 ARG 82 -0.298 -5.437 -11.629 588 2HH1 ARG 82 2HH1 ARG 82 0.152 -5.117 -13.272 589 1HH2 ARG 82 1HH2 ARG 82 3.460 -4.281 -12.505 590 2HH2 ARG 82 2HH2 ARG 82 2.290 -4.460 -13.769 591 H SER 83 H SER 83 4.709 -2.616 -8.096 592 HA SER 83 HA SER 83 3.877 -0.264 -9.628 593 1HB SER 83 1HB SER 83 6.713 -1.029 -9.732 594 2HB SER 83 2HB SER 83 5.977 0.528 -9.351 595 HG SER 83 HG SER 83 7.092 -1.099 -7.668 596 H LYS 84 H LYS 84 5.658 -0.220 -11.670 597 HA LYS 84 HA LYS 84 4.611 -2.310 -13.400 598 1HB LYS 84 1HB LYS 84 6.026 0.295 -13.853 599 2HB LYS 84 2HB LYS 84 5.945 -0.897 -15.143 600 1HG LYS 84 1HG LYS 84 3.352 -0.805 -14.378 601 2HG LYS 84 2HG LYS 84 3.859 0.854 -14.052 602 1HD LYS 84 1HD LYS 84 3.517 1.248 -16.223 603 2HD LYS 84 2HD LYS 84 4.972 0.295 -16.524 604 1HE LYS 84 1HE LYS 84 3.690 -1.687 -16.868 605 2HE LYS 84 2HE LYS 84 2.215 -0.901 -16.306 606 1HZ LYS 84 1HZ LYS 84 2.059 -0.902 -18.620 607 2HZ LYS 84 2HZ LYS 84 3.676 -0.457 -18.838 608 3HZ LYS 84 3HZ LYS 84 2.560 0.671 -18.250 609 H LYS 85 H LYS 85 7.560 -1.424 -11.825 610 HA LYS 85 HA LYS 85 9.182 -3.193 -13.465 611 1HB LYS 85 1HB LYS 85 9.745 -1.295 -11.211 612 2HB LYS 85 2HB LYS 85 10.938 -2.506 -11.663 613 1HG LYS 85 1HG LYS 85 9.943 -1.086 -13.975 614 2HG LYS 85 2HG LYS 85 10.618 0.013 -12.770 615 1HD LYS 85 1HD LYS 85 12.476 -0.534 -14.040 616 2HD LYS 85 2HD LYS 85 12.586 -1.678 -12.701 617 1HE LYS 85 1HE LYS 85 11.430 -3.358 -14.127 618 2HE LYS 85 2HE LYS 85 11.509 -2.214 -15.466 619 1HZ LYS 85 1HZ LYS 85 13.321 -3.771 -15.601 620 2HZ LYS 85 2HZ LYS 85 13.823 -3.396 -14.030 621 3HZ LYS 85 3HZ LYS 85 13.937 -2.234 -15.254 622 H ASN 86 H ASN 86 8.282 -2.932 -10.025 623 HA ASN 86 HA ASN 86 7.888 -5.734 -9.763 624 1HB ASN 86 1HB ASN 86 9.785 -5.862 -7.943 625 2HB ASN 86 2HB ASN 86 10.160 -6.140 -9.641 626 1HD2 ASN 86 1HD2 ASN 86 10.349 -3.871 -6.999 627 2HD2 ASN 86 2HD2 ASN 86 11.582 -2.874 -7.686 628 H GLU 87 H GLU 87 7.420 -6.351 -7.481 629 HA GLU 87 HA GLU 87 6.040 -4.142 -6.162 630 1HB GLU 87 1HB GLU 87 4.859 -5.867 -4.909 631 2HB GLU 87 2HB GLU 87 4.771 -6.191 -6.634 632 1HG GLU 87 1HG GLU 87 5.396 -8.258 -6.117 633 2HG GLU 87 2HG GLU 87 7.007 -7.582 -5.882 634 H ILE 88 H ILE 88 6.681 -3.269 -4.295 635 HA ILE 88 HA ILE 88 8.881 -4.588 -2.843 636 HB ILE 88 HB ILE 88 8.314 -1.626 -2.871 637 1HG1 ILE 88 1HG1 ILE 88 10.630 -1.849 -4.232 638 2HG1 ILE 88 2HG1 ILE 88 9.852 -3.345 -4.736 639 1HG2 ILE 88 1HG2 ILE 88 10.137 -3.362 -1.422 640 2HG2 ILE 88 2HG2 ILE 88 10.969 -2.055 -2.264 641 3HG2 ILE 88 3HG2 ILE 88 9.685 -1.686 -1.113 642 1HD1 ILE 88 1HD1 ILE 88 7.846 -1.905 -5.336 643 2HD1 ILE 88 2HD1 ILE 88 8.935 -0.528 -5.165 644 3HD1 ILE 88 3HD1 ILE 88 9.274 -1.777 -6.362 645 H MET 89 H MET 89 7.904 -5.615 -1.189 646 HA MET 89 HA MET 89 5.645 -4.526 0.195 647 1HB MET 89 1HB MET 89 7.316 -6.978 0.412 648 2HB MET 89 2HB MET 89 6.399 -6.493 1.831 649 1HG MET 89 1HG MET 89 4.456 -6.314 0.029 650 2HG MET 89 2HG MET 89 5.462 -7.513 -0.782 651 1HE MET 89 1HE MET 89 6.491 -8.728 2.542 652 2HE MET 89 2HE MET 89 5.779 -10.245 1.991 653 3HE MET 89 3HE MET 89 6.710 -9.249 0.871 654 H VAL 90 H VAL 90 5.602 -3.278 1.960 655 HA VAL 90 HA VAL 90 7.936 -3.109 3.698 656 HB VAL 90 HB VAL 90 6.762 -0.686 2.326 657 1HG1 VAL 90 1HG1 VAL 90 9.036 0.055 3.753 658 2HG1 VAL 90 2HG1 VAL 90 7.361 0.453 4.141 659 3HG1 VAL 90 3HG1 VAL 90 8.120 -0.969 4.858 660 1HG2 VAL 90 1HG2 VAL 90 8.263 -1.511 0.794 661 2HG2 VAL 90 2HG2 VAL 90 9.315 -0.476 1.759 662 3HG2 VAL 90 3HG2 VAL 90 9.303 -2.219 2.029 663 H ALA 91 H ALA 91 7.372 -2.918 5.778 664 HA ALA 91 HA ALA 91 4.897 -1.627 6.553 665 1HB ALA 91 1HB ALA 91 5.121 -4.328 7.709 666 2HB ALA 91 2HB ALA 91 3.694 -3.416 7.212 667 3HB ALA 91 3HB ALA 91 4.669 -4.255 6.005 668 HA PRO 92 HA PRO 92 7.159 -0.635 10.181 669 1HB PRO 92 1HB PRO 92 5.200 -0.557 12.059 670 2HB PRO 92 2HB PRO 92 5.378 0.675 10.805 671 1HG PRO 92 1HG PRO 92 3.520 -1.669 10.906 672 2HG PRO 92 2HG PRO 92 3.190 -0.002 10.401 673 1HD PRO 92 1HD PRO 92 3.621 -2.003 8.629 674 2HD PRO 92 2HD PRO 92 4.099 -0.324 8.307 675 H ASP 93 H ASP 93 8.450 -1.813 11.440 676 HA ASP 93 HA ASP 93 7.467 -4.408 12.422 677 1HB ASP 93 1HB ASP 93 9.731 -3.833 10.927 678 2HB ASP 93 2HB ASP 93 10.352 -4.009 12.566 679 H LYS 94 H LYS 94 9.346 -4.964 14.324 680 HA LYS 94 HA LYS 94 8.365 -3.799 16.616 681 1HB LYS 94 1HB LYS 94 10.480 -5.602 15.939 682 2HB LYS 94 2HB LYS 94 11.081 -4.454 17.127 683 1HG LYS 94 1HG LYS 94 8.826 -5.037 18.347 684 2HG LYS 94 2HG LYS 94 8.949 -6.509 17.381 685 1HD LYS 94 1HD LYS 94 11.031 -7.082 18.352 686 2HD LYS 94 2HD LYS 94 11.214 -5.484 19.077 687 1HE LYS 94 1HE LYS 94 8.758 -6.630 19.967 688 2HE LYS 94 2HE LYS 94 10.051 -7.804 20.204 689 1HZ LYS 94 1HZ LYS 94 9.484 -5.881 21.942 690 2HZ LYS 94 2HZ LYS 94 10.643 -5.077 21.010 691 3HZ LYS 94 3HZ LYS 94 11.032 -6.539 21.766 692 H ASP 95 H ASP 95 11.400 -2.965 14.946 693 HA ASP 95 HA ASP 95 11.102 -0.201 15.754 694 1HB ASP 95 1HB ASP 95 13.341 -0.079 16.797 695 2HB ASP 95 2HB ASP 95 12.242 -1.119 17.699 696 H TYR 96 H TYR 96 11.402 -2.044 13.336 697 HA TYR 96 HA TYR 96 13.249 -0.296 11.903 698 1HB TYR 96 1HB TYR 96 14.189 -2.342 10.719 699 2HB TYR 96 2HB TYR 96 14.719 -2.093 12.379 700 HD1 TYR 96 HD1 TYR 96 12.942 -4.275 10.095 701 HD2 TYR 96 HD2 TYR 96 13.789 -3.514 14.195 702 HE1 TYR 96 HE1 TYR 96 12.199 -6.549 10.664 703 HE2 TYR 96 HE2 TYR 96 13.050 -5.787 14.775 704 HH TYR 96 HH TYR 96 11.501 -7.531 13.768 705 H PHE 97 H PHE 97 13.138 -0.822 9.471 706 HA PHE 97 HA PHE 97 10.339 -1.430 8.775 707 1HB PHE 97 1HB PHE 97 12.207 0.693 7.770 708 2HB PHE 97 2HB PHE 97 10.898 0.110 6.746 709 HD1 PHE 97 HD1 PHE 97 8.657 -0.218 8.464 710 HD2 PHE 97 HD2 PHE 97 11.688 2.768 8.591 711 HE1 PHE 97 HE1 PHE 97 7.094 1.315 9.587 712 HE2 PHE 97 HE2 PHE 97 10.130 4.305 9.716 713 HZ PHE 97 HZ PHE 97 7.830 3.579 10.216 714 H LEU 98 H LEU 98 10.252 -3.355 7.825 715 HA LEU 98 HA LEU 98 12.499 -4.466 6.414 716 1HB LEU 98 1HB LEU 98 10.494 -5.573 7.808 717 2HB LEU 98 2HB LEU 98 9.829 -5.717 6.182 718 HG LEU 98 HG LEU 98 12.602 -6.670 6.535 719 1HD1 LEU 98 1HD1 LEU 98 11.768 -8.844 7.438 720 2HD1 LEU 98 2HD1 LEU 98 10.241 -8.043 7.805 721 3HD1 LEU 98 3HD1 LEU 98 11.728 -7.509 8.589 722 1HD2 LEU 98 1HD2 LEU 98 10.702 -8.488 5.366 723 2HD2 LEU 98 2HD2 LEU 98 12.107 -7.711 4.636 724 3HD2 LEU 98 3HD2 LEU 98 10.549 -6.883 4.651 725 H ILE 99 H ILE 99 12.772 -4.710 4.248 726 HA ILE 99 HA ILE 99 10.650 -3.714 2.474 727 HB ILE 99 HB ILE 99 13.581 -3.029 2.222 728 1HG1 ILE 99 1HG1 ILE 99 11.788 -0.779 2.334 729 2HG1 ILE 99 2HG1 ILE 99 11.539 -1.808 3.740 730 1HG2 ILE 99 1HG2 ILE 99 12.579 -3.341 0.048 731 2HG2 ILE 99 2HG2 ILE 99 11.223 -2.305 0.490 732 3HG2 ILE 99 3HG2 ILE 99 12.840 -1.621 0.332 733 1HD1 ILE 99 1HD1 ILE 99 13.864 -1.636 4.329 734 2HD1 ILE 99 2HD1 ILE 99 14.200 -0.719 2.860 735 3HD1 ILE 99 3HD1 ILE 99 13.183 -0.023 4.121 736 H VAL 100 H VAL 100 10.058 -5.429 1.318 737 HA VAL 100 HA VAL 100 12.149 -7.253 0.328 738 HB VAL 100 HB VAL 100 9.199 -7.806 0.679 739 1HG1 VAL 100 1HG1 VAL 100 10.081 -10.208 0.353 740 2HG1 VAL 100 2HG1 VAL 100 9.874 -9.184 -1.070 741 3HG1 VAL 100 3HG1 VAL 100 11.481 -9.430 -0.385 742 1HG2 VAL 100 1HG2 VAL 100 11.281 -7.783 2.581 743 2HG2 VAL 100 2HG2 VAL 100 9.631 -8.372 2.783 744 3HG2 VAL 100 3HG2 VAL 100 10.902 -9.474 2.254 745 H ILE 101 H ILE 101 12.675 -6.852 -1.713 746 HA ILE 101 HA ILE 101 10.586 -5.909 -3.559 747 HB ILE 101 HB ILE 101 13.586 -5.694 -3.836 748 1HG1 ILE 101 1HG1 ILE 101 12.049 -3.220 -3.711 749 2HG1 ILE 101 2HG1 ILE 101 11.877 -4.184 -2.249 750 1HG2 ILE 101 1HG2 ILE 101 13.177 -5.393 -5.999 751 2HG2 ILE 101 2HG2 ILE 101 11.434 -5.423 -5.733 752 3HG2 ILE 101 3HG2 ILE 101 12.326 -3.910 -5.566 753 1HD1 ILE 101 1HD1 ILE 101 14.147 -2.650 -3.226 754 2HD1 ILE 101 2HD1 ILE 101 13.750 -3.183 -1.592 755 3HD1 ILE 101 3HD1 ILE 101 14.571 -4.280 -2.702 756 H GLN 102 H GLN 102 9.994 -7.125 -5.247 757 HA GLN 102 HA GLN 102 11.696 -9.024 -6.507 758 1HB GLN 102 1HB GLN 102 10.586 -11.067 -5.893 759 2HB GLN 102 2HB GLN 102 11.104 -10.256 -4.422 760 1HG GLN 102 1HG GLN 102 8.820 -9.401 -4.114 761 2HG GLN 102 2HG GLN 102 8.317 -10.282 -5.556 762 1HE2 GLN 102 1HE2 GLN 102 8.165 -10.380 -2.353 763 2HE2 GLN 102 2HE2 GLN 102 8.139 -12.086 -2.079 764 H ASN 103 H ASN 103 10.350 -10.434 -8.074 765 HA ASN 103 HA ASN 103 9.003 -8.800 -9.845 766 1HB ASN 103 1HB ASN 103 9.367 -11.701 -9.512 767 2HB ASN 103 2HB ASN 103 7.926 -11.249 -10.417 768 1HD2 ASN 103 1HD2 ASN 103 11.403 -11.132 -10.314 769 2HD2 ASN 103 2HD2 ASN 103 11.637 -10.720 -11.975 770 HA PRO 104 HA PRO 104 4.877 -8.292 -8.446 771 1HB PRO 104 1HB PRO 104 3.443 -8.527 -10.739 772 2HB PRO 104 2HB PRO 104 4.461 -7.127 -10.383 773 1HG PRO 104 1HG PRO 104 5.049 -9.510 -12.097 774 2HG PRO 104 2HG PRO 104 5.387 -7.797 -12.408 775 1HD PRO 104 1HD PRO 104 7.282 -9.520 -11.529 776 2HD PRO 104 2HD PRO 104 7.276 -7.801 -11.087 777 H THR 105 H THR 105 3.028 -9.390 -7.818 778 HA THR 105 HA THR 105 3.019 -12.274 -8.413 779 HB THR 105 HB THR 105 1.683 -12.481 -6.287 780 HG1 THR 105 HG1 THR 105 0.981 -10.598 -5.594 781 1HG2 THR 105 1HG2 THR 105 4.286 -11.195 -5.596 782 2HG2 THR 105 2HG2 THR 105 4.291 -12.642 -6.604 783 3HG2 THR 105 3HG2 THR 105 3.575 -12.692 -4.994 784 H GLU 106 H GLU 106 1.036 -9.382 -8.213 785 HA GLU 106 HA GLU 106 -1.497 -10.466 -8.500 786 1HB GLU 106 1HB GLU 106 -0.850 -8.029 -8.141 787 2HB GLU 106 2HB GLU 106 -0.603 -7.939 -9.879 788 1HG GLU 106 1HG GLU 106 -2.769 -7.099 -9.422 789 2HG GLU 106 2HG GLU 106 -2.966 -8.679 -10.177 790 H MET 11 H MET 11 -18.479 4.127 -15.661 791 HA MET 11 HA MET 11 -18.373 3.863 -12.828 792 1HB MET 11 1HB MET 11 -19.469 5.781 -13.763 793 2HB MET 11 2HB MET 11 -20.562 4.770 -14.699 794 1HG MET 11 1HG MET 11 -22.007 4.653 -13.028 795 2HG MET 11 2HG MET 11 -20.752 4.158 -11.894 796 1HE MET 11 1HE MET 11 -20.858 5.648 -9.633 797 2HE MET 11 2HE MET 11 -22.073 6.925 -9.698 798 3HE MET 11 3HE MET 11 -22.461 5.307 -10.286 799 H ALA 12 H ALA 12 -20.504 2.434 -15.301 800 HA ALA 12 HA ALA 12 -22.072 0.848 -13.674 801 1HB ALA 12 1HB ALA 12 -22.761 0.925 -15.879 802 2HB ALA 12 2HB ALA 12 -21.152 0.565 -16.505 803 3HB ALA 12 3HB ALA 12 -22.109 -0.709 -15.750 804 H GLU 13 H GLU 13 -18.859 0.171 -14.986 805 HA GLU 13 HA GLU 13 -18.603 -2.498 -14.317 806 1HB GLU 13 1HB GLU 13 -16.579 -0.269 -14.394 807 2HB GLU 13 2HB GLU 13 -16.121 -1.929 -14.042 808 1HG GLU 13 1HG GLU 13 -17.698 -1.312 -16.497 809 2HG GLU 13 2HG GLU 13 -15.960 -1.020 -16.465 810 H VAL 14 H VAL 14 -17.748 0.322 -12.317 811 HA VAL 14 HA VAL 14 -16.978 -1.150 -10.042 812 HB VAL 14 HB VAL 14 -18.109 1.648 -10.039 813 1HG1 VAL 14 1HG1 VAL 14 -16.210 1.687 -8.178 814 2HG1 VAL 14 2HG1 VAL 14 -17.864 1.184 -7.825 815 3HG1 VAL 14 3HG1 VAL 14 -16.613 -0.028 -8.103 816 1HG2 VAL 14 1HG2 VAL 14 -15.441 0.604 -10.884 817 2HG2 VAL 14 2HG2 VAL 14 -16.437 1.863 -11.616 818 3HG2 VAL 14 3HG2 VAL 14 -15.559 2.191 -10.122 819 H GLU 15 H GLU 15 -20.083 0.092 -11.125 820 HA GLU 15 HA GLU 15 -21.495 -0.338 -8.711 821 1HB GLU 15 1HB GLU 15 -22.375 -0.079 -11.581 822 2HB GLU 15 2HB GLU 15 -23.520 -0.339 -10.273 823 1HG GLU 15 1HG GLU 15 -22.848 1.721 -9.218 824 2HG GLU 15 2HG GLU 15 -21.593 1.966 -10.431 825 H GLU 16 H GLU 16 -20.826 -2.368 -11.509 826 HA GLU 16 HA GLU 16 -22.584 -4.478 -10.830 827 1HB GLU 16 1HB GLU 16 -20.972 -3.889 -12.977 828 2HB GLU 16 2HB GLU 16 -20.146 -5.263 -12.256 829 1HG GLU 16 1HG GLU 16 -22.496 -6.352 -12.249 830 2HG GLU 16 2HG GLU 16 -22.879 -5.115 -13.444 831 H THR 17 H THR 17 -19.284 -3.712 -9.929 832 HA THR 17 HA THR 17 -18.810 -6.250 -8.655 833 HB THR 17 HB THR 17 -17.246 -3.665 -8.516 834 HG1 THR 17 HG1 THR 17 -17.032 -4.456 -10.552 835 1HG2 THR 17 1HG2 THR 17 -16.624 -4.853 -6.589 836 2HG2 THR 17 2HG2 THR 17 -15.402 -5.293 -7.782 837 3HG2 THR 17 3HG2 THR 17 -16.716 -6.409 -7.412 838 H LEU 18 H LEU 18 -20.114 -3.177 -7.744 839 HA LEU 18 HA LEU 18 -19.702 -3.402 -4.939 840 1HB LEU 18 1HB LEU 18 -20.967 -1.570 -6.772 841 2HB LEU 18 2HB LEU 18 -21.976 -1.833 -5.351 842 HG LEU 18 HG LEU 18 -19.670 -1.351 -4.111 843 1HD1 LEU 18 1HD1 LEU 18 -19.430 0.007 -6.782 844 2HD1 LEU 18 2HD1 LEU 18 -18.266 -1.050 -5.985 845 3HD1 LEU 18 3HD1 LEU 18 -18.576 0.563 -5.342 846 1HD2 LEU 18 1HD2 LEU 18 -21.419 0.826 -5.249 847 2HD2 LEU 18 2HD2 LEU 18 -20.421 0.921 -3.798 848 3HD2 LEU 18 3HD2 LEU 18 -21.817 -0.157 -3.840 849 H LYS 19 H LYS 19 -22.436 -4.137 -7.076 850 HA LYS 19 HA LYS 19 -24.311 -4.865 -5.163 851 1HB LYS 19 1HB LYS 19 -23.958 -5.201 -8.015 852 2HB LYS 19 2HB LYS 19 -24.683 -6.637 -7.305 853 1HG LYS 19 1HG LYS 19 -26.559 -5.438 -7.768 854 2HG LYS 19 2HG LYS 19 -26.235 -4.863 -6.130 855 1HD LYS 19 1HD LYS 19 -26.125 -2.782 -6.904 856 2HD LYS 19 2HD LYS 19 -24.743 -3.239 -7.902 857 1HE LYS 19 1HE LYS 19 -26.176 -2.484 -9.518 858 2HE LYS 19 2HE LYS 19 -26.621 -4.190 -9.481 859 1HZ LYS 19 1HZ LYS 19 -28.124 -2.761 -7.565 860 2HZ LYS 19 2HZ LYS 19 -28.671 -3.644 -8.900 861 3HZ LYS 19 3HZ LYS 19 -28.277 -2.008 -9.072 862 H ARG 20 H ARG 20 -21.958 -6.946 -6.842 863 HA ARG 20 HA ARG 20 -22.636 -9.329 -5.527 864 1HB ARG 20 1HB ARG 20 -21.152 -8.963 -7.605 865 2HB ARG 20 2HB ARG 20 -19.847 -8.694 -6.457 866 1HG ARG 20 1HG ARG 20 -19.542 -10.906 -6.743 867 2HG ARG 20 2HG ARG 20 -20.794 -11.008 -5.504 868 1HD ARG 20 1HD ARG 20 -22.473 -11.068 -7.394 869 2HD ARG 20 2HD ARG 20 -21.105 -11.284 -8.484 870 HE ARG 20 HE ARG 20 -20.807 -13.228 -6.577 871 1HH1 ARG 20 1HH1 ARG 20 -23.291 -12.319 -8.841 872 2HH1 ARG 20 2HH1 ARG 20 -23.893 -13.933 -9.029 873 1HH2 ARG 20 1HH2 ARG 20 -21.590 -15.357 -6.816 874 2HH2 ARG 20 2HH2 ARG 20 -22.925 -15.660 -7.876 875 H LEU 21 H LEU 21 -20.230 -6.846 -4.753 876 HA LEU 21 HA LEU 21 -19.049 -8.138 -2.563 877 1HB LEU 21 1HB LEU 21 -19.111 -5.442 -3.682 878 2HB LEU 21 2HB LEU 21 -18.903 -5.470 -1.933 879 HG LEU 21 HG LEU 21 -16.891 -6.774 -2.141 880 1HD1 LEU 21 1HD1 LEU 21 -16.148 -6.924 -4.732 881 2HD1 LEU 21 2HD1 LEU 21 -17.886 -7.185 -4.877 882 3HD1 LEU 21 3HD1 LEU 21 -16.919 -8.239 -3.845 883 1HD2 LEU 21 1HD2 LEU 21 -17.077 -4.356 -3.909 884 2HD2 LEU 21 2HD2 LEU 21 -15.548 -5.189 -3.630 885 3HD2 LEU 21 3HD2 LEU 21 -16.429 -4.483 -2.274 886 H GLN 22 H GLN 22 -21.563 -5.606 -2.571 887 HA GLN 22 HA GLN 22 -22.076 -5.661 0.178 888 1HB GLN 22 1HB GLN 22 -23.165 -4.384 -2.130 889 2HB GLN 22 2HB GLN 22 -24.494 -5.051 -1.191 890 1HG GLN 22 1HG GLN 22 -24.039 -2.761 -0.547 891 2HG GLN 22 2HG GLN 22 -23.706 -3.866 0.785 892 1HE2 GLN 22 1HE2 GLN 22 -22.524 -1.351 -1.079 893 2HE2 GLN 22 2HE2 GLN 22 -20.873 -1.406 -0.575 894 H SER 23 H SER 23 -22.935 -7.866 -2.304 895 HA SER 23 HA SER 23 -25.179 -9.019 -0.904 896 1HB SER 23 1HB SER 23 -23.910 -9.326 -3.520 897 2HB SER 23 2HB SER 23 -24.409 -10.864 -2.817 898 HG SER 23 HG SER 23 -26.076 -9.863 -4.046 899 H GLN 24 H GLN 24 -21.759 -9.462 -1.012 900 HA GLN 24 HA GLN 24 -21.969 -12.030 0.391 901 1HB GLN 24 1HB GLN 24 -19.557 -12.255 -0.054 902 2HB GLN 24 2HB GLN 24 -20.482 -12.032 -1.533 903 1HG GLN 24 1HG GLN 24 -19.652 -9.921 -1.899 904 2HG GLN 24 2HG GLN 24 -19.268 -9.662 -0.198 905 1HE2 GLN 24 1HE2 GLN 24 -17.376 -8.957 -1.876 906 2HE2 GLN 24 2HE2 GLN 24 -16.078 -10.096 -1.909 907 H LYS 25 H LYS 25 -20.564 -12.390 2.257 908 HA LYS 25 HA LYS 25 -20.723 -10.174 4.090 909 1HB LYS 25 1HB LYS 25 -20.999 -12.823 4.440 910 2HB LYS 25 2HB LYS 25 -19.299 -12.662 4.863 911 1HG LYS 25 1HG LYS 25 -20.950 -10.640 6.133 912 2HG LYS 25 2HG LYS 25 -21.446 -12.284 6.545 913 1HD LYS 25 1HD LYS 25 -19.515 -12.733 7.657 914 2HD LYS 25 2HD LYS 25 -18.542 -11.705 6.603 915 1HE LYS 25 1HE LYS 25 -20.202 -9.912 7.872 916 2HE LYS 25 2HE LYS 25 -19.851 -11.091 9.134 917 1HZ LYS 25 1HZ LYS 25 -18.261 -9.190 8.979 918 2HZ LYS 25 2HZ LYS 25 -17.748 -9.803 7.488 919 3HZ LYS 25 3HZ LYS 25 -17.541 -10.719 8.895 920 H GLY 26 H GLY 26 -18.868 -9.572 5.482 921 1HA GLY 26 1HA GLY 26 -16.523 -9.353 5.834 922 2HA GLY 26 2HA GLY 26 -16.255 -9.895 4.183 923 H VAL 27 H VAL 27 -17.900 -8.227 2.755 924 HA VAL 27 HA VAL 27 -16.355 -5.945 2.423 925 HB VAL 27 HB VAL 27 -19.256 -6.331 1.674 926 1HG1 VAL 27 1HG1 VAL 27 -18.689 -3.985 1.628 927 2HG1 VAL 27 2HG1 VAL 27 -17.223 -4.325 0.706 928 3HG1 VAL 27 3HG1 VAL 27 -18.807 -4.591 -0.023 929 1HG2 VAL 27 1HG2 VAL 27 -17.677 -8.026 0.774 930 2HG2 VAL 27 2HG2 VAL 27 -18.446 -7.045 -0.474 931 3HG2 VAL 27 3HG2 VAL 27 -16.779 -6.720 -0.000 932 H GLN 28 H GLN 28 -16.193 -4.089 3.494 933 HA GLN 28 HA GLN 28 -18.112 -3.522 5.622 934 1HB GLN 28 1HB GLN 28 -15.279 -2.969 5.155 935 2HB GLN 28 2HB GLN 28 -16.162 -1.572 5.758 936 1HG GLN 28 1HG GLN 28 -15.084 -3.047 7.490 937 2HG GLN 28 2HG GLN 28 -16.793 -2.686 7.727 938 1HE2 GLN 28 1HE2 GLN 28 -14.443 -5.118 7.149 939 2HE2 GLN 28 2HE2 GLN 28 -15.508 -6.476 7.215 940 H GLY 29 H GLY 29 -16.995 -2.279 2.561 941 1HA GLY 29 1HA GLY 29 -19.180 -0.855 1.844 942 2HA GLY 29 2HA GLY 29 -18.311 0.275 2.872 943 H ILE 30 H ILE 30 -18.925 -0.013 -0.144 944 HA ILE 30 HA ILE 30 -16.161 0.311 -1.107 945 HB ILE 30 HB ILE 30 -18.602 -0.154 -2.815 946 1HG1 ILE 30 1HG1 ILE 30 -17.121 -2.476 -2.902 947 2HG1 ILE 30 2HG1 ILE 30 -17.019 -2.024 -1.204 948 1HG2 ILE 30 1HG2 ILE 30 -16.880 -0.868 -4.471 949 2HG2 ILE 30 2HG2 ILE 30 -16.796 0.837 -4.031 950 3HG2 ILE 30 3HG2 ILE 30 -15.641 -0.308 -3.348 951 1HD1 ILE 30 1HD1 ILE 30 -19.715 -1.747 -2.135 952 2HD1 ILE 30 2HD1 ILE 30 -19.100 -3.361 -2.495 953 3HD1 ILE 30 3HD1 ILE 30 -19.071 -2.755 -0.839 954 H ILE 31 H ILE 31 -15.565 2.124 -2.243 955 HA ILE 31 HA ILE 31 -17.578 4.251 -2.525 956 HB ILE 31 HB ILE 31 -14.773 4.621 -1.467 957 1HG1 ILE 31 1HG1 ILE 31 -17.124 5.511 0.086 958 2HG1 ILE 31 2HG1 ILE 31 -16.935 3.767 -0.062 959 1HG2 ILE 31 1HG2 ILE 31 -15.421 6.473 -2.888 960 2HG2 ILE 31 2HG2 ILE 31 -16.944 6.639 -2.017 961 3HG2 ILE 31 3HG2 ILE 31 -15.420 6.980 -1.199 962 1HD1 ILE 31 1HD1 ILE 31 -15.418 3.793 1.539 963 2HD1 ILE 31 2HD1 ILE 31 -14.410 4.886 0.590 964 3HD1 ILE 31 3HD1 ILE 31 -15.618 5.538 1.696 965 H VAL 32 H VAL 32 -17.349 5.599 -4.286 966 HA VAL 32 HA VAL 32 -15.158 4.961 -6.151 967 HB VAL 32 HB VAL 32 -17.934 5.674 -7.071 968 1HG1 VAL 32 1HG1 VAL 32 -17.209 4.853 -9.191 969 2HG1 VAL 32 2HG1 VAL 32 -15.969 5.961 -8.598 970 3HG1 VAL 32 3HG1 VAL 32 -15.716 4.218 -8.498 971 1HG2 VAL 32 1HG2 VAL 32 -18.149 3.637 -5.782 972 2HG2 VAL 32 2HG2 VAL 32 -18.285 3.269 -7.501 973 3HG2 VAL 32 3HG2 VAL 32 -16.787 2.917 -6.640 974 H VAL 33 H VAL 33 -13.900 6.711 -6.178 975 HA VAL 33 HA VAL 33 -15.188 9.360 -6.300 976 HB VAL 33 HB VAL 33 -12.334 8.866 -5.473 977 1HG1 VAL 33 1HG1 VAL 33 -12.920 11.094 -4.248 978 2HG1 VAL 33 2HG1 VAL 33 -12.528 11.109 -5.968 979 3HG1 VAL 33 3HG1 VAL 33 -14.211 11.188 -5.445 980 1HG2 VAL 33 1HG2 VAL 33 -13.286 9.265 -3.121 981 2HG2 VAL 33 2HG2 VAL 33 -14.838 8.803 -3.819 982 3HG2 VAL 33 3HG2 VAL 33 -13.490 7.665 -3.835 983 H ASN 34 H ASN 34 -14.262 10.948 -7.689 984 HA ASN 34 HA ASN 34 -13.001 9.764 -10.055 985 1HB ASN 34 1HB ASN 34 -14.052 12.566 -9.993 986 2HB ASN 34 2HB ASN 34 -13.989 11.428 -11.335 987 1HD2 ASN 34 1HD2 ASN 34 -16.182 13.052 -10.108 988 2HD2 ASN 34 2HD2 ASN 34 -17.447 11.916 -9.801 989 H THR 35 H THR 35 -11.856 11.922 -11.239 990 HA THR 35 HA THR 35 -9.432 12.201 -9.725 991 HB THR 35 HB THR 35 -8.758 13.680 -11.706 992 HG1 THR 35 HG1 THR 35 -10.270 13.003 -13.563 993 1HG2 THR 35 1HG2 THR 35 -9.435 10.772 -11.835 994 2HG2 THR 35 2HG2 THR 35 -7.856 11.556 -11.800 995 3HG2 THR 35 3HG2 THR 35 -8.822 11.583 -13.275 996 H GLU 36 H GLU 36 -12.276 14.090 -10.231 997 HA GLU 36 HA GLU 36 -11.082 16.599 -9.471 998 1HB GLU 36 1HB GLU 36 -13.807 15.655 -10.200 999 2HB GLU 36 2HB GLU 36 -13.690 17.113 -9.225 1000 1HG GLU 36 1HG GLU 36 -11.831 17.509 -11.230 1001 2HG GLU 36 2HG GLU 36 -13.180 16.720 -12.046 1002 H GLY 37 H GLY 37 -12.946 14.052 -7.917 1003 1HA GLY 37 1HA GLY 37 -12.370 13.724 -5.521 1004 2HA GLY 37 2HA GLY 37 -12.571 15.461 -5.345 1005 H ILE 38 H ILE 38 -14.781 13.925 -7.455 1006 HA ILE 38 HA ILE 38 -16.899 14.278 -5.455 1007 HB ILE 38 HB ILE 38 -17.223 13.903 -8.432 1008 1HG1 ILE 38 1HG1 ILE 38 -17.181 16.461 -6.814 1009 2HG1 ILE 38 2HG1 ILE 38 -15.946 15.947 -7.959 1010 1HG2 ILE 38 1HG2 ILE 38 -19.138 14.951 -6.351 1011 2HG2 ILE 38 2HG2 ILE 38 -19.468 14.741 -8.070 1012 3HG2 ILE 38 3HG2 ILE 38 -19.178 13.332 -7.050 1013 1HD1 ILE 38 1HD1 ILE 38 -17.115 17.365 -9.282 1014 2HD1 ILE 38 2HD1 ILE 38 -18.024 15.886 -9.595 1015 3HD1 ILE 38 3HD1 ILE 38 -18.638 17.073 -8.444 1016 HA PRO 39 HA PRO 39 -16.941 9.808 -5.186 1017 1HB PRO 39 1HB PRO 39 -18.810 9.701 -3.219 1018 2HB PRO 39 2HB PRO 39 -17.113 10.087 -2.912 1019 1HG PRO 39 1HG PRO 39 -19.456 11.931 -3.182 1020 2HG PRO 39 2HG PRO 39 -18.128 11.974 -2.008 1021 1HD PRO 39 1HD PRO 39 -18.198 13.579 -4.187 1022 2HD PRO 39 2HD PRO 39 -16.679 12.976 -3.494 1023 H ILE 40 H ILE 40 -17.926 9.777 -7.357 1024 HA ILE 40 HA ILE 40 -20.574 10.192 -7.979 1025 HB ILE 40 HB ILE 40 -20.254 8.278 -9.659 1026 1HG1 ILE 40 1HG1 ILE 40 -17.394 8.497 -8.706 1027 2HG1 ILE 40 2HG1 ILE 40 -18.465 7.169 -8.273 1028 1HG2 ILE 40 1HG2 ILE 40 -19.093 10.917 -9.509 1029 2HG2 ILE 40 2HG2 ILE 40 -18.135 9.852 -10.536 1030 3HG2 ILE 40 3HG2 ILE 40 -19.849 10.096 -10.874 1031 1HD1 ILE 40 1HD1 ILE 40 -18.033 7.826 -11.146 1032 2HD1 ILE 40 2HD1 ILE 40 -16.805 6.925 -10.254 1033 3HD1 ILE 40 3HD1 ILE 40 -18.443 6.286 -10.390 1034 H LYS 41 H LYS 41 -19.104 7.421 -6.386 1035 HA LYS 41 HA LYS 41 -21.794 6.477 -5.686 1036 1HB LYS 41 1HB LYS 41 -19.997 5.143 -7.439 1037 2HB LYS 41 2HB LYS 41 -20.061 4.218 -5.944 1038 1HG LYS 41 1HG LYS 41 -22.482 5.073 -7.515 1039 2HG LYS 41 2HG LYS 41 -21.704 3.495 -7.651 1040 1HD LYS 41 1HD LYS 41 -22.114 3.117 -5.249 1041 2HD LYS 41 2HD LYS 41 -22.949 4.670 -5.164 1042 1HE LYS 41 1HE LYS 41 -24.413 3.711 -7.070 1043 2HE LYS 41 2HE LYS 41 -23.774 2.150 -6.558 1044 1HZ LYS 41 1HZ LYS 41 -25.949 2.925 -5.531 1045 2HZ LYS 41 2HZ LYS 41 -25.018 4.014 -4.632 1046 3HZ LYS 41 3HZ LYS 41 -24.762 2.350 -4.472 1047 H SER 42 H SER 42 -21.970 5.470 -3.680 1048 HA SER 42 HA SER 42 -19.717 4.845 -2.054 1049 1HB SER 42 1HB SER 42 -19.646 7.334 -1.957 1050 2HB SER 42 2HB SER 42 -21.273 7.323 -1.276 1051 HG SER 42 HG SER 42 -20.440 6.114 0.481 1052 H THR 43 H THR 43 -20.286 3.618 -0.309 1053 HA THR 43 HA THR 43 -23.177 3.225 0.122 1054 HB THR 43 HB THR 43 -22.765 0.905 0.637 1055 HG1 THR 43 HG1 THR 43 -20.828 0.221 1.148 1056 1HG2 THR 43 1HG2 THR 43 -22.930 0.500 -1.547 1057 2HG2 THR 43 2HG2 THR 43 -21.181 0.665 -1.700 1058 3HG2 THR 43 3HG2 THR 43 -22.221 2.073 -1.908 1059 H MET 44 H MET 44 -20.202 4.079 1.528 1060 HA MET 44 HA MET 44 -20.676 3.239 4.197 1061 1HB MET 44 1HB MET 44 -18.955 5.524 3.221 1062 2HB MET 44 2HB MET 44 -18.857 4.748 4.796 1063 1HG MET 44 1HG MET 44 -18.593 2.921 2.525 1064 2HG MET 44 2HG MET 44 -17.317 4.130 2.650 1065 1HE MET 44 1HE MET 44 -18.397 1.457 6.242 1066 2HE MET 44 2HE MET 44 -19.051 3.078 6.011 1067 3HE MET 44 3HE MET 44 -19.477 1.787 4.887 1068 H ASP 45 H ASP 45 -20.387 5.366 5.828 1069 HA ASP 45 HA ASP 45 -23.021 6.509 5.799 1070 1HB ASP 45 1HB ASP 45 -21.101 5.956 7.757 1071 2HB ASP 45 2HB ASP 45 -21.226 7.713 7.730 1072 H ASN 46 H ASN 46 -23.267 8.911 6.287 1073 HA ASN 46 HA ASN 46 -22.417 10.399 4.084 1074 1HB ASN 46 1HB ASN 46 -24.133 10.788 6.293 1075 2HB ASN 46 2HB ASN 46 -23.005 12.140 6.298 1076 1HD2 ASN 46 1HD2 ASN 46 -22.555 12.454 3.605 1077 2HD2 ASN 46 2HD2 ASN 46 -24.015 12.966 2.837 1078 HA PRO 47 HA PRO 47 -19.215 12.563 6.987 1079 1HB PRO 47 1HB PRO 47 -18.769 11.426 9.412 1080 2HB PRO 47 2HB PRO 47 -20.005 12.660 9.142 1081 1HG PRO 47 1HG PRO 47 -20.302 9.686 9.307 1082 2HG PRO 47 2HG PRO 47 -21.320 10.953 10.016 1083 1HD PRO 47 1HD PRO 47 -21.993 9.646 7.742 1084 2HD PRO 47 2HD PRO 47 -22.436 11.340 8.036 1085 H THR 48 H THR 48 -19.506 9.076 6.995 1086 HA THR 48 HA THR 48 -16.693 8.571 7.256 1087 HB THR 48 HB THR 48 -18.908 6.732 6.326 1088 HG1 THR 48 HG1 THR 48 -19.003 7.572 8.544 1089 1HG2 THR 48 1HG2 THR 48 -16.671 6.000 5.596 1090 2HG2 THR 48 2HG2 THR 48 -17.357 4.918 6.808 1091 3HG2 THR 48 3HG2 THR 48 -16.113 6.080 7.266 1092 H THR 49 H THR 49 -18.929 9.062 4.624 1093 HA THR 49 HA THR 49 -17.200 8.051 2.577 1094 HB THR 49 HB THR 49 -19.627 9.845 2.382 1095 HG1 THR 49 HG1 THR 49 -20.710 7.954 1.945 1096 1HG2 THR 49 1HG2 THR 49 -17.899 8.558 0.289 1097 2HG2 THR 49 2HG2 THR 49 -18.471 10.224 0.383 1098 3HG2 THR 49 3HG2 THR 49 -19.595 8.927 -0.023 1099 H THR 50 H THR 50 -18.170 11.326 3.587 1100 HA THR 50 HA THR 50 -16.637 12.781 1.790 1101 HB THR 50 HB THR 50 -16.710 13.974 4.466 1102 HG1 THR 50 HG1 THR 50 -18.657 13.326 4.955 1103 1HG2 THR 50 1HG2 THR 50 -17.446 15.855 3.319 1104 2HG2 THR 50 2HG2 THR 50 -18.222 14.903 2.053 1105 3HG2 THR 50 3HG2 THR 50 -16.465 15.034 2.105 1106 H GLN 51 H GLN 51 -15.749 11.567 5.006 1107 HA GLN 51 HA GLN 51 -13.167 12.688 5.074 1108 1HB GLN 51 1HB GLN 51 -14.129 11.924 7.118 1109 2HB GLN 51 2HB GLN 51 -14.374 10.306 6.475 1110 1HG GLN 51 1HG GLN 51 -11.589 11.226 6.474 1111 2HG GLN 51 2HG GLN 51 -12.316 11.039 8.069 1112 1HE2 GLN 51 1HE2 GLN 51 -11.080 9.455 5.297 1113 2HE2 GLN 51 2HE2 GLN 51 -11.275 7.833 5.858 1114 H TYR 52 H TYR 52 -14.269 9.435 4.149 1115 HA TYR 52 HA TYR 52 -11.766 8.365 3.525 1116 1HB TYR 52 1HB TYR 52 -14.579 7.719 2.798 1117 2HB TYR 52 2HB TYR 52 -13.303 6.982 1.836 1118 HD1 TYR 52 HD1 TYR 52 -12.953 4.794 2.460 1119 HD2 TYR 52 HD2 TYR 52 -13.720 7.681 5.489 1120 HE1 TYR 52 HE1 TYR 52 -12.651 3.061 4.180 1121 HE2 TYR 52 HE2 TYR 52 -13.420 5.957 7.217 1122 HH TYR 52 HH TYR 52 -13.565 3.495 7.405 1123 H ALA 53 H ALA 53 -14.172 9.838 1.347 1124 HA ALA 53 HA ALA 53 -12.550 9.718 -0.963 1125 1HB ALA 53 1HB ALA 53 -14.176 11.188 -1.981 1126 2HB ALA 53 2HB ALA 53 -15.004 9.966 -1.013 1127 3HB ALA 53 3HB ALA 53 -14.829 11.609 -0.397 1128 H SER 54 H SER 54 -12.528 11.800 1.751 1129 HA SER 54 HA SER 54 -11.375 14.082 0.462 1130 1HB SER 54 1HB SER 54 -12.077 13.294 3.218 1131 2HB SER 54 2HB SER 54 -10.707 14.395 3.083 1132 HG SER 54 HG SER 54 -12.426 15.718 3.126 1133 H LEU 55 H LEU 55 -10.063 11.613 2.675 1134 HA LEU 55 HA LEU 55 -7.357 12.458 2.217 1135 1HB LEU 55 1HB LEU 55 -6.766 11.004 3.870 1136 2HB LEU 55 2HB LEU 55 -8.457 11.277 4.286 1137 HG LEU 55 HG LEU 55 -8.774 9.114 2.769 1138 1HD1 LEU 55 1HD1 LEU 55 -6.972 7.859 2.405 1139 2HD1 LEU 55 2HD1 LEU 55 -6.376 8.092 4.048 1140 3HD1 LEU 55 3HD1 LEU 55 -6.024 9.292 2.804 1141 1HD2 LEU 55 1HD2 LEU 55 -7.766 8.473 5.466 1142 2HD2 LEU 55 2HD2 LEU 55 -9.306 8.077 4.702 1143 3HD2 LEU 55 3HD2 LEU 55 -9.045 9.684 5.381 1144 H MET 56 H MET 56 -9.544 10.445 0.587 1145 HA MET 56 HA MET 56 -7.969 8.409 -0.434 1146 1HB MET 56 1HB MET 56 -10.527 9.486 -0.951 1147 2HB MET 56 2HB MET 56 -9.696 9.418 -2.499 1148 1HG MET 56 1HG MET 56 -10.123 7.127 -0.596 1149 2HG MET 56 2HG MET 56 -10.953 7.394 -2.127 1150 1HE MET 56 1HE MET 56 -7.121 6.601 -0.696 1151 2HE MET 56 2HE MET 56 -8.547 5.648 -0.285 1152 3HE MET 56 3HE MET 56 -7.340 4.995 -1.393 1153 H HIS 57 H HIS 57 -8.766 11.388 -2.229 1154 HA HIS 57 HA HIS 57 -6.858 11.093 -4.221 1155 1HB HIS 57 1HB HIS 57 -8.800 12.779 -4.043 1156 2HB HIS 57 2HB HIS 57 -7.662 13.793 -3.161 1157 HD1 HIS 57 HD1 HIS 57 -7.483 15.600 -4.938 1158 HD2 HIS 57 HD2 HIS 57 -6.563 11.806 -6.358 1159 HE1 HIS 57 HE1 HIS 57 -6.488 15.959 -7.219 1160 H SER 58 H SER 58 -6.552 12.420 -0.993 1161 HA SER 58 HA SER 58 -3.995 13.604 -1.366 1162 1HB SER 58 1HB SER 58 -5.902 13.546 0.672 1163 2HB SER 58 2HB SER 58 -4.493 12.742 1.363 1164 HG SER 58 HG SER 58 -4.858 15.309 1.116 1165 H PHE 59 H PHE 59 -5.085 10.383 -0.747 1166 HA PHE 59 HA PHE 59 -2.668 9.361 0.350 1167 1HB PHE 59 1HB PHE 59 -4.832 8.227 0.645 1168 2HB PHE 59 2HB PHE 59 -4.898 7.905 -1.085 1169 HD1 PHE 59 HD1 PHE 59 -2.066 7.601 1.307 1170 HD2 PHE 59 HD2 PHE 59 -4.767 5.610 -1.311 1171 HE1 PHE 59 HE1 PHE 59 -0.846 5.493 1.658 1172 HE2 PHE 59 HE2 PHE 59 -3.552 3.499 -0.963 1173 HZ PHE 59 HZ PHE 59 -1.590 3.438 0.523 1174 H ILE 60 H ILE 60 -4.118 8.995 -2.889 1175 HA ILE 60 HA ILE 60 -1.924 7.723 -4.073 1176 HB ILE 60 HB ILE 60 -3.987 9.487 -5.397 1177 1HG1 ILE 60 1HG1 ILE 60 -5.025 7.645 -4.197 1178 2HG1 ILE 60 2HG1 ILE 60 -5.106 7.339 -5.928 1179 1HG2 ILE 60 1HG2 ILE 60 -3.090 7.455 -7.125 1180 2HG2 ILE 60 2HG2 ILE 60 -2.842 9.194 -7.274 1181 3HG2 ILE 60 3HG2 ILE 60 -1.652 8.203 -6.431 1182 1HD1 ILE 60 1HD1 ILE 60 -3.952 5.746 -3.853 1183 2HD1 ILE 60 2HD1 ILE 60 -4.211 5.355 -5.553 1184 3HD1 ILE 60 3HD1 ILE 60 -2.725 6.160 -5.049 1185 H LEU 61 H LEU 61 -2.737 11.149 -3.778 1186 HA LEU 61 HA LEU 61 -0.676 12.139 -5.427 1187 1HB LEU 61 1HB LEU 61 -2.624 13.210 -3.547 1188 2HB LEU 61 2HB LEU 61 -1.103 14.101 -3.537 1189 HG LEU 61 HG LEU 61 -1.324 14.576 -5.899 1190 1HD1 LEU 61 1HD1 LEU 61 -3.279 12.441 -5.766 1191 2HD1 LEU 61 2HD1 LEU 61 -2.426 13.109 -7.157 1192 3HD1 LEU 61 3HD1 LEU 61 -3.909 13.871 -6.583 1193 1HD2 LEU 61 1HD2 LEU 61 -3.242 16.045 -5.823 1194 2HD2 LEU 61 2HD2 LEU 61 -2.415 16.067 -4.266 1195 3HD2 LEU 61 3HD2 LEU 61 -3.910 15.151 -4.458 1196 H LYS 62 H LYS 62 -0.718 10.995 -2.158 1197 HA LYS 62 HA LYS 62 1.753 12.228 -1.376 1198 1HB LYS 62 1HB LYS 62 -0.159 11.431 0.150 1199 2HB LYS 62 2HB LYS 62 0.513 9.819 -0.063 1200 1HG LYS 62 1HG LYS 62 1.537 10.467 1.875 1201 2HG LYS 62 2HG LYS 62 2.738 10.970 0.683 1202 1HD LYS 62 1HD LYS 62 2.597 12.871 1.959 1203 2HD LYS 62 2HD LYS 62 1.370 13.217 0.738 1204 1HE LYS 62 1HE LYS 62 -0.387 12.710 2.202 1205 2HE LYS 62 2HE LYS 62 0.674 11.856 3.320 1206 1HZ LYS 62 1HZ LYS 62 -0.148 14.434 3.564 1207 2HZ LYS 62 2HZ LYS 62 1.421 14.598 2.953 1208 3HZ LYS 62 3HZ LYS 62 1.157 13.734 4.384 1209 H ALA 63 H ALA 63 0.795 8.881 -2.146 1210 HA ALA 63 HA ALA 63 3.427 7.842 -2.055 1211 1HB ALA 63 1HB ALA 63 2.501 5.843 -3.017 1212 2HB ALA 63 2HB ALA 63 1.368 6.480 -1.824 1213 3HB ALA 63 3HB ALA 63 1.061 6.715 -3.545 1214 H ARG 64 H ARG 64 1.350 8.852 -4.760 1215 HA ARG 64 HA ARG 64 3.035 8.194 -6.862 1216 1HB ARG 64 1HB ARG 64 0.638 9.060 -6.956 1217 2HB ARG 64 2HB ARG 64 1.322 10.673 -6.815 1218 1HG ARG 64 1HG ARG 64 2.748 9.411 -8.871 1219 2HG ARG 64 2HG ARG 64 1.049 9.010 -9.129 1220 1HD ARG 64 1HD ARG 64 1.895 11.822 -8.536 1221 2HD ARG 64 2HD ARG 64 1.995 11.175 -10.173 1222 HE ARG 64 HE ARG 64 -0.573 10.739 -9.025 1223 1HH1 ARG 64 1HH1 ARG 64 1.436 13.149 -10.534 1224 2HH1 ARG 64 2HH1 ARG 64 0.100 14.071 -11.140 1225 1HH2 ARG 64 1HH2 ARG 64 -2.340 11.944 -9.818 1226 2HH2 ARG 64 2HH2 ARG 64 -2.047 13.385 -10.731 1227 H SER 65 H SER 65 3.179 10.868 -4.632 1228 HA SER 65 HA SER 65 5.079 12.384 -6.164 1229 1HB SER 65 1HB SER 65 3.429 13.309 -4.437 1230 2HB SER 65 2HB SER 65 4.539 12.697 -3.211 1231 HG SER 65 HG SER 65 4.702 14.953 -4.640 1232 H THR 66 H THR 66 5.202 9.889 -3.752 1233 HA THR 66 HA THR 66 7.996 10.300 -3.140 1234 HB THR 66 HB THR 66 7.021 7.697 -2.359 1235 HG1 THR 66 HG1 THR 66 5.413 8.723 -0.856 1236 1HG2 THR 66 1HG2 THR 66 7.309 9.734 -0.286 1237 2HG2 THR 66 2HG2 THR 66 8.692 9.647 -1.377 1238 3HG2 THR 66 3HG2 THR 66 8.168 8.210 -0.500 1239 H VAL 67 H VAL 67 6.055 7.936 -4.938 1240 HA VAL 67 HA VAL 67 8.021 6.131 -5.646 1241 HB VAL 67 HB VAL 67 5.710 7.061 -7.355 1242 1HG1 VAL 67 1HG1 VAL 67 6.823 5.850 -8.905 1243 2HG1 VAL 67 2HG1 VAL 67 7.753 4.958 -7.699 1244 3HG1 VAL 67 3HG1 VAL 67 6.087 4.494 -8.050 1245 1HG2 VAL 67 1HG2 VAL 67 4.337 5.764 -6.144 1246 2HG2 VAL 67 2HG2 VAL 67 5.540 4.487 -5.964 1247 3HG2 VAL 67 3HG2 VAL 67 5.577 5.891 -4.896 1248 H ARG 68 H ARG 68 7.381 9.319 -6.932 1249 HA ARG 68 HA ARG 68 8.786 9.205 -9.327 1250 1HB ARG 68 1HB ARG 68 8.448 11.502 -7.394 1251 2HB ARG 68 2HB ARG 68 9.110 11.671 -9.014 1252 1HG ARG 68 1HG ARG 68 6.566 10.284 -9.019 1253 2HG ARG 68 2HG ARG 68 6.457 11.886 -8.286 1254 1HD ARG 68 1HD ARG 68 6.885 12.952 -10.233 1255 2HD ARG 68 2HD ARG 68 8.011 11.714 -10.785 1256 HE ARG 68 HE ARG 68 5.311 10.791 -10.785 1257 1HH1 ARG 68 1HH1 ARG 68 7.639 12.667 -12.569 1258 2HH1 ARG 68 2HH1 ARG 68 6.871 12.405 -14.100 1259 1HH2 ARG 68 1HH2 ARG 68 4.290 10.439 -12.794 1260 2HH2 ARG 68 2HH2 ARG 68 4.966 11.138 -14.227 1261 H ASP 69 H ASP 69 9.940 9.292 -6.063 1262 HA ASP 69 HA ASP 69 12.620 10.092 -6.738 1263 1HB ASP 69 1HB ASP 69 11.162 10.058 -4.408 1264 2HB ASP 69 2HB ASP 69 12.255 8.694 -4.186 1265 H ILE 70 H ILE 70 10.892 7.085 -6.259 1266 HA ILE 70 HA ILE 70 13.033 5.325 -5.977 1267 HB ILE 70 HB ILE 70 10.408 4.819 -7.383 1268 1HG1 ILE 70 1HG1 ILE 70 11.173 4.196 -4.527 1269 2HG1 ILE 70 2HG1 ILE 70 10.298 5.649 -4.998 1270 1HG2 ILE 70 1HG2 ILE 70 12.724 3.175 -7.037 1271 2HG2 ILE 70 2HG2 ILE 70 11.377 2.498 -6.125 1272 3HG2 ILE 70 3HG2 ILE 70 11.206 2.802 -7.853 1273 1HD1 ILE 70 1HD1 ILE 70 8.620 4.017 -6.069 1274 2HD1 ILE 70 2HD1 ILE 70 9.393 2.804 -5.048 1275 3HD1 ILE 70 3HD1 ILE 70 8.624 4.212 -4.316 1276 H ASP 71 H ASP 71 11.581 6.711 -8.875 1277 HA ASP 71 HA ASP 71 13.911 6.525 -10.408 1278 1HB ASP 71 1HB ASP 71 12.242 4.120 -10.395 1279 2HB ASP 71 2HB ASP 71 12.538 4.751 -12.013 1280 HA PRO 72 HA PRO 72 11.641 9.243 -12.993 1281 1HB PRO 72 1HB PRO 72 12.717 8.766 -15.440 1282 2HB PRO 72 2HB PRO 72 13.588 9.613 -14.156 1283 1HG PRO 72 1HG PRO 72 13.780 6.749 -15.003 1284 2HG PRO 72 2HG PRO 72 15.079 7.880 -14.581 1285 1HD PRO 72 1HD PRO 72 14.157 6.011 -12.853 1286 2HD PRO 72 2HD PRO 72 14.768 7.589 -12.316 1287 H GLN 73 H GLN 73 12.014 6.057 -14.559 1288 HA GLN 73 HA GLN 73 9.380 6.361 -15.784 1289 1HB GLN 73 1HB GLN 73 11.420 4.158 -16.137 1290 2HB GLN 73 2HB GLN 73 9.961 4.387 -17.092 1291 1HG GLN 73 1HG GLN 73 10.808 6.335 -18.107 1292 2HG GLN 73 2HG GLN 73 12.127 6.457 -16.944 1293 1HE2 GLN 73 1HE2 GLN 73 14.026 5.723 -17.566 1294 2HE2 GLN 73 2HE2 GLN 73 14.314 4.614 -18.860 1295 H ASN 74 H ASN 74 7.694 5.742 -14.611 1296 HA ASN 74 HA ASN 74 7.309 3.121 -13.724 1297 1HB ASN 74 1HB ASN 74 8.974 4.416 -11.976 1298 2HB ASN 74 2HB ASN 74 7.397 4.707 -11.248 1299 1HD2 ASN 74 1HD2 ASN 74 9.829 2.390 -11.968 1300 2HD2 ASN 74 2HD2 ASN 74 9.117 1.057 -11.130 1301 H ASP 75 H ASP 75 5.326 2.956 -12.267 1302 HA ASP 75 HA ASP 75 3.582 5.165 -11.983 1303 1HB ASP 75 1HB ASP 75 3.663 4.121 -14.588 1304 2HB ASP 75 2HB ASP 75 2.183 3.486 -13.875 1305 H LEU 76 H LEU 76 2.530 4.623 -10.201 1306 HA LEU 76 HA LEU 76 2.324 1.980 -9.235 1307 1HB LEU 76 1HB LEU 76 1.702 4.620 -8.329 1308 2HB LEU 76 2HB LEU 76 0.333 3.559 -8.005 1309 HG LEU 76 HG LEU 76 1.818 3.709 -6.079 1310 1HD1 LEU 76 1HD1 LEU 76 1.746 1.482 -5.543 1311 2HD1 LEU 76 2HD1 LEU 76 2.285 0.965 -7.140 1312 3HD1 LEU 76 3HD1 LEU 76 0.629 1.527 -6.907 1313 1HD2 LEU 76 1HD2 LEU 76 3.937 2.360 -7.730 1314 2HD2 LEU 76 2HD2 LEU 76 4.078 3.042 -6.109 1315 3HD2 LEU 76 3HD2 LEU 76 3.881 4.108 -7.501 1316 H THR 77 H THR 77 0.608 0.560 -9.130 1317 HA THR 77 HA THR 77 -1.870 1.261 -10.514 1318 HB THR 77 HB THR 77 -0.461 0.246 -12.249 1319 HG1 THR 77 HG1 THR 77 -2.656 -0.203 -12.405 1320 1HG2 THR 77 1HG2 THR 77 -0.357 -2.448 -11.576 1321 2HG2 THR 77 2HG2 THR 77 0.151 -1.613 -10.108 1322 3HG2 THR 77 3HG2 THR 77 1.001 -1.325 -11.626 1323 H PHE 78 H PHE 78 -0.776 0.469 -7.745 1324 HA PHE 78 HA PHE 78 -3.086 -0.917 -6.880 1325 1HB PHE 78 1HB PHE 78 -1.310 -2.658 -7.963 1326 2HB PHE 78 2HB PHE 78 -0.755 -2.636 -6.293 1327 HD1 PHE 78 HD1 PHE 78 -3.093 -2.485 -4.691 1328 HD2 PHE 78 HD2 PHE 78 -2.524 -4.558 -8.365 1329 HE1 PHE 78 HE1 PHE 78 -4.881 -4.060 -4.076 1330 HE2 PHE 78 HE2 PHE 78 -4.312 -6.135 -7.756 1331 HZ PHE 78 HZ PHE 78 -5.494 -5.887 -5.610 1332 H LEU 79 H LEU 79 -3.445 -0.246 -4.873 1333 HA LEU 79 HA LEU 79 -1.154 0.272 -3.109 1334 1HB LEU 79 1HB LEU 79 -2.960 2.208 -4.207 1335 2HB LEU 79 2HB LEU 79 -3.155 2.143 -2.457 1336 HG LEU 79 HG LEU 79 -0.846 2.706 -2.120 1337 1HD1 LEU 79 1HD1 LEU 79 0.208 1.506 -3.897 1338 2HD1 LEU 79 2HD1 LEU 79 0.617 3.212 -4.072 1339 3HD1 LEU 79 3HD1 LEU 79 -0.607 2.487 -5.114 1340 1HD2 LEU 79 1HD2 LEU 79 -1.065 4.910 -2.569 1341 2HD2 LEU 79 2HD2 LEU 79 -2.702 4.425 -3.013 1342 3HD2 LEU 79 3HD2 LEU 79 -1.475 4.638 -4.263 1343 H ARG 80 H ARG 80 -1.448 -1.383 -1.715 1344 HA ARG 80 HA ARG 80 -4.095 -1.634 -0.445 1345 1HB ARG 80 1HB ARG 80 -2.679 -3.591 -1.740 1346 2HB ARG 80 2HB ARG 80 -2.206 -3.850 -0.066 1347 1HG ARG 80 1HG ARG 80 -4.291 -4.497 0.574 1348 2HG ARG 80 2HG ARG 80 -5.093 -3.505 -0.646 1349 1HD ARG 80 1HD ARG 80 -4.608 -5.059 -2.362 1350 2HD ARG 80 2HD ARG 80 -3.464 -5.933 -1.346 1351 HE ARG 80 HE ARG 80 -6.330 -6.219 -1.381 1352 1HH1 ARG 80 1HH1 ARG 80 -3.409 -6.692 0.453 1353 2HH1 ARG 80 2HH1 ARG 80 -4.081 -7.942 1.447 1354 1HH2 ARG 80 1HH2 ARG 80 -7.226 -7.863 -0.079 1355 2HH2 ARG 80 2HH2 ARG 80 -6.252 -8.608 1.143 1356 H ILE 81 H ILE 81 -4.259 -1.532 1.743 1357 HA ILE 81 HA ILE 81 -1.792 -1.361 3.322 1358 HB ILE 81 HB ILE 81 -4.063 0.584 3.705 1359 1HG1 ILE 81 1HG1 ILE 81 -1.960 2.086 2.811 1360 2HG1 ILE 81 2HG1 ILE 81 -1.795 0.636 1.828 1361 1HG2 ILE 81 1HG2 ILE 81 -1.904 1.742 4.798 1362 2HG2 ILE 81 2HG2 ILE 81 -2.989 0.678 5.690 1363 3HG2 ILE 81 3HG2 ILE 81 -1.482 0.046 5.030 1364 1HD1 ILE 81 1HD1 ILE 81 -3.221 1.685 0.467 1365 2HD1 ILE 81 2HD1 ILE 81 -4.450 1.125 1.603 1366 3HD1 ILE 81 3HD1 ILE 81 -3.803 2.760 1.738 1367 H ARG 82 H ARG 82 -2.062 -3.196 4.477 1368 HA ARG 82 HA ARG 82 -4.591 -4.056 5.486 1369 1HB ARG 82 1HB ARG 82 -2.244 -5.317 5.005 1370 2HB ARG 82 2HB ARG 82 -2.130 -5.104 6.746 1371 1HG ARG 82 1HG ARG 82 -4.628 -6.057 6.582 1372 2HG ARG 82 2HG ARG 82 -3.921 -6.823 5.157 1373 1HD ARG 82 1HD ARG 82 -3.385 -8.396 6.712 1374 2HD ARG 82 2HD ARG 82 -1.974 -7.353 6.877 1375 HE ARG 82 HE ARG 82 -3.991 -6.494 8.643 1376 1HH1 ARG 82 1HH1 ARG 82 -1.733 -9.103 8.182 1377 2HH1 ARG 82 2HH1 ARG 82 -1.601 -9.461 9.872 1378 1HH2 ARG 82 1HH2 ARG 82 -3.827 -6.956 10.870 1379 2HH2 ARG 82 2HH2 ARG 82 -2.794 -8.240 11.400 1380 H SER 83 H SER 83 -5.618 -3.205 7.159 1381 HA SER 83 HA SER 83 -4.046 -1.865 9.254 1382 1HB SER 83 1HB SER 83 -6.946 -1.418 9.276 1383 2HB SER 83 2HB SER 83 -5.625 -0.252 9.349 1384 HG SER 83 HG SER 83 -7.167 -0.610 7.337 1385 H LYS 84 H LYS 84 -5.833 -1.767 11.292 1386 HA LYS 84 HA LYS 84 -5.908 -4.560 12.141 1387 1HB LYS 84 1HB LYS 84 -6.145 -1.957 13.649 1388 2HB LYS 84 2HB LYS 84 -6.394 -3.525 14.404 1389 1HG LYS 84 1HG LYS 84 -4.042 -4.069 13.448 1390 2HG LYS 84 2HG LYS 84 -3.882 -2.314 13.342 1391 1HD LYS 84 1HD LYS 84 -3.018 -2.771 15.444 1392 2HD LYS 84 2HD LYS 84 -4.692 -2.343 15.807 1393 1HE LYS 84 1HE LYS 84 -5.274 -4.727 15.863 1394 2HE LYS 84 2HE LYS 84 -3.594 -5.140 15.526 1395 1HZ LYS 84 1HZ LYS 84 -2.970 -4.037 17.603 1396 2HZ LYS 84 2HZ LYS 84 -4.043 -5.316 17.873 1397 3HZ LYS 84 3HZ LYS 84 -4.599 -3.719 17.933 1398 H LYS 85 H LYS 85 -8.010 -1.940 11.301 1399 HA LYS 85 HA LYS 85 -10.358 -3.243 12.421 1400 1HB LYS 85 1HB LYS 85 -9.775 -0.594 11.190 1401 2HB LYS 85 2HB LYS 85 -11.424 -1.197 11.089 1402 1HG LYS 85 1HG LYS 85 -10.078 -1.255 13.734 1403 2HG LYS 85 2HG LYS 85 -10.606 0.304 13.097 1404 1HD LYS 85 1HD LYS 85 -12.518 -1.975 13.011 1405 2HD LYS 85 2HD LYS 85 -12.202 -1.209 14.569 1406 1HE LYS 85 1HE LYS 85 -12.571 0.976 13.047 1407 2HE LYS 85 2HE LYS 85 -13.597 -0.167 12.181 1408 1HZ LYS 85 1HZ LYS 85 -13.812 0.709 14.998 1409 2HZ LYS 85 2HZ LYS 85 -14.592 -0.681 14.434 1410 3HZ LYS 85 3HZ LYS 85 -14.971 0.828 13.771 1411 H ASN 86 H ASN 86 -8.852 -2.640 9.308 1412 HA ASN 86 HA ASN 86 -10.038 -4.837 8.055 1413 1HB ASN 86 1HB ASN 86 -11.525 -3.567 6.438 1414 2HB ASN 86 2HB ASN 86 -12.139 -3.717 8.081 1415 1HD2 ASN 86 1HD2 ASN 86 -12.801 -1.937 9.050 1416 2HD2 ASN 86 2HD2 ASN 86 -12.434 -0.322 8.559 1417 H GLU 87 H GLU 87 -9.692 -4.793 5.638 1418 HA GLU 87 HA GLU 87 -7.182 -3.380 5.095 1419 1HB GLU 87 1HB GLU 87 -7.131 -5.810 4.843 1420 2HB GLU 87 2HB GLU 87 -8.458 -5.735 3.693 1421 1HG GLU 87 1HG GLU 87 -7.082 -5.334 2.006 1422 2HG GLU 87 2HG GLU 87 -6.286 -4.025 2.879 1423 H ILE 88 H ILE 88 -7.130 -1.706 3.756 1424 HA ILE 88 HA ILE 88 -9.426 -1.281 1.960 1425 HB ILE 88 HB ILE 88 -7.536 0.840 2.974 1426 1HG1 ILE 88 1HG1 ILE 88 -10.288 0.102 3.996 1427 2HG1 ILE 88 2HG1 ILE 88 -8.772 -0.164 4.850 1428 1HG2 ILE 88 1HG2 ILE 88 -9.001 1.040 0.809 1429 2HG2 ILE 88 2HG2 ILE 88 -10.294 1.344 1.967 1430 3HG2 ILE 88 3HG2 ILE 88 -8.875 2.389 1.937 1431 1HD1 ILE 88 1HD1 ILE 88 -9.627 1.753 5.825 1432 2HD1 ILE 88 2HD1 ILE 88 -8.465 2.378 4.654 1433 3HD1 ILE 88 3HD1 ILE 88 -10.190 2.404 4.286 1434 H MET 89 H MET 89 -8.940 -1.836 -0.058 1435 HA MET 89 HA MET 89 -6.220 -1.322 -1.053 1436 1HB MET 89 1HB MET 89 -6.629 -3.009 -2.730 1437 2HB MET 89 2HB MET 89 -7.027 -3.670 -1.149 1438 1HG MET 89 1HG MET 89 -8.896 -4.358 -2.154 1439 2HG MET 89 2HG MET 89 -9.431 -2.696 -1.919 1440 1HE MET 89 1HE MET 89 -10.099 -4.688 -5.502 1441 2HE MET 89 2HE MET 89 -8.573 -5.369 -4.938 1442 3HE MET 89 3HE MET 89 -9.938 -5.224 -3.830 1443 H VAL 90 H VAL 90 -5.880 0.084 -2.671 1444 HA VAL 90 HA VAL 90 -8.129 0.976 -4.312 1445 HB VAL 90 HB VAL 90 -6.322 2.933 -2.889 1446 1HG1 VAL 90 1HG1 VAL 90 -8.625 4.191 -3.849 1447 2HG1 VAL 90 2HG1 VAL 90 -6.982 4.346 -4.474 1448 3HG1 VAL 90 3HG1 VAL 90 -8.078 3.146 -5.160 1449 1HG2 VAL 90 1HG2 VAL 90 -7.683 2.261 -1.165 1450 2HG2 VAL 90 2HG2 VAL 90 -8.656 3.555 -1.865 1451 3HG2 VAL 90 3HG2 VAL 90 -9.030 1.871 -2.235 1452 H ALA 91 H ALA 91 -7.569 1.608 -6.359 1453 HA ALA 91 HA ALA 91 -4.756 1.954 -7.037 1454 1HB ALA 91 1HB ALA 91 -4.465 0.072 -8.211 1455 2HB ALA 91 2HB ALA 91 -5.843 -0.539 -7.295 1456 3HB ALA 91 3HB ALA 91 -6.085 0.141 -8.905 1457 HA PRO 92 HA PRO 92 -6.268 4.860 -9.957 1458 1HB PRO 92 1HB PRO 92 -4.481 4.611 -11.985 1459 2HB PRO 92 2HB PRO 92 -4.078 5.363 -10.437 1460 1HG PRO 92 1HG PRO 92 -3.514 2.584 -11.396 1461 2HG PRO 92 2HG PRO 92 -2.455 3.700 -10.514 1462 1HD PRO 92 1HD PRO 92 -3.776 1.674 -9.295 1463 2HD PRO 92 2HD PRO 92 -3.426 3.213 -8.481 1464 H ASP 93 H ASP 93 -7.934 4.821 -11.322 1465 HA ASP 93 HA ASP 93 -8.243 2.486 -13.090 1466 1HB ASP 93 1HB ASP 93 -9.999 3.467 -11.182 1467 2HB ASP 93 2HB ASP 93 -10.643 4.097 -12.696 1468 H LYS 94 H LYS 94 -10.190 3.410 -14.774 1469 HA LYS 94 HA LYS 94 -8.807 4.689 -16.779 1470 1HB LYS 94 1HB LYS 94 -11.507 3.864 -16.311 1471 2HB LYS 94 2HB LYS 94 -11.527 5.465 -17.038 1472 1HG LYS 94 1HG LYS 94 -9.727 4.263 -18.629 1473 2HG LYS 94 2HG LYS 94 -10.717 2.873 -18.178 1474 1HD LYS 94 1HD LYS 94 -12.352 5.167 -18.839 1475 2HD LYS 94 2HD LYS 94 -11.264 4.748 -20.165 1476 1HE LYS 94 1HE LYS 94 -12.178 2.632 -20.414 1477 2HE LYS 94 2HE LYS 94 -12.834 2.613 -18.778 1478 1HZ LYS 94 1HZ LYS 94 -14.744 3.099 -19.808 1479 2HZ LYS 94 2HZ LYS 94 -13.986 3.656 -21.213 1480 3HZ LYS 94 3HZ LYS 94 -14.146 4.680 -19.876 1481 H ASP 95 H ASP 95 -11.111 6.184 -14.509 1482 HA ASP 95 HA ASP 95 -9.592 8.647 -14.564 1483 1HB ASP 95 1HB ASP 95 -11.424 10.064 -15.274 1484 2HB ASP 95 2HB ASP 95 -11.117 8.853 -16.516 1485 H TYR 96 H TYR 96 -10.676 6.465 -12.725 1486 HA TYR 96 HA TYR 96 -11.513 8.296 -10.612 1487 1HB TYR 96 1HB TYR 96 -13.257 6.544 -9.915 1488 2HB TYR 96 2HB TYR 96 -13.652 7.582 -11.280 1489 HD1 TYR 96 HD1 TYR 96 -12.989 4.182 -10.188 1490 HD2 TYR 96 HD2 TYR 96 -13.579 6.679 -13.583 1491 HE1 TYR 96 HE1 TYR 96 -13.403 2.192 -11.573 1492 HE2 TYR 96 HE2 TYR 96 -13.996 4.695 -14.976 1493 HH TYR 96 HH TYR 96 -14.365 1.528 -13.601 1494 H PHE 97 H PHE 97 -11.622 7.061 -8.460 1495 HA PHE 97 HA PHE 97 -9.409 5.117 -8.381 1496 1HB PHE 97 1HB PHE 97 -10.126 7.366 -6.515 1497 2HB PHE 97 2HB PHE 97 -9.140 6.012 -5.973 1498 HD1 PHE 97 HD1 PHE 97 -8.950 9.240 -7.072 1499 HD2 PHE 97 HD2 PHE 97 -7.218 5.429 -7.837 1500 HE1 PHE 97 HE1 PHE 97 -6.949 10.338 -7.991 1501 HE2 PHE 97 HE2 PHE 97 -5.214 6.520 -8.757 1502 HZ PHE 97 HZ PHE 97 -5.077 8.978 -8.834 1503 H LEU 98 H LEU 98 -10.316 3.169 -8.144 1504 HA LEU 98 HA LEU 98 -12.765 2.761 -6.712 1505 1HB LEU 98 1HB LEU 98 -11.672 1.433 -8.708 1506 2HB LEU 98 2HB LEU 98 -10.935 0.514 -7.398 1507 HG LEU 98 HG LEU 98 -13.889 0.898 -7.375 1508 1HD1 LEU 98 1HD1 LEU 98 -14.329 -0.772 -8.935 1509 2HD1 LEU 98 2HD1 LEU 98 -12.656 -1.326 -8.960 1510 3HD1 LEU 98 3HD1 LEU 98 -13.087 0.207 -9.716 1511 1HD2 LEU 98 1HD2 LEU 98 -12.841 -1.736 -6.839 1512 2HD2 LEU 98 2HD2 LEU 98 -13.778 -0.664 -5.797 1513 3HD2 LEU 98 3HD2 LEU 98 -12.021 -0.516 -5.865 1514 H ILE 99 H ILE 99 -13.077 2.039 -4.675 1515 HA ILE 99 HA ILE 99 -10.721 1.256 -3.101 1516 HB ILE 99 HB ILE 99 -12.890 3.073 -2.053 1517 1HG1 ILE 99 1HG1 ILE 99 -10.444 4.438 -2.067 1518 2HG1 ILE 99 2HG1 ILE 99 -10.543 3.667 -3.646 1519 1HG2 ILE 99 1HG2 ILE 99 -10.557 1.705 -0.882 1520 2HG2 ILE 99 2HG2 ILE 99 -10.790 3.384 -0.398 1521 3HG2 ILE 99 3HG2 ILE 99 -12.075 2.204 -0.136 1522 1HD1 ILE 99 1HD1 ILE 99 -11.461 5.899 -3.726 1523 2HD1 ILE 99 2HD1 ILE 99 -12.733 4.708 -3.998 1524 3HD1 ILE 99 3HD1 ILE 99 -12.591 5.506 -2.432 1525 H VAL 100 H VAL 100 -11.056 -0.760 -2.453 1526 HA VAL 100 HA VAL 100 -13.794 -1.594 -1.762 1527 HB VAL 100 HB VAL 100 -11.427 -3.307 -2.531 1528 1HG1 VAL 100 1HG1 VAL 100 -14.140 -3.933 -1.494 1529 2HG1 VAL 100 2HG1 VAL 100 -13.459 -4.987 -2.734 1530 3HG1 VAL 100 3HG1 VAL 100 -12.604 -4.750 -1.209 1531 1HG2 VAL 100 1HG2 VAL 100 -12.067 -2.450 -4.551 1532 2HG2 VAL 100 2HG2 VAL 100 -13.174 -3.818 -4.445 1533 3HG2 VAL 100 3HG2 VAL 100 -13.736 -2.196 -4.041 1534 H ILE 101 H ILE 101 -14.164 -1.563 0.351 1535 HA ILE 101 HA ILE 101 -11.959 -2.195 2.192 1536 HB ILE 101 HB ILE 101 -14.567 -0.780 2.760 1537 1HG1 ILE 101 1HG1 ILE 101 -12.030 0.643 3.161 1538 2HG1 ILE 101 2HG1 ILE 101 -12.353 0.227 1.482 1539 1HG2 ILE 101 1HG2 ILE 101 -12.760 -2.107 4.497 1540 2HG2 ILE 101 2HG2 ILE 101 -12.609 -0.373 4.775 1541 3HG2 ILE 101 3HG2 ILE 101 -14.184 -1.154 4.913 1542 1HD1 ILE 101 1HD1 ILE 101 -13.151 2.492 2.318 1543 2HD1 ILE 101 2HD1 ILE 101 -14.309 1.501 1.428 1544 3HD1 ILE 101 3HD1 ILE 101 -14.399 1.598 3.187 1545 H GLN 102 H GLN 102 -12.003 -4.015 3.340 1546 HA GLN 102 HA GLN 102 -14.403 -5.237 4.264 1547 1HB GLN 102 1HB GLN 102 -14.355 -7.275 2.988 1548 2HB GLN 102 2HB GLN 102 -14.433 -5.921 1.868 1549 1HG GLN 102 1HG GLN 102 -12.029 -6.116 1.469 1550 2HG GLN 102 2HG GLN 102 -11.959 -7.480 2.583 1551 1HE2 GLN 102 1HE2 GLN 102 -11.979 -6.720 -0.560 1552 2HE2 GLN 102 2HE2 GLN 102 -12.696 -8.144 -1.224 1553 H ASN 103 H ASN 103 -13.841 -7.546 5.139 1554 HA ASN 103 HA ASN 103 -11.957 -7.294 7.138 1555 1HB ASN 103 1HB ASN 103 -13.488 -9.529 5.961 1556 2HB ASN 103 2HB ASN 103 -12.037 -9.994 6.845 1557 1HD2 ASN 103 1HD2 ASN 103 -15.177 -8.527 7.051 1558 2HD2 ASN 103 2HD2 ASN 103 -15.307 -8.569 8.774 1559 HA PRO 104 HA PRO 104 -7.985 -8.092 5.456 1560 1HB PRO 104 1HB PRO 104 -6.832 -9.631 7.373 1561 2HB PRO 104 2HB PRO 104 -7.147 -7.905 7.587 1562 1HG PRO 104 1HG PRO 104 -8.729 -10.253 8.557 1563 2HG PRO 104 2HG PRO 104 -8.308 -8.758 9.412 1564 1HD PRO 104 1HD PRO 104 -10.741 -9.161 8.295 1565 2HD PRO 104 2HD PRO 104 -9.992 -7.555 8.398 1566 H THR 105 H THR 105 -6.772 -9.579 4.300 1567 HA THR 105 HA THR 105 -7.993 -12.244 4.009 1568 HB THR 105 HB THR 105 -6.892 -12.264 1.744 1569 HG1 THR 105 HG1 THR 105 -5.376 -10.675 1.852 1570 1HG2 THR 105 1HG2 THR 105 -8.514 -10.462 0.812 1571 2HG2 THR 105 2HG2 THR 105 -9.045 -10.318 2.488 1572 3HG2 THR 105 3HG2 THR 105 -9.179 -11.864 1.650 1573 H GLU 106 H GLU 106 -4.976 -10.484 4.371 1574 HA GLU 106 HA GLU 106 -3.639 -13.037 4.968 1575 1HB GLU 106 1HB GLU 106 -3.012 -11.216 2.876 1576 2HB GLU 106 2HB GLU 106 -1.721 -11.125 4.065 1577 1HG GLU 106 1HG GLU 106 -1.020 -13.247 3.680 1578 2HG GLU 106 2HG GLU 106 -2.632 -13.822 3.258 Start of MODEL 2 1 H MET 11 H MET 11 18.345 -9.244 15.067 2 HA MET 11 HA MET 11 18.039 -8.221 12.384 3 1HB MET 11 1HB MET 11 19.843 -7.318 13.671 4 2HB MET 11 2HB MET 11 20.454 -8.923 14.052 5 1HG MET 11 1HG MET 11 21.674 -8.994 12.204 6 2HG MET 11 2HG MET 11 20.313 -8.497 11.201 7 1HE MET 11 1HE MET 11 22.273 -5.777 9.736 8 2HE MET 11 2HE MET 11 21.573 -7.390 9.607 9 3HE MET 11 3HE MET 11 20.527 -5.993 9.865 10 H ALA 12 H ALA 12 19.431 -11.145 13.862 11 HA ALA 12 HA ALA 12 20.218 -12.481 11.581 12 1HB ALA 12 1HB ALA 12 19.148 -14.441 13.292 13 2HB ALA 12 2HB ALA 12 20.827 -13.919 13.156 14 3HB ALA 12 3HB ALA 12 19.756 -13.147 14.325 15 H GLU 13 H GLU 13 17.003 -12.315 13.042 16 HA GLU 13 HA GLU 13 15.681 -14.234 11.555 17 1HB GLU 13 1HB GLU 13 14.791 -12.801 13.474 18 2HB GLU 13 2HB GLU 13 14.453 -11.574 12.261 19 1HG GLU 13 1HG GLU 13 12.952 -13.070 11.109 20 2HG GLU 13 2HG GLU 13 13.351 -14.374 12.224 21 H VAL 14 H VAL 14 16.073 -10.781 10.774 22 HA VAL 14 HA VAL 14 14.775 -10.890 8.277 23 HB VAL 14 HB VAL 14 16.964 -8.963 9.053 24 1HG1 VAL 14 1HG1 VAL 14 14.850 -9.023 6.949 25 2HG1 VAL 14 2HG1 VAL 14 15.379 -7.472 7.604 26 3HG1 VAL 14 3HG1 VAL 14 16.543 -8.547 6.829 27 1HG2 VAL 14 1HG2 VAL 14 15.376 -8.939 10.836 28 2HG2 VAL 14 2HG2 VAL 14 15.079 -7.514 9.840 29 3HG2 VAL 14 3HG2 VAL 14 14.022 -8.920 9.706 30 H GLU 15 H GLU 15 18.075 -11.534 9.256 31 HA GLU 15 HA GLU 15 19.199 -11.535 6.644 32 1HB GLU 15 1HB GLU 15 20.102 -12.668 9.283 33 2HB GLU 15 2HB GLU 15 21.034 -12.896 7.810 34 1HG GLU 15 1HG GLU 15 21.222 -10.473 7.554 35 2HG GLU 15 2HG GLU 15 20.294 -10.248 9.036 36 H GLU 16 H GLU 16 17.889 -14.059 8.748 37 HA GLU 16 HA GLU 16 18.575 -16.278 7.191 38 1HB GLU 16 1HB GLU 16 17.264 -15.888 9.570 39 2HB GLU 16 2HB GLU 16 15.971 -16.470 8.530 40 1HG GLU 16 1HG GLU 16 17.881 -18.254 7.921 41 2HG GLU 16 2HG GLU 16 18.337 -17.873 9.581 42 H THR 17 H THR 17 15.888 -14.033 6.962 43 HA THR 17 HA THR 17 14.499 -15.568 4.959 44 HB THR 17 HB THR 17 14.081 -12.717 5.877 45 HG1 THR 17 HG1 THR 17 13.516 -14.041 7.538 46 1HG2 THR 17 1HG2 THR 17 13.135 -12.876 3.710 47 2HG2 THR 17 2HG2 THR 17 11.795 -13.089 4.837 48 3HG2 THR 17 3HG2 THR 17 12.498 -14.489 4.027 49 H LEU 18 H LEU 18 16.933 -13.107 5.016 50 HA LEU 18 HA LEU 18 16.565 -12.165 2.352 51 1HB LEU 18 1HB LEU 18 18.326 -11.655 4.566 52 2HB LEU 18 2HB LEU 18 19.251 -11.797 3.073 53 HG LEU 18 HG LEU 18 17.367 -10.110 2.223 54 1HD1 LEU 18 1HD1 LEU 18 17.014 -8.438 4.075 55 2HD1 LEU 18 2HD1 LEU 18 17.532 -9.695 5.198 56 3HD1 LEU 18 3HD1 LEU 18 16.092 -9.936 4.208 57 1HD2 LEU 18 1HD2 LEU 18 19.785 -9.760 2.131 58 2HD2 LEU 18 2HD2 LEU 18 19.788 -9.311 3.837 59 3HD2 LEU 18 3HD2 LEU 18 18.944 -8.303 2.661 60 H LYS 19 H LYS 19 18.675 -14.583 3.846 61 HA LYS 19 HA LYS 19 20.247 -15.219 1.640 62 1HB LYS 19 1HB LYS 19 19.273 -16.995 3.884 63 2HB LYS 19 2HB LYS 19 20.529 -17.448 2.738 64 1HG LYS 19 1HG LYS 19 21.017 -14.882 4.036 65 2HG LYS 19 2HG LYS 19 20.932 -16.242 5.159 66 1HD LYS 19 1HD LYS 19 22.520 -16.639 2.690 67 2HD LYS 19 2HD LYS 19 23.183 -15.533 3.895 68 1HE LYS 19 1HE LYS 19 22.141 -18.111 4.897 69 2HE LYS 19 2HE LYS 19 23.610 -18.183 3.925 70 1HZ LYS 19 1HZ LYS 19 24.541 -17.824 5.937 71 2HZ LYS 19 2HZ LYS 19 23.187 -17.032 6.568 72 3HZ LYS 19 3HZ LYS 19 24.250 -16.205 5.544 73 H ARG 20 H ARG 20 17.198 -16.726 2.698 74 HA ARG 20 HA ARG 20 17.006 -18.517 0.526 75 1HB ARG 20 1HB ARG 20 15.751 -18.575 2.760 76 2HB ARG 20 2HB ARG 20 14.651 -17.407 2.040 77 1HG ARG 20 1HG ARG 20 13.510 -19.246 1.447 78 2HG ARG 20 2HG ARG 20 14.668 -19.291 0.116 79 1HD ARG 20 1HD ARG 20 16.126 -20.698 1.677 80 2HD ARG 20 2HD ARG 20 14.677 -20.876 2.666 81 HE ARG 20 HE ARG 20 14.292 -21.555 -0.103 82 1HH1 ARG 20 1HH1 ARG 20 15.274 -22.714 3.029 83 2HH1 ARG 20 2HH1 ARG 20 14.925 -24.372 2.669 84 1HH2 ARG 20 1HH2 ARG 20 13.828 -23.735 -0.589 85 2HH2 ARG 20 2HH2 ARG 20 14.103 -24.952 0.611 86 H LEU 21 H LEU 21 15.854 -15.226 1.019 87 HA LEU 21 HA LEU 21 14.199 -15.060 -1.253 88 1HB LEU 21 1HB LEU 21 15.368 -13.221 0.693 89 2HB LEU 21 2HB LEU 21 15.143 -12.509 -0.903 90 HG LEU 21 HG LEU 21 12.779 -12.935 -0.822 91 1HD1 LEU 21 1HD1 LEU 21 13.541 -14.848 1.182 92 2HD1 LEU 21 2HD1 LEU 21 12.018 -14.684 0.308 93 3HD1 LEU 21 3HD1 LEU 21 12.282 -13.777 1.797 94 1HD2 LEU 21 1HD2 LEU 21 12.191 -11.629 1.258 95 2HD2 LEU 21 2HD2 LEU 21 13.370 -10.877 0.183 96 3HD2 LEU 21 3HD2 LEU 21 13.907 -11.670 1.664 97 H GLN 22 H GLN 22 17.559 -13.973 -0.767 98 HA GLN 22 HA GLN 22 17.957 -13.194 -3.457 99 1HB GLN 22 1HB GLN 22 19.404 -13.053 -1.062 100 2HB GLN 22 2HB GLN 22 20.406 -14.005 -2.150 101 1HG GLN 22 1HG GLN 22 20.992 -12.215 -3.317 102 2HG GLN 22 2HG GLN 22 19.318 -11.687 -3.481 103 1HE2 GLN 22 1HE2 GLN 22 18.538 -11.131 -0.995 104 2HE2 GLN 22 2HE2 GLN 22 19.503 -9.877 -0.301 105 H SER 23 H SER 23 17.850 -16.243 -1.954 106 HA SER 23 HA SER 23 19.546 -17.574 -3.887 107 1HB SER 23 1HB SER 23 18.202 -18.293 -1.374 108 2HB SER 23 2HB SER 23 18.205 -19.579 -2.580 109 HG SER 23 HG SER 23 20.395 -19.581 -2.586 110 H GLN 24 H GLN 24 16.207 -16.800 -3.491 111 HA GLN 24 HA GLN 24 15.390 -18.710 -5.547 112 1HB GLN 24 1HB GLN 24 13.108 -18.078 -4.981 113 2HB GLN 24 2HB GLN 24 13.998 -18.515 -3.529 114 1HG GLN 24 1HG GLN 24 14.174 -16.277 -2.835 115 2HG GLN 24 2HG GLN 24 13.684 -15.667 -4.414 116 1HE2 GLN 24 1HE2 GLN 24 12.415 -14.683 -2.288 117 2HE2 GLN 24 2HE2 GLN 24 10.809 -15.308 -2.172 118 H LYS 25 H LYS 25 14.255 -18.046 -7.430 119 HA LYS 25 HA LYS 25 15.299 -15.617 -8.570 120 1HB LYS 25 1HB LYS 25 15.122 -17.692 -9.890 121 2HB LYS 25 2HB LYS 25 13.372 -17.641 -9.725 122 1HG LYS 25 1HG LYS 25 13.149 -15.876 -11.183 123 2HG LYS 25 2HG LYS 25 14.800 -15.311 -10.918 124 1HD LYS 25 1HD LYS 25 15.453 -17.592 -12.004 125 2HD LYS 25 2HD LYS 25 13.809 -17.542 -12.645 126 1HE LYS 25 1HE LYS 25 14.470 -16.152 -14.244 127 2HE LYS 25 2HE LYS 25 14.985 -14.985 -13.028 128 1HZ LYS 25 1HZ LYS 25 16.998 -16.767 -12.997 129 2HZ LYS 25 2HZ LYS 25 17.002 -15.332 -13.892 130 3HZ LYS 25 3HZ LYS 25 16.564 -16.789 -14.632 131 H GLY 26 H GLY 26 14.290 -13.713 -8.820 132 1HA GLY 26 1HA GLY 26 12.054 -12.691 -9.392 133 2HA GLY 26 2HA GLY 26 11.457 -13.576 -7.996 134 H VAL 27 H VAL 27 13.735 -13.108 -6.320 135 HA VAL 27 HA VAL 27 12.982 -10.608 -5.214 136 HB VAL 27 HB VAL 27 15.392 -12.322 -4.595 137 1HG1 VAL 27 1HG1 VAL 27 14.706 -10.921 -2.321 138 2HG1 VAL 27 2HG1 VAL 27 16.062 -10.565 -3.392 139 3HG1 VAL 27 3HG1 VAL 27 14.524 -9.729 -3.608 140 1HG2 VAL 27 1HG2 VAL 27 12.677 -12.177 -3.288 141 2HG2 VAL 27 2HG2 VAL 27 13.301 -13.515 -4.253 142 3HG2 VAL 27 3HG2 VAL 27 14.045 -13.124 -2.703 143 H GLN 28 H GLN 28 13.725 -8.622 -5.589 144 HA GLN 28 HA GLN 28 15.950 -8.300 -7.456 145 1HB GLN 28 1HB GLN 28 13.533 -6.795 -6.810 146 2HB GLN 28 2HB GLN 28 14.960 -5.773 -6.923 147 1HG GLN 28 1HG GLN 28 15.341 -6.351 -9.154 148 2HG GLN 28 2HG GLN 28 14.280 -7.756 -9.062 149 1HE2 GLN 28 1HE2 GLN 28 12.409 -7.512 -10.029 150 2HE2 GLN 28 2HE2 GLN 28 11.559 -6.026 -10.256 151 H GLY 29 H GLY 29 15.047 -7.659 -4.146 152 1HA GLY 29 1HA GLY 29 17.557 -7.532 -3.083 153 2HA GLY 29 2HA GLY 29 17.247 -5.886 -3.614 154 H ILE 30 H ILE 30 17.564 -7.137 -0.903 155 HA ILE 30 HA ILE 30 15.002 -6.236 0.243 156 HB ILE 30 HB ILE 30 16.940 -8.134 1.560 157 1HG1 ILE 30 1HG1 ILE 30 14.858 -9.716 1.006 158 2HG1 ILE 30 2HG1 ILE 30 14.714 -8.613 -0.358 159 1HG2 ILE 30 1HG2 ILE 30 14.971 -8.629 2.993 160 2HG2 ILE 30 2HG2 ILE 30 15.552 -6.971 3.133 161 3HG2 ILE 30 3HG2 ILE 30 14.107 -7.321 2.185 162 1HD1 ILE 30 1HD1 ILE 30 16.680 -9.307 -1.299 163 2HD1 ILE 30 2HD1 ILE 30 17.361 -9.829 0.242 164 3HD1 ILE 30 3HD1 ILE 30 16.119 -10.801 -0.548 165 H ILE 31 H ILE 31 15.039 -4.882 2.029 166 HA ILE 31 HA ILE 31 17.670 -3.850 2.845 167 HB ILE 31 HB ILE 31 15.237 -2.165 2.240 168 1HG1 ILE 31 1HG1 ILE 31 17.815 -1.671 0.882 169 2HG1 ILE 31 2HG1 ILE 31 17.003 -3.168 0.436 170 1HG2 ILE 31 1HG2 ILE 31 17.923 -1.481 3.403 171 2HG2 ILE 31 2HG2 ILE 31 16.871 -0.277 2.661 172 3HG2 ILE 31 3HG2 ILE 31 16.326 -1.169 4.081 173 1HD1 ILE 31 1HD1 ILE 31 15.320 -0.755 0.482 174 2HD1 ILE 31 2HD1 ILE 31 16.562 -0.820 -0.768 175 3HD1 ILE 31 3HD1 ILE 31 15.355 -2.100 -0.657 176 H VAL 32 H VAL 32 17.868 -3.227 4.976 177 HA VAL 32 HA VAL 32 15.514 -3.648 6.696 178 HB VAL 32 HB VAL 32 18.295 -4.383 7.574 179 1HG1 VAL 32 1HG1 VAL 32 16.603 -4.044 9.306 180 2HG1 VAL 32 2HG1 VAL 32 15.559 -5.231 8.523 181 3HG1 VAL 32 3HG1 VAL 32 17.101 -5.733 9.218 182 1HG2 VAL 32 1HG2 VAL 32 17.716 -6.734 7.059 183 2HG2 VAL 32 2HG2 VAL 32 16.273 -6.167 6.219 184 3HG2 VAL 32 3HG2 VAL 32 17.872 -5.731 5.617 185 H VAL 33 H VAL 33 15.024 -1.636 7.339 186 HA VAL 33 HA VAL 33 17.206 0.112 8.259 187 HB VAL 33 HB VAL 33 14.380 0.966 7.649 188 1HG1 VAL 33 1HG1 VAL 33 15.352 3.191 7.517 189 2HG1 VAL 33 2HG1 VAL 33 15.702 2.457 9.083 190 3HG1 VAL 33 3HG1 VAL 33 16.954 2.528 7.842 191 1HG2 VAL 33 1HG2 VAL 33 15.303 0.017 5.624 192 2HG2 VAL 33 2HG2 VAL 33 15.250 1.774 5.483 193 3HG2 VAL 33 3HG2 VAL 33 16.779 0.962 5.820 194 H ASN 34 H ASN 34 17.185 0.990 10.291 195 HA ASN 34 HA ASN 34 15.696 -0.412 12.289 196 1HB ASN 34 1HB ASN 34 17.629 1.902 12.392 197 2HB ASN 34 2HB ASN 34 16.827 1.283 13.833 198 1HD2 ASN 34 1HD2 ASN 34 19.480 1.244 13.832 199 2HD2 ASN 34 2HD2 ASN 34 20.087 -0.361 13.626 200 H THR 35 H THR 35 14.908 1.250 14.179 201 HA THR 35 HA THR 35 12.503 2.379 13.122 202 HB THR 35 HB THR 35 12.807 3.288 15.766 203 HG1 THR 35 HG1 THR 35 13.786 1.704 16.836 204 1HG2 THR 35 1HG2 THR 35 10.931 1.993 16.174 205 2HG2 THR 35 2HG2 THR 35 11.468 0.695 15.107 206 3HG2 THR 35 3HG2 THR 35 10.851 2.199 14.425 207 H GLU 36 H GLU 36 15.635 3.603 13.936 208 HA GLU 36 HA GLU 36 14.755 6.364 14.043 209 1HB GLU 36 1HB GLU 36 17.232 4.889 14.624 210 2HB GLU 36 2HB GLU 36 17.484 6.472 13.904 211 1HG GLU 36 1HG GLU 36 15.599 6.979 15.829 212 2HG GLU 36 2HG GLU 36 16.615 5.752 16.584 213 H GLY 37 H GLY 37 16.136 4.137 11.752 214 1HA GLY 37 1HA GLY 37 15.616 4.748 9.392 215 2HA GLY 37 2HA GLY 37 16.274 6.332 9.776 216 H ILE 38 H ILE 38 17.736 3.428 11.021 217 HA ILE 38 HA ILE 38 20.079 3.956 9.326 218 HB ILE 38 HB ILE 38 20.003 2.303 11.848 219 1HG1 ILE 38 1HG1 ILE 38 20.770 5.210 11.498 220 2HG1 ILE 38 2HG1 ILE 38 19.349 4.615 12.349 221 1HG2 ILE 38 1HG2 ILE 38 22.351 2.355 11.784 222 2HG2 ILE 38 2HG2 ILE 38 21.855 2.005 10.129 223 3HG2 ILE 38 3HG2 ILE 38 22.373 3.632 10.569 224 1HD1 ILE 38 1HD1 ILE 38 22.173 4.699 13.194 225 2HD1 ILE 38 2HD1 ILE 38 20.695 4.919 14.131 226 3HD1 ILE 38 3HD1 ILE 38 21.232 3.296 13.699 227 HA PRO 39 HA PRO 39 18.898 0.194 7.205 228 1HB PRO 39 1HB PRO 39 20.861 0.342 5.335 229 2HB PRO 39 2HB PRO 39 19.383 1.309 5.255 230 1HG PRO 39 1HG PRO 39 22.107 2.087 6.224 231 2HG PRO 39 2HG PRO 39 20.978 3.001 5.206 232 1HD PRO 39 1HD PRO 39 21.263 3.478 7.856 233 2HD PRO 39 2HD PRO 39 19.719 3.695 7.007 234 H ILE 40 H ILE 40 19.667 -0.894 9.245 235 HA ILE 40 HA ILE 40 22.260 -1.621 9.811 236 HB ILE 40 HB ILE 40 21.220 -3.786 10.721 237 1HG1 ILE 40 1HG1 ILE 40 18.660 -2.304 10.101 238 2HG1 ILE 40 2HG1 ILE 40 19.251 -3.661 9.149 239 1HG2 ILE 40 1HG2 ILE 40 20.230 -2.608 12.611 240 2HG2 ILE 40 2HG2 ILE 40 21.714 -1.815 12.082 241 3HG2 ILE 40 3HG2 ILE 40 20.147 -1.127 11.656 242 1HD1 ILE 40 1HD1 ILE 40 18.525 -5.154 10.632 243 2HD1 ILE 40 2HD1 ILE 40 19.110 -4.215 12.006 244 3HD1 ILE 40 3HD1 ILE 40 17.553 -3.829 11.273 245 H LYS 41 H LYS 41 20.064 -3.003 7.436 246 HA LYS 41 HA LYS 41 22.332 -4.432 6.254 247 1HB LYS 41 1HB LYS 41 20.307 -5.730 7.674 248 2HB LYS 41 2HB LYS 41 19.878 -5.956 5.983 249 1HG LYS 41 1HG LYS 41 22.487 -6.562 5.866 250 2HG LYS 41 2HG LYS 41 22.141 -7.041 7.529 251 1HD LYS 41 1HD LYS 41 20.628 -8.668 6.883 252 2HD LYS 41 2HD LYS 41 20.315 -7.902 5.323 253 1HE LYS 41 1HE LYS 41 21.639 -10.004 5.171 254 2HE LYS 41 2HE LYS 41 22.448 -8.597 4.484 255 1HZ LYS 41 1HZ LYS 41 22.963 -9.385 7.275 256 2HZ LYS 41 2HZ LYS 41 23.947 -8.506 6.218 257 3HZ LYS 41 3HZ LYS 41 23.763 -10.174 6.011 258 H SER 42 H SER 42 22.194 -4.749 4.013 259 HA SER 42 HA SER 42 19.897 -4.034 2.492 260 1HB SER 42 1HB SER 42 20.676 -1.773 3.207 261 2HB SER 42 2HB SER 42 22.210 -2.082 2.393 262 HG SER 42 HG SER 42 20.898 -2.424 0.457 263 H THR 43 H THR 43 20.077 -4.653 0.363 264 HA THR 43 HA THR 43 22.656 -5.858 -0.405 265 HB THR 43 HB THR 43 21.437 -7.512 -1.708 266 HG1 THR 43 HG1 THR 43 19.323 -7.374 -2.037 267 1HG2 THR 43 1HG2 THR 43 19.866 -7.987 0.637 268 2HG2 THR 43 2HG2 THR 43 21.434 -7.330 1.109 269 3HG2 THR 43 3HG2 THR 43 21.349 -8.785 0.117 270 H MET 44 H MET 44 20.195 -3.629 -1.225 271 HA MET 44 HA MET 44 20.472 -3.560 -4.027 272 1HB MET 44 1HB MET 44 19.742 -1.281 -2.179 273 2HB MET 44 2HB MET 44 19.411 -1.369 -3.904 274 1HG MET 44 1HG MET 44 18.363 -3.619 -2.353 275 2HG MET 44 2HG MET 44 17.668 -2.053 -1.941 276 1HE MET 44 1HE MET 44 18.984 -2.580 -5.633 277 2HE MET 44 2HE MET 44 18.779 -4.203 -4.975 278 3HE MET 44 3HE MET 44 17.722 -3.636 -6.268 279 H ASP 45 H ASP 45 21.104 -1.055 -4.809 280 HA ASP 45 HA ASP 45 23.964 -1.095 -4.707 281 1HB ASP 45 1HB ASP 45 22.133 -0.194 -6.528 282 2HB ASP 45 2HB ASP 45 22.689 1.315 -5.810 283 H ASN 46 H ASN 46 25.166 1.039 -4.352 284 HA ASN 46 HA ASN 46 24.897 1.785 -1.657 285 1HB ASN 46 1HB ASN 46 26.774 2.183 -3.720 286 2HB ASN 46 2HB ASN 46 26.317 3.791 -3.166 287 1HD2 ASN 46 1HD2 ASN 46 25.839 3.310 -0.503 288 2HD2 ASN 46 2HD2 ASN 46 27.317 2.866 0.273 289 HA PRO 47 HA PRO 47 23.120 5.982 -3.269 290 1HB PRO 47 1HB PRO 47 22.394 6.100 -5.883 291 2HB PRO 47 2HB PRO 47 24.017 6.514 -5.317 292 1HG PRO 47 1HG PRO 47 23.033 3.972 -6.555 293 2HG PRO 47 2HG PRO 47 24.537 4.859 -6.865 294 1HD PRO 47 1HD PRO 47 24.440 2.664 -5.281 295 2HD PRO 47 2HD PRO 47 25.578 3.997 -4.997 296 H THR 48 H THR 48 21.906 2.951 -4.517 297 HA THR 48 HA THR 48 19.168 3.800 -4.677 298 HB THR 48 HB THR 48 20.317 1.002 -4.652 299 HG1 THR 48 HG1 THR 48 19.687 1.355 -7.010 300 1HG2 THR 48 1HG2 THR 48 18.184 0.324 -5.619 301 2HG2 THR 48 2HG2 THR 48 17.595 1.984 -5.519 302 3HG2 THR 48 3HG2 THR 48 17.934 1.078 -4.045 303 H THR 49 H THR 49 21.177 2.137 -2.316 304 HA THR 49 HA THR 49 19.074 1.341 -0.589 305 HB THR 49 HB THR 49 22.007 1.791 -0.015 306 HG1 THR 49 HG1 THR 49 22.224 -0.171 -0.777 307 1HG2 THR 49 1HG2 THR 49 19.813 0.609 1.678 308 2HG2 THR 49 2HG2 THR 49 20.904 1.935 2.081 309 3HG2 THR 49 3HG2 THR 49 21.523 0.288 1.965 310 H THR 50 H THR 50 21.347 4.079 -0.463 311 HA THR 50 HA THR 50 20.438 5.268 1.872 312 HB THR 50 HB THR 50 21.130 7.212 -0.209 313 HG1 THR 50 HG1 THR 50 23.193 6.411 -0.581 314 1HG2 THR 50 1HG2 THR 50 21.951 8.230 1.595 315 2HG2 THR 50 2HG2 THR 50 23.071 6.896 1.876 316 3HG2 THR 50 3HG2 THR 50 21.449 6.848 2.568 317 H GLN 51 H GLN 51 19.295 5.728 -1.456 318 HA GLN 51 HA GLN 51 17.350 7.690 -0.780 319 1HB GLN 51 1HB GLN 51 18.414 7.131 -3.085 320 2HB GLN 51 2HB GLN 51 17.145 5.918 -3.194 321 1HG GLN 51 1HG GLN 51 15.722 8.117 -2.478 322 2HG GLN 51 2HG GLN 51 17.003 8.829 -3.457 323 1HE2 GLN 51 1HE2 GLN 51 14.844 6.010 -3.531 324 2HE2 GLN 51 2HE2 GLN 51 14.435 6.154 -5.203 325 H TYR 52 H TYR 52 17.128 4.213 -1.501 326 HA TYR 52 HA TYR 52 14.385 3.907 -1.228 327 1HB TYR 52 1HB TYR 52 16.731 2.095 -0.932 328 2HB TYR 52 2HB TYR 52 15.175 1.523 -0.340 329 HD1 TYR 52 HD1 TYR 52 14.558 -0.130 -1.867 330 HD2 TYR 52 HD2 TYR 52 15.905 3.636 -3.317 331 HE1 TYR 52 HE1 TYR 52 13.928 -0.791 -4.151 332 HE2 TYR 52 HE2 TYR 52 15.277 2.986 -5.605 333 HH TYR 52 HH TYR 52 15.007 0.517 -6.807 334 H ALA 53 H ALA 53 16.887 3.448 1.268 335 HA ALA 53 HA ALA 53 15.076 2.970 3.382 336 1HB ALA 53 1HB ALA 53 17.855 4.090 3.666 337 2HB ALA 53 2HB ALA 53 16.945 3.133 4.836 338 3HB ALA 53 3HB ALA 53 17.522 2.388 3.345 339 H SER 54 H SER 54 16.175 5.866 1.856 340 HA SER 54 HA SER 54 15.542 7.628 4.031 341 1HB SER 54 1HB SER 54 16.407 7.950 1.194 342 2HB SER 54 2HB SER 54 15.628 9.323 1.980 343 HG SER 54 HG SER 54 18.126 8.283 2.354 344 H LEU 55 H LEU 55 14.105 7.294 0.780 345 HA LEU 55 HA LEU 55 11.784 8.757 1.358 346 1HB LEU 55 1HB LEU 55 11.112 8.253 -0.755 347 2HB LEU 55 2HB LEU 55 12.831 7.888 -0.896 348 HG LEU 55 HG LEU 55 11.963 5.458 -0.233 349 1HD1 LEU 55 1HD1 LEU 55 9.807 4.989 -0.658 350 2HD1 LEU 55 2HD1 LEU 55 9.711 6.130 -1.998 351 3HD1 LEU 55 3HD1 LEU 55 9.572 6.708 -0.338 352 1HD2 LEU 55 1HD2 LEU 55 13.117 6.471 -2.365 353 2HD2 LEU 55 2HD2 LEU 55 11.511 6.267 -3.064 354 3HD2 LEU 55 3HD2 LEU 55 12.372 4.873 -2.410 355 H MET 56 H MET 56 12.683 5.540 2.150 356 HA MET 56 HA MET 56 10.145 4.343 2.362 357 1HB MET 56 1HB MET 56 12.874 3.763 3.307 358 2HB MET 56 2HB MET 56 11.592 3.081 4.297 359 1HG MET 56 1HG MET 56 11.845 2.688 1.325 360 2HG MET 56 2HG MET 56 12.424 1.553 2.543 361 1HE MET 56 1HE MET 56 8.422 1.554 0.653 362 2HE MET 56 2HE MET 56 9.363 3.046 0.672 363 3HE MET 56 3HE MET 56 10.066 1.568 0.012 364 H HIS 57 H HIS 57 12.196 5.792 4.897 365 HA HIS 57 HA HIS 57 10.445 5.555 7.023 366 1HB HIS 57 1HB HIS 57 12.860 6.370 7.049 367 2HB HIS 57 2HB HIS 57 12.228 7.954 6.610 368 HD1 HIS 57 HD1 HIS 57 10.483 5.716 9.073 369 HD2 HIS 57 HD2 HIS 57 12.838 9.139 9.040 370 HE1 HIS 57 HE1 HIS 57 10.370 6.633 11.412 371 H SER 58 H SER 58 10.540 7.975 4.475 372 HA SER 58 HA SER 58 8.544 9.651 5.674 373 1HB SER 58 1HB SER 58 10.303 9.772 3.399 374 2HB SER 58 2HB SER 58 8.661 10.178 2.902 375 HG SER 58 HG SER 58 8.644 11.694 4.668 376 H PHE 59 H PHE 59 8.558 6.898 3.574 377 HA PHE 59 HA PHE 59 6.004 7.236 2.409 378 1HB PHE 59 1HB PHE 59 7.747 5.675 1.556 379 2HB PHE 59 2HB PHE 59 7.467 4.647 2.957 380 HD1 PHE 59 HD1 PHE 59 5.251 6.395 0.512 381 HD2 PHE 59 HD2 PHE 59 6.337 2.738 2.400 382 HE1 PHE 59 HE1 PHE 59 3.452 5.237 -0.703 383 HE2 PHE 59 HE2 PHE 59 4.540 1.574 1.187 384 HZ PHE 59 HZ PHE 59 3.096 2.823 -0.368 385 H ILE 60 H ILE 60 7.045 5.128 5.092 386 HA ILE 60 HA ILE 60 4.548 4.190 5.840 387 HB ILE 60 HB ILE 60 6.895 4.770 7.651 388 1HG1 ILE 60 1HG1 ILE 60 7.494 3.280 5.812 389 2HG1 ILE 60 2HG1 ILE 60 7.425 2.380 7.323 390 1HG2 ILE 60 1HG2 ILE 60 5.574 4.150 9.323 391 2HG2 ILE 60 2HG2 ILE 60 4.249 3.818 8.209 392 3HG2 ILE 60 3HG2 ILE 60 5.431 2.561 8.570 393 1HD1 ILE 60 1HD1 ILE 60 4.869 2.172 6.251 394 2HD1 ILE 60 2HD1 ILE 60 5.965 1.980 4.881 395 3HD1 ILE 60 3HD1 ILE 60 6.119 0.928 6.288 396 H LEU 61 H LEU 61 6.310 6.969 7.216 397 HA LEU 61 HA LEU 61 4.358 7.818 8.999 398 1HB LEU 61 1HB LEU 61 6.757 8.910 7.798 399 2HB LEU 61 2HB LEU 61 5.536 10.153 8.063 400 HG LEU 61 HG LEU 61 5.469 9.605 10.435 401 1HD1 LEU 61 1HD1 LEU 61 7.300 7.405 9.586 402 2HD1 LEU 61 2HD1 LEU 61 5.906 7.354 10.665 403 3HD1 LEU 61 3HD1 LEU 61 7.420 8.073 11.214 404 1HD2 LEU 61 1HD2 LEU 61 7.328 10.796 10.967 405 2HD2 LEU 61 2HD2 LEU 61 7.334 11.062 9.223 406 3HD2 LEU 61 3HD2 LEU 61 8.381 9.831 9.932 407 H LYS 62 H LYS 62 4.513 8.132 5.553 408 HA LYS 62 HA LYS 62 2.622 10.255 5.309 409 1HB LYS 62 1HB LYS 62 4.276 8.724 3.569 410 2HB LYS 62 2HB LYS 62 2.624 8.614 2.973 411 1HG LYS 62 1HG LYS 62 3.619 10.460 1.890 412 2HG LYS 62 2HG LYS 62 2.522 11.122 3.105 413 1HD LYS 62 1HD LYS 62 4.231 12.324 3.873 414 2HD LYS 62 2HD LYS 62 4.966 10.814 4.418 415 1HE LYS 62 1HE LYS 62 6.296 10.636 2.506 416 2HE LYS 62 2HE LYS 62 5.300 11.771 1.596 417 1HZ LYS 62 1HZ LYS 62 7.585 12.498 2.591 418 2HZ LYS 62 2HZ LYS 62 6.679 12.728 4.000 419 3HZ LYS 62 3HZ LYS 62 6.272 13.565 2.588 420 H ALA 63 H ALA 63 2.392 6.737 4.778 421 HA ALA 63 HA ALA 63 -0.420 6.761 4.366 422 1HB ALA 63 1HB ALA 63 1.657 4.884 4.149 423 2HB ALA 63 2HB ALA 63 0.498 4.210 5.296 424 3HB ALA 63 3HB ALA 63 -0.032 4.686 3.682 425 H ARG 64 H ARG 64 1.598 6.630 7.181 426 HA ARG 64 HA ARG 64 -0.292 5.509 8.975 427 1HB ARG 64 1HB ARG 64 2.316 5.941 9.184 428 2HB ARG 64 2HB ARG 64 1.774 7.435 9.935 429 1HG ARG 64 1HG ARG 64 0.289 5.290 11.056 430 2HG ARG 64 2HG ARG 64 2.001 4.864 11.086 431 1HD ARG 64 1HD ARG 64 1.185 7.596 11.946 432 2HD ARG 64 2HD ARG 64 0.897 6.244 13.040 433 HE ARG 64 HE ARG 64 3.425 7.430 12.382 434 1HH1 ARG 64 1HH1 ARG 64 1.833 4.526 13.456 435 2HH1 ARG 64 2HH1 ARG 64 3.238 3.894 14.250 436 1HH2 ARG 64 1HH2 ARG 64 5.281 6.609 13.424 437 2HH2 ARG 64 2HH2 ARG 64 5.198 5.080 14.232 438 H SER 65 H SER 65 0.638 8.858 8.238 439 HA SER 65 HA SER 65 -1.080 10.102 10.076 440 1HB SER 65 1HB SER 65 0.861 11.022 8.481 441 2HB SER 65 2HB SER 65 -0.528 11.473 7.492 442 HG SER 65 HG SER 65 0.361 12.530 9.858 443 H THR 66 H THR 66 -1.663 8.669 6.983 444 HA THR 66 HA THR 66 -4.183 9.986 6.533 445 HB THR 66 HB THR 66 -4.067 7.612 4.997 446 HG1 THR 66 HG1 THR 66 -1.896 8.287 4.001 447 1HG2 THR 66 1HG2 THR 66 -4.027 9.095 3.155 448 2HG2 THR 66 2HG2 THR 66 -3.228 10.358 4.091 449 3HG2 THR 66 3HG2 THR 66 -4.909 9.943 4.425 450 H VAL 67 H VAL 67 -3.134 6.771 7.604 451 HA VAL 67 HA VAL 67 -5.566 5.482 7.764 452 HB VAL 67 HB VAL 67 -3.260 5.243 9.702 453 1HG1 VAL 67 1HG1 VAL 67 -5.625 3.454 9.176 454 2HG1 VAL 67 2HG1 VAL 67 -4.180 2.936 10.047 455 3HG1 VAL 67 3HG1 VAL 67 -5.180 4.238 10.692 456 1HG2 VAL 67 1HG2 VAL 67 -2.141 4.181 8.103 457 2HG2 VAL 67 2HG2 VAL 67 -3.501 3.096 7.815 458 3HG2 VAL 67 3HG2 VAL 67 -3.407 4.637 6.963 459 H ARG 68 H ARG 68 -4.108 7.731 10.064 460 HA ARG 68 HA ARG 68 -5.902 7.414 12.177 461 1HB ARG 68 1HB ARG 68 -4.531 9.972 11.332 462 2HB ARG 68 2HB ARG 68 -5.172 9.609 12.928 463 1HG ARG 68 1HG ARG 68 -3.012 7.953 11.667 464 2HG ARG 68 2HG ARG 68 -2.663 9.406 12.606 465 1HD ARG 68 1HD ARG 68 -3.982 8.391 14.483 466 2HD ARG 68 2HD ARG 68 -4.049 6.902 13.542 467 HE ARG 68 HE ARG 68 -1.904 6.467 14.180 468 1HH1 ARG 68 1HH1 ARG 68 -2.525 9.866 14.606 469 2HH1 ARG 68 2HH1 ARG 68 -1.001 10.182 15.366 470 1HH2 ARG 68 1HH2 ARG 68 0.106 6.871 15.180 471 2HH2 ARG 68 2HH2 ARG 68 0.495 8.478 15.692 472 H ASP 69 H ASP 69 -6.184 9.191 9.181 473 HA ASP 69 HA ASP 69 -8.536 10.641 9.972 474 1HB ASP 69 1HB ASP 69 -6.702 10.699 7.793 475 2HB ASP 69 2HB ASP 69 -8.321 10.491 7.132 476 H ILE 70 H ILE 70 -7.836 7.618 8.366 477 HA ILE 70 HA ILE 70 -10.382 7.148 7.248 478 HB ILE 70 HB ILE 70 -8.432 5.056 8.215 479 1HG1 ILE 70 1HG1 ILE 70 -8.575 6.463 5.539 480 2HG1 ILE 70 2HG1 ILE 70 -7.311 6.673 6.746 481 1HG2 ILE 70 1HG2 ILE 70 -10.772 4.358 7.598 482 2HG2 ILE 70 2HG2 ILE 70 -10.413 4.892 5.957 483 3HG2 ILE 70 3HG2 ILE 70 -9.481 3.582 6.681 484 1HD1 ILE 70 1HD1 ILE 70 -6.816 4.224 6.487 485 2HD1 ILE 70 2HD1 ILE 70 -7.902 4.237 5.097 486 3HD1 ILE 70 3HD1 ILE 70 -6.448 5.235 5.091 487 H ASP 71 H ASP 71 -8.951 6.160 10.347 488 HA ASP 71 HA ASP 71 -11.599 6.050 11.527 489 1HB ASP 71 1HB ASP 71 -9.983 3.644 10.924 490 2HB ASP 71 2HB ASP 71 -10.687 3.713 12.537 491 HA PRO 72 HA PRO 72 -9.536 7.444 15.137 492 1HB PRO 72 1HB PRO 72 -10.942 6.238 17.122 493 2HB PRO 72 2HB PRO 72 -11.594 7.565 16.153 494 1HG PRO 72 1HG PRO 72 -12.048 4.619 15.879 495 2HG PRO 72 2HG PRO 72 -13.219 5.947 15.769 496 1HD PRO 72 1HD PRO 72 -12.185 4.730 13.582 497 2HD PRO 72 2HD PRO 72 -12.635 6.447 13.596 498 H GLN 73 H GLN 73 -10.277 3.961 15.389 499 HA GLN 73 HA GLN 73 -7.625 3.578 16.613 500 1HB GLN 73 1HB GLN 73 -10.029 1.767 16.873 501 2HB GLN 73 2HB GLN 73 -8.504 1.630 17.739 502 1HG GLN 73 1HG GLN 73 -8.975 3.811 18.814 503 2HG GLN 73 2HG GLN 73 -10.551 3.816 18.025 504 1HE2 GLN 73 1HE2 GLN 73 -12.148 2.435 18.742 505 2HE2 GLN 73 2HE2 GLN 73 -12.035 1.572 20.234 506 H ASN 74 H ASN 74 -6.199 2.263 15.644 507 HA ASN 74 HA ASN 74 -6.798 0.053 14.040 508 1HB ASN 74 1HB ASN 74 -7.396 2.330 12.654 509 2HB ASN 74 2HB ASN 74 -5.727 2.056 12.165 510 1HD2 ASN 74 1HD2 ASN 74 -7.777 1.932 10.355 511 2HD2 ASN 74 2HD2 ASN 74 -7.981 0.301 9.823 512 H ASP 75 H ASP 75 -4.816 -0.592 12.666 513 HA ASP 75 HA ASP 75 -2.300 0.535 13.531 514 1HB ASP 75 1HB ASP 75 -3.436 -1.661 14.957 515 2HB ASP 75 2HB ASP 75 -2.036 -2.250 14.065 516 H LEU 76 H LEU 76 -0.750 0.247 12.032 517 HA LEU 76 HA LEU 76 -1.465 -1.151 9.603 518 1HB LEU 76 1HB LEU 76 0.149 1.056 10.275 519 2HB LEU 76 2HB LEU 76 1.226 -0.164 9.597 520 HG LEU 76 HG LEU 76 0.565 1.278 7.826 521 1HD1 LEU 76 1HD1 LEU 76 0.351 -1.369 7.664 522 2HD1 LEU 76 2HD1 LEU 76 -0.007 -0.304 6.305 523 3HD1 LEU 76 3HD1 LEU 76 -1.320 -0.943 7.294 524 1HD2 LEU 76 1HD2 LEU 76 -1.533 2.029 9.121 525 2HD2 LEU 76 2HD2 LEU 76 -2.334 0.686 8.305 526 3HD2 LEU 76 3HD2 LEU 76 -1.601 1.983 7.360 527 H THR 77 H THR 77 -0.920 -3.172 9.153 528 HA THR 77 HA THR 77 1.340 -4.378 10.615 529 HB THR 77 HB THR 77 -0.626 -5.497 11.337 530 HG1 THR 77 HG1 THR 77 0.608 -7.200 11.032 531 1HG2 THR 77 1HG2 THR 77 -2.281 -4.859 9.790 532 2HG2 THR 77 2HG2 THR 77 -2.132 -6.605 9.591 533 3HG2 THR 77 3HG2 THR 77 -1.379 -5.517 8.426 534 H PHE 78 H PHE 78 -0.041 -3.677 7.548 535 HA PHE 78 HA PHE 78 2.307 -4.767 6.228 536 1HB PHE 78 1HB PHE 78 -0.015 -6.281 6.271 537 2HB PHE 78 2HB PHE 78 -0.094 -5.455 4.719 538 HD1 PHE 78 HD1 PHE 78 2.191 -7.490 6.830 539 HD2 PHE 78 HD2 PHE 78 1.068 -6.294 2.903 540 HE1 PHE 78 HE1 PHE 78 3.764 -9.129 5.885 541 HE2 PHE 78 HE2 PHE 78 2.638 -7.932 1.951 542 HZ PHE 78 HZ PHE 78 3.988 -9.353 3.443 543 H LEU 79 H LEU 79 2.827 -3.726 4.325 544 HA LEU 79 HA LEU 79 0.974 -1.816 3.167 545 1HB LEU 79 1HB LEU 79 2.280 -0.736 5.101 546 2HB LEU 79 2HB LEU 79 3.672 -0.824 4.024 547 HG LEU 79 HG LEU 79 2.377 0.549 2.378 548 1HD1 LEU 79 1HD1 LEU 79 0.289 1.273 2.753 549 2HD1 LEU 79 2HD1 LEU 79 0.580 1.546 4.470 550 3HD1 LEU 79 3HD1 LEU 79 0.209 -0.076 3.886 551 1HD2 LEU 79 1HD2 LEU 79 2.504 2.658 3.887 552 2HD2 LEU 79 2HD2 LEU 79 3.979 1.764 3.518 553 3HD2 LEU 79 3HD2 LEU 79 3.184 1.549 5.078 554 H ARG 80 H ARG 80 1.058 -2.712 1.177 555 HA ARG 80 HA ARG 80 3.711 -2.933 -0.089 556 1HB ARG 80 1HB ARG 80 2.573 -4.589 -1.633 557 2HB ARG 80 2HB ARG 80 2.811 -5.122 0.025 558 1HG ARG 80 1HG ARG 80 0.451 -4.464 0.496 559 2HG ARG 80 2HG ARG 80 0.255 -4.160 -1.231 560 1HD ARG 80 1HD ARG 80 1.443 -6.729 -0.866 561 2HD ARG 80 2HD ARG 80 0.013 -6.610 0.158 562 HE ARG 80 HE ARG 80 -0.791 -5.656 -2.275 563 1HH1 ARG 80 1HH1 ARG 80 0.638 -8.615 -1.123 564 2HH1 ARG 80 2HH1 ARG 80 -0.109 -9.601 -2.336 565 1HH2 ARG 80 1HH2 ARG 80 -1.780 -6.944 -3.877 566 2HH2 ARG 80 2HH2 ARG 80 -1.484 -8.649 -3.902 567 H ILE 81 H ILE 81 3.690 -2.604 -2.470 568 HA ILE 81 HA ILE 81 1.531 -0.924 -3.476 569 HB ILE 81 HB ILE 81 3.328 0.709 -4.343 570 1HG1 ILE 81 1HG1 ILE 81 4.784 -0.488 -1.976 571 2HG1 ILE 81 2HG1 ILE 81 5.275 -0.622 -3.661 572 1HG2 ILE 81 1HG2 ILE 81 2.582 2.147 -2.789 573 2HG2 ILE 81 2HG2 ILE 81 1.600 0.785 -2.250 574 3HG2 ILE 81 3HG2 ILE 81 3.131 1.140 -1.450 575 1HD1 ILE 81 1HD1 ILE 81 6.473 1.213 -3.400 576 2HD1 ILE 81 2HD1 ILE 81 4.981 2.118 -3.142 577 3HD1 ILE 81 3HD1 ILE 81 5.848 1.434 -1.767 578 H ARG 82 H ARG 82 1.115 -2.538 -4.985 579 HA ARG 82 HA ARG 82 3.051 -3.773 -6.609 580 1HB ARG 82 1HB ARG 82 0.437 -4.213 -6.181 581 2HB ARG 82 2HB ARG 82 0.328 -3.362 -7.716 582 1HG ARG 82 1HG ARG 82 2.340 -5.499 -7.616 583 2HG ARG 82 2HG ARG 82 0.663 -6.027 -7.468 584 1HD ARG 82 1HD ARG 82 1.550 -4.135 -9.625 585 2HD ARG 82 2HD ARG 82 1.664 -5.884 -9.818 586 HE ARG 82 HE ARG 82 -0.728 -4.279 -9.874 587 1HH1 ARG 82 1HH1 ARG 82 0.596 -7.462 -9.384 588 2HH1 ARG 82 2HH1 ARG 82 -0.883 -8.278 -9.769 589 1HH2 ARG 82 1HH2 ARG 82 -2.681 -5.342 -10.382 590 2HH2 ARG 82 2HH2 ARG 82 -2.746 -7.072 -10.337 591 H SER 83 H SER 83 4.410 -2.638 -7.844 592 HA SER 83 HA SER 83 3.501 -0.239 -9.219 593 1HB SER 83 1HB SER 83 6.245 -1.224 -9.705 594 2HB SER 83 2HB SER 83 5.684 0.394 -9.287 595 HG SER 83 HG SER 83 6.743 -1.464 -7.691 596 H LYS 84 H LYS 84 4.985 -0.200 -11.490 597 HA LYS 84 HA LYS 84 3.516 -2.035 -13.173 598 1HB LYS 84 1HB LYS 84 5.021 0.466 -13.530 599 2HB LYS 84 2HB LYS 84 5.184 -0.672 -14.861 600 1HG LYS 84 1HG LYS 84 2.454 -0.613 -14.231 601 2HG LYS 84 2HG LYS 84 3.002 1.065 -14.210 602 1HD LYS 84 1HD LYS 84 2.508 0.837 -16.434 603 2HD LYS 84 2HD LYS 84 4.202 0.338 -16.447 604 1HE LYS 84 1HE LYS 84 3.225 -2.039 -16.049 605 2HE LYS 84 2HE LYS 84 1.728 -1.332 -16.656 606 1HZ LYS 84 1HZ LYS 84 4.216 -0.979 -18.182 607 2HZ LYS 84 2HZ LYS 84 2.617 -1.009 -18.732 608 3HZ LYS 84 3HZ LYS 84 3.384 -2.449 -18.285 609 H LYS 85 H LYS 85 6.706 -1.737 -11.875 610 HA LYS 85 HA LYS 85 7.742 -3.782 -13.700 611 1HB LYS 85 1HB LYS 85 9.034 -1.847 -11.800 612 2HB LYS 85 2HB LYS 85 9.916 -3.251 -12.386 613 1HG LYS 85 1HG LYS 85 8.893 -2.180 -14.694 614 2HG LYS 85 2HG LYS 85 9.268 -0.751 -13.729 615 1HD LYS 85 1HD LYS 85 11.187 -3.011 -14.288 616 2HD LYS 85 2HD LYS 85 11.152 -1.477 -15.160 617 1HE LYS 85 1HE LYS 85 11.599 -0.289 -13.060 618 2HE LYS 85 2HE LYS 85 11.654 -1.830 -12.205 619 1HZ LYS 85 1HZ LYS 85 13.745 -0.536 -13.475 620 2HZ LYS 85 2HZ LYS 85 13.400 -1.891 -14.426 621 3HZ LYS 85 3HZ LYS 85 13.762 -2.081 -12.784 622 H ASN 86 H ASN 86 8.080 -3.120 -10.209 623 HA ASN 86 HA ASN 86 7.390 -5.907 -9.649 624 1HB ASN 86 1HB ASN 86 9.364 -5.870 -7.961 625 2HB ASN 86 2HB ASN 86 9.709 -6.178 -9.660 626 1HD2 ASN 86 1HD2 ASN 86 10.558 -4.459 -10.934 627 2HD2 ASN 86 2HD2 ASN 86 11.449 -3.179 -10.191 628 H GLU 87 H GLU 87 7.059 -6.283 -7.291 629 HA GLU 87 HA GLU 87 5.737 -3.945 -6.126 630 1HB GLU 87 1HB GLU 87 4.612 -5.580 -4.655 631 2HB GLU 87 2HB GLU 87 4.347 -5.916 -6.360 632 1HG GLU 87 1HG GLU 87 5.382 -7.896 -6.263 633 2HG GLU 87 2HG GLU 87 6.655 -7.293 -5.203 634 H ILE 88 H ILE 88 6.040 -3.361 -3.939 635 HA ILE 88 HA ILE 88 8.512 -4.397 -2.717 636 HB ILE 88 HB ILE 88 7.579 -1.524 -2.717 637 1HG1 ILE 88 1HG1 ILE 88 10.160 -1.694 -3.761 638 2HG1 ILE 88 2HG1 ILE 88 9.307 -3.052 -4.487 639 1HG2 ILE 88 1HG2 ILE 88 8.622 -2.038 -0.620 640 2HG2 ILE 88 2HG2 ILE 88 9.963 -2.844 -1.432 641 3HG2 ILE 88 3HG2 ILE 88 9.757 -1.100 -1.591 642 1HD1 ILE 88 1HD1 ILE 88 8.070 -1.726 -5.792 643 2HD1 ILE 88 2HD1 ILE 88 7.821 -0.532 -4.518 644 3HD1 ILE 88 3HD1 ILE 88 9.315 -0.523 -5.455 645 H MET 89 H MET 89 7.632 -5.675 -1.162 646 HA MET 89 HA MET 89 5.384 -4.824 0.418 647 1HB MET 89 1HB MET 89 7.165 -7.234 0.386 648 2HB MET 89 2HB MET 89 6.110 -6.945 1.764 649 1HG MET 89 1HG MET 89 4.185 -7.237 0.520 650 2HG MET 89 2HG MET 89 5.001 -6.911 -1.007 651 1HE MET 89 1HE MET 89 6.963 -9.673 1.340 652 2HE MET 89 2HE MET 89 5.510 -8.983 2.064 653 3HE MET 89 3HE MET 89 5.518 -10.666 1.533 654 H VAL 90 H VAL 90 5.422 -3.718 2.265 655 HA VAL 90 HA VAL 90 7.799 -3.755 3.954 656 HB VAL 90 HB VAL 90 6.609 -1.148 2.998 657 1HG1 VAL 90 1HG1 VAL 90 7.505 -0.403 4.907 658 2HG1 VAL 90 2HG1 VAL 90 8.426 -1.887 5.160 659 3HG1 VAL 90 3HG1 VAL 90 9.061 -0.623 4.106 660 1HG2 VAL 90 1HG2 VAL 90 8.693 -0.820 1.780 661 2HG2 VAL 90 2HG2 VAL 90 9.258 -2.410 2.290 662 3HG2 VAL 90 3HG2 VAL 90 7.866 -2.272 1.217 663 H ALA 91 H ALA 91 7.359 -3.497 6.094 664 HA ALA 91 HA ALA 91 4.855 -2.385 6.998 665 1HB ALA 91 1HB ALA 91 4.772 -5.034 6.369 666 2HB ALA 91 2HB ALA 91 5.168 -5.084 8.087 667 3HB ALA 91 3HB ALA 91 3.720 -4.239 7.540 668 HA PRO 92 HA PRO 92 7.222 -1.447 10.574 669 1HB PRO 92 1HB PRO 92 5.319 -1.460 12.510 670 2HB PRO 92 2HB PRO 92 5.439 -0.188 11.288 671 1HG PRO 92 1HG PRO 92 3.624 -2.567 11.374 672 2HG PRO 92 2HG PRO 92 3.252 -0.892 10.928 673 1HD PRO 92 1HD PRO 92 3.664 -2.833 9.085 674 2HD PRO 92 2HD PRO 92 4.103 -1.137 8.800 675 H ASP 93 H ASP 93 8.637 -2.803 11.468 676 HA ASP 93 HA ASP 93 7.720 -5.400 12.464 677 1HB ASP 93 1HB ASP 93 9.957 -4.649 10.992 678 2HB ASP 93 2HB ASP 93 10.588 -4.925 12.613 679 H LYS 94 H LYS 94 9.655 -5.982 14.311 680 HA LYS 94 HA LYS 94 8.657 -5.001 16.677 681 1HB LYS 94 1HB LYS 94 10.856 -6.644 15.869 682 2HB LYS 94 2HB LYS 94 11.411 -5.535 17.117 683 1HG LYS 94 1HG LYS 94 9.702 -6.299 18.627 684 2HG LYS 94 2HG LYS 94 8.994 -7.313 17.368 685 1HD LYS 94 1HD LYS 94 11.025 -8.657 17.289 686 2HD LYS 94 2HD LYS 94 11.773 -7.621 18.508 687 1HE LYS 94 1HE LYS 94 9.821 -8.243 20.011 688 2HE LYS 94 2HE LYS 94 9.437 -9.490 18.826 689 1HZ LYS 94 1HZ LYS 94 10.833 -10.252 20.718 690 2HZ LYS 94 2HZ LYS 94 12.076 -9.251 20.160 691 3HZ LYS 94 3HZ LYS 94 11.525 -10.530 19.200 692 H ASP 95 H ASP 95 11.614 -3.908 15.018 693 HA ASP 95 HA ASP 95 11.187 -1.222 16.030 694 1HB ASP 95 1HB ASP 95 13.341 -3.020 17.004 695 2HB ASP 95 2HB ASP 95 13.798 -1.356 16.651 696 H TYR 96 H TYR 96 11.488 -2.886 13.469 697 HA TYR 96 HA TYR 96 13.131 -0.910 12.081 698 1HB TYR 96 1HB TYR 96 14.130 -2.827 10.708 699 2HB TYR 96 2HB TYR 96 14.762 -2.593 12.334 700 HD1 TYR 96 HD1 TYR 96 14.105 -4.152 14.150 701 HD2 TYR 96 HD2 TYR 96 12.983 -4.829 10.102 702 HE1 TYR 96 HE1 TYR 96 13.595 -6.497 14.690 703 HE2 TYR 96 HE2 TYR 96 12.468 -7.175 10.631 704 HH TYR 96 HH TYR 96 13.491 -8.709 13.370 705 H PHE 97 H PHE 97 12.950 -1.318 9.618 706 HA PHE 97 HA PHE 97 10.170 -2.079 9.007 707 1HB PHE 97 1HB PHE 97 11.810 0.263 8.122 708 2HB PHE 97 2HB PHE 97 10.568 -0.370 7.048 709 HD1 PHE 97 HD1 PHE 97 8.214 -0.709 8.150 710 HD2 PHE 97 HD2 PHE 97 11.240 1.878 9.655 711 HE1 PHE 97 HE1 PHE 97 6.505 0.577 9.366 712 HE2 PHE 97 HE2 PHE 97 9.537 3.167 10.875 713 HZ PHE 97 HZ PHE 97 7.166 2.517 10.732 714 H LEU 98 H LEU 98 10.325 -4.034 8.080 715 HA LEU 98 HA LEU 98 12.528 -4.857 6.477 716 1HB LEU 98 1HB LEU 98 10.726 -6.216 7.846 717 2HB LEU 98 2HB LEU 98 9.885 -6.213 6.298 718 HG LEU 98 HG LEU 98 12.720 -7.105 6.333 719 1HD1 LEU 98 1HD1 LEU 98 11.591 -8.176 8.309 720 2HD1 LEU 98 2HD1 LEU 98 12.209 -9.292 7.092 721 3HD1 LEU 98 3HD1 LEU 98 10.483 -8.937 7.167 722 1HD2 LEU 98 1HD2 LEU 98 10.695 -8.678 4.951 723 2HD2 LEU 98 2HD2 LEU 98 12.185 -7.959 4.340 724 3HD2 LEU 98 3HD2 LEU 98 10.718 -6.986 4.454 725 H ILE 99 H ILE 99 12.798 -4.860 4.310 726 HA ILE 99 HA ILE 99 10.557 -3.999 2.619 727 HB ILE 99 HB ILE 99 13.358 -2.887 2.411 728 1HG1 ILE 99 1HG1 ILE 99 11.420 -0.855 2.780 729 2HG1 ILE 99 2HG1 ILE 99 11.109 -2.082 4.003 730 1HG2 ILE 99 1HG2 ILE 99 12.463 -3.014 0.233 731 2HG2 ILE 99 2HG2 ILE 99 10.872 -2.480 0.773 732 3HG2 ILE 99 3HG2 ILE 99 12.222 -1.346 0.751 733 1HD1 ILE 99 1HD1 ILE 99 12.594 -0.427 4.892 734 2HD1 ILE 99 2HD1 ILE 99 13.481 -1.937 4.681 735 3HD1 ILE 99 3HD1 ILE 99 13.694 -0.620 3.528 736 H VAL 100 H VAL 100 10.228 -5.817 1.476 737 HA VAL 100 HA VAL 100 12.560 -7.084 0.196 738 HB VAL 100 HB VAL 100 11.452 -8.646 1.655 739 1HG1 VAL 100 1HG1 VAL 100 9.110 -7.282 0.845 740 2HG1 VAL 100 2HG1 VAL 100 8.920 -8.978 0.394 741 3HG1 VAL 100 3HG1 VAL 100 9.274 -8.543 2.067 742 1HG2 VAL 100 1HG2 VAL 100 10.590 -9.303 -1.155 743 2HG2 VAL 100 2HG2 VAL 100 12.263 -9.394 -0.604 744 3HG2 VAL 100 3HG2 VAL 100 11.036 -10.426 0.130 745 H ILE 101 H ILE 101 12.752 -6.713 -1.903 746 HA ILE 101 HA ILE 101 10.342 -6.025 -3.446 747 HB ILE 101 HB ILE 101 13.225 -5.435 -4.128 748 1HG1 ILE 101 1HG1 ILE 101 11.553 -3.125 -3.685 749 2HG1 ILE 101 2HG1 ILE 101 11.534 -4.167 -2.267 750 1HG2 ILE 101 1HG2 ILE 101 10.625 -4.922 -5.505 751 2HG2 ILE 101 2HG2 ILE 101 11.968 -3.799 -5.717 752 3HG2 ILE 101 3HG2 ILE 101 12.155 -5.493 -6.170 753 1HD1 ILE 101 1HD1 ILE 101 13.308 -2.315 -2.438 754 2HD1 ILE 101 2HD1 ILE 101 13.806 -3.921 -1.904 755 3HD1 ILE 101 3HD1 ILE 101 14.117 -3.407 -3.562 756 H GLN 102 H GLN 102 9.790 -7.162 -5.237 757 HA GLN 102 HA GLN 102 11.562 -8.905 -6.617 758 1HB GLN 102 1HB GLN 102 10.625 -11.036 -6.023 759 2HB GLN 102 2HB GLN 102 11.136 -10.230 -4.546 760 1HG GLN 102 1HG GLN 102 8.797 -9.535 -4.163 761 2HG GLN 102 2HG GLN 102 8.323 -10.459 -5.588 762 1HE2 GLN 102 1HE2 GLN 102 8.242 -10.565 -2.395 763 2HE2 GLN 102 2HE2 GLN 102 8.382 -12.264 -2.114 764 H ASN 103 H ASN 103 10.263 -10.347 -8.185 765 HA ASN 103 HA ASN 103 8.710 -8.747 -9.824 766 1HB ASN 103 1HB ASN 103 9.397 -11.594 -9.681 767 2HB ASN 103 2HB ASN 103 7.848 -11.282 -10.458 768 1HD2 ASN 103 1HD2 ASN 103 10.677 -12.076 -11.343 769 2HD2 ASN 103 2HD2 ASN 103 10.969 -11.049 -12.701 770 HA PRO 104 HA PRO 104 4.614 -8.714 -8.252 771 1HB PRO 104 1HB PRO 104 3.116 -8.968 -10.502 772 2HB PRO 104 2HB PRO 104 4.011 -7.496 -10.105 773 1HG PRO 104 1HG PRO 104 4.751 -9.720 -11.969 774 2HG PRO 104 2HG PRO 104 4.913 -7.968 -12.196 775 1HD PRO 104 1HD PRO 104 6.997 -9.543 -11.483 776 2HD PRO 104 2HD PRO 104 6.846 -7.857 -10.946 777 H THR 105 H THR 105 2.912 -10.018 -7.612 778 HA THR 105 HA THR 105 3.155 -12.856 -8.359 779 HB THR 105 HB THR 105 1.926 -13.299 -6.211 780 HG1 THR 105 HG1 THR 105 2.171 -11.405 -4.704 781 1HG2 THR 105 1HG2 THR 105 4.518 -11.791 -5.862 782 2HG2 THR 105 2HG2 THR 105 4.402 -13.455 -6.435 783 3HG2 THR 105 3HG2 THR 105 3.866 -13.044 -4.807 784 H GLU 106 H GLU 106 0.904 -10.189 -7.950 785 HA GLU 106 HA GLU 106 -1.289 -9.918 -8.514 786 1HB GLU 106 1HB GLU 106 -0.464 -10.023 -10.752 787 2HB GLU 106 2HB GLU 106 -0.333 -11.775 -10.690 788 1HG GLU 106 1HG GLU 106 -2.682 -12.045 -10.753 789 2HG GLU 106 2HG GLU 106 -2.954 -10.326 -10.473 790 H MET 11 H MET 11 -18.907 4.410 -15.797 791 HA MET 11 HA MET 11 -19.326 3.895 -13.239 792 1HB MET 11 1HB MET 11 -21.321 4.581 -15.364 793 2HB MET 11 2HB MET 11 -21.867 4.324 -13.712 794 1HG MET 11 1HG MET 11 -19.581 6.075 -13.784 795 2HG MET 11 2HG MET 11 -20.876 6.673 -14.818 796 1HE MET 11 1HE MET 11 -20.799 4.856 -11.141 797 2HE MET 11 2HE MET 11 -19.503 6.019 -11.424 798 3HE MET 11 3HE MET 11 -20.788 6.392 -10.274 799 H ALA 12 H ALA 12 -21.001 2.068 -15.794 800 HA ALA 12 HA ALA 12 -22.474 0.342 -14.217 801 1HB ALA 12 1HB ALA 12 -21.703 -1.239 -16.342 802 2HB ALA 12 2HB ALA 12 -23.088 -0.147 -16.304 803 3HB ALA 12 3HB ALA 12 -21.550 0.401 -16.971 804 H GLU 13 H GLU 13 -19.093 0.089 -15.222 805 HA GLU 13 HA GLU 13 -18.519 -2.483 -14.391 806 1HB GLU 13 1HB GLU 13 -17.032 -0.123 -15.077 807 2HB GLU 13 2HB GLU 13 -16.286 -0.902 -13.688 808 1HG GLU 13 1HG GLU 13 -17.013 -2.429 -16.163 809 2HG GLU 13 2HG GLU 13 -15.475 -1.585 -15.997 810 H VAL 14 H VAL 14 -18.255 0.512 -12.481 811 HA VAL 14 HA VAL 14 -17.503 -0.752 -10.074 812 HB VAL 14 HB VAL 14 -18.956 1.881 -10.346 813 1HG1 VAL 14 1HG1 VAL 14 -17.184 2.123 -8.290 814 2HG1 VAL 14 2HG1 VAL 14 -18.894 1.725 -8.108 815 3HG1 VAL 14 3HG1 VAL 14 -17.686 0.440 -8.133 816 1HG2 VAL 14 1HG2 VAL 14 -16.359 2.560 -10.067 817 2HG2 VAL 14 2HG2 VAL 14 -16.200 1.085 -11.022 818 3HG2 VAL 14 3HG2 VAL 14 -17.177 2.425 -11.624 819 H GLU 15 H GLU 15 -20.645 0.173 -11.400 820 HA GLU 15 HA GLU 15 -22.208 -0.346 -9.136 821 1HB GLU 15 1HB GLU 15 -22.852 -0.475 -12.081 822 2HB GLU 15 2HB GLU 15 -24.065 -0.710 -10.830 823 1HG GLU 15 1HG GLU 15 -23.883 1.498 -10.077 824 2HG GLU 15 2HG GLU 15 -22.359 1.751 -10.927 825 H GLU 16 H GLU 16 -20.978 -2.476 -11.647 826 HA GLU 16 HA GLU 16 -22.512 -4.750 -10.888 827 1HB GLU 16 1HB GLU 16 -20.978 -4.132 -13.046 828 2HB GLU 16 2HB GLU 16 -19.905 -5.224 -12.182 829 1HG GLU 16 1HG GLU 16 -21.575 -6.959 -12.209 830 2HG GLU 16 2HG GLU 16 -22.742 -5.866 -12.950 831 H THR 17 H THR 17 -19.328 -3.525 -10.024 832 HA THR 17 HA THR 17 -18.599 -5.845 -8.499 833 HB THR 17 HB THR 17 -17.389 -3.081 -8.651 834 HG1 THR 17 HG1 THR 17 -16.979 -4.229 -10.504 835 1HG2 THR 17 1HG2 THR 17 -16.694 -3.751 -6.542 836 2HG2 THR 17 2HG2 THR 17 -15.405 -4.379 -7.569 837 3HG2 THR 17 3HG2 THR 17 -16.669 -5.459 -6.981 838 H LEU 18 H LEU 18 -20.290 -2.884 -7.883 839 HA LEU 18 HA LEU 18 -19.975 -2.920 -5.038 840 1HB LEU 18 1HB LEU 18 -21.016 -1.156 -6.975 841 2HB LEU 18 2HB LEU 18 -22.334 -1.521 -5.863 842 HG LEU 18 HG LEU 18 -20.500 -0.935 -4.052 843 1HD1 LEU 18 1HD1 LEU 18 -18.673 -0.620 -5.606 844 2HD1 LEU 18 2HD1 LEU 18 -19.075 0.912 -4.830 845 3HD1 LEU 18 3HD1 LEU 18 -19.597 0.598 -6.485 846 1HD2 LEU 18 1HD2 LEU 18 -22.722 0.287 -5.050 847 2HD2 LEU 18 2HD2 LEU 18 -21.487 1.521 -5.303 848 3HD2 LEU 18 3HD2 LEU 18 -21.770 0.874 -3.686 849 H LYS 19 H LYS 19 -22.680 -3.693 -7.223 850 HA LYS 19 HA LYS 19 -24.450 -4.587 -5.236 851 1HB LYS 19 1HB LYS 19 -24.278 -5.395 -8.145 852 2HB LYS 19 2HB LYS 19 -25.649 -5.706 -7.088 853 1HG LYS 19 1HG LYS 19 -24.795 -2.897 -7.247 854 2HG LYS 19 2HG LYS 19 -25.452 -3.583 -8.735 855 1HD LYS 19 1HD LYS 19 -26.833 -3.784 -6.066 856 2HD LYS 19 2HD LYS 19 -27.131 -2.480 -7.217 857 1HE LYS 19 1HE LYS 19 -27.762 -4.175 -8.906 858 2HE LYS 19 2HE LYS 19 -27.557 -5.430 -7.685 859 1HZ LYS 19 1HZ LYS 19 -29.582 -3.275 -7.768 860 2HZ LYS 19 2HZ LYS 19 -29.247 -4.131 -6.348 861 3HZ LYS 19 3HZ LYS 19 -29.831 -4.948 -7.710 862 H ARG 20 H ARG 20 -21.758 -6.122 -6.795 863 HA ARG 20 HA ARG 20 -22.503 -8.792 -6.001 864 1HB ARG 20 1HB ARG 20 -21.147 -8.273 -8.047 865 2HB ARG 20 2HB ARG 20 -19.823 -7.808 -6.987 866 1HG ARG 20 1HG ARG 20 -19.150 -9.918 -7.090 867 2HG ARG 20 2HG ARG 20 -20.546 -10.324 -6.090 868 1HD ARG 20 1HD ARG 20 -21.880 -10.572 -8.184 869 2HD ARG 20 2HD ARG 20 -20.389 -10.348 -9.099 870 HE ARG 20 HE ARG 20 -20.227 -12.452 -7.154 871 1HH1 ARG 20 1HH1 ARG 20 -21.205 -11.630 -10.393 872 2HH1 ARG 20 2HH1 ARG 20 -21.059 -13.250 -10.988 873 1HH2 ARG 20 1HH2 ARG 20 -20.031 -14.590 -7.926 874 2HH2 ARG 20 2HH2 ARG 20 -20.392 -14.933 -9.584 875 H LEU 21 H LEU 21 -20.170 -6.344 -4.945 876 HA LEU 21 HA LEU 21 -19.021 -7.936 -2.891 877 1HB LEU 21 1HB LEU 21 -18.882 -5.133 -3.780 878 2HB LEU 21 2HB LEU 21 -18.545 -5.400 -2.071 879 HG LEU 21 HG LEU 21 -16.694 -6.832 -2.595 880 1HD1 LEU 21 1HD1 LEU 21 -16.911 -8.094 -4.425 881 2HD1 LEU 21 2HD1 LEU 21 -16.239 -6.713 -5.291 882 3HD1 LEU 21 3HD1 LEU 21 -17.986 -6.938 -5.210 883 1HD2 LEU 21 1HD2 LEU 21 -16.699 -4.310 -4.247 884 2HD2 LEU 21 2HD2 LEU 21 -15.259 -5.257 -3.875 885 3HD2 LEU 21 3HD2 LEU 21 -16.170 -4.489 -2.574 886 H GLN 22 H GLN 22 -21.520 -5.417 -2.904 887 HA GLN 22 HA GLN 22 -21.985 -5.193 -0.192 888 1HB GLN 22 1HB GLN 22 -23.452 -4.608 -2.639 889 2HB GLN 22 2HB GLN 22 -24.520 -5.037 -1.309 890 1HG GLN 22 1HG GLN 22 -24.389 -2.847 -0.853 891 2HG GLN 22 2HG GLN 22 -22.892 -3.316 -0.050 892 1HE2 GLN 22 1HE2 GLN 22 -21.448 -1.792 -0.408 893 2HE2 GLN 22 2HE2 GLN 22 -21.104 -1.055 -1.932 894 H SER 23 H SER 23 -22.928 -7.735 -2.391 895 HA SER 23 HA SER 23 -24.791 -8.972 -0.599 896 1HB SER 23 1HB SER 23 -23.942 -9.332 -3.315 897 2HB SER 23 2HB SER 23 -23.846 -10.879 -2.474 898 HG SER 23 HG SER 23 -25.914 -10.901 -2.918 899 H GLN 24 H GLN 24 -21.372 -9.262 -1.269 900 HA GLN 24 HA GLN 24 -20.846 -11.730 -0.082 901 1HB GLN 24 1HB GLN 24 -19.112 -9.259 -0.216 902 2HB GLN 24 2HB GLN 24 -18.537 -10.854 0.248 903 1HG GLN 24 1HG GLN 24 -19.191 -11.708 -1.963 904 2HG GLN 24 2HG GLN 24 -19.688 -10.080 -2.422 905 1HE2 GLN 24 1HE2 GLN 24 -17.709 -8.535 -1.432 906 2HE2 GLN 24 2HE2 GLN 24 -16.206 -8.918 -2.192 907 H LYS 25 H LYS 25 -20.002 -12.268 1.991 908 HA LYS 25 HA LYS 25 -21.150 -10.625 4.122 909 1HB LYS 25 1HB LYS 25 -21.388 -13.263 3.725 910 2HB LYS 25 2HB LYS 25 -19.928 -13.271 4.706 911 1HG LYS 25 1HG LYS 25 -21.829 -11.542 5.927 912 2HG LYS 25 2HG LYS 25 -22.613 -13.078 5.553 913 1HD LYS 25 1HD LYS 25 -20.328 -14.015 6.568 914 2HD LYS 25 2HD LYS 25 -20.397 -12.476 7.429 915 1HE LYS 25 1HE LYS 25 -22.552 -13.013 8.335 916 2HE LYS 25 2HE LYS 25 -22.664 -14.461 7.336 917 1HZ LYS 25 1HZ LYS 25 -22.050 -15.064 9.560 918 2HZ LYS 25 2HZ LYS 25 -20.743 -13.990 9.551 919 3HZ LYS 25 3HZ LYS 25 -20.729 -15.347 8.541 920 H GLY 26 H GLY 26 -19.625 -9.014 4.399 921 1HA GLY 26 1HA GLY 26 -17.700 -9.137 6.239 922 2HA GLY 26 2HA GLY 26 -16.840 -9.744 4.832 923 H VAL 27 H VAL 27 -18.625 -7.893 3.168 924 HA VAL 27 HA VAL 27 -16.781 -5.788 2.901 925 HB VAL 27 HB VAL 27 -19.647 -5.924 1.955 926 1HG1 VAL 27 1HG1 VAL 27 -17.598 -3.852 1.749 927 2HG1 VAL 27 2HG1 VAL 27 -18.288 -4.328 0.196 928 3HG1 VAL 27 3HG1 VAL 27 -19.340 -3.756 1.491 929 1HG2 VAL 27 1HG2 VAL 27 -18.540 -7.712 0.941 930 2HG2 VAL 27 2HG2 VAL 27 -18.430 -6.418 -0.252 931 3HG2 VAL 27 3HG2 VAL 27 -17.039 -6.803 0.762 932 H GLN 28 H GLN 28 -16.587 -3.873 3.882 933 HA GLN 28 HA GLN 28 -18.523 -3.193 5.962 934 1HB GLN 28 1HB GLN 28 -15.659 -2.753 5.541 935 2HB GLN 28 2HB GLN 28 -16.505 -1.328 6.130 936 1HG GLN 28 1HG GLN 28 -15.508 -2.828 7.882 937 2HG GLN 28 2HG GLN 28 -17.212 -2.426 8.085 938 1HE2 GLN 28 1HE2 GLN 28 -14.909 -4.913 7.559 939 2HE2 GLN 28 2HE2 GLN 28 -16.008 -6.246 7.599 940 H GLY 29 H GLY 29 -17.217 -1.999 2.941 941 1HA GLY 29 1HA GLY 29 -19.364 -0.490 2.176 942 2HA GLY 29 2HA GLY 29 -18.407 0.606 3.161 943 H ILE 30 H ILE 30 -19.065 0.527 0.231 944 HA ILE 30 HA ILE 30 -16.312 0.474 -0.817 945 HB ILE 30 HB ILE 30 -18.874 0.289 -2.404 946 1HG1 ILE 30 1HG1 ILE 30 -16.897 -1.921 -1.827 947 2HG1 ILE 30 2HG1 ILE 30 -18.377 -1.685 -0.903 948 1HG2 ILE 30 1HG2 ILE 30 -17.183 1.220 -3.767 949 2HG2 ILE 30 2HG2 ILE 30 -15.969 0.101 -3.152 950 3HG2 ILE 30 3HG2 ILE 30 -17.265 -0.490 -4.192 951 1HD1 ILE 30 1HD1 ILE 30 -18.157 -3.300 -3.048 952 2HD1 ILE 30 2HD1 ILE 30 -19.666 -2.558 -2.513 953 3HD1 ILE 30 3HD1 ILE 30 -18.731 -1.818 -3.812 954 H ILE 31 H ILE 31 -15.483 2.250 -1.813 955 HA ILE 31 HA ILE 31 -17.220 4.625 -1.980 956 HB ILE 31 HB ILE 31 -14.311 4.562 -1.172 957 1HG1 ILE 31 1HG1 ILE 31 -16.451 5.677 0.568 958 2HG1 ILE 31 2HG1 ILE 31 -16.357 3.924 0.431 959 1HG2 ILE 31 1HG2 ILE 31 -16.211 6.817 -1.725 960 2HG2 ILE 31 2HG2 ILE 31 -14.801 7.023 -0.687 961 3HG2 ILE 31 3HG2 ILE 31 -14.593 6.552 -2.374 962 1HD1 ILE 31 1HD1 ILE 31 -13.835 5.361 0.980 963 2HD1 ILE 31 2HD1 ILE 31 -15.032 5.299 2.274 964 3HD1 ILE 31 3HD1 ILE 31 -14.412 3.804 1.574 965 H VAL 32 H VAL 32 -16.942 5.988 -3.726 966 HA VAL 32 HA VAL 32 -14.927 5.253 -5.726 967 HB VAL 32 HB VAL 32 -17.781 5.808 -6.514 968 1HG1 VAL 32 1HG1 VAL 32 -15.517 4.522 -8.034 969 2HG1 VAL 32 2HG1 VAL 32 -17.111 4.945 -8.661 970 3HG1 VAL 32 3HG1 VAL 32 -15.987 6.215 -8.176 971 1HG2 VAL 32 1HG2 VAL 32 -16.448 3.122 -6.176 972 2HG2 VAL 32 2HG2 VAL 32 -17.748 3.769 -5.175 973 3HG2 VAL 32 3HG2 VAL 32 -18.045 3.399 -6.874 974 H VAL 33 H VAL 33 -13.869 6.981 -6.437 975 HA VAL 33 HA VAL 33 -15.237 9.580 -6.483 976 HB VAL 33 HB VAL 33 -12.377 9.346 -5.582 977 1HG1 VAL 33 1HG1 VAL 33 -14.115 11.537 -4.674 978 2HG1 VAL 33 2HG1 VAL 33 -12.455 11.574 -5.271 979 3HG1 VAL 33 3HG1 VAL 33 -13.800 11.496 -6.409 980 1HG2 VAL 33 1HG2 VAL 33 -14.838 9.402 -3.838 981 2HG2 VAL 33 2HG2 VAL 33 -13.696 8.068 -3.994 982 3HG2 VAL 33 3HG2 VAL 33 -13.180 9.589 -3.268 983 H ASN 34 H ASN 34 -14.768 10.855 -8.206 984 HA ASN 34 HA ASN 34 -13.539 9.678 -10.470 985 1HB ASN 34 1HB ASN 34 -14.033 12.632 -10.214 986 2HB ASN 34 2HB ASN 34 -14.168 11.610 -11.641 987 1HD2 ASN 34 1HD2 ASN 34 -15.882 13.267 -9.408 988 2HD2 ASN 34 2HD2 ASN 34 -17.383 12.416 -9.495 989 H THR 35 H THR 35 -12.047 11.594 -11.689 990 HA THR 35 HA THR 35 -9.528 11.316 -10.334 991 HB THR 35 HB THR 35 -9.395 13.106 -12.592 992 HG1 THR 35 HG1 THR 35 -10.176 11.525 -14.135 993 1HG2 THR 35 1HG2 THR 35 -7.527 11.765 -11.829 994 2HG2 THR 35 2HG2 THR 35 -7.947 11.301 -13.478 995 3HG2 THR 35 3HG2 THR 35 -8.433 10.282 -12.124 996 H GLU 36 H GLU 36 -11.935 13.775 -10.651 997 HA GLU 36 HA GLU 36 -10.256 16.001 -10.037 998 1HB GLU 36 1HB GLU 36 -13.173 15.522 -10.312 999 2HB GLU 36 2HB GLU 36 -12.685 16.904 -9.343 1000 1HG GLU 36 1HG GLU 36 -11.126 17.282 -11.495 1001 2HG GLU 36 2HG GLU 36 -12.492 16.460 -12.246 1002 H GLY 37 H GLY 37 -12.229 13.773 -8.157 1003 1HA GLY 37 1HA GLY 37 -11.290 13.325 -5.890 1004 2HA GLY 37 2HA GLY 37 -11.215 15.071 -5.703 1005 H ILE 38 H ILE 38 -13.949 14.067 -7.419 1006 HA ILE 38 HA ILE 38 -15.612 14.530 -5.046 1007 HB ILE 38 HB ILE 38 -16.495 14.551 -7.930 1008 1HG1 ILE 38 1HG1 ILE 38 -15.722 16.881 -6.161 1009 2HG1 ILE 38 2HG1 ILE 38 -14.791 16.285 -7.530 1010 1HG2 ILE 38 1HG2 ILE 38 -18.242 14.167 -6.225 1011 2HG2 ILE 38 2HG2 ILE 38 -17.800 15.696 -5.466 1012 3HG2 ILE 38 3HG2 ILE 38 -18.458 15.682 -7.102 1013 1HD1 ILE 38 1HD1 ILE 38 -15.910 18.122 -8.383 1014 2HD1 ILE 38 2HD1 ILE 38 -16.912 16.765 -8.900 1015 3HD1 ILE 38 3HD1 ILE 38 -17.398 17.743 -7.516 1016 HA PRO 39 HA PRO 39 -16.682 10.235 -4.987 1017 1HB PRO 39 1HB PRO 39 -18.761 10.428 -3.252 1018 2HB PRO 39 2HB PRO 39 -17.071 10.531 -2.742 1019 1HG PRO 39 1HG PRO 39 -19.036 12.734 -3.240 1020 2HG PRO 39 2HG PRO 39 -17.866 12.555 -1.919 1021 1HD PRO 39 1HD PRO 39 -17.419 14.157 -4.056 1022 2HD PRO 39 2HD PRO 39 -16.109 13.312 -3.206 1023 H ILE 40 H ILE 40 -18.051 8.938 -6.098 1024 HA ILE 40 HA ILE 40 -20.432 10.199 -7.297 1025 HB ILE 40 HB ILE 40 -20.104 8.358 -9.085 1026 1HG1 ILE 40 1HG1 ILE 40 -17.306 8.534 -7.945 1027 2HG1 ILE 40 2HG1 ILE 40 -18.353 7.120 -7.887 1028 1HG2 ILE 40 1HG2 ILE 40 -18.074 10.577 -9.055 1029 2HG2 ILE 40 2HG2 ILE 40 -18.873 9.852 -10.449 1030 3HG2 ILE 40 3HG2 ILE 40 -19.795 10.851 -9.325 1031 1HD1 ILE 40 1HD1 ILE 40 -16.501 7.830 -9.872 1032 2HD1 ILE 40 2HD1 ILE 40 -17.617 6.464 -9.862 1033 3HD1 ILE 40 3HD1 ILE 40 -18.103 7.994 -10.591 1034 H LYS 41 H LYS 41 -19.075 7.295 -5.856 1035 HA LYS 41 HA LYS 41 -21.792 6.394 -5.241 1036 1HB LYS 41 1HB LYS 41 -19.684 4.824 -6.693 1037 2HB LYS 41 2HB LYS 41 -20.885 4.001 -5.705 1038 1HG LYS 41 1HG LYS 41 -22.220 5.866 -7.391 1039 2HG LYS 41 2HG LYS 41 -21.118 4.896 -8.371 1040 1HD LYS 41 1HD LYS 41 -22.253 2.962 -7.975 1041 2HD LYS 41 2HD LYS 41 -22.764 3.465 -6.362 1042 1HE LYS 41 1HE LYS 41 -23.869 4.601 -8.927 1043 2HE LYS 41 2HE LYS 41 -24.618 3.286 -8.024 1044 1HZ LYS 41 1HZ LYS 41 -25.727 5.052 -7.156 1045 2HZ LYS 41 2HZ LYS 41 -24.440 6.130 -7.361 1046 3HZ LYS 41 3HZ LYS 41 -24.419 5.022 -6.083 1047 H SER 42 H SER 42 -21.994 5.877 -3.164 1048 HA SER 42 HA SER 42 -19.880 4.595 -1.693 1049 1HB SER 42 1HB SER 42 -19.651 7.289 -1.731 1050 2HB SER 42 2HB SER 42 -20.732 7.095 -0.350 1051 HG SER 42 HG SER 42 -19.102 5.439 0.329 1052 H THR 43 H THR 43 -20.800 3.209 -0.340 1053 HA THR 43 HA THR 43 -23.636 3.509 0.284 1054 HB THR 43 HB THR 43 -23.663 1.213 0.865 1055 HG1 THR 43 HG1 THR 43 -21.963 0.228 1.670 1056 1HG2 THR 43 1HG2 THR 43 -21.632 1.035 -1.300 1057 2HG2 THR 43 2HG2 THR 43 -23.097 1.964 -1.619 1058 3HG2 THR 43 3HG2 THR 43 -23.211 0.263 -1.166 1059 H MET 44 H MET 44 -20.733 4.317 1.676 1060 HA MET 44 HA MET 44 -21.317 3.653 4.404 1061 1HB MET 44 1HB MET 44 -19.073 4.556 2.970 1062 2HB MET 44 2HB MET 44 -19.435 5.822 4.135 1063 1HG MET 44 1HG MET 44 -19.236 4.315 5.959 1064 2HG MET 44 2HG MET 44 -19.162 2.925 4.879 1065 1HE MET 44 1HE MET 44 -17.287 2.459 3.236 1066 2HE MET 44 2HE MET 44 -17.039 4.074 2.574 1067 3HE MET 44 3HE MET 44 -15.681 3.186 3.265 1068 H ASP 45 H ASP 45 -20.762 5.915 5.827 1069 HA ASP 45 HA ASP 45 -23.270 7.267 5.771 1070 1HB ASP 45 1HB ASP 45 -21.222 6.891 7.641 1071 2HB ASP 45 2HB ASP 45 -21.257 8.628 7.348 1072 H ASN 46 H ASN 46 -23.332 9.730 5.896 1073 HA ASN 46 HA ASN 46 -22.460 10.774 3.419 1074 1HB ASN 46 1HB ASN 46 -24.265 11.534 5.439 1075 2HB ASN 46 2HB ASN 46 -23.110 12.858 5.309 1076 1HD2 ASN 46 1HD2 ASN 46 -22.506 12.753 2.626 1077 2HD2 ASN 46 2HD2 ASN 46 -23.911 13.168 1.709 1078 HA PRO 47 HA PRO 47 -19.335 13.384 6.028 1079 1HB PRO 47 1HB PRO 47 -18.971 12.654 8.617 1080 2HB PRO 47 2HB PRO 47 -20.189 13.831 8.114 1081 1HG PRO 47 1HG PRO 47 -20.513 10.924 8.749 1082 2HG PRO 47 2HG PRO 47 -21.543 12.291 9.211 1083 1HD PRO 47 1HD PRO 47 -22.157 10.634 7.160 1084 2HD PRO 47 2HD PRO 47 -22.595 12.355 7.162 1085 H THR 48 H THR 48 -19.656 9.945 6.552 1086 HA THR 48 HA THR 48 -16.879 9.452 7.037 1087 HB THR 48 HB THR 48 -18.905 7.435 6.065 1088 HG1 THR 48 HG1 THR 48 -18.409 8.414 8.694 1089 1HG2 THR 48 1HG2 THR 48 -16.541 6.731 6.079 1090 2HG2 THR 48 2HG2 THR 48 -17.506 5.840 7.257 1091 3HG2 THR 48 3HG2 THR 48 -16.443 7.142 7.791 1092 H THR 49 H THR 49 -18.974 9.433 4.211 1093 HA THR 49 HA THR 49 -17.094 8.243 2.440 1094 HB THR 49 HB THR 49 -19.533 9.939 1.887 1095 HG1 THR 49 HG1 THR 49 -20.413 8.079 2.404 1096 1HG2 THR 49 1HG2 THR 49 -18.023 10.131 0.003 1097 2HG2 THR 49 2HG2 THR 49 -19.364 9.069 -0.427 1098 3HG2 THR 49 3HG2 THR 49 -17.790 8.384 -0.026 1099 H THR 50 H THR 50 -18.090 11.612 3.004 1100 HA THR 50 HA THR 50 -16.488 12.852 1.109 1101 HB THR 50 HB THR 50 -16.641 14.338 3.630 1102 HG1 THR 50 HG1 THR 50 -18.757 14.176 3.965 1103 1HG2 THR 50 1HG2 THR 50 -17.286 16.081 2.257 1104 2HG2 THR 50 2HG2 THR 50 -18.094 15.016 1.107 1105 3HG2 THR 50 3HG2 THR 50 -16.333 15.098 1.146 1106 H GLN 51 H GLN 51 -15.729 12.188 4.527 1107 HA GLN 51 HA GLN 51 -13.152 13.245 4.548 1108 1HB GLN 51 1HB GLN 51 -14.198 12.684 6.620 1109 2HB GLN 51 2HB GLN 51 -14.388 11.003 6.141 1110 1HG GLN 51 1HG GLN 51 -11.619 11.926 6.125 1111 2HG GLN 51 2HG GLN 51 -12.389 11.991 7.709 1112 1HE2 GLN 51 1HE2 GLN 51 -10.943 10.024 5.363 1113 2HE2 GLN 51 2HE2 GLN 51 -11.221 8.497 6.121 1114 H TYR 52 H TYR 52 -14.151 9.863 4.037 1115 HA TYR 52 HA TYR 52 -11.626 8.791 3.578 1116 1HB TYR 52 1HB TYR 52 -14.396 8.004 2.770 1117 2HB TYR 52 2HB TYR 52 -13.028 7.140 2.077 1118 HD1 TYR 52 HD1 TYR 52 -13.783 8.443 5.503 1119 HD2 TYR 52 HD2 TYR 52 -12.765 5.089 3.091 1120 HE1 TYR 52 HE1 TYR 52 -13.656 7.039 7.519 1121 HE2 TYR 52 HE2 TYR 52 -12.636 3.676 5.100 1122 HH TYR 52 HH TYR 52 -13.489 3.640 7.384 1123 H ALA 53 H ALA 53 -13.988 9.982 1.193 1124 HA ALA 53 HA ALA 53 -12.405 9.573 -1.083 1125 1HB ALA 53 1HB ALA 53 -13.890 11.429 -2.057 1126 2HB ALA 53 2HB ALA 53 -14.669 9.950 -1.491 1127 3HB ALA 53 3HB ALA 53 -14.705 11.403 -0.493 1128 H SER 54 H SER 54 -12.162 11.900 1.413 1129 HA SER 54 HA SER 54 -10.852 13.944 -0.104 1130 1HB SER 54 1HB SER 54 -12.100 14.196 2.139 1131 2HB SER 54 2HB SER 54 -10.615 13.599 2.879 1132 HG SER 54 HG SER 54 -11.152 16.061 2.137 1133 H LEU 55 H LEU 55 -9.726 11.510 2.238 1134 HA LEU 55 HA LEU 55 -6.959 12.101 1.673 1135 1HB LEU 55 1HB LEU 55 -6.440 10.777 3.458 1136 2HB LEU 55 2HB LEU 55 -8.077 11.267 3.887 1137 HG LEU 55 HG LEU 55 -8.663 8.991 2.633 1138 1HD1 LEU 55 1HD1 LEU 55 -7.014 7.507 2.403 1139 2HD1 LEU 55 2HD1 LEU 55 -6.315 7.906 3.972 1140 3HD1 LEU 55 3HD1 LEU 55 -5.921 8.882 2.558 1141 1HD2 LEU 55 1HD2 LEU 55 -9.228 8.237 4.684 1142 2HD2 LEU 55 2HD2 LEU 55 -8.791 9.877 5.166 1143 3HD2 LEU 55 3HD2 LEU 55 -7.633 8.561 5.364 1144 H MET 56 H MET 56 -9.362 10.127 0.326 1145 HA MET 56 HA MET 56 -7.918 7.886 -0.514 1146 1HB MET 56 1HB MET 56 -10.487 9.017 -0.996 1147 2HB MET 56 2HB MET 56 -9.774 8.614 -2.553 1148 1HG MET 56 1HG MET 56 -11.106 6.778 -1.694 1149 2HG MET 56 2HG MET 56 -9.406 6.330 -1.812 1150 1HE MET 56 1HE MET 56 -8.739 4.605 0.954 1151 2HE MET 56 2HE MET 56 -8.115 5.537 -0.407 1152 3HE MET 56 3HE MET 56 -7.907 6.134 1.241 1153 H HIS 57 H HIS 57 -8.397 11.029 -2.092 1154 HA HIS 57 HA HIS 57 -6.858 10.363 -4.398 1155 1HB HIS 57 1HB HIS 57 -8.612 12.137 -4.350 1156 2HB HIS 57 2HB HIS 57 -7.549 13.111 -3.338 1157 HD1 HIS 57 HD1 HIS 57 -8.159 14.598 -5.695 1158 HD2 HIS 57 HD2 HIS 57 -5.252 11.634 -5.834 1159 HE1 HIS 57 HE1 HIS 57 -6.741 15.140 -7.700 1160 H SER 58 H SER 58 -6.199 12.429 -1.570 1161 HA SER 58 HA SER 58 -3.575 13.107 -2.214 1162 1HB SER 58 1HB SER 58 -4.570 14.329 -0.459 1163 2HB SER 58 2HB SER 58 -5.024 12.867 0.417 1164 HG SER 58 HG SER 58 -2.985 14.253 0.960 1165 H PHE 59 H PHE 59 -4.892 10.149 -1.019 1166 HA PHE 59 HA PHE 59 -2.630 9.031 0.201 1167 1HB PHE 59 1HB PHE 59 -4.828 8.025 0.446 1168 2HB PHE 59 2HB PHE 59 -4.897 7.682 -1.279 1169 HD1 PHE 59 HD1 PHE 59 -4.984 5.374 -1.432 1170 HD2 PHE 59 HD2 PHE 59 -2.105 7.188 1.124 1171 HE1 PHE 59 HE1 PHE 59 -3.956 3.174 -1.035 1172 HE2 PHE 59 HE2 PHE 59 -1.071 4.992 1.524 1173 HZ PHE 59 HZ PHE 59 -1.996 2.981 0.444 1174 H ILE 60 H ILE 60 -3.845 8.518 -3.115 1175 HA ILE 60 HA ILE 60 -1.468 7.162 -3.941 1176 HB ILE 60 HB ILE 60 -3.723 8.324 -5.579 1177 1HG1 ILE 60 1HG1 ILE 60 -3.591 5.471 -5.604 1178 2HG1 ILE 60 2HG1 ILE 60 -3.546 6.011 -3.929 1179 1HG2 ILE 60 1HG2 ILE 60 -1.322 6.701 -6.338 1180 2HG2 ILE 60 2HG2 ILE 60 -2.804 6.641 -7.291 1181 3HG2 ILE 60 3HG2 ILE 60 -1.950 8.170 -7.084 1182 1HD1 ILE 60 1HD1 ILE 60 -5.782 5.725 -5.577 1183 2HD1 ILE 60 2HD1 ILE 60 -5.716 6.424 -3.958 1184 3HD1 ILE 60 3HD1 ILE 60 -5.549 7.461 -5.375 1185 H LEU 61 H LEU 61 -2.666 10.456 -4.156 1186 HA LEU 61 HA LEU 61 -0.821 11.446 -6.028 1187 1HB LEU 61 1HB LEU 61 -2.918 12.464 -4.498 1188 2HB LEU 61 2HB LEU 61 -1.503 13.391 -4.003 1189 HG LEU 61 HG LEU 61 -1.129 14.091 -6.299 1190 1HD1 LEU 61 1HD1 LEU 61 -1.818 12.358 -7.669 1191 2HD1 LEU 61 2HD1 LEU 61 -3.076 13.568 -7.919 1192 3HD1 LEU 61 3HD1 LEU 61 -3.374 12.195 -6.855 1193 1HD2 LEU 61 1HD2 LEU 61 -3.769 14.552 -5.001 1194 2HD2 LEU 61 2HD2 LEU 61 -3.494 15.200 -6.618 1195 3HD2 LEU 61 3HD2 LEU 61 -2.438 15.674 -5.287 1196 H LYS 62 H LYS 62 -0.614 10.946 -2.564 1197 HA LYS 62 HA LYS 62 1.863 12.365 -2.263 1198 1HB LYS 62 1HB LYS 62 0.093 11.938 -0.459 1199 2HB LYS 62 2HB LYS 62 0.761 10.314 -0.351 1200 1HG LYS 62 1HG LYS 62 1.716 11.696 1.367 1201 2HG LYS 62 2HG LYS 62 2.961 11.284 0.186 1202 1HD LYS 62 1HD LYS 62 3.399 13.457 -0.007 1203 2HD LYS 62 2HD LYS 62 1.805 13.661 -0.737 1204 1HE LYS 62 1HE LYS 62 1.401 15.039 0.980 1205 2HE LYS 62 2HE LYS 62 1.212 13.567 1.931 1206 1HZ LYS 62 1HZ LYS 62 2.747 15.238 2.907 1207 2HZ LYS 62 2HZ LYS 62 3.794 14.990 1.602 1208 3HZ LYS 62 3HZ LYS 62 3.453 13.719 2.666 1209 H ALA 63 H ALA 63 0.961 8.917 -2.165 1210 HA ALA 63 HA ALA 63 3.556 7.896 -1.937 1211 1HB ALA 63 1HB ALA 63 1.557 6.560 -1.515 1212 2HB ALA 63 2HB ALA 63 1.152 6.612 -3.231 1213 3HB ALA 63 3HB ALA 63 2.610 5.776 -2.694 1214 H ARG 64 H ARG 64 1.545 8.315 -4.851 1215 HA ARG 64 HA ARG 64 3.316 7.371 -6.745 1216 1HB ARG 64 1HB ARG 64 0.913 8.150 -7.072 1217 2HB ARG 64 2HB ARG 64 1.559 9.782 -7.185 1218 1HG ARG 64 1HG ARG 64 3.083 8.216 -8.945 1219 2HG ARG 64 2HG ARG 64 1.398 7.753 -9.193 1220 1HD ARG 64 1HD ARG 64 2.488 10.565 -9.246 1221 2HD ARG 64 2HD ARG 64 2.050 9.602 -10.657 1222 HE ARG 64 HE ARG 64 -0.092 9.930 -8.768 1223 1HH1 ARG 64 1HH1 ARG 64 1.552 11.321 -11.504 1224 2HH1 ARG 64 2HH1 ARG 64 0.185 12.253 -12.017 1225 1HH2 ARG 64 1HH2 ARG 64 -1.899 11.152 -9.434 1226 2HH2 ARG 64 2HH2 ARG 64 -1.777 12.158 -10.838 1227 H SER 65 H SER 65 3.326 10.417 -5.041 1228 HA SER 65 HA SER 65 5.135 11.793 -6.730 1229 1HB SER 65 1HB SER 65 3.592 12.666 -4.789 1230 2HB SER 65 2HB SER 65 5.006 12.341 -3.787 1231 HG SER 65 HG SER 65 4.630 14.504 -5.039 1232 H THR 66 H THR 66 5.550 9.613 -4.013 1233 HA THR 66 HA THR 66 8.404 10.053 -3.870 1234 HB THR 66 HB THR 66 7.185 7.687 -2.547 1235 HG1 THR 66 HG1 THR 66 6.559 10.387 -1.908 1236 1HG2 THR 66 1HG2 THR 66 9.526 8.241 -2.177 1237 2HG2 THR 66 2HG2 THR 66 8.608 8.459 -0.687 1238 3HG2 THR 66 3HG2 THR 66 9.078 9.862 -1.647 1239 H VAL 67 H VAL 67 6.194 7.735 -5.279 1240 HA VAL 67 HA VAL 67 7.842 5.581 -5.775 1241 HB VAL 67 HB VAL 67 5.717 6.716 -7.599 1242 1HG1 VAL 67 1HG1 VAL 67 5.755 4.023 -8.025 1243 2HG1 VAL 67 2HG1 VAL 67 6.532 5.222 -9.060 1244 3HG1 VAL 67 3HG1 VAL 67 7.470 4.381 -7.824 1245 1HG2 VAL 67 1HG2 VAL 67 4.148 5.586 -6.401 1246 2HG2 VAL 67 2HG2 VAL 67 5.273 4.322 -5.906 1247 3HG2 VAL 67 3HG2 VAL 67 5.301 5.891 -5.102 1248 H ARG 68 H ARG 68 7.428 8.502 -7.758 1249 HA ARG 68 HA ARG 68 9.050 7.853 -9.893 1250 1HB ARG 68 1HB ARG 68 9.140 10.146 -10.398 1251 2HB ARG 68 2HB ARG 68 7.624 9.947 -9.528 1252 1HG ARG 68 1HG ARG 68 8.931 10.635 -7.446 1253 2HG ARG 68 2HG ARG 68 10.186 11.168 -8.566 1254 1HD ARG 68 1HD ARG 68 8.670 12.994 -7.914 1255 2HD ARG 68 2HD ARG 68 8.629 12.672 -9.647 1256 HE ARG 68 HE ARG 68 6.594 11.302 -8.135 1257 1HH1 ARG 68 1HH1 ARG 68 7.447 14.207 -9.854 1258 2HH1 ARG 68 2HH1 ARG 68 5.805 14.657 -10.173 1259 1HH2 ARG 68 1HH2 ARG 68 4.427 11.883 -8.548 1260 2HH2 ARG 68 2HH2 ARG 68 4.088 13.335 -9.429 1261 H ASP 69 H ASP 69 9.944 8.766 -6.653 1262 HA ASP 69 HA ASP 69 12.688 9.321 -7.238 1263 1HB ASP 69 1HB ASP 69 10.965 9.502 -4.975 1264 2HB ASP 69 2HB ASP 69 12.369 8.543 -4.513 1265 H ILE 70 H ILE 70 10.898 6.511 -6.064 1266 HA ILE 70 HA ILE 70 13.003 4.848 -5.376 1267 HB ILE 70 HB ILE 70 10.411 4.029 -6.693 1268 1HG1 ILE 70 1HG1 ILE 70 11.061 4.095 -3.745 1269 2HG1 ILE 70 2HG1 ILE 70 10.266 5.428 -4.576 1270 1HG2 ILE 70 1HG2 ILE 70 12.071 2.253 -6.749 1271 2HG2 ILE 70 2HG2 ILE 70 12.353 2.441 -5.020 1272 3HG2 ILE 70 3HG2 ILE 70 10.790 1.867 -5.601 1273 1HD1 ILE 70 1HD1 ILE 70 8.723 3.318 -5.321 1274 2HD1 ILE 70 2HD1 ILE 70 9.201 2.861 -3.686 1275 3HD1 ILE 70 3HD1 ILE 70 8.385 4.398 -3.969 1276 H ASP 71 H ASP 71 11.473 5.284 -8.551 1277 HA ASP 71 HA ASP 71 13.943 4.449 -9.836 1278 1HB ASP 71 1HB ASP 71 11.421 2.873 -9.890 1279 2HB ASP 71 2HB ASP 71 12.312 3.020 -11.403 1280 HA PRO 72 HA PRO 72 12.876 7.463 -12.837 1281 1HB PRO 72 1HB PRO 72 13.824 6.366 -15.133 1282 2HB PRO 72 2HB PRO 72 14.879 7.008 -13.868 1283 1HG PRO 72 1HG PRO 72 14.098 4.172 -14.424 1284 2HG PRO 72 2HG PRO 72 15.690 4.833 -14.007 1285 1HD PRO 72 1HD PRO 72 14.101 3.605 -12.191 1286 2HD PRO 72 2HD PRO 72 15.199 4.931 -11.757 1287 H GLN 73 H GLN 73 12.185 4.182 -14.064 1288 HA GLN 73 HA GLN 73 9.699 5.241 -15.237 1289 1HB GLN 73 1HB GLN 73 11.388 2.880 -16.073 1290 2HB GLN 73 2HB GLN 73 9.813 3.255 -16.758 1291 1HG GLN 73 1HG GLN 73 10.832 5.548 -17.309 1292 2HG GLN 73 2HG GLN 73 12.383 4.763 -17.018 1293 1HE2 GLN 73 1HE2 GLN 73 12.923 5.136 -19.205 1294 2HE2 GLN 73 2HE2 GLN 73 12.287 4.137 -20.462 1295 H ASN 74 H ASN 74 7.929 4.703 -14.162 1296 HA ASN 74 HA ASN 74 7.192 2.087 -13.520 1297 1HB ASN 74 1HB ASN 74 8.915 3.296 -11.572 1298 2HB ASN 74 2HB ASN 74 7.315 3.077 -10.868 1299 1HD2 ASN 74 1HD2 ASN 74 9.865 1.729 -10.319 1300 2HD2 ASN 74 2HD2 ASN 74 9.556 0.043 -10.535 1301 H ASP 75 H ASP 75 5.220 2.048 -12.051 1302 HA ASP 75 HA ASP 75 3.811 4.471 -11.560 1303 1HB ASP 75 1HB ASP 75 3.664 3.552 -14.202 1304 2HB ASP 75 2HB ASP 75 2.146 3.058 -13.459 1305 H LEU 76 H LEU 76 2.762 3.996 -9.756 1306 HA LEU 76 HA LEU 76 2.226 1.350 -8.909 1307 1HB LEU 76 1HB LEU 76 2.096 3.982 -7.819 1308 2HB LEU 76 2HB LEU 76 0.576 3.155 -7.484 1309 HG LEU 76 HG LEU 76 2.009 2.836 -5.610 1310 1HD1 LEU 76 1HD1 LEU 76 2.479 0.206 -6.833 1311 2HD1 LEU 76 2HD1 LEU 76 0.820 0.795 -6.924 1312 3HD1 LEU 76 3HD1 LEU 76 1.615 0.639 -5.358 1313 1HD2 LEU 76 1HD2 LEU 76 4.089 3.182 -7.235 1314 2HD2 LEU 76 2HD2 LEU 76 4.116 1.421 -7.140 1315 3HD2 LEU 76 3HD2 LEU 76 4.234 2.386 -5.668 1316 H THR 77 H THR 77 0.333 0.190 -8.805 1317 HA THR 77 HA THR 77 -2.085 1.350 -9.971 1318 HB THR 77 HB THR 77 -0.949 0.261 -11.852 1319 HG1 THR 77 HG1 THR 77 -2.719 -1.066 -12.438 1320 1HG2 THR 77 1HG2 THR 77 -0.272 -1.677 -9.918 1321 2HG2 THR 77 2HG2 THR 77 0.161 -1.658 -11.628 1322 3HG2 THR 77 3HG2 THR 77 -1.306 -2.481 -11.099 1323 H PHE 78 H PHE 78 -1.006 0.255 -7.321 1324 HA PHE 78 HA PHE 78 -3.432 -0.816 -6.378 1325 1HB PHE 78 1HB PHE 78 -2.205 -2.753 -7.731 1326 2HB PHE 78 2HB PHE 78 -1.336 -2.928 -6.209 1327 HD1 PHE 78 HD1 PHE 78 -2.183 -4.403 -4.675 1328 HD2 PHE 78 HD2 PHE 78 -4.843 -2.540 -7.426 1329 HE1 PHE 78 HE1 PHE 78 -4.046 -5.726 -3.764 1330 HE2 PHE 78 HE2 PHE 78 -6.711 -3.860 -6.518 1331 HZ PHE 78 HZ PHE 78 -6.314 -5.455 -4.684 1332 H LEU 79 H LEU 79 -3.522 -0.201 -4.327 1333 HA LEU 79 HA LEU 79 -1.042 -0.189 -2.742 1334 1HB LEU 79 1HB LEU 79 -2.803 2.016 -3.415 1335 2HB LEU 79 2HB LEU 79 -2.627 1.819 -1.672 1336 HG LEU 79 HG LEU 79 -0.252 2.126 -1.816 1337 1HD1 LEU 79 1HD1 LEU 79 0.328 1.010 -3.815 1338 2HD1 LEU 79 2HD1 LEU 79 0.767 2.701 -4.051 1339 3HD1 LEU 79 3HD1 LEU 79 -0.701 2.061 -4.789 1340 1HD2 LEU 79 1HD2 LEU 79 -0.763 4.286 -1.690 1341 2HD2 LEU 79 2HD2 LEU 79 -2.149 4.086 -2.763 1342 3HD2 LEU 79 3HD2 LEU 79 -0.544 4.369 -3.439 1343 H ARG 80 H ARG 80 -1.401 -1.926 -1.468 1344 HA ARG 80 HA ARG 80 -3.998 -2.195 -0.139 1345 1HB ARG 80 1HB ARG 80 -1.801 -4.056 -0.847 1346 2HB ARG 80 2HB ARG 80 -2.657 -4.389 0.653 1347 1HG ARG 80 1HG ARG 80 -4.548 -3.823 -1.416 1348 2HG ARG 80 2HG ARG 80 -3.419 -5.065 -1.961 1349 1HD ARG 80 1HD ARG 80 -4.946 -5.128 0.639 1350 2HD ARG 80 2HD ARG 80 -5.408 -5.995 -0.826 1351 HE ARG 80 HE ARG 80 -3.323 -6.703 1.029 1352 1HH1 ARG 80 1HH1 ARG 80 -4.528 -7.054 -2.218 1353 2HH1 ARG 80 2HH1 ARG 80 -3.707 -8.553 -2.500 1354 1HH2 ARG 80 1HH2 ARG 80 -2.237 -8.677 0.670 1355 2HH2 ARG 80 2HH2 ARG 80 -2.405 -9.476 -0.856 1356 H ILE 81 H ILE 81 -4.221 -2.230 2.080 1357 HA ILE 81 HA ILE 81 -1.849 -1.785 3.728 1358 HB ILE 81 HB ILE 81 -4.247 0.016 4.006 1359 1HG1 ILE 81 1HG1 ILE 81 -1.636 0.585 2.586 1360 2HG1 ILE 81 2HG1 ILE 81 -3.212 0.425 1.819 1361 1HG2 ILE 81 1HG2 ILE 81 -1.441 0.376 5.031 1362 2HG2 ILE 81 2HG2 ILE 81 -2.882 1.289 5.474 1363 3HG2 ILE 81 3HG2 ILE 81 -2.724 -0.398 5.961 1364 1HD1 ILE 81 1HD1 ILE 81 -3.374 2.390 3.876 1365 2HD1 ILE 81 2HD1 ILE 81 -1.998 2.745 2.831 1366 3HD1 ILE 81 3HD1 ILE 81 -3.610 2.571 2.138 1367 H ARG 82 H ARG 82 -2.183 -3.798 4.664 1368 HA ARG 82 HA ARG 82 -4.656 -4.701 5.682 1369 1HB ARG 82 1HB ARG 82 -1.839 -5.487 6.449 1370 2HB ARG 82 2HB ARG 82 -3.291 -6.360 6.920 1371 1HG ARG 82 1HG ARG 82 -3.443 -6.108 4.142 1372 2HG ARG 82 2HG ARG 82 -1.765 -6.527 4.496 1373 1HD ARG 82 1HD ARG 82 -2.612 -8.628 4.441 1374 2HD ARG 82 2HD ARG 82 -2.982 -8.257 6.124 1375 HE ARG 82 HE ARG 82 -5.218 -8.230 5.600 1376 1HH1 ARG 82 1HH1 ARG 82 -3.333 -8.205 2.673 1377 2HH1 ARG 82 2HH1 ARG 82 -4.697 -8.470 1.638 1378 1HH2 ARG 82 1HH2 ARG 82 -7.021 -8.579 4.248 1379 2HH2 ARG 82 2HH2 ARG 82 -6.794 -8.682 2.535 1380 H SER 83 H SER 83 -5.766 -3.869 7.312 1381 HA SER 83 HA SER 83 -4.282 -2.721 9.586 1382 1HB SER 83 1HB SER 83 -6.864 -1.592 9.565 1383 2HB SER 83 2HB SER 83 -5.340 -0.784 9.195 1384 HG SER 83 HG SER 83 -7.352 -1.349 7.549 1385 H LYS 84 H LYS 84 -5.151 -3.030 11.661 1386 HA LYS 84 HA LYS 84 -6.208 -5.535 12.210 1387 1HB LYS 84 1HB LYS 84 -6.468 -3.072 13.943 1388 2HB LYS 84 2HB LYS 84 -6.554 -4.744 14.482 1389 1HG LYS 84 1HG LYS 84 -4.168 -4.938 13.517 1390 2HG LYS 84 2HG LYS 84 -4.175 -3.174 13.579 1391 1HD LYS 84 1HD LYS 84 -3.365 -3.555 15.662 1392 2HD LYS 84 2HD LYS 84 -5.083 -3.696 16.043 1393 1HE LYS 84 1HE LYS 84 -4.865 -6.164 15.620 1394 2HE LYS 84 2HE LYS 84 -3.121 -5.922 15.521 1395 1HZ LYS 84 1HZ LYS 84 -3.265 -6.382 17.709 1396 2HZ LYS 84 2HZ LYS 84 -4.872 -5.872 17.844 1397 3HZ LYS 84 3HZ LYS 84 -3.621 -4.733 17.829 1398 H LYS 85 H LYS 85 -7.843 -2.471 11.674 1399 HA LYS 85 HA LYS 85 -10.419 -3.308 12.504 1400 1HB LYS 85 1HB LYS 85 -9.345 -1.040 10.879 1401 2HB LYS 85 2HB LYS 85 -11.076 -1.350 10.861 1402 1HG LYS 85 1HG LYS 85 -9.722 -1.197 13.497 1403 2HG LYS 85 2HG LYS 85 -9.965 0.301 12.596 1404 1HD LYS 85 1HD LYS 85 -12.392 -1.069 12.413 1405 2HD LYS 85 2HD LYS 85 -11.868 -1.277 14.085 1406 1HE LYS 85 1HE LYS 85 -11.650 1.109 14.359 1407 2HE LYS 85 2HE LYS 85 -12.008 1.373 12.653 1408 1HZ LYS 85 1HZ LYS 85 -14.211 0.300 13.106 1409 2HZ LYS 85 2HZ LYS 85 -13.982 1.805 13.841 1410 3HZ LYS 85 3HZ LYS 85 -13.849 0.389 14.756 1411 H ASN 86 H ASN 86 -8.885 -3.104 9.303 1412 HA ASN 86 HA ASN 86 -10.107 -5.406 8.294 1413 1HB ASN 86 1HB ASN 86 -11.591 -4.087 6.578 1414 2HB ASN 86 2HB ASN 86 -12.223 -4.470 8.177 1415 1HD2 ASN 86 1HD2 ASN 86 -10.684 -1.948 6.268 1416 2HD2 ASN 86 2HD2 ASN 86 -11.338 -0.620 7.161 1417 H GLU 87 H GLU 87 -10.151 -5.205 5.698 1418 HA GLU 87 HA GLU 87 -7.518 -4.105 5.006 1419 1HB GLU 87 1HB GLU 87 -7.686 -5.664 3.034 1420 2HB GLU 87 2HB GLU 87 -7.602 -6.449 4.605 1421 1HG GLU 87 1HG GLU 87 -9.894 -6.993 4.569 1422 2HG GLU 87 2HG GLU 87 -10.202 -5.921 3.203 1423 H ILE 88 H ILE 88 -7.306 -2.521 3.548 1424 HA ILE 88 HA ILE 88 -9.692 -1.747 1.999 1425 HB ILE 88 HB ILE 88 -7.562 0.153 2.975 1426 1HG1 ILE 88 1HG1 ILE 88 -10.304 -0.391 4.137 1427 2HG1 ILE 88 2HG1 ILE 88 -8.767 -0.805 4.889 1428 1HG2 ILE 88 1HG2 ILE 88 -8.561 1.674 1.704 1429 2HG2 ILE 88 2HG2 ILE 88 -9.557 0.389 1.023 1430 3HG2 ILE 88 3HG2 ILE 88 -10.131 1.304 2.417 1431 1HD1 ILE 88 1HD1 ILE 88 -9.742 1.977 4.290 1432 2HD1 ILE 88 2HD1 ILE 88 -9.726 1.196 5.871 1433 3HD1 ILE 88 3HD1 ILE 88 -8.207 1.560 5.052 1434 H MET 89 H MET 89 -9.454 -1.798 -0.132 1435 HA MET 89 HA MET 89 -6.724 -1.819 -1.233 1436 1HB MET 89 1HB MET 89 -9.265 -2.967 -2.402 1437 2HB MET 89 2HB MET 89 -7.679 -3.022 -3.161 1438 1HG MET 89 1HG MET 89 -6.991 -4.735 -1.898 1439 2HG MET 89 2HG MET 89 -7.763 -4.106 -0.444 1440 1HE MET 89 1HE MET 89 -10.113 -6.269 -3.753 1441 2HE MET 89 2HE MET 89 -10.174 -4.513 -3.602 1442 3HE MET 89 3HE MET 89 -8.647 -5.314 -3.972 1443 H VAL 90 H VAL 90 -6.163 0.062 -2.099 1444 HA VAL 90 HA VAL 90 -8.174 1.539 -3.666 1445 HB VAL 90 HB VAL 90 -6.056 2.730 -1.871 1446 1HG1 VAL 90 1HG1 VAL 90 -6.123 4.260 -3.581 1447 2HG1 VAL 90 2HG1 VAL 90 -7.804 3.902 -3.983 1448 3HG1 VAL 90 3HG1 VAL 90 -7.422 4.861 -2.552 1449 1HG2 VAL 90 1HG2 VAL 90 -8.600 1.827 -1.243 1450 2HG2 VAL 90 2HG2 VAL 90 -7.617 2.940 -0.292 1451 3HG2 VAL 90 3HG2 VAL 90 -8.796 3.568 -1.442 1452 H ALA 91 H ALA 91 -7.614 1.610 -5.730 1453 HA ALA 91 HA ALA 91 -4.807 2.064 -6.437 1454 1HB ALA 91 1HB ALA 91 -6.258 0.156 -8.166 1455 2HB ALA 91 2HB ALA 91 -4.554 0.213 -7.715 1456 3HB ALA 91 3HB ALA 91 -5.743 -0.438 -6.587 1457 HA PRO 92 HA PRO 92 -6.396 4.936 -9.351 1458 1HB PRO 92 1HB PRO 92 -4.551 4.764 -11.336 1459 2HB PRO 92 2HB PRO 92 -4.218 5.531 -9.779 1460 1HG PRO 92 1HG PRO 92 -3.514 2.779 -10.725 1461 2HG PRO 92 2HG PRO 92 -2.525 3.937 -9.817 1462 1HD PRO 92 1HD PRO 92 -3.788 1.857 -8.631 1463 2HD PRO 92 2HD PRO 92 -3.523 3.408 -7.808 1464 H ASP 93 H ASP 93 -8.326 4.160 -10.127 1465 HA ASP 93 HA ASP 93 -8.500 1.971 -11.958 1466 1HB ASP 93 1HB ASP 93 -10.291 3.385 -10.347 1467 2HB ASP 93 2HB ASP 93 -10.804 3.735 -11.996 1468 H LYS 94 H LYS 94 -10.264 2.766 -13.887 1469 HA LYS 94 HA LYS 94 -8.664 3.666 -15.941 1470 1HB LYS 94 1HB LYS 94 -11.435 3.055 -15.572 1471 2HB LYS 94 2HB LYS 94 -11.307 4.536 -16.512 1472 1HG LYS 94 1HG LYS 94 -9.672 2.146 -17.247 1473 2HG LYS 94 2HG LYS 94 -11.368 2.252 -17.724 1474 1HD LYS 94 1HD LYS 94 -10.319 4.738 -18.374 1475 2HD LYS 94 2HD LYS 94 -9.044 3.600 -18.818 1476 1HE LYS 94 1HE LYS 94 -10.456 3.885 -20.719 1477 2HE LYS 94 2HE LYS 94 -10.769 2.281 -20.058 1478 1HZ LYS 94 1HZ LYS 94 -12.525 4.565 -20.263 1479 2HZ LYS 94 2HZ LYS 94 -12.581 3.782 -18.765 1480 3HZ LYS 94 3HZ LYS 94 -12.897 2.916 -20.184 1481 H ASP 95 H ASP 95 -11.024 5.586 -14.086 1482 HA ASP 95 HA ASP 95 -9.364 7.946 -14.454 1483 1HB ASP 95 1HB ASP 95 -12.286 8.027 -15.217 1484 2HB ASP 95 2HB ASP 95 -11.096 9.314 -15.390 1485 H TYR 96 H TYR 96 -10.601 6.068 -12.338 1486 HA TYR 96 HA TYR 96 -11.255 8.216 -10.473 1487 1HB TYR 96 1HB TYR 96 -13.124 6.676 -9.564 1488 2HB TYR 96 2HB TYR 96 -13.455 7.630 -11.005 1489 HD1 TYR 96 HD1 TYR 96 -13.524 6.542 -13.223 1490 HD2 TYR 96 HD2 TYR 96 -13.058 4.284 -9.647 1491 HE1 TYR 96 HE1 TYR 96 -14.140 4.497 -14.442 1492 HE2 TYR 96 HE2 TYR 96 -13.672 2.232 -10.856 1493 HH TYR 96 HH TYR 96 -15.244 2.008 -13.417 1494 H PHE 97 H PHE 97 -11.626 7.093 -8.192 1495 HA PHE 97 HA PHE 97 -9.434 5.152 -7.854 1496 1HB PHE 97 1HB PHE 97 -10.282 7.486 -6.151 1497 2HB PHE 97 2HB PHE 97 -9.321 6.168 -5.488 1498 HD1 PHE 97 HD1 PHE 97 -7.441 5.535 -7.568 1499 HD2 PHE 97 HD2 PHE 97 -8.930 9.333 -6.352 1500 HE1 PHE 97 HE1 PHE 97 -5.391 6.605 -8.411 1501 HE2 PHE 97 HE2 PHE 97 -6.884 10.408 -7.194 1502 HZ PHE 97 HZ PHE 97 -5.111 9.044 -8.225 1503 H LEU 98 H LEU 98 -10.285 3.209 -7.493 1504 HA LEU 98 HA LEU 98 -12.847 2.899 -6.195 1505 1HB LEU 98 1HB LEU 98 -11.654 1.493 -8.119 1506 2HB LEU 98 2HB LEU 98 -11.100 0.563 -6.728 1507 HG LEU 98 HG LEU 98 -14.012 1.137 -6.994 1508 1HD1 LEU 98 1HD1 LEU 98 -13.292 0.385 -9.231 1509 2HD1 LEU 98 2HD1 LEU 98 -14.342 -0.778 -8.422 1510 3HD1 LEU 98 3HD1 LEU 98 -12.604 -1.064 -8.497 1511 1HD2 LEU 98 1HD2 LEU 98 -12.233 -0.737 -5.589 1512 2HD2 LEU 98 2HD2 LEU 98 -13.723 -1.438 -6.222 1513 3HD2 LEU 98 3HD2 LEU 98 -13.794 -0.071 -5.108 1514 H ILE 99 H ILE 99 -13.231 1.823 -4.244 1515 HA ILE 99 HA ILE 99 -10.914 1.235 -2.553 1516 HB ILE 99 HB ILE 99 -13.211 2.965 -1.630 1517 1HG1 ILE 99 1HG1 ILE 99 -11.020 4.512 -1.333 1518 2HG1 ILE 99 2HG1 ILE 99 -10.538 3.589 -2.752 1519 1HG2 ILE 99 1HG2 ILE 99 -10.995 3.100 0.106 1520 2HG2 ILE 99 2HG2 ILE 99 -12.583 2.403 0.421 1521 3HG2 ILE 99 3HG2 ILE 99 -11.289 1.392 -0.221 1522 1HD1 ILE 99 1HD1 ILE 99 -11.566 5.614 -3.472 1523 2HD1 ILE 99 2HD1 ILE 99 -12.662 4.281 -3.839 1524 3HD1 ILE 99 3HD1 ILE 99 -12.974 5.323 -2.451 1525 H VAL 100 H VAL 100 -11.159 -0.771 -1.846 1526 HA VAL 100 HA VAL 100 -13.884 -1.762 -1.317 1527 HB VAL 100 HB VAL 100 -11.428 -3.398 -1.966 1528 1HG1 VAL 100 1HG1 VAL 100 -12.809 -4.790 -0.718 1529 2HG1 VAL 100 2HG1 VAL 100 -14.285 -4.085 -1.381 1530 3HG1 VAL 100 3HG1 VAL 100 -13.285 -5.142 -2.379 1531 1HG2 VAL 100 1HG2 VAL 100 -12.812 -3.855 -4.091 1532 2HG2 VAL 100 2HG2 VAL 100 -13.671 -2.373 -3.671 1533 3HG2 VAL 100 3HG2 VAL 100 -11.934 -2.329 -3.974 1534 H ILE 101 H ILE 101 -14.324 -1.780 0.783 1535 HA ILE 101 HA ILE 101 -12.166 -2.463 2.670 1536 HB ILE 101 HB ILE 101 -14.683 -0.880 3.205 1537 1HG1 ILE 101 1HG1 ILE 101 -12.069 0.389 3.616 1538 2HG1 ILE 101 2HG1 ILE 101 -12.402 -0.019 1.936 1539 1HG2 ILE 101 1HG2 ILE 101 -12.691 -0.602 5.222 1540 2HG2 ILE 101 2HG2 ILE 101 -14.332 -1.231 5.366 1541 3HG2 ILE 101 3HG2 ILE 101 -13.002 -2.318 4.963 1542 1HD1 ILE 101 1HD1 ILE 101 -14.447 1.267 2.002 1543 2HD1 ILE 101 2HD1 ILE 101 -14.192 1.623 3.711 1544 3HD1 ILE 101 3HD1 ILE 101 -13.079 2.262 2.501 1545 H GLN 102 H GLN 102 -12.357 -4.261 3.842 1546 HA GLN 102 HA GLN 102 -14.845 -5.318 4.724 1547 1HB GLN 102 1HB GLN 102 -14.931 -7.351 3.450 1548 2HB GLN 102 2HB GLN 102 -14.878 -6.002 2.323 1549 1HG GLN 102 1HG GLN 102 -12.444 -6.387 2.058 1550 2HG GLN 102 2HG GLN 102 -12.602 -7.819 3.074 1551 1HE2 GLN 102 1HE2 GLN 102 -12.225 -6.960 0.027 1552 2HE2 GLN 102 2HE2 GLN 102 -13.109 -8.202 -0.785 1553 H ASN 103 H ASN 103 -14.516 -7.533 5.756 1554 HA ASN 103 HA ASN 103 -12.546 -7.410 7.684 1555 1HB ASN 103 1HB ASN 103 -14.366 -9.523 6.679 1556 2HB ASN 103 2HB ASN 103 -12.983 -10.073 7.620 1557 1HD2 ASN 103 1HD2 ASN 103 -16.111 -9.282 7.847 1558 2HD2 ASN 103 2HD2 ASN 103 -16.180 -8.749 9.489 1559 HA PRO 104 HA PRO 104 -8.775 -8.842 5.958 1560 1HB PRO 104 1HB PRO 104 -7.776 -10.409 7.937 1561 2HB PRO 104 2HB PRO 104 -7.849 -8.647 8.052 1562 1HG PRO 104 1HG PRO 104 -9.699 -10.699 9.205 1563 2HG PRO 104 2HG PRO 104 -9.052 -9.228 9.955 1564 1HD PRO 104 1HD PRO 104 -11.554 -9.360 8.926 1565 2HD PRO 104 2HD PRO 104 -10.593 -7.868 8.911 1566 H THR 105 H THR 105 -7.828 -10.535 4.848 1567 HA THR 105 HA THR 105 -9.413 -13.013 4.737 1568 HB THR 105 HB THR 105 -8.379 -13.328 2.475 1569 HG1 THR 105 HG1 THR 105 -6.659 -11.668 3.081 1570 1HG2 THR 105 1HG2 THR 105 -10.391 -12.523 1.925 1571 2HG2 THR 105 2HG2 THR 105 -9.612 -10.951 1.738 1572 3HG2 THR 105 3HG2 THR 105 -10.376 -11.380 3.268 1573 H GLU 106 H GLU 106 -6.157 -11.706 4.964 1574 HA GLU 106 HA GLU 106 -4.909 -14.305 4.958 1575 1HB GLU 106 1HB GLU 106 -4.048 -11.656 4.582 1576 2HB GLU 106 2HB GLU 106 -3.237 -12.217 6.037 1577 1HG GLU 106 1HG GLU 106 -1.970 -13.718 4.924 1578 2HG GLU 106 2HG GLU 106 -3.222 -14.058 3.731 Start of MODEL 3 1 H MET 11 H MET 11 17.459 -8.956 14.732 2 HA MET 11 HA MET 11 17.333 -7.876 12.018 3 1HB MET 11 1HB MET 11 19.049 -6.907 13.389 4 2HB MET 11 2HB MET 11 19.650 -8.493 13.852 5 1HG MET 11 1HG MET 11 20.888 -8.701 12.005 6 2HG MET 11 2HG MET 11 19.635 -8.021 10.970 7 1HE MET 11 1HE MET 11 21.536 -7.289 9.657 8 2HE MET 11 2HE MET 11 20.737 -5.722 9.529 9 3HE MET 11 3HE MET 11 22.457 -5.806 9.912 10 H ALA 12 H ALA 12 18.634 -10.712 13.732 11 HA ALA 12 HA ALA 12 19.561 -12.162 11.575 12 1HB ALA 12 1HB ALA 12 18.353 -13.999 13.366 13 2HB ALA 12 2HB ALA 12 20.056 -13.565 13.219 14 3HB ALA 12 3HB ALA 12 19.007 -12.664 14.315 15 H GLU 13 H GLU 13 16.265 -11.938 12.833 16 HA GLU 13 HA GLU 13 15.039 -13.941 11.374 17 1HB GLU 13 1HB GLU 13 13.803 -12.784 13.064 18 2HB GLU 13 2HB GLU 13 14.003 -11.243 12.240 19 1HG GLU 13 1HG GLU 13 12.608 -12.065 10.396 20 2HG GLU 13 2HG GLU 13 12.380 -13.582 11.264 21 H VAL 14 H VAL 14 15.464 -10.531 10.435 22 HA VAL 14 HA VAL 14 14.318 -10.780 7.876 23 HB VAL 14 HB VAL 14 16.453 -8.803 8.675 24 1HG1 VAL 14 1HG1 VAL 14 15.023 -7.381 7.057 25 2HG1 VAL 14 2HG1 VAL 14 16.136 -8.575 6.385 26 3HG1 VAL 14 3HG1 VAL 14 14.412 -8.934 6.488 27 1HG2 VAL 14 1HG2 VAL 14 13.510 -8.857 9.254 28 2HG2 VAL 14 2HG2 VAL 14 14.850 -8.565 10.362 29 3HG2 VAL 14 3HG2 VAL 14 14.406 -7.341 9.173 30 H GLU 15 H GLU 15 17.567 -11.326 9.074 31 HA GLU 15 HA GLU 15 18.842 -11.464 6.542 32 1HB GLU 15 1HB GLU 15 19.583 -12.463 9.284 33 2HB GLU 15 2HB GLU 15 20.603 -12.762 7.884 34 1HG GLU 15 1HG GLU 15 20.820 -10.361 7.520 35 2HG GLU 15 2HG GLU 15 19.787 -10.054 8.915 36 H GLU 16 H GLU 16 17.419 -13.893 8.687 37 HA GLU 16 HA GLU 16 18.197 -16.178 7.277 38 1HB GLU 16 1HB GLU 16 16.760 -15.689 9.559 39 2HB GLU 16 2HB GLU 16 15.522 -16.314 8.479 40 1HG GLU 16 1HG GLU 16 18.098 -17.781 8.707 41 2HG GLU 16 2HG GLU 16 16.920 -17.911 10.012 42 H THR 17 H THR 17 15.515 -13.966 6.796 43 HA THR 17 HA THR 17 14.249 -15.600 4.791 44 HB THR 17 HB THR 17 13.767 -12.714 5.557 45 HG1 THR 17 HG1 THR 17 13.166 -14.066 7.228 46 1HG2 THR 17 1HG2 THR 17 12.769 -12.730 3.508 47 2HG2 THR 17 2HG2 THR 17 11.464 -13.472 4.433 48 3HG2 THR 17 3HG2 THR 17 12.567 -14.481 3.499 49 H LEU 18 H LEU 18 16.655 -13.109 4.871 50 HA LEU 18 HA LEU 18 16.438 -12.264 2.169 51 1HB LEU 18 1HB LEU 18 18.128 -11.739 4.439 52 2HB LEU 18 2HB LEU 18 19.098 -11.926 2.979 53 HG LEU 18 HG LEU 18 17.233 -10.226 2.060 54 1HD1 LEU 18 1HD1 LEU 18 17.448 -9.722 5.018 55 2HD1 LEU 18 2HD1 LEU 18 15.989 -9.962 4.058 56 3HD1 LEU 18 3HD1 LEU 18 16.943 -8.492 3.860 57 1HD2 LEU 18 1HD2 LEU 18 19.747 -10.048 2.080 58 2HD2 LEU 18 2HD2 LEU 18 19.601 -9.280 3.661 59 3HD2 LEU 18 3HD2 LEU 18 18.873 -8.525 2.243 60 H LYS 19 H LYS 19 18.390 -14.712 3.810 61 HA LYS 19 HA LYS 19 20.039 -15.433 1.672 62 1HB LYS 19 1HB LYS 19 19.065 -16.851 4.123 63 2HB LYS 19 2HB LYS 19 19.965 -17.748 2.907 64 1HG LYS 19 1HG LYS 19 21.182 -15.206 3.729 65 2HG LYS 19 2HG LYS 19 21.084 -16.439 4.988 66 1HD LYS 19 1HD LYS 19 21.963 -17.572 2.479 67 2HD LYS 19 2HD LYS 19 23.004 -16.236 2.975 68 1HE LYS 19 1HE LYS 19 23.877 -17.406 4.673 69 2HE LYS 19 2HE LYS 19 22.304 -18.031 5.166 70 1HZ LYS 19 1HZ LYS 19 24.279 -19.188 3.353 71 2HZ LYS 19 2HZ LYS 19 22.650 -19.446 2.981 72 3HZ LYS 19 3HZ LYS 19 23.265 -19.947 4.475 73 H ARG 20 H ARG 20 16.928 -16.831 2.697 74 HA ARG 20 HA ARG 20 16.769 -18.699 0.580 75 1HB ARG 20 1HB ARG 20 15.472 -18.693 2.785 76 2HB ARG 20 2HB ARG 20 14.402 -17.522 2.025 77 1HG ARG 20 1HG ARG 20 13.234 -19.315 1.390 78 2HG ARG 20 2HG ARG 20 14.475 -19.487 0.147 79 1HD ARG 20 1HD ARG 20 14.715 -21.553 0.996 80 2HD ARG 20 2HD ARG 20 15.660 -20.736 2.241 81 HE ARG 20 HE ARG 20 12.876 -20.815 2.870 82 1HH1 ARG 20 1HH1 ARG 20 15.825 -22.666 2.914 83 2HH1 ARG 20 2HH1 ARG 20 15.319 -23.686 4.220 84 1HH2 ARG 20 1HH2 ARG 20 12.199 -22.152 4.590 85 2HH2 ARG 20 2HH2 ARG 20 13.256 -23.393 5.172 86 H LEU 21 H LEU 21 15.722 -15.367 0.933 87 HA LEU 21 HA LEU 21 14.089 -15.257 -1.374 88 1HB LEU 21 1HB LEU 21 15.209 -13.383 0.561 89 2HB LEU 21 2HB LEU 21 15.057 -12.705 -1.058 90 HG LEU 21 HG LEU 21 12.685 -13.102 -1.060 91 1HD1 LEU 21 1HD1 LEU 21 12.062 -13.865 1.549 92 2HD1 LEU 21 2HD1 LEU 21 13.347 -14.960 1.038 93 3HD1 LEU 21 3HD1 LEU 21 11.872 -14.823 0.080 94 1HD2 LEU 21 1HD2 LEU 21 13.213 -11.025 -0.102 95 2HD2 LEU 21 2HD2 LEU 21 13.770 -11.762 1.400 96 3HD2 LEU 21 3HD2 LEU 21 12.051 -11.755 1.005 97 H GLN 22 H GLN 22 17.433 -14.146 -0.831 98 HA GLN 22 HA GLN 22 17.923 -13.427 -3.509 99 1HB GLN 22 1HB GLN 22 19.318 -13.313 -1.086 100 2HB GLN 22 2HB GLN 22 20.317 -14.306 -2.140 101 1HG GLN 22 1HG GLN 22 21.024 -12.527 -3.243 102 2HG GLN 22 2HG GLN 22 19.370 -12.010 -3.569 103 1HE2 GLN 22 1HE2 GLN 22 18.320 -11.240 -1.333 104 2HE2 GLN 22 2HE2 GLN 22 19.242 -10.013 -0.541 105 H SER 23 H SER 23 17.833 -16.473 -1.929 106 HA SER 23 HA SER 23 19.492 -17.852 -3.838 107 1HB SER 23 1HB SER 23 18.053 -18.527 -1.366 108 2HB SER 23 2HB SER 23 18.062 -19.818 -2.567 109 HG SER 23 HG SER 23 19.935 -20.154 -1.583 110 H GLN 24 H GLN 24 16.161 -16.998 -3.546 111 HA GLN 24 HA GLN 24 15.392 -18.869 -5.664 112 1HB GLN 24 1HB GLN 24 13.095 -18.307 -5.114 113 2HB GLN 24 2HB GLN 24 13.966 -18.756 -3.654 114 1HG GLN 24 1HG GLN 24 14.089 -16.523 -2.917 115 2HG GLN 24 2HG GLN 24 13.590 -15.899 -4.489 116 1HE2 GLN 24 1HE2 GLN 24 12.223 -14.893 -2.536 117 2HE2 GLN 24 2HE2 GLN 24 10.658 -15.605 -2.370 118 H LYS 25 H LYS 25 14.322 -18.151 -7.554 119 HA LYS 25 HA LYS 25 15.368 -15.698 -8.600 120 1HB LYS 25 1HB LYS 25 15.159 -17.664 -10.027 121 2HB LYS 25 2HB LYS 25 13.418 -17.687 -9.778 122 1HG LYS 25 1HG LYS 25 13.067 -15.849 -11.128 123 2HG LYS 25 2HG LYS 25 14.724 -15.270 -10.948 124 1HD LYS 25 1HD LYS 25 15.212 -17.622 -12.133 125 2HD LYS 25 2HD LYS 25 13.604 -17.302 -12.788 126 1HE LYS 25 1HE LYS 25 14.673 -14.906 -13.198 127 2HE LYS 25 2HE LYS 25 16.162 -15.850 -13.209 128 1HZ LYS 25 1HZ LYS 25 15.658 -16.764 -15.172 129 2HZ LYS 25 2HZ LYS 25 14.581 -15.471 -15.344 130 3HZ LYS 25 3HZ LYS 25 14.022 -16.969 -14.792 131 H GLY 26 H GLY 26 14.217 -13.877 -9.301 132 1HA GLY 26 1HA GLY 26 12.071 -12.764 -9.644 133 2HA GLY 26 2HA GLY 26 11.465 -13.653 -8.255 134 H VAL 27 H VAL 27 13.404 -13.277 -6.383 135 HA VAL 27 HA VAL 27 12.799 -10.809 -5.285 136 HB VAL 27 HB VAL 27 15.264 -12.484 -4.789 137 1HG1 VAL 27 1HG1 VAL 27 14.060 -10.195 -3.249 138 2HG1 VAL 27 2HG1 VAL 27 15.225 -11.325 -2.557 139 3HG1 VAL 27 3HG1 VAL 27 15.684 -10.311 -3.925 140 1HG2 VAL 27 1HG2 VAL 27 12.599 -12.415 -3.377 141 2HG2 VAL 27 2HG2 VAL 27 13.194 -13.713 -4.412 142 3HG2 VAL 27 3HG2 VAL 27 13.999 -13.366 -2.882 143 H GLN 28 H GLN 28 13.349 -8.812 -5.829 144 HA GLN 28 HA GLN 28 15.559 -8.368 -7.664 145 1HB GLN 28 1HB GLN 28 13.087 -7.008 -6.992 146 2HB GLN 28 2HB GLN 28 14.448 -5.895 -7.005 147 1HG GLN 28 1HG GLN 28 13.217 -6.118 -9.171 148 2HG GLN 28 2HG GLN 28 14.956 -6.393 -9.257 149 1HE2 GLN 28 1HE2 GLN 28 11.818 -7.779 -9.581 150 2HE2 GLN 28 2HE2 GLN 28 12.322 -9.310 -10.203 151 H GLY 29 H GLY 29 14.718 -7.817 -4.323 152 1HA GLY 29 1HA GLY 29 17.241 -7.614 -3.314 153 2HA GLY 29 2HA GLY 29 16.869 -5.973 -3.820 154 H ILE 30 H ILE 30 17.326 -7.101 -1.130 155 HA ILE 30 HA ILE 30 14.750 -6.333 0.080 156 HB ILE 30 HB ILE 30 16.761 -8.188 1.348 157 1HG1 ILE 30 1HG1 ILE 30 14.553 -9.719 0.770 158 2HG1 ILE 30 2HG1 ILE 30 14.683 -8.703 -0.662 159 1HG2 ILE 30 1HG2 ILE 30 15.346 -7.054 2.935 160 2HG2 ILE 30 2HG2 ILE 30 13.906 -7.489 2.015 161 3HG2 ILE 30 3HG2 ILE 30 14.850 -8.742 2.820 162 1HD1 ILE 30 1HD1 ILE 30 16.066 -11.044 -0.145 163 2HD1 ILE 30 2HD1 ILE 30 16.397 -9.878 -1.427 164 3HD1 ILE 30 3HD1 ILE 30 17.251 -9.763 0.112 165 H ILE 31 H ILE 31 14.778 -4.868 1.728 166 HA ILE 31 HA ILE 31 17.408 -3.819 2.542 167 HB ILE 31 HB ILE 31 14.921 -2.193 2.000 168 1HG1 ILE 31 1HG1 ILE 31 17.408 -1.593 0.552 169 2HG1 ILE 31 2HG1 ILE 31 16.715 -3.164 0.167 170 1HG2 ILE 31 1HG2 ILE 31 16.693 -0.308 2.299 171 2HG2 ILE 31 2HG2 ILE 31 15.943 -1.041 3.716 172 3HG2 ILE 31 3HG2 ILE 31 17.563 -1.532 3.224 173 1HD1 ILE 31 1HD1 ILE 31 14.850 -2.257 -0.789 174 2HD1 ILE 31 2HD1 ILE 31 14.942 -0.779 0.169 175 3HD1 ILE 31 3HD1 ILE 31 16.050 -1.026 -1.180 176 H VAL 32 H VAL 32 17.637 -3.179 4.667 177 HA VAL 32 HA VAL 32 15.326 -3.583 6.441 178 HB VAL 32 HB VAL 32 18.082 -4.443 7.268 179 1HG1 VAL 32 1HG1 VAL 32 16.958 -5.659 8.963 180 2HG1 VAL 32 2HG1 VAL 32 16.219 -4.056 8.925 181 3HG1 VAL 32 3HG1 VAL 32 15.391 -5.428 8.187 182 1HG2 VAL 32 1HG2 VAL 32 17.349 -6.779 6.713 183 2HG2 VAL 32 2HG2 VAL 32 16.021 -6.072 5.792 184 3HG2 VAL 32 3HG2 VAL 32 17.690 -5.756 5.318 185 H VAL 33 H VAL 33 14.931 -1.631 7.261 186 HA VAL 33 HA VAL 33 17.214 0.037 8.089 187 HB VAL 33 HB VAL 33 14.402 1.025 7.652 188 1HG1 VAL 33 1HG1 VAL 33 16.110 2.337 9.005 189 2HG1 VAL 33 2HG1 VAL 33 16.982 2.557 7.486 190 3HG1 VAL 33 3HG1 VAL 33 15.341 3.181 7.661 191 1HG2 VAL 33 1HG2 VAL 33 15.427 1.915 5.460 192 2HG2 VAL 33 2HG2 VAL 33 16.621 0.636 5.675 193 3HG2 VAL 33 3HG2 VAL 33 14.911 0.230 5.524 194 H ASN 34 H ASN 34 17.331 0.822 10.147 195 HA ASN 34 HA ASN 34 15.595 -0.452 12.104 196 1HB ASN 34 1HB ASN 34 17.223 0.511 13.756 197 2HB ASN 34 2HB ASN 34 17.947 -0.580 12.578 198 1HD2 ASN 34 1HD2 ASN 34 19.958 0.418 13.091 199 2HD2 ASN 34 2HD2 ASN 34 20.384 1.936 12.382 200 H THR 35 H THR 35 15.450 1.190 14.181 201 HA THR 35 HA THR 35 13.424 3.022 13.465 202 HB THR 35 HB THR 35 14.414 3.758 16.012 203 HG1 THR 35 HG1 THR 35 14.685 1.777 17.016 204 1HG2 THR 35 1HG2 THR 35 12.048 3.608 15.249 205 2HG2 THR 35 2HG2 THR 35 12.336 2.822 16.801 206 3HG2 THR 35 3HG2 THR 35 12.172 1.851 15.338 207 H GLU 36 H GLU 36 16.858 3.320 13.758 208 HA GLU 36 HA GLU 36 16.898 6.174 14.048 209 1HB GLU 36 1HB GLU 36 18.913 4.024 13.678 210 2HB GLU 36 2HB GLU 36 19.376 5.643 13.176 211 1HG GLU 36 1HG GLU 36 18.327 6.155 15.613 212 2HG GLU 36 2HG GLU 36 18.981 4.537 15.863 213 H GLY 37 H GLY 37 16.684 3.950 11.413 214 1HA GLY 37 1HA GLY 37 15.860 4.738 9.290 215 2HA GLY 37 2HA GLY 37 16.749 6.232 9.550 216 H ILE 38 H ILE 38 18.792 3.912 10.561 217 HA ILE 38 HA ILE 38 20.312 4.023 8.094 218 HB ILE 38 HB ILE 38 21.037 2.729 10.725 219 1HG1 ILE 38 1HG1 ILE 38 21.884 5.416 9.624 220 2HG1 ILE 38 2HG1 ILE 38 20.644 5.194 10.853 221 1HG2 ILE 38 1HG2 ILE 38 23.308 2.728 9.892 222 2HG2 ILE 38 2HG2 ILE 38 22.261 1.856 8.774 223 3HG2 ILE 38 3HG2 ILE 38 22.786 3.496 8.392 224 1HD1 ILE 38 1HD1 ILE 38 23.585 4.970 11.056 225 2HD1 ILE 38 2HD1 ILE 38 22.411 5.629 12.196 226 3HD1 ILE 38 3HD1 ILE 38 22.613 3.884 12.049 227 HA PRO 39 HA PRO 39 18.941 0.067 6.665 228 1HB PRO 39 1HB PRO 39 20.829 -0.280 4.745 229 2HB PRO 39 2HB PRO 39 19.464 0.828 4.561 230 1HG PRO 39 1HG PRO 39 22.294 1.421 5.337 231 2HG PRO 39 2HG PRO 39 21.231 2.302 4.224 232 1HD PRO 39 1HD PRO 39 21.675 3.118 6.768 233 2HD PRO 39 2HD PRO 39 20.130 3.387 5.934 234 H ILE 40 H ILE 40 19.581 -0.921 8.738 235 HA ILE 40 HA ILE 40 22.085 -1.792 9.461 236 HB ILE 40 HB ILE 40 20.847 -3.797 10.494 237 1HG1 ILE 40 1HG1 ILE 40 18.439 -2.166 9.670 238 2HG1 ILE 40 2HG1 ILE 40 18.943 -3.639 8.848 239 1HG2 ILE 40 1HG2 ILE 40 20.057 -2.463 12.296 240 2HG2 ILE 40 2HG2 ILE 40 21.456 -1.634 11.614 241 3HG2 ILE 40 3HG2 ILE 40 19.828 -1.066 11.245 242 1HD1 ILE 40 1HD1 ILE 40 18.557 -3.787 11.776 243 2HD1 ILE 40 2HD1 ILE 40 17.119 -3.626 10.767 244 3HD1 ILE 40 3HD1 ILE 40 18.222 -4.980 10.521 245 H LYS 41 H LYS 41 19.873 -3.211 7.122 246 HA LYS 41 HA LYS 41 22.069 -4.880 6.139 247 1HB LYS 41 1HB LYS 41 19.768 -5.873 7.514 248 2HB LYS 41 2HB LYS 41 19.675 -6.380 5.833 249 1HG LYS 41 1HG LYS 41 22.282 -6.730 7.178 250 2HG LYS 41 2HG LYS 41 20.960 -7.772 7.710 251 1HD LYS 41 1HD LYS 41 20.695 -8.712 5.577 252 2HD LYS 41 2HD LYS 41 21.617 -7.422 4.800 253 1HE LYS 41 1HE LYS 41 23.527 -8.334 6.390 254 2HE LYS 41 2HE LYS 41 22.565 -9.808 6.301 255 1HZ LYS 41 1HZ LYS 41 22.659 -9.500 3.812 256 2HZ LYS 41 2HZ LYS 41 24.108 -9.946 4.562 257 3HZ LYS 41 3HZ LYS 41 23.863 -8.342 4.082 258 H SER 42 H SER 42 22.106 -5.160 3.945 259 HA SER 42 HA SER 42 19.875 -4.644 2.254 260 1HB SER 42 1HB SER 42 20.539 -2.313 2.960 261 2HB SER 42 2HB SER 42 22.078 -2.575 2.141 262 HG SER 42 HG SER 42 19.485 -2.535 1.002 263 H THR 43 H THR 43 20.250 -5.261 0.132 264 HA THR 43 HA THR 43 22.922 -6.391 -0.396 265 HB THR 43 HB THR 43 21.946 -8.179 -1.624 266 HG1 THR 43 HG1 THR 43 19.738 -8.254 -2.092 267 1HG2 THR 43 1HG2 THR 43 21.412 -7.785 1.090 268 2HG2 THR 43 2HG2 THR 43 21.391 -9.316 0.214 269 3HG2 THR 43 3HG2 THR 43 19.903 -8.390 0.406 270 H MET 44 H MET 44 20.500 -4.231 -1.434 271 HA MET 44 HA MET 44 21.026 -4.225 -4.220 272 1HB MET 44 1HB MET 44 19.255 -2.922 -2.471 273 2HB MET 44 2HB MET 44 20.179 -1.643 -3.246 274 1HG MET 44 1HG MET 44 19.502 -2.340 -5.406 275 2HG MET 44 2HG MET 44 18.819 -3.838 -4.778 276 1HE MET 44 1HE MET 44 17.296 -2.716 -2.119 277 2HE MET 44 2HE MET 44 15.686 -2.580 -2.826 278 3HE MET 44 3HE MET 44 16.715 -3.954 -3.233 279 H ASP 45 H ASP 45 21.537 -1.645 -4.935 280 HA ASP 45 HA ASP 45 24.366 -1.509 -4.663 281 1HB ASP 45 1HB ASP 45 22.446 -0.452 -6.409 282 2HB ASP 45 2HB ASP 45 23.194 0.949 -5.646 283 H ASN 46 H ASN 46 25.506 0.523 -4.009 284 HA ASN 46 HA ASN 46 24.951 1.118 -1.313 285 1HB ASN 46 1HB ASN 46 27.065 1.565 -3.124 286 2HB ASN 46 2HB ASN 46 26.594 3.153 -2.525 287 1HD2 ASN 46 1HD2 ASN 46 25.797 2.528 0.032 288 2HD2 ASN 46 2HD2 ASN 46 27.164 1.988 0.940 289 HA PRO 47 HA PRO 47 23.493 5.453 -2.880 290 1HB PRO 47 1HB PRO 47 23.084 5.734 -5.549 291 2HB PRO 47 2HB PRO 47 24.640 6.061 -4.776 292 1HG PRO 47 1HG PRO 47 23.738 3.624 -6.262 293 2HG PRO 47 2HG PRO 47 25.293 4.474 -6.344 294 1HD PRO 47 1HD PRO 47 24.948 2.203 -4.910 295 2HD PRO 47 2HD PRO 47 26.082 3.479 -4.421 296 H THR 48 H THR 48 22.351 2.538 -4.438 297 HA THR 48 HA THR 48 19.678 3.483 -4.872 298 HB THR 48 HB THR 48 20.770 0.662 -4.866 299 HG1 THR 48 HG1 THR 48 20.290 1.186 -7.261 300 1HG2 THR 48 1HG2 THR 48 18.376 0.638 -4.475 301 2HG2 THR 48 2HG2 THR 48 18.711 0.115 -6.126 302 3HG2 THR 48 3HG2 THR 48 18.118 1.747 -5.821 303 H THR 49 H THR 49 21.356 1.726 -2.344 304 HA THR 49 HA THR 49 19.020 0.916 -0.927 305 HB THR 49 HB THR 49 21.885 1.185 -0.000 306 HG1 THR 49 HG1 THR 49 21.347 -0.430 -1.643 307 1HG2 THR 49 1HG2 THR 49 19.515 -0.100 1.362 308 2HG2 THR 49 2HG2 THR 49 20.406 1.317 1.918 309 3HG2 THR 49 3HG2 THR 49 21.192 -0.261 1.883 310 H THR 50 H THR 50 21.372 3.542 -0.438 311 HA THR 50 HA THR 50 20.281 4.667 1.849 312 HB THR 50 HB THR 50 21.250 6.666 -0.062 313 HG1 THR 50 HG1 THR 50 23.453 5.688 0.154 314 1HG2 THR 50 1HG2 THR 50 21.111 6.499 2.613 315 2HG2 THR 50 2HG2 THR 50 22.289 7.509 1.775 316 3HG2 THR 50 3HG2 THR 50 22.758 5.918 2.373 317 H GLN 51 H GLN 51 19.500 5.323 -1.550 318 HA GLN 51 HA GLN 51 17.651 7.385 -1.093 319 1HB GLN 51 1HB GLN 51 18.502 7.074 -3.301 320 2HB GLN 51 2HB GLN 51 17.939 5.409 -3.353 321 1HG GLN 51 1HG GLN 51 15.851 7.427 -2.912 322 2HG GLN 51 2HG GLN 51 16.651 7.489 -4.482 323 1HE2 GLN 51 1HE2 GLN 51 14.446 5.814 -2.475 324 2HE2 GLN 51 2HE2 GLN 51 14.003 4.582 -3.602 325 H TYR 52 H TYR 52 17.124 3.900 -1.595 326 HA TYR 52 HA TYR 52 14.340 3.931 -1.320 327 1HB TYR 52 1HB TYR 52 16.458 1.845 -1.063 328 2HB TYR 52 2HB TYR 52 14.841 1.465 -0.480 329 HD1 TYR 52 HD1 TYR 52 16.219 3.230 -3.482 330 HD2 TYR 52 HD2 TYR 52 13.645 0.195 -1.978 331 HE1 TYR 52 HE1 TYR 52 15.525 2.689 -5.779 332 HE2 TYR 52 HE2 TYR 52 12.944 -0.356 -4.270 333 HH TYR 52 HH TYR 52 14.335 0.102 -6.779 334 H ALA 53 H ALA 53 16.831 3.164 1.110 335 HA ALA 53 HA ALA 53 15.067 2.841 3.272 336 1HB ALA 53 1HB ALA 53 17.248 3.509 4.586 337 2HB ALA 53 2HB ALA 53 17.129 1.968 3.736 338 3HB ALA 53 3HB ALA 53 17.990 3.318 2.998 339 H SER 54 H SER 54 16.208 5.659 1.673 340 HA SER 54 HA SER 54 15.880 7.489 3.841 341 1HB SER 54 1HB SER 54 16.597 7.626 1.007 342 2HB SER 54 2HB SER 54 15.625 8.997 1.539 343 HG SER 54 HG SER 54 17.873 9.344 1.847 344 H LEU 55 H LEU 55 13.924 6.747 0.958 345 HA LEU 55 HA LEU 55 11.736 8.378 1.881 346 1HB LEU 55 1HB LEU 55 10.803 8.057 -0.170 347 2HB LEU 55 2HB LEU 55 12.496 7.754 -0.558 348 HG LEU 55 HG LEU 55 11.759 5.250 -0.038 349 1HD1 LEU 55 1HD1 LEU 55 9.295 5.944 -1.445 350 2HD1 LEU 55 2HD1 LEU 55 9.341 6.490 0.231 351 3HD1 LEU 55 3HD1 LEU 55 9.576 4.783 -0.147 352 1HD2 LEU 55 1HD2 LEU 55 11.974 4.904 -2.272 353 2HD2 LEU 55 2HD2 LEU 55 12.558 6.567 -2.209 354 3HD2 LEU 55 3HD2 LEU 55 10.895 6.233 -2.697 355 H MET 56 H MET 56 12.762 5.142 2.301 356 HA MET 56 HA MET 56 10.394 3.739 2.596 357 1HB MET 56 1HB MET 56 13.130 3.333 3.219 358 2HB MET 56 2HB MET 56 12.207 2.937 4.663 359 1HG MET 56 1HG MET 56 12.547 0.972 3.298 360 2HG MET 56 2HG MET 56 10.837 1.390 3.370 361 1HE MET 56 1HE MET 56 9.646 0.862 0.449 362 2HE MET 56 2HE MET 56 9.461 1.897 1.865 363 3HE MET 56 3HE MET 56 9.729 2.615 0.276 364 H HIS 57 H HIS 57 12.035 5.863 4.889 365 HA HIS 57 HA HIS 57 10.160 5.333 7.007 366 1HB HIS 57 1HB HIS 57 12.591 6.023 7.311 367 2HB HIS 57 2HB HIS 57 12.092 7.647 6.849 368 HD1 HIS 57 HD1 HIS 57 13.011 8.161 9.355 369 HD2 HIS 57 HD2 HIS 57 9.455 6.032 9.059 370 HE1 HIS 57 HE1 HIS 57 11.925 8.347 11.616 371 H SER 58 H SER 58 10.866 8.146 4.937 372 HA SER 58 HA SER 58 8.857 9.827 5.851 373 1HB SER 58 1HB SER 58 10.256 10.961 4.435 374 2HB SER 58 2HB SER 58 10.421 9.596 3.331 375 HG SER 58 HG SER 58 8.736 11.702 3.206 376 H PHE 59 H PHE 59 8.664 7.046 3.791 377 HA PHE 59 HA PHE 59 6.142 7.604 2.615 378 1HB PHE 59 1HB PHE 59 7.540 5.980 1.555 379 2HB PHE 59 2HB PHE 59 7.666 5.031 3.032 380 HD1 PHE 59 HD1 PHE 59 6.761 2.967 2.514 381 HD2 PHE 59 HD2 PHE 59 4.667 6.501 1.398 382 HE1 PHE 59 HE1 PHE 59 4.843 1.601 1.799 383 HE2 PHE 59 HE2 PHE 59 2.746 5.141 0.682 384 HZ PHE 59 HZ PHE 59 2.832 2.688 0.883 385 H ILE 60 H ILE 60 7.043 5.371 5.248 386 HA ILE 60 HA ILE 60 4.449 4.653 5.984 387 HB ILE 60 HB ILE 60 6.889 4.835 7.756 388 1HG1 ILE 60 1HG1 ILE 60 7.212 3.406 5.772 389 2HG1 ILE 60 2HG1 ILE 60 7.180 2.460 7.256 390 1HG2 ILE 60 1HG2 ILE 60 5.665 3.051 9.056 391 2HG2 ILE 60 2HG2 ILE 60 4.993 4.677 9.162 392 3HG2 ILE 60 3HG2 ILE 60 4.231 3.475 8.121 393 1HD1 ILE 60 1HD1 ILE 60 5.621 2.133 4.932 394 2HD1 ILE 60 2HD1 ILE 60 5.564 1.205 6.431 395 3HD1 ILE 60 3HD1 ILE 60 4.535 2.623 6.232 396 H LEU 61 H LEU 61 6.538 7.226 7.270 397 HA LEU 61 HA LEU 61 4.788 8.166 9.240 398 1HB LEU 61 1HB LEU 61 7.275 8.933 8.112 399 2HB LEU 61 2HB LEU 61 6.234 10.355 8.137 400 HG LEU 61 HG LEU 61 5.964 10.174 10.525 401 1HD1 LEU 61 1HD1 LEU 61 5.982 8.101 11.359 402 2HD1 LEU 61 2HD1 LEU 61 7.731 8.305 11.446 403 3HD1 LEU 61 3HD1 LEU 61 7.007 7.485 10.063 404 1HD2 LEU 61 1HD2 LEU 61 8.277 10.546 11.240 405 2HD2 LEU 61 2HD2 LEU 61 7.922 11.375 9.724 406 3HD2 LEU 61 3HD2 LEU 61 8.854 9.877 9.713 407 H LYS 62 H LYS 62 4.784 8.577 5.806 408 HA LYS 62 HA LYS 62 3.075 10.883 5.774 409 1HB LYS 62 1HB LYS 62 4.668 10.262 3.933 410 2HB LYS 62 2HB LYS 62 3.600 8.922 3.536 411 1HG LYS 62 1HG LYS 62 2.904 10.506 2.038 412 2HG LYS 62 2HG LYS 62 1.786 10.792 3.374 413 1HD LYS 62 1HD LYS 62 2.470 12.938 2.944 414 2HD LYS 62 2HD LYS 62 3.667 12.463 4.152 415 1HE LYS 62 1HE LYS 62 5.333 12.144 2.538 416 2HE LYS 62 2HE LYS 62 4.167 12.081 1.218 417 1HZ LYS 62 1HZ LYS 62 4.890 14.189 0.942 418 2HZ LYS 62 2HZ LYS 62 5.328 14.390 2.563 419 3HZ LYS 62 3HZ LYS 62 3.706 14.522 2.103 420 H ALA 63 H ALA 63 2.593 7.440 4.986 421 HA ALA 63 HA ALA 63 -0.204 7.654 4.616 422 1HB ALA 63 1HB ALA 63 -0.128 5.133 4.922 423 2HB ALA 63 2HB ALA 63 0.848 5.804 3.615 424 3HB ALA 63 3HB ALA 63 1.614 5.318 5.127 425 H ARG 64 H ARG 64 1.807 7.143 7.424 426 HA ARG 64 HA ARG 64 -0.076 6.090 9.195 427 1HB ARG 64 1HB ARG 64 2.443 6.397 9.526 428 2HB ARG 64 2HB ARG 64 2.066 8.048 10.000 429 1HG ARG 64 1HG ARG 64 0.342 6.429 11.491 430 2HG ARG 64 2HG ARG 64 1.915 5.629 11.534 431 1HD ARG 64 1HD ARG 64 1.938 8.551 11.933 432 2HD ARG 64 2HD ARG 64 1.185 7.606 13.216 433 HE ARG 64 HE ARG 64 3.757 6.613 12.403 434 1HH1 ARG 64 1HH1 ARG 64 2.070 8.846 14.474 435 2HH1 ARG 64 2HH1 ARG 64 3.353 8.942 15.634 436 1HH2 ARG 64 1HH2 ARG 64 5.454 6.731 13.923 437 2HH2 ARG 64 2HH2 ARG 64 5.278 7.740 15.319 438 H SER 65 H SER 65 0.616 9.431 8.291 439 HA SER 65 HA SER 65 -1.254 10.527 10.182 440 1HB SER 65 1HB SER 65 0.890 11.605 9.041 441 2HB SER 65 2HB SER 65 -0.297 12.111 7.838 442 HG SER 65 HG SER 65 -0.774 12.524 10.582 443 H THR 66 H THR 66 -1.335 9.429 6.897 444 HA THR 66 HA THR 66 -3.737 10.795 6.152 445 HB THR 66 HB THR 66 -2.931 8.274 4.777 446 HG1 THR 66 HG1 THR 66 -1.377 9.796 3.621 447 1HG2 THR 66 1HG2 THR 66 -3.289 10.730 3.241 448 2HG2 THR 66 2HG2 THR 66 -4.690 10.320 4.231 449 3HG2 THR 66 3HG2 THR 66 -4.067 9.159 3.059 450 H VAL 67 H VAL 67 -2.996 7.419 7.016 451 HA VAL 67 HA VAL 67 -5.653 6.490 6.906 452 HB VAL 67 HB VAL 67 -3.341 5.422 8.533 453 1HG1 VAL 67 1HG1 VAL 67 -4.876 4.098 9.462 454 2HG1 VAL 67 2HG1 VAL 67 -6.124 4.613 8.325 455 3HG1 VAL 67 3HG1 VAL 67 -5.007 3.319 7.886 456 1HG2 VAL 67 1HG2 VAL 67 -3.536 3.703 6.524 457 2HG2 VAL 67 2HG2 VAL 67 -4.178 5.123 5.699 458 3HG2 VAL 67 3HG2 VAL 67 -2.562 5.169 6.404 459 H ARG 68 H ARG 68 -3.862 8.183 9.361 460 HA ARG 68 HA ARG 68 -5.322 7.555 11.639 461 1HB ARG 68 1HB ARG 68 -3.703 9.901 10.771 462 2HB ARG 68 2HB ARG 68 -4.715 10.082 12.198 463 1HG ARG 68 1HG ARG 68 -3.210 7.623 12.296 464 2HG ARG 68 2HG ARG 68 -2.153 9.019 12.080 465 1HD ARG 68 1HD ARG 68 -2.653 8.369 14.468 466 2HD ARG 68 2HD ARG 68 -2.961 10.053 14.046 467 HE ARG 68 HE ARG 68 -5.291 8.440 13.746 468 1HH1 ARG 68 1HH1 ARG 68 -3.312 10.089 16.089 469 2HH1 ARG 68 2HH1 ARG 68 -4.604 10.302 17.223 470 1HH2 ARG 68 1HH2 ARG 68 -7.000 8.714 15.232 471 2HH2 ARG 68 2HH2 ARG 68 -6.701 9.519 16.735 472 H ASP 69 H ASP 69 -6.127 9.614 8.951 473 HA ASP 69 HA ASP 69 -8.275 10.993 10.229 474 1HB ASP 69 1HB ASP 69 -6.901 11.489 7.991 475 2HB ASP 69 2HB ASP 69 -8.268 10.640 7.274 476 H ILE 70 H ILE 70 -7.926 7.923 8.682 477 HA ILE 70 HA ILE 70 -10.632 7.474 7.989 478 HB ILE 70 HB ILE 70 -8.592 5.374 8.718 479 1HG1 ILE 70 1HG1 ILE 70 -9.135 6.617 6.013 480 2HG1 ILE 70 2HG1 ILE 70 -7.730 6.965 7.015 481 1HG2 ILE 70 1HG2 ILE 70 -9.913 3.844 7.563 482 2HG2 ILE 70 2HG2 ILE 70 -11.089 4.820 8.442 483 3HG2 ILE 70 3HG2 ILE 70 -10.812 5.108 6.724 484 1HD1 ILE 70 1HD1 ILE 70 -7.490 4.320 6.886 485 2HD1 ILE 70 2HD1 ILE 70 -8.351 4.594 5.370 486 3HD1 ILE 70 3HD1 ILE 70 -6.813 5.403 5.670 487 H ASP 71 H ASP 71 -8.734 6.694 10.878 488 HA ASP 71 HA ASP 71 -10.876 6.950 12.652 489 1HB ASP 71 1HB ASP 71 -10.808 4.421 11.283 490 2HB ASP 71 2HB ASP 71 -10.500 4.173 12.999 491 HA PRO 72 HA PRO 72 -7.578 6.877 15.543 492 1HB PRO 72 1HB PRO 72 -8.835 6.060 17.806 493 2HB PRO 72 2HB PRO 72 -9.070 7.665 17.103 494 1HG PRO 72 1HG PRO 72 -10.794 5.228 16.878 495 2HG PRO 72 2HG PRO 72 -11.270 6.915 17.144 496 1HD PRO 72 1HD PRO 72 -11.424 5.725 14.717 497 2HD PRO 72 2HD PRO 72 -11.077 7.455 14.912 498 H GLN 73 H GLN 73 -9.654 3.995 15.900 499 HA GLN 73 HA GLN 73 -7.682 2.354 17.051 500 1HB GLN 73 1HB GLN 73 -10.074 1.513 15.405 501 2HB GLN 73 2HB GLN 73 -9.165 0.490 16.509 502 1HG GLN 73 1HG GLN 73 -10.198 1.303 18.324 503 2HG GLN 73 2HG GLN 73 -10.227 2.951 17.698 504 1HE2 GLN 73 1HE2 GLN 73 -12.324 3.413 18.130 505 2HE2 GLN 73 2HE2 GLN 73 -13.661 2.611 17.386 506 H ASN 74 H ASN 74 -8.444 3.132 13.733 507 HA ASN 74 HA ASN 74 -7.229 1.072 12.359 508 1HB ASN 74 1HB ASN 74 -7.369 4.019 11.710 509 2HB ASN 74 2HB ASN 74 -6.763 2.812 10.580 510 1HD2 ASN 74 1HD2 ASN 74 -8.399 3.245 9.109 511 2HD2 ASN 74 2HD2 ASN 74 -10.029 2.733 9.368 512 H ASP 75 H ASP 75 -5.164 0.602 11.683 513 HA ASP 75 HA ASP 75 -2.952 2.339 12.326 514 1HB ASP 75 1HB ASP 75 -3.743 0.434 14.240 515 2HB ASP 75 2HB ASP 75 -2.308 -0.232 13.464 516 H LEU 76 H LEU 76 -1.269 2.020 10.975 517 HA LEU 76 HA LEU 76 -1.600 0.200 8.795 518 1HB LEU 76 1HB LEU 76 0.523 2.162 9.587 519 2HB LEU 76 2HB LEU 76 0.759 1.064 8.229 520 HG LEU 76 HG LEU 76 0.047 3.207 7.407 521 1HD1 LEU 76 1HD1 LEU 76 -2.466 1.641 7.171 522 2HD1 LEU 76 2HD1 LEU 76 -0.969 0.915 6.588 523 3HD1 LEU 76 3HD1 LEU 76 -1.517 2.456 5.928 524 1HD2 LEU 76 1HD2 LEU 76 -2.622 3.104 8.652 525 2HD2 LEU 76 2HD2 LEU 76 -1.591 4.486 8.282 526 3HD2 LEU 76 3HD2 LEU 76 -1.286 3.519 9.726 527 H THR 77 H THR 77 -1.037 -1.863 8.770 528 HA THR 77 HA THR 77 1.313 -2.716 10.318 529 HB THR 77 HB THR 77 -0.693 -3.367 11.581 530 HG1 THR 77 HG1 THR 77 1.036 -4.789 11.725 531 1HG2 THR 77 1HG2 THR 77 -2.365 -3.562 9.907 532 2HG2 THR 77 2HG2 THR 77 -2.138 -5.182 10.566 533 3HG2 THR 77 3HG2 THR 77 -1.427 -4.755 9.010 534 H PHE 78 H PHE 78 0.313 -2.263 7.366 535 HA PHE 78 HA PHE 78 2.066 -4.104 6.170 536 1HB PHE 78 1HB PHE 78 -0.112 -5.470 6.853 537 2HB PHE 78 2HB PHE 78 -0.717 -4.788 5.347 538 HD1 PHE 78 HD1 PHE 78 -0.627 -6.274 3.612 539 HD2 PHE 78 HD2 PHE 78 2.532 -6.252 6.466 540 HE1 PHE 78 HE1 PHE 78 0.522 -8.045 2.349 541 HE2 PHE 78 HE2 PHE 78 3.686 -8.023 5.206 542 HZ PHE 78 HZ PHE 78 2.682 -8.921 3.145 543 H LEU 79 H LEU 79 2.771 -3.059 4.439 544 HA LEU 79 HA LEU 79 0.865 -1.424 2.901 545 1HB LEU 79 1HB LEU 79 3.397 -0.686 4.162 546 2HB LEU 79 2HB LEU 79 3.291 -0.226 2.464 547 HG LEU 79 HG LEU 79 1.358 1.129 2.891 548 1HD1 LEU 79 1HD1 LEU 79 0.118 -0.072 4.476 549 2HD1 LEU 79 2HD1 LEU 79 0.609 1.402 5.310 550 3HD1 LEU 79 3HD1 LEU 79 1.458 -0.112 5.622 551 1HD2 LEU 79 1HD2 LEU 79 3.893 1.628 3.925 552 2HD2 LEU 79 2HD2 LEU 79 2.780 2.101 5.209 553 3HD2 LEU 79 3HD2 LEU 79 2.626 2.812 3.601 554 H ARG 80 H ARG 80 0.593 -2.363 0.991 555 HA ARG 80 HA ARG 80 2.958 -3.483 -0.366 556 1HB ARG 80 1HB ARG 80 0.720 -4.882 0.409 557 2HB ARG 80 2HB ARG 80 0.358 -4.490 -1.267 558 1HG ARG 80 1HG ARG 80 2.312 -5.602 -2.035 559 2HG ARG 80 2HG ARG 80 2.924 -5.787 -0.390 560 1HD ARG 80 1HD ARG 80 2.026 -7.890 -1.089 561 2HD ARG 80 2HD ARG 80 0.936 -7.202 0.114 562 HE ARG 80 HE ARG 80 0.029 -6.437 -2.413 563 1HH1 ARG 80 1HH1 ARG 80 0.409 -9.329 -0.512 564 2HH1 ARG 80 2HH1 ARG 80 -0.915 -10.155 -1.266 565 1HH2 ARG 80 1HH2 ARG 80 -1.716 -7.513 -3.412 566 2HH2 ARG 80 2HH2 ARG 80 -2.122 -9.121 -2.916 567 H ILE 81 H ILE 81 3.534 -2.333 -2.077 568 HA ILE 81 HA ILE 81 1.443 -0.896 -3.579 569 HB ILE 81 HB ILE 81 4.348 -0.105 -3.484 570 1HG1 ILE 81 1HG1 ILE 81 2.060 0.964 -1.815 571 2HG1 ILE 81 2HG1 ILE 81 3.419 0.020 -1.214 572 1HG2 ILE 81 1HG2 ILE 81 3.552 2.001 -4.369 573 2HG2 ILE 81 2HG2 ILE 81 3.010 0.676 -5.398 574 3HG2 ILE 81 3HG2 ILE 81 1.883 1.438 -4.277 575 1HD1 ILE 81 1HD1 ILE 81 4.515 1.902 -0.859 576 2HD1 ILE 81 2HD1 ILE 81 4.506 2.214 -2.595 577 3HD1 ILE 81 3HD1 ILE 81 3.204 2.835 -1.580 578 H ARG 82 H ARG 82 1.011 -2.247 -5.241 579 HA ARG 82 HA ARG 82 3.089 -3.698 -6.608 580 1HB ARG 82 1HB ARG 82 0.404 -4.098 -6.279 581 2HB ARG 82 2HB ARG 82 0.469 -3.481 -7.925 582 1HG ARG 82 1HG ARG 82 2.338 -5.656 -7.124 583 2HG ARG 82 2HG ARG 82 0.646 -6.043 -7.442 584 1HD ARG 82 1HD ARG 82 1.325 -4.426 -9.562 585 2HD ARG 82 2HD ARG 82 2.794 -5.362 -9.291 586 HE ARG 82 HE ARG 82 0.703 -7.168 -9.261 587 1HH1 ARG 82 1HH1 ARG 82 2.098 -4.907 -11.511 588 2HH1 ARG 82 2HH1 ARG 82 1.658 -5.829 -12.910 589 1HH2 ARG 82 1HH2 ARG 82 0.119 -8.390 -11.096 590 2HH2 ARG 82 2HH2 ARG 82 0.532 -7.809 -12.673 591 H SER 83 H SER 83 4.456 -2.577 -7.846 592 HA SER 83 HA SER 83 3.441 -0.354 -9.461 593 1HB SER 83 1HB SER 83 6.300 -0.819 -9.665 594 2HB SER 83 2HB SER 83 5.436 0.619 -9.119 595 HG SER 83 HG SER 83 6.680 -1.300 -7.664 596 H LYS 84 H LYS 84 5.193 -0.275 -11.528 597 HA LYS 84 HA LYS 84 4.279 -2.506 -13.151 598 1HB LYS 84 1HB LYS 84 5.647 0.101 -13.804 599 2HB LYS 84 2HB LYS 84 5.357 -1.143 -15.013 600 1HG LYS 84 1HG LYS 84 2.894 -0.983 -14.215 601 2HG LYS 84 2HG LYS 84 3.397 0.577 -13.560 602 1HD LYS 84 1HD LYS 84 2.667 1.176 -15.664 603 2HD LYS 84 2HD LYS 84 4.392 0.934 -15.950 604 1HE LYS 84 1HE LYS 84 3.894 -1.372 -16.708 605 2HE LYS 84 2HE LYS 84 2.175 -1.032 -16.516 606 1HZ LYS 84 1HZ LYS 84 2.271 -0.372 -18.627 607 2HZ LYS 84 2HZ LYS 84 3.960 -0.282 -18.635 608 3HZ LYS 84 3HZ LYS 84 3.046 1.019 -18.056 609 H LYS 85 H LYS 85 7.180 -1.349 -11.658 610 HA LYS 85 HA LYS 85 8.938 -3.002 -13.249 611 1HB LYS 85 1HB LYS 85 9.332 -1.205 -10.869 612 2HB LYS 85 2HB LYS 85 10.618 -2.260 -11.438 613 1HG LYS 85 1HG LYS 85 9.253 -0.381 -13.320 614 2HG LYS 85 2HG LYS 85 10.541 0.183 -12.253 615 1HD LYS 85 1HD LYS 85 11.332 -2.265 -13.520 616 2HD LYS 85 2HD LYS 85 10.796 -1.109 -14.741 617 1HE LYS 85 1HE LYS 85 12.358 0.530 -13.972 618 2HE LYS 85 2HE LYS 85 12.772 -0.448 -12.564 619 1HZ LYS 85 1HZ LYS 85 13.395 -1.032 -15.404 620 2HZ LYS 85 2HZ LYS 85 13.609 -2.152 -14.155 621 3HZ LYS 85 3HZ LYS 85 14.491 -0.708 -14.156 622 H ASN 86 H ASN 86 7.697 -2.990 -9.923 623 HA ASN 86 HA ASN 86 7.500 -5.770 -9.725 624 1HB ASN 86 1HB ASN 86 9.409 -5.986 -7.954 625 2HB ASN 86 2HB ASN 86 9.800 -6.103 -9.668 626 1HD2 ASN 86 1HD2 ASN 86 11.107 -4.614 -10.583 627 2HD2 ASN 86 2HD2 ASN 86 11.850 -3.316 -9.719 628 H GLU 87 H GLU 87 7.024 -6.495 -7.493 629 HA GLU 87 HA GLU 87 5.484 -4.473 -6.127 630 1HB GLU 87 1HB GLU 87 4.692 -6.315 -4.727 631 2HB GLU 87 2HB GLU 87 4.565 -6.721 -6.432 632 1HG GLU 87 1HG GLU 87 6.317 -8.240 -6.332 633 2HG GLU 87 2HG GLU 87 6.950 -7.558 -4.835 634 H ILE 88 H ILE 88 5.804 -3.692 -4.068 635 HA ILE 88 HA ILE 88 8.354 -4.403 -2.777 636 HB ILE 88 HB ILE 88 7.165 -1.634 -2.977 637 1HG1 ILE 88 1HG1 ILE 88 9.826 -1.802 -3.976 638 2HG1 ILE 88 2HG1 ILE 88 8.892 -3.092 -4.724 639 1HG2 ILE 88 1HG2 ILE 88 9.357 -2.796 -1.349 640 2HG2 ILE 88 2HG2 ILE 88 9.590 -1.179 -2.012 641 3HG2 ILE 88 3HG2 ILE 88 8.215 -1.510 -0.959 642 1HD1 ILE 88 1HD1 ILE 88 7.269 -0.823 -4.841 643 2HD1 ILE 88 2HD1 ILE 88 8.890 -0.284 -5.280 644 3HD1 ILE 88 3HD1 ILE 88 8.130 -1.605 -6.167 645 H MET 89 H MET 89 7.576 -5.648 -1.142 646 HA MET 89 HA MET 89 5.272 -4.821 0.397 647 1HB MET 89 1HB MET 89 7.113 -7.193 0.465 648 2HB MET 89 2HB MET 89 5.996 -6.888 1.789 649 1HG MET 89 1HG MET 89 4.135 -7.288 0.492 650 2HG MET 89 2HG MET 89 4.985 -6.956 -1.014 651 1HE MET 89 1HE MET 89 6.902 -9.476 1.527 652 2HE MET 89 2HE MET 89 5.288 -9.071 2.113 653 3HE MET 89 3HE MET 89 5.636 -10.705 1.546 654 H VAL 90 H VAL 90 5.307 -3.650 2.202 655 HA VAL 90 HA VAL 90 7.691 -3.605 3.880 656 HB VAL 90 HB VAL 90 6.486 -1.081 2.735 657 1HG1 VAL 90 1HG1 VAL 90 8.081 -1.593 5.118 658 2HG1 VAL 90 2HG1 VAL 90 8.805 -0.395 4.043 659 3HG1 VAL 90 3HG1 VAL 90 7.167 -0.158 4.653 660 1HG2 VAL 90 1HG2 VAL 90 7.939 -2.229 1.154 661 2HG2 VAL 90 2HG2 VAL 90 8.700 -0.748 1.734 662 3HG2 VAL 90 3HG2 VAL 90 9.217 -2.311 2.367 663 H ALA 91 H ALA 91 7.232 -3.391 6.003 664 HA ALA 91 HA ALA 91 4.762 -2.206 6.911 665 1HB ALA 91 1HB ALA 91 5.010 -4.930 7.972 666 2HB ALA 91 2HB ALA 91 3.578 -4.028 7.472 667 3HB ALA 91 3HB ALA 91 4.578 -4.836 6.265 668 HA PRO 92 HA PRO 92 7.108 -1.377 10.525 669 1HB PRO 92 1HB PRO 92 5.223 -1.481 12.475 670 2HB PRO 92 2HB PRO 92 5.313 -0.169 11.295 671 1HG PRO 92 1HG PRO 92 3.535 -2.577 11.318 672 2HG PRO 92 2HG PRO 92 3.133 -0.894 10.930 673 1HD PRO 92 1HD PRO 92 3.558 -2.767 9.022 674 2HD PRO 92 2HD PRO 92 3.970 -1.056 8.788 675 H ASP 93 H ASP 93 8.501 -2.614 11.601 676 HA ASP 93 HA ASP 93 7.641 -5.292 12.460 677 1HB ASP 93 1HB ASP 93 9.850 -4.502 10.963 678 2HB ASP 93 2HB ASP 93 10.508 -4.805 12.568 679 H LYS 94 H LYS 94 9.592 -5.900 14.270 680 HA LYS 94 HA LYS 94 8.631 -4.928 16.661 681 1HB LYS 94 1HB LYS 94 10.778 -6.615 15.811 682 2HB LYS 94 2HB LYS 94 11.380 -5.528 17.056 683 1HG LYS 94 1HG LYS 94 10.222 -6.545 18.678 684 2HG LYS 94 2HG LYS 94 8.787 -6.741 17.669 685 1HD LYS 94 1HD LYS 94 9.964 -8.605 16.493 686 2HD LYS 94 2HD LYS 94 11.264 -8.463 17.679 687 1HE LYS 94 1HE LYS 94 10.124 -9.857 18.983 688 2HE LYS 94 2HE LYS 94 8.911 -8.593 19.177 689 1HZ LYS 94 1HZ LYS 94 8.563 -11.061 18.004 690 2HZ LYS 94 2HZ LYS 94 8.554 -9.963 16.719 691 3HZ LYS 94 3HZ LYS 94 7.468 -9.772 18.002 692 H ASP 95 H ASP 95 11.596 -3.887 14.981 693 HA ASP 95 HA ASP 95 11.239 -1.200 16.015 694 1HB ASP 95 1HB ASP 95 13.175 -3.069 17.136 695 2HB ASP 95 2HB ASP 95 13.937 -1.602 16.527 696 H TYR 96 H TYR 96 11.489 -2.852 13.442 697 HA TYR 96 HA TYR 96 13.174 -0.909 12.060 698 1HB TYR 96 1HB TYR 96 14.144 -2.817 10.678 699 2HB TYR 96 2HB TYR 96 14.753 -2.654 12.321 700 HD1 TYR 96 HD1 TYR 96 13.989 -4.239 14.081 701 HD2 TYR 96 HD2 TYR 96 12.973 -4.770 9.984 702 HE1 TYR 96 HE1 TYR 96 13.396 -6.582 14.538 703 HE2 TYR 96 HE2 TYR 96 12.376 -7.114 10.429 704 HH TYR 96 HH TYR 96 13.297 -8.776 13.063 705 H PHE 97 H PHE 97 12.998 -1.383 9.577 706 HA PHE 97 HA PHE 97 10.186 -2.033 8.981 707 1HB PHE 97 1HB PHE 97 11.897 0.252 8.079 708 2HB PHE 97 2HB PHE 97 10.629 -0.345 7.014 709 HD1 PHE 97 HD1 PHE 97 11.365 1.995 9.459 710 HD2 PHE 97 HD2 PHE 97 8.295 -0.706 8.279 711 HE1 PHE 97 HE1 PHE 97 9.711 3.346 10.682 712 HE2 PHE 97 HE2 PHE 97 6.636 0.641 9.499 713 HZ PHE 97 HZ PHE 97 7.343 2.670 10.702 714 H LEU 98 H LEU 98 10.156 -3.912 7.937 715 HA LEU 98 HA LEU 98 12.370 -4.832 6.359 716 1HB LEU 98 1HB LEU 98 10.437 -6.093 7.743 717 2HB LEU 98 2HB LEU 98 9.752 -6.176 6.121 718 HG LEU 98 HG LEU 98 12.570 -7.034 6.418 719 1HD1 LEU 98 1HD1 LEU 98 11.849 -8.136 8.339 720 2HD1 LEU 98 2HD1 LEU 98 11.653 -9.341 7.068 721 3HD1 LEU 98 3HD1 LEU 98 10.249 -8.460 7.670 722 1HD2 LEU 98 1HD2 LEU 98 11.889 -8.676 4.779 723 2HD2 LEU 98 2HD2 LEU 98 11.357 -7.072 4.272 724 3HD2 LEU 98 3HD2 LEU 98 10.199 -8.206 4.968 725 H ILE 99 H ILE 99 12.506 -5.052 4.152 726 HA ILE 99 HA ILE 99 10.300 -4.000 2.530 727 HB ILE 99 HB ILE 99 13.179 -3.153 2.183 728 1HG1 ILE 99 1HG1 ILE 99 11.630 -0.890 2.564 729 2HG1 ILE 99 2HG1 ILE 99 10.956 -2.037 3.717 730 1HG2 ILE 99 1HG2 ILE 99 12.271 -1.642 0.464 731 2HG2 ILE 99 2HG2 ILE 99 12.026 -3.341 0.064 732 3HG2 ILE 99 3HG2 ILE 99 10.683 -2.378 0.680 733 1HD1 ILE 99 1HD1 ILE 99 13.819 -1.139 3.526 734 2HD1 ILE 99 2HD1 ILE 99 12.656 -0.740 4.790 735 3HD1 ILE 99 3HD1 ILE 99 13.231 -2.397 4.613 736 H VAL 100 H VAL 100 9.762 -5.804 1.448 737 HA VAL 100 HA VAL 100 11.904 -7.406 0.227 738 HB VAL 100 HB VAL 100 8.999 -8.111 0.674 739 1HG1 VAL 100 1HG1 VAL 100 11.233 -9.483 -0.741 740 2HG1 VAL 100 2HG1 VAL 100 10.058 -10.458 0.144 741 3HG1 VAL 100 3HG1 VAL 100 9.521 -9.392 -1.155 742 1HG2 VAL 100 1HG2 VAL 100 9.669 -8.567 2.751 743 2HG2 VAL 100 2HG2 VAL 100 10.602 -9.894 2.061 744 3HG2 VAL 100 3HG2 VAL 100 11.367 -8.329 2.336 745 H ILE 101 H ILE 101 12.344 -6.874 -1.804 746 HA ILE 101 HA ILE 101 10.143 -5.974 -3.540 747 HB ILE 101 HB ILE 101 13.108 -5.487 -3.849 748 1HG1 ILE 101 1HG1 ILE 101 11.300 -3.196 -3.562 749 2HG1 ILE 101 2HG1 ILE 101 11.356 -4.229 -2.138 750 1HG2 ILE 101 1HG2 ILE 101 12.472 -4.013 -5.693 751 2HG2 ILE 101 2HG2 ILE 101 11.975 -5.677 -5.998 752 3HG2 ILE 101 3HG2 ILE 101 10.784 -4.480 -5.486 753 1HD1 ILE 101 1HD1 ILE 101 14.013 -3.795 -3.061 754 2HD1 ILE 101 2HD1 ILE 101 13.184 -2.243 -2.928 755 3HD1 ILE 101 3HD1 ILE 101 13.272 -3.318 -1.533 756 H GLN 102 H GLN 102 9.559 -7.207 -5.204 757 HA GLN 102 HA GLN 102 11.390 -8.852 -6.650 758 1HB GLN 102 1HB GLN 102 10.506 -11.017 -6.110 759 2HB GLN 102 2HB GLN 102 10.984 -10.234 -4.609 760 1HG GLN 102 1HG GLN 102 8.624 -9.608 -4.231 761 2HG GLN 102 2HG GLN 102 8.186 -10.509 -5.682 762 1HE2 GLN 102 1HE2 GLN 102 8.069 -10.697 -2.498 763 2HE2 GLN 102 2HE2 GLN 102 8.255 -12.397 -2.255 764 H ASN 103 H ASN 103 10.150 -10.258 -8.276 765 HA ASN 103 HA ASN 103 8.565 -8.662 -9.877 766 1HB ASN 103 1HB ASN 103 9.238 -11.532 -9.770 767 2HB ASN 103 2HB ASN 103 7.747 -11.152 -10.627 768 1HD2 ASN 103 1HD2 ASN 103 11.166 -11.037 -10.672 769 2HD2 ASN 103 2HD2 ASN 103 11.347 -10.347 -12.245 770 HA PRO 104 HA PRO 104 4.463 -8.733 -8.322 771 1HB PRO 104 1HB PRO 104 2.979 -8.959 -10.583 772 2HB PRO 104 2HB PRO 104 3.848 -7.483 -10.149 773 1HG PRO 104 1HG PRO 104 4.632 -9.649 -12.060 774 2HG PRO 104 2HG PRO 104 4.766 -7.891 -12.246 775 1HD PRO 104 1HD PRO 104 6.872 -9.447 -11.560 776 2HD PRO 104 2HD PRO 104 6.692 -7.777 -10.985 777 H THR 105 H THR 105 2.775 -10.079 -7.725 778 HA THR 105 HA THR 105 3.061 -12.892 -8.548 779 HB THR 105 HB THR 105 1.848 -13.410 -6.402 780 HG1 THR 105 HG1 THR 105 2.196 -11.501 -4.862 781 1HG2 THR 105 1HG2 THR 105 4.114 -13.841 -6.247 782 2HG2 THR 105 2HG2 THR 105 3.897 -12.658 -4.957 783 3HG2 THR 105 3HG2 THR 105 4.559 -12.156 -6.512 784 H GLU 106 H GLU 106 0.782 -10.266 -8.051 785 HA GLU 106 HA GLU 106 -1.632 -11.577 -8.314 786 1HB GLU 106 1HB GLU 106 -0.669 -8.861 -8.611 787 2HB GLU 106 2HB GLU 106 -1.947 -9.210 -9.767 788 1HG GLU 106 1HG GLU 106 -3.529 -9.244 -8.194 789 2HG GLU 106 2HG GLU 106 -2.521 -10.144 -7.062 790 H MET 11 H MET 11 -19.464 4.297 -15.362 791 HA MET 11 HA MET 11 -19.493 3.720 -12.732 792 1HB MET 11 1HB MET 11 -20.889 5.457 -13.832 793 2HB MET 11 2HB MET 11 -21.997 4.197 -14.358 794 1HG MET 11 1HG MET 11 -23.113 4.483 -12.474 795 2HG MET 11 2HG MET 11 -21.724 3.828 -11.610 796 1HE MET 11 1HE MET 11 -19.711 7.152 -10.867 797 2HE MET 11 2HE MET 11 -19.631 5.393 -10.958 798 3HE MET 11 3HE MET 11 -19.637 6.353 -12.438 799 H ALA 12 H ALA 12 -21.498 2.028 -15.142 800 HA ALA 12 HA ALA 12 -22.784 0.239 -13.482 801 1HB ALA 12 1HB ALA 12 -22.251 -1.235 -15.772 802 2HB ALA 12 2HB ALA 12 -23.649 -0.197 -15.484 803 3HB ALA 12 3HB ALA 12 -22.230 0.444 -16.313 804 H GLU 13 H GLU 13 -19.549 0.009 -14.892 805 HA GLU 13 HA GLU 13 -18.912 -2.602 -14.247 806 1HB GLU 13 1HB GLU 13 -17.559 -0.629 -15.427 807 2HB GLU 13 2HB GLU 13 -16.815 -0.531 -13.838 808 1HG GLU 13 1HG GLU 13 -16.955 -3.022 -15.520 809 2HG GLU 13 2HG GLU 13 -15.562 -1.946 -15.414 810 H VAL 14 H VAL 14 -18.387 0.305 -12.257 811 HA VAL 14 HA VAL 14 -17.357 -1.056 -10.015 812 HB VAL 14 HB VAL 14 -18.851 1.567 -9.966 813 1HG1 VAL 14 1HG1 VAL 14 -18.442 1.363 -7.778 814 2HG1 VAL 14 2HG1 VAL 14 -17.308 0.033 -8.023 815 3HG1 VAL 14 3HG1 VAL 14 -16.761 1.702 -8.191 816 1HG2 VAL 14 1HG2 VAL 14 -17.251 1.941 -11.612 817 2HG2 VAL 14 2HG2 VAL 14 -16.446 2.487 -10.141 818 3HG2 VAL 14 3HG2 VAL 14 -16.057 0.909 -10.825 819 H GLU 15 H GLU 15 -20.631 -0.252 -11.004 820 HA GLU 15 HA GLU 15 -21.896 -0.874 -8.548 821 1HB GLU 15 1HB GLU 15 -22.899 -0.720 -11.386 822 2HB GLU 15 2HB GLU 15 -23.954 -1.125 -10.039 823 1HG GLU 15 1HG GLU 15 -23.518 1.004 -8.998 824 2HG GLU 15 2HG GLU 15 -22.343 1.408 -10.249 825 H GLU 16 H GLU 16 -21.087 -2.773 -11.404 826 HA GLU 16 HA GLU 16 -22.520 -5.100 -10.700 827 1HB GLU 16 1HB GLU 16 -21.039 -4.288 -12.873 828 2HB GLU 16 2HB GLU 16 -20.037 -5.559 -12.187 829 1HG GLU 16 1HG GLU 16 -21.486 -7.191 -12.738 830 2HG GLU 16 2HG GLU 16 -22.902 -6.183 -12.446 831 H THR 17 H THR 17 -19.333 -3.916 -9.856 832 HA THR 17 HA THR 17 -18.514 -6.385 -8.613 833 HB THR 17 HB THR 17 -17.266 -3.632 -8.512 834 HG1 THR 17 HG1 THR 17 -16.186 -4.250 -10.254 835 1HG2 THR 17 1HG2 THR 17 -16.376 -6.294 -7.437 836 2HG2 THR 17 2HG2 THR 17 -16.455 -4.740 -6.606 837 3HG2 THR 17 3HG2 THR 17 -15.222 -5.023 -7.834 838 H LEU 18 H LEU 18 -20.145 -3.484 -7.659 839 HA LEU 18 HA LEU 18 -19.643 -3.719 -4.855 840 1HB LEU 18 1HB LEU 18 -21.095 -1.948 -6.633 841 2HB LEU 18 2HB LEU 18 -21.993 -2.276 -5.153 842 HG LEU 18 HG LEU 18 -19.657 -1.656 -4.050 843 1HD1 LEU 18 1HD1 LEU 18 -18.634 0.218 -5.288 844 2HD1 LEU 18 2HD1 LEU 18 -19.657 -0.168 -6.671 845 3HD1 LEU 18 3HD1 LEU 18 -18.455 -1.331 -6.113 846 1HD2 LEU 18 1HD2 LEU 18 -21.700 -0.541 -3.501 847 2HD2 LEU 18 2HD2 LEU 18 -21.742 0.268 -5.068 848 3HD2 LEU 18 3HD2 LEU 18 -20.497 0.689 -3.891 849 H LYS 19 H LYS 19 -22.321 -4.613 -6.994 850 HA LYS 19 HA LYS 19 -24.120 -5.502 -5.055 851 1HB LYS 19 1HB LYS 19 -23.718 -6.564 -7.858 852 2HB LYS 19 2HB LYS 19 -25.142 -6.829 -6.861 853 1HG LYS 19 1HG LYS 19 -24.373 -4.016 -7.284 854 2HG LYS 19 2HG LYS 19 -24.949 -4.891 -8.705 855 1HD LYS 19 1HD LYS 19 -26.501 -5.161 -6.186 856 2HD LYS 19 2HD LYS 19 -26.605 -3.629 -7.056 857 1HE LYS 19 1HE LYS 19 -27.472 -4.664 -8.983 858 2HE LYS 19 2HE LYS 19 -27.003 -6.271 -8.430 859 1HZ LYS 19 1HZ LYS 19 -29.367 -5.949 -8.181 860 2HZ LYS 19 2HZ LYS 19 -29.123 -4.564 -7.241 861 3HZ LYS 19 3HZ LYS 19 -28.651 -6.078 -6.653 862 H ARG 20 H ARG 20 -21.502 -7.218 -6.708 863 HA ARG 20 HA ARG 20 -22.063 -9.736 -5.484 864 1HB ARG 20 1HB ARG 20 -20.782 -9.301 -7.661 865 2HB ARG 20 2HB ARG 20 -19.408 -8.906 -6.638 866 1HG ARG 20 1HG ARG 20 -18.928 -11.082 -6.878 867 2HG ARG 20 2HG ARG 20 -20.120 -11.288 -5.593 868 1HD ARG 20 1HD ARG 20 -21.189 -11.161 -8.338 869 2HD ARG 20 2HD ARG 20 -20.214 -12.580 -7.959 870 HE ARG 20 HE ARG 20 -22.079 -12.179 -5.901 871 1HH1 ARG 20 1HH1 ARG 20 -21.949 -13.120 -9.250 872 2HH1 ARG 20 2HH1 ARG 20 -23.371 -14.105 -9.164 873 1HH2 ARG 20 1HH2 ARG 20 -23.953 -13.473 -5.774 874 2HH2 ARG 20 2HH2 ARG 20 -24.511 -14.305 -7.186 875 H LEU 21 H LEU 21 -20.016 -6.996 -4.712 876 HA LEU 21 HA LEU 21 -18.491 -8.273 -2.688 877 1HB LEU 21 1HB LEU 21 -18.854 -5.570 -3.730 878 2HB LEU 21 2HB LEU 21 -18.524 -5.616 -2.000 879 HG LEU 21 HG LEU 21 -16.429 -6.736 -2.374 880 1HD1 LEU 21 1HD1 LEU 21 -16.198 -8.080 -4.122 881 2HD1 LEU 21 2HD1 LEU 21 -16.052 -6.651 -5.144 882 3HD1 LEU 21 3HD1 LEU 21 -17.629 -7.401 -4.898 883 1HD2 LEU 21 1HD2 LEU 21 -16.254 -4.377 -2.498 884 2HD2 LEU 21 2HD2 LEU 21 -16.894 -4.345 -4.142 885 3HD2 LEU 21 3HD2 LEU 21 -15.294 -5.021 -3.830 886 H GLN 22 H GLN 22 -21.278 -6.059 -2.522 887 HA GLN 22 HA GLN 22 -21.575 -6.218 0.282 888 1HB GLN 22 1HB GLN 22 -22.775 -4.800 -1.816 889 2HB GLN 22 2HB GLN 22 -24.079 -5.719 -1.077 890 1HG GLN 22 1HG GLN 22 -24.166 -4.342 0.651 891 2HG GLN 22 2HG GLN 22 -22.435 -4.505 0.942 892 1HE2 GLN 22 1HE2 GLN 22 -21.154 -3.335 -0.942 893 2HE2 GLN 22 2HE2 GLN 22 -21.638 -1.696 -1.194 894 H SER 23 H SER 23 -22.301 -8.424 -2.193 895 HA SER 23 HA SER 23 -24.441 -9.760 -0.768 896 1HB SER 23 1HB SER 23 -23.224 -9.932 -3.441 897 2HB SER 23 2HB SER 23 -23.708 -11.487 -2.765 898 HG SER 23 HG SER 23 -25.446 -10.593 -3.864 899 H GLN 24 H GLN 24 -21.009 -9.944 -1.029 900 HA GLN 24 HA GLN 24 -20.942 -12.605 0.187 901 1HB GLN 24 1HB GLN 24 -18.546 -12.562 -0.267 902 2HB GLN 24 2HB GLN 24 -19.457 -12.197 -1.726 903 1HG GLN 24 1HG GLN 24 -18.900 -9.912 -1.625 904 2HG GLN 24 2HG GLN 24 -18.304 -10.053 0.028 905 1HE2 GLN 24 1HE2 GLN 24 -16.721 -8.860 -1.770 906 2HE2 GLN 24 2HE2 GLN 24 -15.386 -9.874 -2.189 907 H LYS 25 H LYS 25 -19.746 -13.009 2.108 908 HA LYS 25 HA LYS 25 -20.025 -10.910 4.061 909 1HB LYS 25 1HB LYS 25 -20.163 -13.655 4.159 910 2HB LYS 25 2HB LYS 25 -18.600 -13.331 4.899 911 1HG LYS 25 1HG LYS 25 -19.932 -11.585 6.297 912 2HG LYS 25 2HG LYS 25 -21.328 -12.553 5.816 913 1HD LYS 25 1HD LYS 25 -20.460 -14.492 6.861 914 2HD LYS 25 2HD LYS 25 -18.868 -13.757 7.064 915 1HE LYS 25 1HE LYS 25 -21.304 -12.574 8.353 916 2HE LYS 25 2HE LYS 25 -20.429 -13.905 9.109 917 1HZ LYS 25 1HZ LYS 25 -18.784 -12.558 9.729 918 2HZ LYS 25 2HZ LYS 25 -19.847 -11.282 9.409 919 3HZ LYS 25 3HZ LYS 25 -18.724 -11.761 8.238 920 H GLY 26 H GLY 26 -18.464 -9.669 4.938 921 1HA GLY 26 1HA GLY 26 -16.058 -9.660 5.661 922 2HA GLY 26 2HA GLY 26 -15.700 -10.157 4.014 923 H VAL 27 H VAL 27 -17.559 -8.459 2.697 924 HA VAL 27 HA VAL 27 -16.004 -6.118 2.455 925 HB VAL 27 HB VAL 27 -18.824 -6.632 1.500 926 1HG1 VAL 27 1HG1 VAL 27 -17.200 -4.262 1.450 927 2HG1 VAL 27 2HG1 VAL 27 -17.518 -4.823 -0.192 928 3HG1 VAL 27 3HG1 VAL 27 -18.860 -4.492 0.903 929 1HG2 VAL 27 1HG2 VAL 27 -17.167 -8.230 0.639 930 2HG2 VAL 27 2HG2 VAL 27 -17.796 -7.182 -0.633 931 3HG2 VAL 27 3HG2 VAL 27 -16.194 -6.886 0.042 932 H GLN 28 H GLN 28 -16.032 -4.266 3.548 933 HA GLN 28 HA GLN 28 -18.145 -3.855 5.535 934 1HB GLN 28 1HB GLN 28 -15.310 -3.374 5.471 935 2HB GLN 28 2HB GLN 28 -16.159 -1.871 5.804 936 1HG GLN 28 1HG GLN 28 -17.197 -2.779 7.728 937 2HG GLN 28 2HG GLN 28 -16.675 -4.412 7.318 938 1HE2 GLN 28 1HE2 GLN 28 -14.683 -5.091 7.911 939 2HE2 GLN 28 2HE2 GLN 28 -13.569 -4.142 8.829 940 H GLY 29 H GLY 29 -16.786 -2.493 2.634 941 1HA GLY 29 1HA GLY 29 -18.985 -1.020 1.895 942 2HA GLY 29 2HA GLY 29 -18.026 0.074 2.880 943 H ILE 30 H ILE 30 -18.685 0.254 0.044 944 HA ILE 30 HA ILE 30 -15.943 0.242 -1.036 945 HB ILE 30 HB ILE 30 -18.428 -0.124 -2.705 946 1HG1 ILE 30 1HG1 ILE 30 -17.097 -2.514 -2.820 947 2HG1 ILE 30 2HG1 ILE 30 -16.869 -2.063 -1.134 948 1HG2 ILE 30 1HG2 ILE 30 -16.931 -0.688 -4.473 949 2HG2 ILE 30 2HG2 ILE 30 -16.368 0.824 -3.762 950 3HG2 ILE 30 3HG2 ILE 30 -15.548 -0.689 -3.378 951 1HD1 ILE 30 1HD1 ILE 30 -19.052 -3.347 -2.203 952 2HD1 ILE 30 2HD1 ILE 30 -18.970 -2.563 -0.625 953 3HD1 ILE 30 3HD1 ILE 30 -19.603 -1.683 -2.015 954 H ILE 31 H ILE 31 -15.209 2.141 -1.744 955 HA ILE 31 HA ILE 31 -17.154 4.327 -2.103 956 HB ILE 31 HB ILE 31 -14.275 4.519 -1.209 957 1HG1 ILE 31 1HG1 ILE 31 -16.625 5.391 0.425 958 2HG1 ILE 31 2HG1 ILE 31 -16.216 3.680 0.368 959 1HG2 ILE 31 1HG2 ILE 31 -14.694 6.468 -2.438 960 2HG2 ILE 31 2HG2 ILE 31 -16.344 6.600 -1.832 961 3HG2 ILE 31 3HG2 ILE 31 -14.983 6.931 -0.761 962 1HD1 ILE 31 1HD1 ILE 31 -14.805 5.930 1.648 963 2HD1 ILE 31 2HD1 ILE 31 -14.976 4.251 2.160 964 3HD1 ILE 31 3HD1 ILE 31 -13.802 4.678 0.915 965 H VAL 32 H VAL 32 -16.934 5.706 -3.846 966 HA VAL 32 HA VAL 32 -14.842 5.064 -5.809 967 HB VAL 32 HB VAL 32 -17.664 5.641 -6.673 968 1HG1 VAL 32 1HG1 VAL 32 -16.971 5.073 -8.784 969 2HG1 VAL 32 2HG1 VAL 32 -15.487 5.775 -8.138 970 3HG1 VAL 32 3HG1 VAL 32 -15.682 4.022 -8.198 971 1HG2 VAL 32 1HG2 VAL 32 -17.787 3.650 -5.299 972 2HG2 VAL 32 2HG2 VAL 32 -17.962 3.215 -6.999 973 3HG2 VAL 32 3HG2 VAL 32 -16.432 2.933 -6.170 974 H VAL 33 H VAL 33 -13.687 6.857 -6.048 975 HA VAL 33 HA VAL 33 -15.103 9.443 -6.119 976 HB VAL 33 HB VAL 33 -12.191 9.138 -5.428 977 1HG1 VAL 33 1HG1 VAL 33 -14.243 11.309 -5.071 978 2HG1 VAL 33 2HG1 VAL 33 -12.673 11.325 -4.267 979 3HG1 VAL 33 3HG1 VAL 33 -12.763 11.358 -6.028 980 1HG2 VAL 33 1HG2 VAL 33 -14.570 9.003 -3.589 981 2HG2 VAL 33 2HG2 VAL 33 -13.273 7.823 -3.773 982 3HG2 VAL 33 3HG2 VAL 33 -12.941 9.390 -3.035 983 H ASN 34 H ASN 34 -14.175 11.087 -7.514 984 HA ASN 34 HA ASN 34 -13.349 9.957 -10.045 985 1HB ASN 34 1HB ASN 34 -13.855 12.844 -9.288 986 2HB ASN 34 2HB ASN 34 -13.665 12.219 -10.924 987 1HD2 ASN 34 1HD2 ASN 34 -15.892 13.460 -9.132 988 2HD2 ASN 34 2HD2 ASN 34 -17.270 12.496 -9.531 989 H THR 35 H THR 35 -11.779 11.819 -11.196 990 HA THR 35 HA THR 35 -9.225 11.279 -10.006 991 HB THR 35 HB THR 35 -9.079 13.244 -12.112 992 HG1 THR 35 HG1 THR 35 -10.218 12.210 -13.693 993 1HG2 THR 35 1HG2 THR 35 -7.702 11.575 -13.170 994 2HG2 THR 35 2HG2 THR 35 -8.351 10.314 -12.122 995 3HG2 THR 35 3HG2 THR 35 -7.340 11.589 -11.445 996 H GLU 36 H GLU 36 -11.485 13.867 -9.897 997 HA GLU 36 HA GLU 36 -9.551 15.871 -9.121 998 1HB GLU 36 1HB GLU 36 -12.473 15.790 -9.624 999 2HB GLU 36 2HB GLU 36 -11.906 17.005 -8.487 1000 1HG GLU 36 1HG GLU 36 -10.151 17.233 -10.600 1001 2HG GLU 36 2HG GLU 36 -11.702 16.921 -11.377 1002 H GLY 37 H GLY 37 -12.159 14.041 -7.542 1003 1HA GLY 37 1HA GLY 37 -11.168 13.298 -5.228 1004 2HA GLY 37 2HA GLY 37 -11.262 15.028 -4.934 1005 H ILE 38 H ILE 38 -13.755 14.783 -6.834 1006 HA ILE 38 HA ILE 38 -15.647 14.661 -4.675 1007 HB ILE 38 HB ILE 38 -16.391 14.776 -7.583 1008 1HG1 ILE 38 1HG1 ILE 38 -16.296 17.400 -6.784 1009 2HG1 ILE 38 2HG1 ILE 38 -14.862 16.733 -6.011 1010 1HG2 ILE 38 1HG2 ILE 38 -18.206 14.538 -5.997 1011 2HG2 ILE 38 2HG2 ILE 38 -17.619 15.925 -5.081 1012 3HG2 ILE 38 3HG2 ILE 38 -18.241 16.147 -6.716 1013 1HD1 ILE 38 1HD1 ILE 38 -15.448 17.182 -8.861 1014 2HD1 ILE 38 2HD1 ILE 38 -13.924 17.282 -7.979 1015 3HD1 ILE 38 3HD1 ILE 38 -14.560 15.711 -8.465 1016 HA PRO 39 HA PRO 39 -16.512 10.331 -5.024 1017 1HB PRO 39 1HB PRO 39 -18.729 10.310 -3.457 1018 2HB PRO 39 2HB PRO 39 -17.092 10.435 -2.803 1019 1HG PRO 39 1HG PRO 39 -19.106 12.595 -3.295 1020 2HG PRO 39 2HG PRO 39 -18.038 12.358 -1.899 1021 1HD PRO 39 1HD PRO 39 -17.493 14.138 -3.865 1022 2HD PRO 39 2HD PRO 39 -16.220 13.279 -2.975 1023 H ILE 40 H ILE 40 -17.961 8.961 -6.069 1024 HA ILE 40 HA ILE 40 -20.138 10.298 -7.542 1025 HB ILE 40 HB ILE 40 -19.697 8.335 -9.222 1026 1HG1 ILE 40 1HG1 ILE 40 -16.974 8.679 -7.945 1027 2HG1 ILE 40 2HG1 ILE 40 -17.985 7.244 -7.810 1028 1HG2 ILE 40 1HG2 ILE 40 -17.791 10.666 -9.128 1029 2HG2 ILE 40 2HG2 ILE 40 -18.350 9.795 -10.555 1030 3HG2 ILE 40 3HG2 ILE 40 -19.477 10.786 -9.629 1031 1HD1 ILE 40 1HD1 ILE 40 -17.723 6.735 -10.100 1032 2HD1 ILE 40 2HD1 ILE 40 -17.004 8.310 -10.438 1033 3HD1 ILE 40 3HD1 ILE 40 -16.118 7.124 -9.480 1034 H LYS 41 H LYS 41 -19.054 7.430 -5.850 1035 HA LYS 41 HA LYS 41 -21.762 6.718 -5.208 1036 1HB LYS 41 1HB LYS 41 -20.237 5.233 -7.276 1037 2HB LYS 41 2HB LYS 41 -21.115 4.266 -6.098 1038 1HG LYS 41 1HG LYS 41 -23.039 6.010 -6.762 1039 2HG LYS 41 2HG LYS 41 -22.121 5.987 -8.270 1040 1HD LYS 41 1HD LYS 41 -23.100 4.067 -8.812 1041 2HD LYS 41 2HD LYS 41 -22.364 3.309 -7.398 1042 1HE LYS 41 1HE LYS 41 -24.724 2.966 -7.270 1043 2HE LYS 41 2HE LYS 41 -24.283 4.152 -6.042 1044 1HZ LYS 41 1HZ LYS 41 -25.026 5.259 -8.612 1045 2HZ LYS 41 2HZ LYS 41 -25.455 5.756 -7.053 1046 3HZ LYS 41 3HZ LYS 41 -26.279 4.475 -7.788 1047 H SER 42 H SER 42 -21.846 5.724 -3.277 1048 HA SER 42 HA SER 42 -19.798 4.010 -2.287 1049 1HB SER 42 1HB SER 42 -18.796 5.345 -0.629 1050 2HB SER 42 2HB SER 42 -18.843 6.396 -2.044 1051 HG SER 42 HG SER 42 -20.283 6.538 0.335 1052 H THR 43 H THR 43 -20.799 2.596 -1.028 1053 HA THR 43 HA THR 43 -23.479 3.060 -0.123 1054 HB THR 43 HB THR 43 -23.492 0.800 0.624 1055 HG1 THR 43 HG1 THR 43 -20.728 1.186 0.778 1056 1HG2 THR 43 1HG2 THR 43 -22.838 1.485 -1.966 1057 2HG2 THR 43 2HG2 THR 43 -23.391 -0.101 -1.426 1058 3HG2 THR 43 3HG2 THR 43 -21.665 0.228 -1.576 1059 H MET 44 H MET 44 -20.452 3.770 1.148 1060 HA MET 44 HA MET 44 -20.809 3.265 3.889 1061 1HB MET 44 1HB MET 44 -19.212 5.489 2.608 1062 2HB MET 44 2HB MET 44 -19.014 4.878 4.245 1063 1HG MET 44 1HG MET 44 -18.800 2.840 2.156 1064 2HG MET 44 2HG MET 44 -17.560 4.090 2.096 1065 1HE MET 44 1HE MET 44 -19.528 1.919 4.671 1066 2HE MET 44 2HE MET 44 -18.374 1.784 5.998 1067 3HE MET 44 3HE MET 44 -19.102 3.345 5.617 1068 H ASP 45 H ASP 45 -20.514 5.542 5.297 1069 HA ASP 45 HA ASP 45 -23.181 6.614 5.277 1070 1HB ASP 45 1HB ASP 45 -21.083 6.348 7.172 1071 2HB ASP 45 2HB ASP 45 -21.463 8.063 7.049 1072 H ASN 46 H ASN 46 -23.607 8.958 5.372 1073 HA ASN 46 HA ASN 46 -22.651 10.271 3.087 1074 1HB ASN 46 1HB ASN 46 -24.660 10.704 5.013 1075 2HB ASN 46 2HB ASN 46 -23.661 12.154 5.025 1076 1HD2 ASN 46 1HD2 ASN 46 -22.882 12.271 2.390 1077 2HD2 ASN 46 2HD2 ASN 46 -24.264 12.572 1.399 1078 HA PRO 47 HA PRO 47 -20.031 13.044 6.058 1079 1HB PRO 47 1HB PRO 47 -19.773 12.209 8.628 1080 2HB PRO 47 2HB PRO 47 -21.077 13.274 8.090 1081 1HG PRO 47 1HG PRO 47 -21.116 10.317 8.553 1082 2HG PRO 47 2HG PRO 47 -22.323 11.536 9.002 1083 1HD PRO 47 1HD PRO 47 -22.599 9.944 6.829 1084 2HD PRO 47 2HD PRO 47 -23.227 11.603 6.883 1085 H THR 48 H THR 48 -19.999 9.565 6.396 1086 HA THR 48 HA THR 48 -17.205 9.379 7.029 1087 HB THR 48 HB THR 48 -19.087 7.230 6.035 1088 HG1 THR 48 HG1 THR 48 -19.614 8.266 8.098 1089 1HG2 THR 48 1HG2 THR 48 -16.709 6.678 5.721 1090 2HG2 THR 48 2HG2 THR 48 -17.459 5.663 6.953 1091 3HG2 THR 48 3HG2 THR 48 -16.417 7.004 7.429 1092 H THR 49 H THR 49 -19.158 9.272 4.120 1093 HA THR 49 HA THR 49 -17.101 8.293 2.404 1094 HB THR 49 HB THR 49 -19.642 9.796 1.746 1095 HG1 THR 49 HG1 THR 49 -20.524 7.901 2.023 1096 1HG2 THR 49 1HG2 THR 49 -19.322 8.962 -0.539 1097 2HG2 THR 49 2HG2 THR 49 -17.766 8.276 -0.070 1098 3HG2 THR 49 3HG2 THR 49 -18.001 10.023 -0.051 1099 H THR 50 H THR 50 -18.376 11.525 3.124 1100 HA THR 50 HA THR 50 -16.887 12.995 1.293 1101 HB THR 50 HB THR 50 -17.176 14.328 3.886 1102 HG1 THR 50 HG1 THR 50 -19.241 13.913 4.231 1103 1HG2 THR 50 1HG2 THR 50 -18.064 14.801 1.054 1104 2HG2 THR 50 2HG2 THR 50 -16.886 15.704 2.006 1105 3HG2 THR 50 3HG2 THR 50 -18.605 15.831 2.378 1106 H GLN 51 H GLN 51 -16.058 12.030 4.607 1107 HA GLN 51 HA GLN 51 -13.529 13.331 4.617 1108 1HB GLN 51 1HB GLN 51 -14.591 12.849 6.715 1109 2HB GLN 51 2HB GLN 51 -14.680 11.134 6.337 1110 1HG GLN 51 1HG GLN 51 -11.968 12.205 6.273 1111 2HG GLN 51 2HG GLN 51 -12.750 12.339 7.847 1112 1HE2 GLN 51 1HE2 GLN 51 -11.305 10.254 5.557 1113 2HE2 GLN 51 2HE2 GLN 51 -11.460 8.786 6.455 1114 H TYR 52 H TYR 52 -14.480 9.922 4.233 1115 HA TYR 52 HA TYR 52 -11.954 8.831 3.886 1116 1HB TYR 52 1HB TYR 52 -14.703 8.046 3.042 1117 2HB TYR 52 2HB TYR 52 -13.345 7.190 2.319 1118 HD1 TYR 52 HD1 TYR 52 -14.030 8.446 5.776 1119 HD2 TYR 52 HD2 TYR 52 -13.102 5.116 3.295 1120 HE1 TYR 52 HE1 TYR 52 -13.883 7.010 7.768 1121 HE2 TYR 52 HE2 TYR 52 -12.953 3.671 5.280 1122 HH TYR 52 HH TYR 52 -14.169 4.447 8.215 1123 H ALA 53 H ALA 53 -14.210 9.945 1.362 1124 HA ALA 53 HA ALA 53 -12.522 9.495 -0.824 1125 1HB ALA 53 1HB ALA 53 -14.832 9.860 -1.225 1126 2HB ALA 53 2HB ALA 53 -14.787 11.439 -0.439 1127 3HB ALA 53 3HB ALA 53 -13.966 11.198 -1.981 1128 H SER 54 H SER 54 -12.401 11.884 1.620 1129 HA SER 54 HA SER 54 -11.018 13.886 0.106 1130 1HB SER 54 1HB SER 54 -12.390 14.095 2.346 1131 2HB SER 54 2HB SER 54 -10.835 13.726 3.091 1132 HG SER 54 HG SER 54 -11.487 15.898 1.395 1133 H LEU 55 H LEU 55 -10.037 11.500 2.556 1134 HA LEU 55 HA LEU 55 -7.235 12.088 2.128 1135 1HB LEU 55 1HB LEU 55 -6.812 10.857 4.001 1136 2HB LEU 55 2HB LEU 55 -8.470 11.362 4.321 1137 HG LEU 55 HG LEU 55 -8.989 9.027 3.152 1138 1HD1 LEU 55 1HD1 LEU 55 -7.292 7.610 2.972 1139 2HD1 LEU 55 2HD1 LEU 55 -6.790 7.912 4.636 1140 3HD1 LEU 55 3HD1 LEU 55 -6.206 8.952 3.336 1141 1HD2 LEU 55 1HD2 LEU 55 -8.095 8.723 5.945 1142 2HD2 LEU 55 2HD2 LEU 55 -9.658 8.375 5.206 1143 3HD2 LEU 55 3HD2 LEU 55 -9.234 10.033 5.634 1144 H MET 56 H MET 56 -9.536 10.190 0.619 1145 HA MET 56 HA MET 56 -8.042 7.870 -0.003 1146 1HB MET 56 1HB MET 56 -10.615 8.933 -0.619 1147 2HB MET 56 2HB MET 56 -9.843 8.463 -2.128 1148 1HG MET 56 1HG MET 56 -11.180 6.654 -1.211 1149 2HG MET 56 2HG MET 56 -9.471 6.226 -1.265 1150 1HE MET 56 1HE MET 56 -8.198 5.842 2.001 1151 2HE MET 56 2HE MET 56 -9.012 4.458 1.271 1152 3HE MET 56 3HE MET 56 -8.149 5.612 0.252 1153 H HIS 57 H HIS 57 -8.968 10.457 -2.275 1154 HA HIS 57 HA HIS 57 -7.113 9.828 -4.242 1155 1HB HIS 57 1HB HIS 57 -8.925 11.310 -4.755 1156 2HB HIS 57 2HB HIS 57 -8.400 12.468 -3.537 1157 HD1 HIS 57 HD1 HIS 57 -8.036 14.418 -5.114 1158 HD2 HIS 57 HD2 HIS 57 -5.922 11.015 -6.213 1159 HE1 HIS 57 HE1 HIS 57 -6.466 15.160 -6.932 1160 H SER 58 H SER 58 -6.767 11.811 -1.366 1161 HA SER 58 HA SER 58 -4.282 12.984 -2.036 1162 1HB SER 58 1HB SER 58 -6.088 13.040 0.167 1163 2HB SER 58 2HB SER 58 -4.481 12.674 0.795 1164 HG SER 58 HG SER 58 -4.152 14.735 0.591 1165 H PHE 59 H PHE 59 -5.170 9.856 -0.905 1166 HA PHE 59 HA PHE 59 -2.787 9.081 0.366 1167 1HB PHE 59 1HB PHE 59 -5.027 7.864 0.361 1168 2HB PHE 59 2HB PHE 59 -4.568 7.232 -1.217 1169 HD1 PHE 59 HD1 PHE 59 -4.098 4.994 -0.980 1170 HD2 PHE 59 HD2 PHE 59 -2.614 7.737 1.916 1171 HE1 PHE 59 HE1 PHE 59 -2.862 3.167 0.112 1172 HE2 PHE 59 HE2 PHE 59 -1.375 5.916 3.012 1173 HZ PHE 59 HZ PHE 59 -1.498 3.627 2.110 1174 H ILE 60 H ILE 60 -3.879 8.390 -2.960 1175 HA ILE 60 HA ILE 60 -1.401 7.306 -3.794 1176 HB ILE 60 HB ILE 60 -3.657 8.457 -5.438 1177 1HG1 ILE 60 1HG1 ILE 60 -3.417 5.641 -5.680 1178 2HG1 ILE 60 2HG1 ILE 60 -3.360 6.019 -3.962 1179 1HG2 ILE 60 1HG2 ILE 60 -1.803 8.498 -6.865 1180 2HG2 ILE 60 2HG2 ILE 60 -1.160 6.989 -6.219 1181 3HG2 ILE 60 3HG2 ILE 60 -2.603 6.970 -7.233 1182 1HD1 ILE 60 1HD1 ILE 60 -5.620 5.736 -5.509 1183 2HD1 ILE 60 2HD1 ILE 60 -5.533 6.454 -3.900 1184 3HD1 ILE 60 3HD1 ILE 60 -5.449 7.482 -5.331 1185 H LEU 61 H LEU 61 -2.739 10.546 -3.813 1186 HA LEU 61 HA LEU 61 -0.940 11.768 -5.575 1187 1HB LEU 61 1HB LEU 61 -3.049 12.568 -3.941 1188 2HB LEU 61 2HB LEU 61 -1.660 13.489 -3.367 1189 HG LEU 61 HG LEU 61 -1.328 14.416 -5.590 1190 1HD1 LEU 61 1HD1 LEU 61 -1.979 13.044 -7.251 1191 2HD1 LEU 61 2HD1 LEU 61 -3.505 13.914 -7.097 1192 3HD1 LEU 61 3HD1 LEU 61 -3.299 12.351 -6.308 1193 1HD2 LEU 61 1HD2 LEU 61 -2.707 15.763 -4.266 1194 2HD2 LEU 61 2HD2 LEU 61 -4.066 14.644 -4.381 1195 3HD2 LEU 61 3HD2 LEU 61 -3.589 15.600 -5.785 1196 H LYS 62 H LYS 62 -0.723 11.126 -2.111 1197 HA LYS 62 HA LYS 62 1.777 12.504 -1.803 1198 1HB LYS 62 1HB LYS 62 -0.185 11.346 -0.091 1199 2HB LYS 62 2HB LYS 62 1.369 10.620 0.298 1200 1HG LYS 62 1HG LYS 62 0.961 12.566 1.680 1201 2HG LYS 62 2HG LYS 62 2.333 12.846 0.605 1202 1HD LYS 62 1HD LYS 62 1.332 14.703 -0.100 1203 2HD LYS 62 2HD LYS 62 0.056 13.702 -0.799 1204 1HE LYS 62 1HE LYS 62 0.125 14.832 1.998 1205 2HE LYS 62 2HE LYS 62 -0.892 15.388 0.670 1206 1HZ LYS 62 1HZ LYS 62 -1.025 12.768 2.054 1207 2HZ LYS 62 2HZ LYS 62 -1.882 13.122 0.640 1208 3HZ LYS 62 3HZ LYS 62 -2.195 13.991 2.058 1209 H ALA 63 H ALA 63 0.821 9.070 -1.741 1210 HA ALA 63 HA ALA 63 3.353 7.960 -1.488 1211 1HB ALA 63 1HB ALA 63 1.072 6.814 -1.393 1212 2HB ALA 63 2HB ALA 63 1.201 6.688 -3.147 1213 3HB ALA 63 3HB ALA 63 2.405 5.915 -2.117 1214 H ARG 64 H ARG 64 1.525 8.563 -4.490 1215 HA ARG 64 HA ARG 64 3.381 7.679 -6.324 1216 1HB ARG 64 1HB ARG 64 1.027 8.531 -6.758 1217 2HB ARG 64 2HB ARG 64 1.705 10.154 -6.727 1218 1HG ARG 64 1HG ARG 64 3.320 8.699 -8.486 1219 2HG ARG 64 2HG ARG 64 1.658 8.235 -8.859 1220 1HD ARG 64 1HD ARG 64 2.786 11.029 -8.757 1221 2HD ARG 64 2HD ARG 64 2.275 10.145 -10.194 1222 HE ARG 64 HE ARG 64 0.177 10.437 -8.271 1223 1HH1 ARG 64 1HH1 ARG 64 1.875 12.017 -10.867 1224 2HH1 ARG 64 2HH1 ARG 64 0.550 13.056 -11.275 1225 1HH2 ARG 64 1HH2 ARG 64 -1.575 11.800 -8.799 1226 2HH2 ARG 64 2HH2 ARG 64 -1.411 12.932 -10.098 1227 H SER 65 H SER 65 3.201 10.827 -4.724 1228 HA SER 65 HA SER 65 5.182 12.163 -6.151 1229 1HB SER 65 1HB SER 65 3.559 12.972 -4.244 1230 2HB SER 65 2HB SER 65 4.924 12.586 -3.195 1231 HG SER 65 HG SER 65 6.174 13.944 -4.718 1232 H THR 66 H THR 66 5.432 9.803 -3.582 1233 HA THR 66 HA THR 66 8.272 10.215 -3.221 1234 HB THR 66 HB THR 66 6.941 7.763 -2.180 1235 HG1 THR 66 HG1 THR 66 5.464 8.864 -1.156 1236 1HG2 THR 66 1HG2 THR 66 8.828 9.794 -0.980 1237 2HG2 THR 66 2HG2 THR 66 9.279 8.228 -1.653 1238 3HG2 THR 66 3HG2 THR 66 8.287 8.310 -0.198 1239 H VAL 67 H VAL 67 6.159 8.058 -4.980 1240 HA VAL 67 HA VAL 67 7.812 5.926 -5.538 1241 HB VAL 67 HB VAL 67 5.851 7.262 -7.406 1242 1HG1 VAL 67 1HG1 VAL 67 6.638 5.876 -8.961 1243 2HG1 VAL 67 2HG1 VAL 67 7.654 5.029 -7.793 1244 3HG1 VAL 67 3HG1 VAL 67 5.967 4.557 -8.003 1245 1HG2 VAL 67 1HG2 VAL 67 4.201 5.872 -6.543 1246 2HG2 VAL 67 2HG2 VAL 67 5.369 4.759 -5.833 1247 3HG2 VAL 67 3HG2 VAL 67 5.109 6.344 -5.107 1248 H ARG 68 H ARG 68 7.725 9.102 -7.083 1249 HA ARG 68 HA ARG 68 9.385 8.671 -9.243 1250 1HB ARG 68 1HB ARG 68 9.725 10.999 -9.324 1251 2HB ARG 68 2HB ARG 68 8.147 10.803 -8.573 1252 1HG ARG 68 1HG ARG 68 9.299 11.031 -6.348 1253 2HG ARG 68 2HG ARG 68 10.748 11.498 -7.241 1254 1HD ARG 68 1HD ARG 68 9.418 13.429 -6.438 1255 2HD ARG 68 2HD ARG 68 9.618 13.394 -8.189 1256 HE ARG 68 HE ARG 68 7.205 12.119 -7.405 1257 1HH1 ARG 68 1HH1 ARG 68 8.671 15.245 -7.847 1258 2HH1 ARG 68 2HH1 ARG 68 7.170 16.049 -8.165 1259 1HH2 ARG 68 1HH2 ARG 68 5.222 13.166 -7.821 1260 2HH2 ARG 68 2HH2 ARG 68 5.208 14.866 -8.149 1261 H ASP 69 H ASP 69 10.200 8.938 -5.864 1262 HA ASP 69 HA ASP 69 13.023 9.244 -6.298 1263 1HB ASP 69 1HB ASP 69 11.241 9.417 -4.087 1264 2HB ASP 69 2HB ASP 69 12.473 8.222 -3.689 1265 H ILE 70 H ILE 70 10.821 6.583 -5.636 1266 HA ILE 70 HA ILE 70 12.702 4.595 -5.053 1267 HB ILE 70 HB ILE 70 10.058 4.233 -6.468 1268 1HG1 ILE 70 1HG1 ILE 70 10.648 4.062 -3.508 1269 2HG1 ILE 70 2HG1 ILE 70 9.951 5.479 -4.286 1270 1HG2 ILE 70 1HG2 ILE 70 11.730 2.298 -4.869 1271 2HG2 ILE 70 2HG2 ILE 70 10.134 1.968 -5.542 1272 3HG2 ILE 70 3HG2 ILE 70 11.497 2.275 -6.617 1273 1HD1 ILE 70 1HD1 ILE 70 8.126 3.888 -5.109 1274 2HD1 ILE 70 2HD1 ILE 70 8.746 2.771 -3.892 1275 3HD1 ILE 70 3HD1 ILE 70 8.125 4.349 -3.407 1276 H ASP 71 H ASP 71 11.408 5.724 -8.142 1277 HA ASP 71 HA ASP 71 13.722 4.670 -9.515 1278 1HB ASP 71 1HB ASP 71 11.208 3.240 -9.524 1279 2HB ASP 71 2HB ASP 71 11.629 3.767 -11.151 1280 HA PRO 72 HA PRO 72 13.091 8.115 -12.153 1281 1HB PRO 72 1HB PRO 72 13.929 7.175 -14.559 1282 2HB PRO 72 2HB PRO 72 15.036 7.530 -13.227 1283 1HG PRO 72 1HG PRO 72 13.913 4.897 -14.107 1284 2HG PRO 72 2HG PRO 72 15.569 5.299 -13.614 1285 1HD PRO 72 1HD PRO 72 13.809 4.084 -11.953 1286 2HD PRO 72 2HD PRO 72 15.058 5.202 -11.368 1287 H GLN 73 H GLN 73 12.009 5.109 -13.747 1288 HA GLN 73 HA GLN 73 9.586 6.546 -14.601 1289 1HB GLN 73 1HB GLN 73 11.058 4.433 -16.184 1290 2HB GLN 73 2HB GLN 73 9.588 5.262 -16.679 1291 1HG GLN 73 1HG GLN 73 10.877 7.406 -16.591 1292 2HG GLN 73 2HG GLN 73 12.331 6.441 -16.344 1293 1HE2 GLN 73 1HE2 GLN 73 12.400 8.016 -18.441 1294 2HE2 GLN 73 2HE2 GLN 73 12.174 7.146 -19.917 1295 H ASN 74 H ASN 74 7.929 5.751 -13.495 1296 HA ASN 74 HA ASN 74 7.515 2.869 -13.435 1297 1HB ASN 74 1HB ASN 74 6.806 3.229 -10.925 1298 2HB ASN 74 2HB ASN 74 8.489 2.919 -11.341 1299 1HD2 ASN 74 1HD2 ASN 74 9.401 3.962 -9.641 1300 2HD2 ASN 74 2HD2 ASN 74 9.300 5.669 -9.396 1301 H ASP 75 H ASP 75 5.306 2.528 -12.110 1302 HA ASP 75 HA ASP 75 3.389 4.642 -12.480 1303 1HB ASP 75 1HB ASP 75 3.860 2.944 -14.663 1304 2HB ASP 75 2HB ASP 75 2.362 2.366 -13.938 1305 H LEU 76 H LEU 76 2.066 4.496 -10.804 1306 HA LEU 76 HA LEU 76 1.942 2.131 -9.194 1307 1HB LEU 76 1HB LEU 76 1.350 4.880 -8.891 1308 2HB LEU 76 2HB LEU 76 -0.125 3.984 -8.529 1309 HG LEU 76 HG LEU 76 1.126 4.429 -6.501 1310 1HD1 LEU 76 1HD1 LEU 76 0.024 2.073 -7.180 1311 2HD1 LEU 76 2HD1 LEU 76 0.718 2.407 -5.594 1312 3HD1 LEU 76 3HD1 LEU 76 1.666 1.548 -6.808 1313 1HD2 LEU 76 1HD2 LEU 76 3.358 2.704 -7.517 1314 2HD2 LEU 76 2HD2 LEU 76 3.339 3.794 -6.130 1315 3HD2 LEU 76 3HD2 LEU 76 3.360 4.450 -7.768 1316 H THR 77 H THR 77 0.610 0.471 -9.429 1317 HA THR 77 HA THR 77 -1.972 0.903 -10.777 1318 HB THR 77 HB THR 77 -0.341 -0.222 -12.298 1319 HG1 THR 77 HG1 THR 77 -2.010 -1.273 -13.079 1320 1HG2 THR 77 1HG2 THR 77 0.924 -1.482 -10.636 1321 2HG2 THR 77 2HG2 THR 77 0.241 -2.569 -11.846 1322 3HG2 THR 77 3HG2 THR 77 -0.507 -2.439 -10.254 1323 H PHE 78 H PHE 78 -0.972 0.553 -7.909 1324 HA PHE 78 HA PHE 78 -3.191 -0.806 -6.895 1325 1HB PHE 78 1HB PHE 78 -1.388 -2.632 -7.859 1326 2HB PHE 78 2HB PHE 78 -0.920 -2.520 -6.165 1327 HD1 PHE 78 HD1 PHE 78 -1.830 -4.129 -4.824 1328 HD2 PHE 78 HD2 PHE 78 -4.120 -2.645 -8.090 1329 HE1 PHE 78 HE1 PHE 78 -3.673 -5.641 -4.214 1330 HE2 PHE 78 HE2 PHE 78 -5.967 -4.153 -7.485 1331 HZ PHE 78 HZ PHE 78 -5.745 -5.653 -5.544 1332 H LEU 79 H LEU 79 -3.466 -0.255 -4.809 1333 HA LEU 79 HA LEU 79 -1.190 0.324 -3.109 1334 1HB LEU 79 1HB LEU 79 -1.891 2.408 -4.488 1335 2HB LEU 79 2HB LEU 79 -3.262 2.465 -3.383 1336 HG LEU 79 HG LEU 79 -1.713 2.688 -1.490 1337 1HD1 LEU 79 1HD1 LEU 79 0.669 3.185 -1.971 1338 2HD1 LEU 79 2HD1 LEU 79 0.398 2.687 -3.640 1339 3HD1 LEU 79 3HD1 LEU 79 0.208 1.521 -2.331 1340 1HD2 LEU 79 1HD2 LEU 79 -2.610 4.691 -2.533 1341 2HD2 LEU 79 2HD2 LEU 79 -1.285 4.699 -3.698 1342 3HD2 LEU 79 3HD2 LEU 79 -0.956 4.968 -1.986 1343 H ARG 80 H ARG 80 -1.783 -1.120 -1.581 1344 HA ARG 80 HA ARG 80 -4.406 -0.705 -0.306 1345 1HB ARG 80 1HB ARG 80 -4.229 -3.180 0.318 1346 2HB ARG 80 2HB ARG 80 -4.622 -2.799 -1.353 1347 1HG ARG 80 1HG ARG 80 -2.232 -3.124 -1.935 1348 2HG ARG 80 2HG ARG 80 -1.944 -3.645 -0.273 1349 1HD ARG 80 1HD ARG 80 -3.888 -4.940 -2.180 1350 2HD ARG 80 2HD ARG 80 -2.260 -5.528 -1.847 1351 HE ARG 80 HE ARG 80 -4.583 -5.789 -0.162 1352 1HH1 ARG 80 1HH1 ARG 80 -1.104 -5.800 -0.300 1353 2HH1 ARG 80 2HH1 ARG 80 -0.920 -6.744 1.141 1354 1HH2 ARG 80 1HH2 ARG 80 -4.353 -7.032 1.736 1355 2HH2 ARG 80 2HH2 ARG 80 -2.769 -7.445 2.298 1356 H ILE 81 H ILE 81 -4.499 -1.071 1.967 1357 HA ILE 81 HA ILE 81 -1.950 -1.334 3.371 1358 HB ILE 81 HB ILE 81 -2.657 0.598 4.880 1359 1HG1 ILE 81 1HG1 ILE 81 -4.056 1.800 2.562 1360 2HG1 ILE 81 2HG1 ILE 81 -4.952 0.577 3.456 1361 1HG2 ILE 81 1HG2 ILE 81 -1.238 1.978 3.761 1362 2HG2 ILE 81 2HG2 ILE 81 -0.926 0.490 2.868 1363 3HG2 ILE 81 3HG2 ILE 81 -2.021 1.703 2.205 1364 1HD1 ILE 81 1HD1 ILE 81 -4.256 1.964 5.533 1365 2HD1 ILE 81 2HD1 ILE 81 -3.984 3.248 4.354 1366 3HD1 ILE 81 3HD1 ILE 81 -5.582 2.517 4.510 1367 H ARG 82 H ARG 82 -2.573 -3.263 4.271 1368 HA ARG 82 HA ARG 82 -5.099 -3.794 5.395 1369 1HB ARG 82 1HB ARG 82 -3.259 -5.449 4.716 1370 2HB ARG 82 2HB ARG 82 -2.542 -5.109 6.285 1371 1HG ARG 82 1HG ARG 82 -5.245 -5.673 6.775 1372 2HG ARG 82 2HG ARG 82 -4.686 -6.880 5.616 1373 1HD ARG 82 1HD ARG 82 -3.237 -7.820 7.088 1374 2HD ARG 82 2HD ARG 82 -2.887 -6.288 7.886 1375 HE ARG 82 HE ARG 82 -5.441 -6.798 8.617 1376 1HH1 ARG 82 1HH1 ARG 82 -2.498 -8.654 8.737 1377 2HH1 ARG 82 2HH1 ARG 82 -2.965 -9.548 10.146 1378 1HH2 ARG 82 1HH2 ARG 82 -6.067 -7.969 10.472 1379 2HH2 ARG 82 2HH2 ARG 82 -4.996 -9.158 11.131 1380 H SER 83 H SER 83 -5.932 -2.608 6.992 1381 HA SER 83 HA SER 83 -4.202 -1.605 9.119 1382 1HB SER 83 1HB SER 83 -5.813 -0.056 8.058 1383 2HB SER 83 2HB SER 83 -7.140 -1.079 8.604 1384 HG SER 83 HG SER 83 -6.738 -0.515 10.676 1385 H LYS 84 H LYS 84 -5.296 -1.613 11.370 1386 HA LYS 84 HA LYS 84 -5.469 -4.286 12.236 1387 1HB LYS 84 1HB LYS 84 -6.227 -1.708 13.617 1388 2HB LYS 84 2HB LYS 84 -6.190 -3.274 14.417 1389 1HG LYS 84 1HG LYS 84 -3.754 -3.402 13.644 1390 2HG LYS 84 2HG LYS 84 -3.906 -1.672 13.325 1391 1HD LYS 84 1HD LYS 84 -3.024 -1.843 15.507 1392 2HD LYS 84 2HD LYS 84 -4.732 -1.450 15.715 1393 1HE LYS 84 1HE LYS 84 -5.225 -3.810 16.121 1394 2HE LYS 84 2HE LYS 84 -3.523 -4.209 15.896 1395 1HZ LYS 84 1HZ LYS 84 -4.860 -3.106 18.194 1396 2HZ LYS 84 2HZ LYS 84 -3.437 -2.286 17.787 1397 3HZ LYS 84 3HZ LYS 84 -3.396 -3.949 18.095 1398 H LYS 85 H LYS 85 -7.885 -1.970 11.264 1399 HA LYS 85 HA LYS 85 -10.078 -3.592 12.256 1400 1HB LYS 85 1HB LYS 85 -9.832 -0.923 10.934 1401 2HB LYS 85 2HB LYS 85 -11.377 -1.761 10.867 1402 1HG LYS 85 1HG LYS 85 -11.305 -0.200 12.725 1403 2HG LYS 85 2HG LYS 85 -11.438 -1.863 13.303 1404 1HD LYS 85 1HD LYS 85 -8.693 -0.834 12.998 1405 2HD LYS 85 2HD LYS 85 -9.660 -0.064 14.259 1406 1HE LYS 85 1HE LYS 85 -9.828 -2.997 14.177 1407 2HE LYS 85 2HE LYS 85 -8.236 -2.356 14.580 1408 1HZ LYS 85 1HZ LYS 85 -8.945 -1.613 16.557 1409 2HZ LYS 85 2HZ LYS 85 -10.197 -2.732 16.357 1410 3HZ LYS 85 3HZ LYS 85 -10.447 -1.105 15.966 1411 H ASN 86 H ASN 86 -8.706 -2.621 9.136 1412 HA ASN 86 HA ASN 86 -9.278 -5.039 7.858 1413 1HB ASN 86 1HB ASN 86 -11.051 -3.946 6.242 1414 2HB ASN 86 2HB ASN 86 -11.560 -4.700 7.750 1415 1HD2 ASN 86 1HD2 ASN 86 -10.884 -1.653 6.163 1416 2HD2 ASN 86 2HD2 ASN 86 -11.827 -0.672 7.228 1417 H GLU 87 H GLU 87 -8.889 -4.937 5.495 1418 HA GLU 87 HA GLU 87 -6.849 -2.937 4.938 1419 1HB GLU 87 1HB GLU 87 -6.317 -4.355 2.986 1420 2HB GLU 87 2HB GLU 87 -6.271 -5.249 4.499 1421 1HG GLU 87 1HG GLU 87 -8.187 -6.439 4.011 1422 2HG GLU 87 2HG GLU 87 -8.756 -5.244 2.847 1423 H ILE 88 H ILE 88 -6.924 -1.457 3.299 1424 HA ILE 88 HA ILE 88 -9.496 -1.223 1.876 1425 HB ILE 88 HB ILE 88 -7.666 1.069 2.581 1426 1HG1 ILE 88 1HG1 ILE 88 -10.184 0.154 3.988 1427 2HG1 ILE 88 2HG1 ILE 88 -8.550 0.027 4.629 1428 1HG2 ILE 88 1HG2 ILE 88 -9.663 2.426 2.059 1429 2HG2 ILE 88 2HG2 ILE 88 -9.081 1.503 0.675 1430 3HG2 ILE 88 3HG2 ILE 88 -10.502 0.956 1.564 1431 1HD1 ILE 88 1HD1 ILE 88 -10.106 2.537 4.080 1432 2HD1 ILE 88 2HD1 ILE 88 -9.602 1.899 5.644 1433 3HD1 ILE 88 3HD1 ILE 88 -8.397 2.511 4.511 1434 H MET 89 H MET 89 -9.013 -2.144 -0.059 1435 HA MET 89 HA MET 89 -6.531 -1.670 -1.415 1436 1HB MET 89 1HB MET 89 -9.084 -3.080 -2.130 1437 2HB MET 89 2HB MET 89 -7.843 -2.801 -3.344 1438 1HG MET 89 1HG MET 89 -6.342 -4.226 -2.336 1439 2HG MET 89 2HG MET 89 -7.114 -4.090 -0.758 1440 1HE MET 89 1HE MET 89 -9.227 -6.288 -4.208 1441 2HE MET 89 2HE MET 89 -9.524 -4.597 -3.802 1442 3HE MET 89 3HE MET 89 -7.951 -5.091 -4.431 1443 H VAL 90 H VAL 90 -6.031 -0.025 -2.702 1444 HA VAL 90 HA VAL 90 -8.139 1.384 -4.155 1445 HB VAL 90 HB VAL 90 -6.161 2.791 -2.355 1446 1HG1 VAL 90 1HG1 VAL 90 -6.451 4.023 -4.421 1447 2HG1 VAL 90 2HG1 VAL 90 -8.206 3.916 -4.267 1448 3HG1 VAL 90 3HG1 VAL 90 -7.273 4.858 -3.103 1449 1HG2 VAL 90 1HG2 VAL 90 -8.002 1.886 -1.094 1450 2HG2 VAL 90 2HG2 VAL 90 -8.209 3.632 -1.234 1451 3HG2 VAL 90 3HG2 VAL 90 -9.165 2.548 -2.243 1452 H ALA 91 H ALA 91 -7.530 1.983 -6.152 1453 HA ALA 91 HA ALA 91 -4.727 2.376 -6.799 1454 1HB ALA 91 1HB ALA 91 -6.109 0.465 -8.596 1455 2HB ALA 91 2HB ALA 91 -4.401 0.595 -8.173 1456 3HB ALA 91 3HB ALA 91 -5.536 -0.144 -7.043 1457 HA PRO 92 HA PRO 92 -6.349 5.303 -9.640 1458 1HB PRO 92 1HB PRO 92 -4.437 5.287 -11.567 1459 2HB PRO 92 2HB PRO 92 -4.186 6.003 -9.971 1460 1HG PRO 92 1HG PRO 92 -3.337 3.323 -10.998 1461 2HG PRO 92 2HG PRO 92 -2.427 4.483 -10.014 1462 1HD PRO 92 1HD PRO 92 -3.639 2.307 -8.952 1463 2HD PRO 92 2HD PRO 92 -3.465 3.833 -8.062 1464 H ASP 93 H ASP 93 -8.040 5.029 -10.941 1465 HA ASP 93 HA ASP 93 -8.028 2.792 -12.845 1466 1HB ASP 93 1HB ASP 93 -9.926 3.458 -11.019 1467 2HB ASP 93 2HB ASP 93 -10.526 4.314 -12.437 1468 H LYS 94 H LYS 94 -9.964 3.642 -14.603 1469 HA LYS 94 HA LYS 94 -8.573 5.016 -16.530 1470 1HB LYS 94 1HB LYS 94 -11.254 4.085 -16.170 1471 2HB LYS 94 2HB LYS 94 -11.309 5.699 -16.868 1472 1HG LYS 94 1HG LYS 94 -9.319 4.066 -18.172 1473 2HG LYS 94 2HG LYS 94 -10.910 3.303 -18.212 1474 1HD LYS 94 1HD LYS 94 -11.649 5.765 -18.880 1475 2HD LYS 94 2HD LYS 94 -9.979 5.839 -19.449 1476 1HE LYS 94 1HE LYS 94 -10.593 3.528 -20.539 1477 2HE LYS 94 2HE LYS 94 -12.240 4.139 -20.391 1478 1HZ LYS 94 1HZ LYS 94 -11.902 5.304 -22.225 1479 2HZ LYS 94 2HZ LYS 94 -10.292 4.794 -22.312 1480 3HZ LYS 94 3HZ LYS 94 -10.690 6.192 -21.446 1481 H ASP 95 H ASP 95 -11.004 6.386 -14.313 1482 HA ASP 95 HA ASP 95 -9.576 8.905 -14.286 1483 1HB ASP 95 1HB ASP 95 -11.808 8.525 -16.023 1484 2HB ASP 95 2HB ASP 95 -12.295 9.623 -14.735 1485 H TYR 96 H TYR 96 -10.624 6.648 -12.513 1486 HA TYR 96 HA TYR 96 -11.571 8.408 -10.385 1487 1HB TYR 96 1HB TYR 96 -13.280 6.608 -9.760 1488 2HB TYR 96 2HB TYR 96 -13.666 7.630 -11.140 1489 HD1 TYR 96 HD1 TYR 96 -12.940 4.257 -10.016 1490 HD2 TYR 96 HD2 TYR 96 -13.478 6.725 -13.439 1491 HE1 TYR 96 HE1 TYR 96 -13.244 2.251 -11.407 1492 HE2 TYR 96 HE2 TYR 96 -13.785 4.727 -14.839 1493 HH TYR 96 HH TYR 96 -14.487 1.774 -13.701 1494 H PHE 97 H PHE 97 -11.620 7.208 -8.251 1495 HA PHE 97 HA PHE 97 -9.394 5.279 -8.165 1496 1HB PHE 97 1HB PHE 97 -10.127 7.540 -6.325 1497 2HB PHE 97 2HB PHE 97 -9.154 6.190 -5.750 1498 HD1 PHE 97 HD1 PHE 97 -9.048 9.378 -7.168 1499 HD2 PHE 97 HD2 PHE 97 -7.099 5.597 -7.305 1500 HE1 PHE 97 HE1 PHE 97 -7.030 10.455 -8.076 1501 HE2 PHE 97 HE2 PHE 97 -5.078 6.667 -8.212 1502 HZ PHE 97 HZ PHE 97 -5.042 9.099 -8.599 1503 H LEU 98 H LEU 98 -10.348 3.335 -7.984 1504 HA LEU 98 HA LEU 98 -12.780 2.887 -6.576 1505 1HB LEU 98 1HB LEU 98 -11.579 1.535 -8.490 1506 2HB LEU 98 2HB LEU 98 -10.859 0.678 -7.128 1507 HG LEU 98 HG LEU 98 -13.817 0.963 -7.178 1508 1HD1 LEU 98 1HD1 LEU 98 -12.398 -1.117 -8.827 1509 2HD1 LEU 98 2HD1 LEU 98 -13.129 0.338 -9.504 1510 3HD1 LEU 98 3HD1 LEU 98 -14.136 -0.852 -8.680 1511 1HD2 LEU 98 1HD2 LEU 98 -12.395 -1.569 -6.612 1512 2HD2 LEU 98 2HD2 LEU 98 -13.772 -0.830 -5.793 1513 3HD2 LEU 98 3HD2 LEU 98 -12.139 -0.239 -5.482 1514 H ILE 99 H ILE 99 -13.140 1.899 -4.598 1515 HA ILE 99 HA ILE 99 -10.807 1.423 -2.884 1516 HB ILE 99 HB ILE 99 -13.203 3.070 -2.068 1517 1HG1 ILE 99 1HG1 ILE 99 -10.820 4.481 -1.634 1518 2HG1 ILE 99 2HG1 ILE 99 -10.643 3.760 -3.230 1519 1HG2 ILE 99 1HG2 ILE 99 -12.709 2.180 -0.058 1520 2HG2 ILE 99 2HG2 ILE 99 -11.083 1.708 -0.549 1521 3HG2 ILE 99 3HG2 ILE 99 -11.411 3.375 -0.076 1522 1HD1 ILE 99 1HD1 ILE 99 -11.590 5.994 -3.356 1523 2HD1 ILE 99 2HD1 ILE 99 -12.738 4.784 -3.928 1524 3HD1 ILE 99 3HD1 ILE 99 -12.930 5.494 -2.325 1525 H VAL 100 H VAL 100 -10.943 -0.602 -2.202 1526 HA VAL 100 HA VAL 100 -13.609 -1.735 -1.658 1527 HB VAL 100 HB VAL 100 -11.068 -3.202 -2.379 1528 1HG1 VAL 100 1HG1 VAL 100 -13.782 -4.100 -1.533 1529 2HG1 VAL 100 2HG1 VAL 100 -12.877 -5.071 -2.695 1530 3HG1 VAL 100 3HG1 VAL 100 -12.198 -4.742 -1.101 1531 1HG2 VAL 100 1HG2 VAL 100 -13.227 -2.056 -3.975 1532 2HG2 VAL 100 2HG2 VAL 100 -11.621 -2.596 -4.463 1533 3HG2 VAL 100 3HG2 VAL 100 -12.934 -3.763 -4.308 1534 H ILE 101 H ILE 101 -14.035 -1.789 0.444 1535 HA ILE 101 HA ILE 101 -11.826 -2.296 2.324 1536 HB ILE 101 HB ILE 101 -14.504 -1.006 2.856 1537 1HG1 ILE 101 1HG1 ILE 101 -12.038 0.516 3.330 1538 2HG1 ILE 101 2HG1 ILE 101 -12.313 0.114 1.638 1539 1HG2 ILE 101 1HG2 ILE 101 -13.920 -2.070 4.851 1540 2HG2 ILE 101 2HG2 ILE 101 -12.204 -1.724 4.639 1541 3HG2 ILE 101 3HG2 ILE 101 -13.321 -0.424 5.055 1542 1HD1 ILE 101 1HD1 ILE 101 -14.425 1.390 3.341 1543 2HD1 ILE 101 2HD1 ILE 101 -13.218 2.328 2.460 1544 3HD1 ILE 101 3HD1 ILE 101 -14.341 1.288 1.582 1545 H GLN 102 H GLN 102 -11.800 -4.143 3.426 1546 HA GLN 102 HA GLN 102 -14.164 -5.483 4.291 1547 1HB GLN 102 1HB GLN 102 -14.072 -7.454 2.976 1548 2HB GLN 102 2HB GLN 102 -14.011 -6.109 1.844 1549 1HG GLN 102 1HG GLN 102 -11.542 -6.371 1.760 1550 2HG GLN 102 2HG GLN 102 -11.708 -7.814 2.758 1551 1HE2 GLN 102 1HE2 GLN 102 -11.416 -6.729 -0.326 1552 2HE2 GLN 102 2HE2 GLN 102 -12.079 -8.081 -1.174 1553 H ASN 103 H ASN 103 -13.593 -7.644 5.319 1554 HA ASN 103 HA ASN 103 -11.668 -7.313 7.265 1555 1HB ASN 103 1HB ASN 103 -13.289 -9.560 6.267 1556 2HB ASN 103 2HB ASN 103 -11.809 -10.037 7.093 1557 1HD2 ASN 103 1HD2 ASN 103 -14.866 -8.401 7.401 1558 2HD2 ASN 103 2HD2 ASN 103 -14.914 -8.395 9.128 1559 HA PRO 104 HA PRO 104 -7.742 -8.288 5.567 1560 1HB PRO 104 1HB PRO 104 -6.585 -9.738 7.548 1561 2HB PRO 104 2HB PRO 104 -6.862 -7.997 7.669 1562 1HG PRO 104 1HG PRO 104 -8.472 -10.255 8.797 1563 2HG PRO 104 2HG PRO 104 -8.007 -8.722 9.559 1564 1HD PRO 104 1HD PRO 104 -10.467 -9.139 8.507 1565 2HD PRO 104 2HD PRO 104 -9.686 -7.545 8.506 1566 H THR 105 H THR 105 -6.591 -9.857 4.464 1567 HA THR 105 HA THR 105 -7.881 -12.499 4.323 1568 HB THR 105 HB THR 105 -6.826 -12.691 2.073 1569 HG1 THR 105 HG1 THR 105 -5.885 -10.848 1.172 1570 1HG2 THR 105 1HG2 THR 105 -8.438 -10.164 2.137 1571 2HG2 THR 105 2HG2 THR 105 -9.166 -11.706 2.585 1572 3HG2 THR 105 3HG2 THR 105 -8.487 -11.486 0.973 1573 H GLU 106 H GLU 106 -4.786 -10.836 4.556 1574 HA GLU 106 HA GLU 106 -3.565 -13.385 5.376 1575 1HB GLU 106 1HB GLU 106 -2.874 -12.651 3.060 1576 2HB GLU 106 2HB GLU 106 -2.125 -11.246 3.806 1577 1HG GLU 106 1HG GLU 106 -0.302 -12.405 4.260 1578 2HG GLU 106 2HG GLU 106 -1.240 -13.605 5.147 Start of MODEL 4 1 H MET 11 H MET 11 17.451 -8.474 14.457 2 HA MET 11 HA MET 11 17.878 -8.532 11.993 3 1HB MET 11 1HB MET 11 19.877 -8.925 14.093 4 2HB MET 11 2HB MET 11 20.426 -9.450 12.507 5 1HG MET 11 1HG MET 11 19.186 -6.963 12.124 6 2HG MET 11 2HG MET 11 20.191 -6.804 13.563 7 1HE MET 11 1HE MET 11 21.465 -8.152 9.428 8 2HE MET 11 2HE MET 11 19.843 -8.021 10.107 9 3HE MET 11 3HE MET 11 20.655 -6.586 9.481 10 H ALA 12 H ALA 12 18.755 -11.494 13.759 11 HA ALA 12 HA ALA 12 19.498 -13.094 11.639 12 1HB ALA 12 1HB ALA 12 18.927 -13.463 14.364 13 2HB ALA 12 2HB ALA 12 17.967 -14.655 13.488 14 3HB ALA 12 3HB ALA 12 19.714 -14.592 13.261 15 H GLU 13 H GLU 13 16.248 -12.387 12.835 16 HA GLU 13 HA GLU 13 14.773 -14.215 11.379 17 1HB GLU 13 1HB GLU 13 14.255 -11.612 12.640 18 2HB GLU 13 2HB GLU 13 13.159 -12.005 11.322 19 1HG GLU 13 1HG GLU 13 13.058 -14.320 12.621 20 2HG GLU 13 2HG GLU 13 13.472 -13.271 13.976 21 H VAL 14 H VAL 14 15.688 -10.914 10.405 22 HA VAL 14 HA VAL 14 14.562 -11.039 7.827 23 HB VAL 14 HB VAL 14 16.939 -9.367 8.642 24 1HG1 VAL 14 1HG1 VAL 14 15.380 -9.588 6.243 25 2HG1 VAL 14 2HG1 VAL 14 15.204 -7.974 6.935 26 3HG1 VAL 14 3HG1 VAL 14 16.808 -8.604 6.560 27 1HG2 VAL 14 1HG2 VAL 14 15.515 -8.640 10.247 28 2HG2 VAL 14 2HG2 VAL 14 14.875 -7.681 8.912 29 3HG2 VAL 14 3HG2 VAL 14 14.081 -9.185 9.378 30 H GLU 15 H GLU 15 17.767 -11.859 9.054 31 HA GLU 15 HA GLU 15 19.049 -12.240 6.587 32 1HB GLU 15 1HB GLU 15 19.526 -13.378 9.333 33 2HB GLU 15 2HB GLU 15 20.537 -13.819 7.964 34 1HG GLU 15 1HG GLU 15 21.217 -11.534 7.662 35 2HG GLU 15 2HG GLU 15 20.100 -11.000 8.918 36 H GLU 16 H GLU 16 17.328 -14.535 8.683 37 HA GLU 16 HA GLU 16 17.766 -16.857 7.230 38 1HB GLU 16 1HB GLU 16 16.419 -16.285 9.494 39 2HB GLU 16 2HB GLU 16 15.065 -16.516 8.397 40 1HG GLU 16 1HG GLU 16 16.787 -18.654 7.901 41 2HG GLU 16 2HG GLU 16 16.759 -18.466 9.653 42 H THR 17 H THR 17 15.293 -14.370 6.802 43 HA THR 17 HA THR 17 14.004 -15.764 4.641 44 HB THR 17 HB THR 17 13.690 -12.913 5.600 45 HG1 THR 17 HG1 THR 17 12.471 -13.819 7.061 46 1HG2 THR 17 1HG2 THR 17 12.427 -14.447 3.387 47 2HG2 THR 17 2HG2 THR 17 12.810 -12.729 3.497 48 3HG2 THR 17 3HG2 THR 17 11.401 -13.375 4.338 49 H LEU 18 H LEU 18 16.583 -13.482 4.975 50 HA LEU 18 HA LEU 18 16.517 -12.484 2.301 51 1HB LEU 18 1HB LEU 18 17.996 -12.005 4.680 52 2HB LEU 18 2HB LEU 18 19.140 -12.321 3.377 53 HG LEU 18 HG LEU 18 17.396 -10.525 2.236 54 1HD1 LEU 18 1HD1 LEU 18 17.387 -8.660 3.940 55 2HD1 LEU 18 2HD1 LEU 18 17.737 -9.889 5.155 56 3HD1 LEU 18 3HD1 LEU 18 16.243 -9.973 4.220 57 1HD2 LEU 18 1HD2 LEU 18 19.290 -8.878 2.785 58 2HD2 LEU 18 2HD2 LEU 18 19.684 -10.315 1.841 59 3HD2 LEU 18 3HD2 LEU 18 20.072 -10.255 3.561 60 H LYS 19 H LYS 19 18.282 -15.057 3.956 61 HA LYS 19 HA LYS 19 20.045 -15.744 1.898 62 1HB LYS 19 1HB LYS 19 18.836 -17.310 4.164 63 2HB LYS 19 2HB LYS 19 19.927 -18.070 3.013 64 1HG LYS 19 1HG LYS 19 20.933 -15.562 4.128 65 2HG LYS 19 2HG LYS 19 20.681 -16.839 5.320 66 1HD LYS 19 1HD LYS 19 21.943 -17.866 2.931 67 2HD LYS 19 2HD LYS 19 22.871 -16.532 3.621 68 1HE LYS 19 1HE LYS 19 23.074 -17.636 5.707 69 2HE LYS 19 2HE LYS 19 21.866 -18.842 5.267 70 1HZ LYS 19 1HZ LYS 19 23.334 -19.896 3.825 71 2HZ LYS 19 2HZ LYS 19 24.305 -19.511 5.156 72 3HZ LYS 19 3HZ LYS 19 24.387 -18.573 3.751 73 H ARG 20 H ARG 20 16.785 -16.955 2.619 74 HA ARG 20 HA ARG 20 16.709 -18.789 0.452 75 1HB ARG 20 1HB ARG 20 15.249 -18.760 2.561 76 2HB ARG 20 2HB ARG 20 14.292 -17.536 1.738 77 1HG ARG 20 1HG ARG 20 13.110 -19.249 0.946 78 2HG ARG 20 2HG ARG 20 14.468 -19.502 -0.154 79 1HD ARG 20 1HD ARG 20 15.195 -20.742 2.247 80 2HD ARG 20 2HD ARG 20 13.505 -21.170 1.988 81 HE ARG 20 HE ARG 20 15.083 -21.505 -0.369 82 1HH1 ARG 20 1HH1 ARG 20 14.202 -22.975 2.661 83 2HH1 ARG 20 2HH1 ARG 20 14.509 -24.591 2.116 84 1HH2 ARG 20 1HH2 ARG 20 15.489 -23.627 -1.099 85 2HH2 ARG 20 2HH2 ARG 20 15.242 -24.961 -0.023 86 H LEU 21 H LEU 21 15.912 -15.404 0.804 87 HA LEU 21 HA LEU 21 14.443 -15.159 -1.623 88 1HB LEU 21 1HB LEU 21 15.469 -13.387 0.466 89 2HB LEU 21 2HB LEU 21 15.444 -12.658 -1.139 90 HG LEU 21 HG LEU 21 13.068 -12.988 -1.311 91 1HD1 LEU 21 1HD1 LEU 21 12.121 -14.707 -0.279 92 2HD1 LEU 21 2HD1 LEU 21 12.268 -13.818 1.236 93 3HD1 LEU 21 3HD1 LEU 21 13.538 -14.938 0.747 94 1HD2 LEU 21 1HD2 LEU 21 13.511 -10.956 -0.270 95 2HD2 LEU 21 2HD2 LEU 21 14.069 -11.725 1.216 96 3HD2 LEU 21 3HD2 LEU 21 12.351 -11.723 0.814 97 H GLN 22 H GLN 22 17.747 -14.144 -0.737 98 HA GLN 22 HA GLN 22 18.506 -13.388 -3.339 99 1HB GLN 22 1HB GLN 22 19.665 -13.354 -0.793 100 2HB GLN 22 2HB GLN 22 20.739 -14.347 -1.768 101 1HG GLN 22 1HG GLN 22 21.541 -12.586 -2.852 102 2HG GLN 22 2HG GLN 22 19.928 -11.944 -3.161 103 1HE2 GLN 22 1HE2 GLN 22 18.871 -11.036 -1.102 104 2HE2 GLN 22 2HE2 GLN 22 19.872 -10.000 -0.148 105 H SER 23 H SER 23 18.205 -16.463 -1.841 106 HA SER 23 HA SER 23 20.007 -17.837 -3.622 107 1HB SER 23 1HB SER 23 19.610 -18.665 -1.333 108 2HB SER 23 2HB SER 23 17.915 -18.945 -1.732 109 HG SER 23 HG SER 23 19.037 -20.865 -1.975 110 H GLN 24 H GLN 24 16.716 -16.858 -3.656 111 HA GLN 24 HA GLN 24 16.099 -18.689 -5.865 112 1HB GLN 24 1HB GLN 24 13.771 -18.143 -5.494 113 2HB GLN 24 2HB GLN 24 14.510 -18.612 -3.969 114 1HG GLN 24 1HG GLN 24 14.550 -16.398 -3.184 115 2HG GLN 24 2HG GLN 24 14.223 -15.741 -4.787 116 1HE2 GLN 24 1HE2 GLN 24 12.659 -14.747 -2.997 117 2HE2 GLN 24 2HE2 GLN 24 11.082 -15.454 -3.000 118 H LYS 25 H LYS 25 14.681 -17.702 -7.612 119 HA LYS 25 HA LYS 25 16.037 -15.337 -8.614 120 1HB LYS 25 1HB LYS 25 15.077 -17.628 -9.816 121 2HB LYS 25 2HB LYS 25 13.870 -16.426 -10.253 122 1HG LYS 25 1HG LYS 25 16.563 -15.422 -10.597 123 2HG LYS 25 2HG LYS 25 16.276 -16.893 -11.528 124 1HD LYS 25 1HD LYS 25 14.036 -15.649 -12.155 125 2HD LYS 25 2HD LYS 25 14.984 -14.217 -11.745 126 1HE LYS 25 1HE LYS 25 16.264 -14.393 -13.584 127 2HE LYS 25 2HE LYS 25 16.377 -16.148 -13.456 128 1HZ LYS 25 1HZ LYS 25 14.238 -16.372 -14.469 129 2HZ LYS 25 2HZ LYS 25 15.186 -15.378 -15.456 130 3HZ LYS 25 3HZ LYS 25 13.993 -14.698 -14.468 131 H GLY 26 H GLY 26 14.724 -13.628 -9.712 132 1HA GLY 26 1HA GLY 26 12.746 -12.331 -9.880 133 2HA GLY 26 2HA GLY 26 12.079 -13.219 -8.518 134 H VAL 27 H VAL 27 14.097 -12.962 -6.655 135 HA VAL 27 HA VAL 27 13.547 -10.549 -5.438 136 HB VAL 27 HB VAL 27 16.047 -12.216 -5.128 137 1HG1 VAL 27 1HG1 VAL 27 15.756 -11.094 -2.735 138 2HG1 VAL 27 2HG1 VAL 27 16.690 -10.332 -4.025 139 3HG1 VAL 27 3HG1 VAL 27 15.032 -9.817 -3.712 140 1HG2 VAL 27 1HG2 VAL 27 14.770 -12.998 -3.060 141 2HG2 VAL 27 2HG2 VAL 27 13.341 -12.307 -3.827 142 3HG2 VAL 27 3HG2 VAL 27 14.226 -13.608 -4.623 143 H GLN 28 H GLN 28 14.541 -8.560 -5.308 144 HA GLN 28 HA GLN 28 16.578 -8.014 -7.366 145 1HB GLN 28 1HB GLN 28 14.034 -6.775 -6.850 146 2HB GLN 28 2HB GLN 28 15.321 -5.595 -6.645 147 1HG GLN 28 1HG GLN 28 16.080 -5.893 -8.859 148 2HG GLN 28 2HG GLN 28 15.100 -7.342 -9.076 149 1HE2 GLN 28 1HE2 GLN 28 13.165 -7.129 -9.972 150 2HE2 GLN 28 2HE2 GLN 28 12.338 -5.635 -10.235 151 H GLY 29 H GLY 29 15.598 -7.577 -4.051 152 1HA GLY 29 1HA GLY 29 18.061 -7.323 -2.931 153 2HA GLY 29 2HA GLY 29 17.677 -5.682 -3.427 154 H ILE 30 H ILE 30 17.907 -7.233 -0.764 155 HA ILE 30 HA ILE 30 15.345 -6.304 0.359 156 HB ILE 30 HB ILE 30 17.141 -8.394 1.582 157 1HG1 ILE 30 1HG1 ILE 30 15.026 -9.830 0.799 158 2HG1 ILE 30 2HG1 ILE 30 14.991 -8.608 -0.467 159 1HG2 ILE 30 1HG2 ILE 30 15.771 -7.404 3.232 160 2HG2 ILE 30 2HG2 ILE 30 14.361 -7.414 2.174 161 3HG2 ILE 30 3HG2 ILE 30 14.996 -8.931 2.810 162 1HD1 ILE 30 1HD1 ILE 30 16.994 -9.288 -1.360 163 2HD1 ILE 30 2HD1 ILE 30 17.543 -10.016 0.150 164 3HD1 ILE 30 3HD1 ILE 30 16.304 -10.817 -0.816 165 H ILE 31 H ILE 31 15.511 -4.532 1.547 166 HA ILE 31 HA ILE 31 18.074 -3.961 2.882 167 HB ILE 31 HB ILE 31 15.935 -1.959 2.160 168 1HG1 ILE 31 1HG1 ILE 31 18.287 -1.561 0.632 169 2HG1 ILE 31 2HG1 ILE 31 17.865 -3.263 0.483 170 1HG2 ILE 31 1HG2 ILE 31 18.792 -1.631 3.068 171 2HG2 ILE 31 2HG2 ILE 31 17.723 -0.320 2.573 172 3HG2 ILE 31 3HG2 ILE 31 17.344 -1.271 4.008 173 1HD1 ILE 31 1HD1 ILE 31 15.593 -1.457 0.187 174 2HD1 ILE 31 2HD1 ILE 31 16.849 -1.248 -1.034 175 3HD1 ILE 31 3HD1 ILE 31 16.098 -2.826 -0.802 176 H VAL 32 H VAL 32 18.094 -3.301 5.020 177 HA VAL 32 HA VAL 32 15.534 -3.489 6.466 178 HB VAL 32 HB VAL 32 18.164 -4.462 7.575 179 1HG1 VAL 32 1HG1 VAL 32 16.710 -5.586 9.216 180 2HG1 VAL 32 2HG1 VAL 32 16.529 -3.831 9.248 181 3HG1 VAL 32 3HG1 VAL 32 15.305 -4.831 8.465 182 1HG2 VAL 32 1HG2 VAL 32 15.956 -6.096 6.326 183 2HG2 VAL 32 2HG2 VAL 32 17.554 -5.823 5.633 184 3HG2 VAL 32 3HG2 VAL 32 17.388 -6.735 7.133 185 H VAL 33 H VAL 33 15.085 -1.543 7.255 186 HA VAL 33 HA VAL 33 17.299 0.115 8.271 187 HB VAL 33 HB VAL 33 14.573 1.140 7.504 188 1HG1 VAL 33 1HG1 VAL 33 17.173 2.336 8.302 189 2HG1 VAL 33 2HG1 VAL 33 16.182 3.205 7.129 190 3HG1 VAL 33 3HG1 VAL 33 15.529 2.817 8.721 191 1HG2 VAL 33 1HG2 VAL 33 17.039 0.982 5.773 192 2HG2 VAL 33 2HG2 VAL 33 15.543 0.078 5.538 193 3HG2 VAL 33 3HG2 VAL 33 15.549 1.832 5.362 194 H ASN 34 H ASN 34 17.207 0.951 10.310 195 HA ASN 34 HA ASN 34 15.384 -0.316 12.146 196 1HB ASN 34 1HB ASN 34 17.308 1.860 12.913 197 2HB ASN 34 2HB ASN 34 16.769 0.475 13.858 198 1HD2 ASN 34 1HD2 ASN 34 19.467 1.433 13.209 199 2HD2 ASN 34 2HD2 ASN 34 20.268 0.098 12.459 200 H THR 35 H THR 35 14.929 1.532 14.083 201 HA THR 35 HA THR 35 12.742 3.010 12.987 202 HB THR 35 HB THR 35 13.237 3.933 15.609 203 HG1 THR 35 HG1 THR 35 14.327 2.341 16.468 204 1HG2 THR 35 1HG2 THR 35 11.022 3.634 15.203 205 2HG2 THR 35 2HG2 THR 35 11.332 2.073 15.963 206 3HG2 THR 35 3HG2 THR 35 11.289 2.205 14.205 207 H GLU 36 H GLU 36 16.040 3.717 13.741 208 HA GLU 36 HA GLU 36 15.685 6.574 13.863 209 1HB GLU 36 1HB GLU 36 17.975 4.687 14.038 210 2HB GLU 36 2HB GLU 36 18.327 6.331 13.524 211 1HG GLU 36 1HG GLU 36 16.770 6.811 15.675 212 2HG GLU 36 2HG GLU 36 17.536 5.298 16.156 213 H GLY 37 H GLY 37 16.619 4.191 11.458 214 1HA GLY 37 1HA GLY 37 15.978 4.815 9.142 215 2HA GLY 37 2HA GLY 37 16.736 6.368 9.462 216 H ILE 38 H ILE 38 18.285 3.596 10.768 217 HA ILE 38 HA ILE 38 20.458 3.932 8.834 218 HB ILE 38 HB ILE 38 20.505 2.378 11.421 219 1HG1 ILE 38 1HG1 ILE 38 21.424 5.207 10.864 220 2HG1 ILE 38 2HG1 ILE 38 20.032 4.753 11.842 221 1HG2 ILE 38 1HG2 ILE 38 22.868 2.351 11.183 222 2HG2 ILE 38 2HG2 ILE 38 22.192 1.826 9.642 223 3HG2 ILE 38 3HG2 ILE 38 22.809 3.469 9.821 224 1HD1 ILE 38 1HD1 ILE 38 22.083 3.351 13.005 225 2HD1 ILE 38 2HD1 ILE 38 22.846 4.872 12.540 226 3HD1 ILE 38 3HD1 ILE 38 21.416 4.882 13.572 227 HA PRO 39 HA PRO 39 19.009 0.156 6.918 228 1HB PRO 39 1HB PRO 39 20.833 0.185 4.908 229 2HB PRO 39 2HB PRO 39 19.386 1.200 4.906 230 1HG PRO 39 1HG PRO 39 22.197 1.909 5.653 231 2HG PRO 39 2HG PRO 39 21.028 2.833 4.692 232 1HD PRO 39 1HD PRO 39 21.520 3.372 7.300 233 2HD PRO 39 2HD PRO 39 19.926 3.620 6.558 234 H ILE 40 H ILE 40 19.868 -0.931 8.906 235 HA ILE 40 HA ILE 40 22.464 -1.719 9.343 236 HB ILE 40 HB ILE 40 21.404 -3.866 10.304 237 1HG1 ILE 40 1HG1 ILE 40 18.845 -2.313 10.050 238 2HG1 ILE 40 2HG1 ILE 40 19.325 -3.453 8.798 239 1HG2 ILE 40 1HG2 ILE 40 21.163 -1.069 11.183 240 2HG2 ILE 40 2HG2 ILE 40 20.131 -2.223 12.027 241 3HG2 ILE 40 3HG2 ILE 40 21.878 -2.459 11.998 242 1HD1 ILE 40 1HD1 ILE 40 17.850 -4.056 11.003 243 2HD1 ILE 40 2HD1 ILE 40 18.758 -5.218 10.036 244 3HD1 ILE 40 3HD1 ILE 40 19.470 -4.542 11.501 245 H LYS 41 H LYS 41 20.131 -3.046 7.076 246 HA LYS 41 HA LYS 41 22.221 -4.863 6.066 247 1HB LYS 41 1HB LYS 41 19.715 -5.551 6.957 248 2HB LYS 41 2HB LYS 41 19.466 -5.418 5.221 249 1HG LYS 41 1HG LYS 41 21.678 -7.052 6.432 250 2HG LYS 41 2HG LYS 41 20.073 -7.702 6.085 251 1HD LYS 41 1HD LYS 41 20.702 -8.067 3.985 252 2HD LYS 41 2HD LYS 41 20.933 -6.330 3.769 253 1HE LYS 41 1HE LYS 41 23.074 -6.859 3.376 254 2HE LYS 41 2HE LYS 41 23.195 -7.043 5.125 255 1HZ LYS 41 1HZ LYS 41 23.695 -8.971 3.248 256 2HZ LYS 41 2HZ LYS 41 22.188 -9.402 3.883 257 3HZ LYS 41 3HZ LYS 41 23.517 -9.215 4.913 258 H SER 42 H SER 42 22.701 -4.856 3.910 259 HA SER 42 HA SER 42 21.101 -3.270 2.072 260 1HB SER 42 1HB SER 42 22.981 -1.863 3.281 261 2HB SER 42 2HB SER 42 24.031 -2.663 2.111 262 HG SER 42 HG SER 42 23.373 -1.173 0.793 263 H THR 43 H THR 43 20.728 -4.828 0.617 264 HA THR 43 HA THR 43 22.980 -6.483 -0.293 265 HB THR 43 HB THR 43 21.413 -8.094 -1.074 266 HG1 THR 43 HG1 THR 43 19.824 -6.778 -1.963 267 1HG2 THR 43 1HG2 THR 43 20.993 -8.869 0.976 268 2HG2 THR 43 2HG2 THR 43 19.808 -7.597 1.274 269 3HG2 THR 43 3HG2 THR 43 21.516 -7.307 1.605 270 H MET 44 H MET 44 21.239 -3.779 -1.163 271 HA MET 44 HA MET 44 21.570 -4.264 -4.041 272 1HB MET 44 1HB MET 44 19.484 -3.116 -2.590 273 2HB MET 44 2HB MET 44 20.296 -1.750 -3.343 274 1HG MET 44 1HG MET 44 20.037 -2.765 -5.527 275 2HG MET 44 2HG MET 44 19.293 -4.186 -4.797 276 1HE MET 44 1HE MET 44 16.197 -3.857 -3.966 277 2HE MET 44 2HE MET 44 17.616 -3.747 -2.925 278 3HE MET 44 3HE MET 44 16.406 -2.463 -2.905 279 H ASP 45 H ASP 45 21.768 -1.709 -4.986 280 HA ASP 45 HA ASP 45 24.510 -1.160 -4.706 281 1HB ASP 45 1HB ASP 45 22.299 -0.161 -6.258 282 2HB ASP 45 2HB ASP 45 23.269 1.183 -5.663 283 H ASN 46 H ASN 46 25.569 0.684 -3.823 284 HA ASN 46 HA ASN 46 24.870 1.292 -1.194 285 1HB ASN 46 1HB ASN 46 27.028 1.835 -2.914 286 2HB ASN 46 2HB ASN 46 26.467 3.404 -2.346 287 1HD2 ASN 46 1HD2 ASN 46 25.586 2.736 0.182 288 2HD2 ASN 46 2HD2 ASN 46 26.940 2.269 1.148 289 HA PRO 47 HA PRO 47 23.284 5.580 -2.769 290 1HB PRO 47 1HB PRO 47 22.938 5.866 -5.447 291 2HB PRO 47 2HB PRO 47 24.457 6.250 -4.628 292 1HG PRO 47 1HG PRO 47 23.699 3.790 -6.155 293 2HG PRO 47 2HG PRO 47 25.218 4.703 -6.188 294 1HD PRO 47 1HD PRO 47 24.928 2.409 -4.779 295 2HD PRO 47 2HD PRO 47 25.994 3.726 -4.250 296 H THR 48 H THR 48 22.306 2.626 -4.356 297 HA THR 48 HA THR 48 19.614 3.460 -4.881 298 HB THR 48 HB THR 48 20.836 0.695 -4.829 299 HG1 THR 48 HG1 THR 48 21.467 2.370 -6.479 300 1HG2 THR 48 1HG2 THR 48 18.826 0.020 -6.099 301 2HG2 THR 48 2HG2 THR 48 18.141 1.623 -5.830 302 3HG2 THR 48 3HG2 THR 48 18.440 0.550 -4.463 303 H THR 49 H THR 49 21.235 1.601 -2.354 304 HA THR 49 HA THR 49 18.910 0.763 -0.991 305 HB THR 49 HB THR 49 21.723 1.179 0.034 306 HG1 THR 49 HG1 THR 49 21.178 -0.494 -1.633 307 1HG2 THR 49 1HG2 THR 49 20.420 -0.729 1.603 308 2HG2 THR 49 2HG2 THR 49 19.273 0.603 1.453 309 3HG2 THR 49 3HG2 THR 49 20.892 0.900 2.086 310 H THR 50 H THR 50 21.125 3.483 -0.373 311 HA THR 50 HA THR 50 19.833 4.554 1.842 312 HB THR 50 HB THR 50 20.895 6.593 0.024 313 HG1 THR 50 HG1 THR 50 22.374 5.216 -0.721 314 1HG2 THR 50 1HG2 THR 50 22.513 6.515 2.210 315 2HG2 THR 50 2HG2 THR 50 21.034 5.799 2.851 316 3HG2 THR 50 3HG2 THR 50 20.995 7.406 2.124 317 H GLN 51 H GLN 51 19.305 5.221 -1.604 318 HA GLN 51 HA GLN 51 17.435 7.259 -1.370 319 1HB GLN 51 1HB GLN 51 18.404 6.672 -3.509 320 2HB GLN 51 2HB GLN 51 17.650 5.085 -3.456 321 1HG GLN 51 1HG GLN 51 15.763 7.301 -3.219 322 2HG GLN 51 2HG GLN 51 16.652 7.269 -4.741 323 1HE2 GLN 51 1HE2 GLN 51 14.291 5.711 -2.768 324 2HE2 GLN 51 2HE2 GLN 51 13.775 4.543 -3.933 325 H TYR 52 H TYR 52 16.912 3.749 -1.464 326 HA TYR 52 HA TYR 52 14.084 3.912 -1.248 327 1HB TYR 52 1HB TYR 52 16.099 1.714 -0.933 328 2HB TYR 52 2HB TYR 52 14.424 1.443 -0.464 329 HD1 TYR 52 HD1 TYR 52 16.140 3.093 -3.355 330 HD2 TYR 52 HD2 TYR 52 13.232 0.276 -2.047 331 HE1 TYR 52 HE1 TYR 52 15.571 2.602 -5.697 332 HE2 TYR 52 HE2 TYR 52 12.656 -0.224 -4.385 333 HH TYR 52 HH TYR 52 14.057 1.601 -7.053 334 H ALA 53 H ALA 53 16.606 3.059 1.121 335 HA ALA 53 HA ALA 53 14.948 2.762 3.340 336 1HB ALA 53 1HB ALA 53 17.104 1.980 3.650 337 2HB ALA 53 2HB ALA 53 17.840 3.453 3.018 338 3HB ALA 53 3HB ALA 53 17.094 3.455 4.616 339 H SER 54 H SER 54 15.979 5.613 1.696 340 HA SER 54 HA SER 54 15.549 7.430 3.868 341 1HB SER 54 1HB SER 54 16.142 7.675 0.955 342 2HB SER 54 2HB SER 54 15.449 9.073 1.776 343 HG SER 54 HG SER 54 17.217 8.616 3.386 344 H LEU 55 H LEU 55 13.771 6.857 0.827 345 HA LEU 55 HA LEU 55 11.515 8.387 1.639 346 1HB LEU 55 1HB LEU 55 10.649 7.941 -0.421 347 2HB LEU 55 2HB LEU 55 12.360 7.656 -0.734 348 HG LEU 55 HG LEU 55 11.654 5.164 -0.116 349 1HD1 LEU 55 1HD1 LEU 55 9.485 4.666 -0.236 350 2HD1 LEU 55 2HD1 LEU 55 9.240 5.687 -1.652 351 3HD1 LEU 55 3HD1 LEU 55 9.197 6.395 -0.038 352 1HD2 LEU 55 1HD2 LEU 55 10.864 5.975 -2.850 353 2HD2 LEU 55 2HD2 LEU 55 11.980 4.718 -2.314 354 3HD2 LEU 55 3HD2 LEU 55 12.493 6.406 -2.327 355 H MET 56 H MET 56 12.568 5.249 2.380 356 HA MET 56 HA MET 56 10.160 3.850 2.644 357 1HB MET 56 1HB MET 56 12.891 3.439 3.310 358 2HB MET 56 2HB MET 56 11.939 3.090 4.746 359 1HG MET 56 1HG MET 56 12.290 1.088 3.430 360 2HG MET 56 2HG MET 56 10.582 1.517 3.478 361 1HE MET 56 1HE MET 56 9.417 0.848 0.650 362 2HE MET 56 2HE MET 56 9.221 2.042 1.934 363 3HE MET 56 3HE MET 56 9.499 2.569 0.273 364 H HIS 57 H HIS 57 12.045 5.185 5.361 365 HA HIS 57 HA HIS 57 10.027 5.043 7.258 366 1HB HIS 57 1HB HIS 57 12.601 5.699 7.401 367 2HB HIS 57 2HB HIS 57 11.935 7.329 7.403 368 HD1 HIS 57 HD1 HIS 57 10.117 7.782 9.372 369 HD2 HIS 57 HD2 HIS 57 12.590 4.475 9.828 370 HE1 HIS 57 HE1 HIS 57 9.981 7.172 11.807 371 H SER 58 H SER 58 10.741 7.571 4.918 372 HA SER 58 HA SER 58 8.931 9.491 5.966 373 1HB SER 58 1HB SER 58 10.565 10.403 4.562 374 2HB SER 58 2HB SER 58 10.346 9.154 3.336 375 HG SER 58 HG SER 58 9.181 11.545 3.493 376 H PHE 59 H PHE 59 8.565 6.710 3.950 377 HA PHE 59 HA PHE 59 6.038 7.479 2.825 378 1HB PHE 59 1HB PHE 59 7.431 5.936 1.593 379 2HB PHE 59 2HB PHE 59 7.461 4.815 2.950 380 HD1 PHE 59 HD1 PHE 59 6.415 2.887 2.241 381 HD2 PHE 59 HD2 PHE 59 4.630 6.654 1.383 382 HE1 PHE 59 HE1 PHE 59 4.435 1.739 1.338 383 HE2 PHE 59 HE2 PHE 59 2.647 5.512 0.479 384 HZ PHE 59 HZ PHE 59 2.547 3.052 0.456 385 H ILE 60 H ILE 60 7.104 5.365 5.456 386 HA ILE 60 HA ILE 60 4.556 4.379 6.151 387 HB ILE 60 HB ILE 60 6.985 4.724 7.914 388 1HG1 ILE 60 1HG1 ILE 60 7.454 3.341 5.955 389 2HG1 ILE 60 2HG1 ILE 60 7.399 2.345 7.405 390 1HG2 ILE 60 1HG2 ILE 60 4.302 3.714 8.420 391 2HG2 ILE 60 2HG2 ILE 60 5.564 2.552 8.824 392 3HG2 ILE 60 3HG2 ILE 60 5.578 4.157 9.554 393 1HD1 ILE 60 1HD1 ILE 60 5.852 2.157 4.998 394 2HD1 ILE 60 2HD1 ILE 60 5.981 1.024 6.344 395 3HD1 ILE 60 3HD1 ILE 60 4.798 2.331 6.401 396 H LEU 61 H LEU 61 6.483 7.033 7.539 397 HA LEU 61 HA LEU 61 4.586 7.836 9.448 398 1HB LEU 61 1HB LEU 61 7.126 8.707 8.516 399 2HB LEU 61 2HB LEU 61 6.048 10.101 8.554 400 HG LEU 61 HG LEU 61 5.642 9.786 10.907 401 1HD1 LEU 61 1HD1 LEU 61 5.593 7.537 11.361 402 2HD1 LEU 61 2HD1 LEU 61 7.165 7.979 12.027 403 3HD1 LEU 61 3HD1 LEU 61 7.063 7.206 10.445 404 1HD2 LEU 61 1HD2 LEU 61 8.170 9.783 11.661 405 2HD2 LEU 61 2HD2 LEU 61 7.484 11.129 10.751 406 3HD2 LEU 61 3HD2 LEU 61 8.446 9.904 9.923 407 H LYS 62 H LYS 62 4.804 8.382 6.042 408 HA LYS 62 HA LYS 62 3.132 10.687 5.924 409 1HB LYS 62 1HB LYS 62 4.702 10.069 4.120 410 2HB LYS 62 2HB LYS 62 3.734 8.640 3.781 411 1HG LYS 62 1HG LYS 62 3.165 10.275 2.166 412 2HG LYS 62 2HG LYS 62 1.811 10.168 3.293 413 1HD LYS 62 1HD LYS 62 2.063 12.451 3.090 414 2HD LYS 62 2HD LYS 62 3.045 12.115 4.518 415 1HE LYS 62 1HE LYS 62 4.929 11.807 2.671 416 2HE LYS 62 2HE LYS 62 3.871 12.895 1.774 417 1HZ LYS 62 1HZ LYS 62 4.858 14.531 2.876 418 2HZ LYS 62 2HZ LYS 62 5.629 13.469 3.942 419 3HZ LYS 62 3HZ LYS 62 4.058 14.003 4.270 420 H ALA 63 H ALA 63 2.538 7.246 5.202 421 HA ALA 63 HA ALA 63 -0.263 7.597 4.831 422 1HB ALA 63 1HB ALA 63 1.293 5.709 3.977 423 2HB ALA 63 2HB ALA 63 0.964 4.964 5.542 424 3HB ALA 63 3HB ALA 63 -0.364 5.319 4.437 425 H ARG 64 H ARG 64 1.766 6.667 7.554 426 HA ARG 64 HA ARG 64 -0.250 5.767 9.283 427 1HB ARG 64 1HB ARG 64 2.308 5.608 9.533 428 2HB ARG 64 2HB ARG 64 2.210 7.225 10.219 429 1HG ARG 64 1HG ARG 64 0.268 5.719 11.555 430 2HG ARG 64 2HG ARG 64 1.696 4.688 11.450 431 1HD ARG 64 1HD ARG 64 1.953 7.544 12.300 432 2HD ARG 64 2HD ARG 64 1.431 6.319 13.455 433 HE ARG 64 HE ARG 64 3.761 5.439 12.147 434 1HH1 ARG 64 1HH1 ARG 64 2.704 7.801 14.476 435 2HH1 ARG 64 2HH1 ARG 64 4.227 7.863 15.299 436 1HH2 ARG 64 1HH2 ARG 64 5.772 5.512 13.223 437 2HH2 ARG 64 2HH2 ARG 64 5.972 6.561 14.585 438 H SER 65 H SER 65 0.842 8.981 8.454 439 HA SER 65 HA SER 65 -0.571 10.274 10.601 440 1HB SER 65 1HB SER 65 1.529 11.115 9.316 441 2HB SER 65 2HB SER 65 0.368 11.679 8.115 442 HG SER 65 HG SER 65 0.741 13.323 9.588 443 H THR 66 H THR 66 -1.276 9.271 7.366 444 HA THR 66 HA THR 66 -3.599 10.968 7.085 445 HB THR 66 HB THR 66 -3.284 8.618 5.305 446 HG1 THR 66 HG1 THR 66 -1.597 9.876 4.163 447 1HG2 THR 66 1HG2 THR 66 -4.110 10.053 3.676 448 2HG2 THR 66 2HG2 THR 66 -3.502 11.493 4.492 449 3HG2 THR 66 3HG2 THR 66 -4.906 10.643 5.135 450 H VAL 67 H VAL 67 -2.940 7.542 7.702 451 HA VAL 67 HA VAL 67 -5.496 6.510 7.616 452 HB VAL 67 HB VAL 67 -3.331 5.759 9.585 453 1HG1 VAL 67 1HG1 VAL 67 -6.011 4.767 9.151 454 2HG1 VAL 67 2HG1 VAL 67 -4.803 3.505 8.897 455 3HG1 VAL 67 3HG1 VAL 67 -4.860 4.379 10.429 456 1HG2 VAL 67 1HG2 VAL 67 -3.702 4.009 7.307 457 2HG2 VAL 67 2HG2 VAL 67 -3.262 5.645 6.814 458 3HG2 VAL 67 3HG2 VAL 67 -2.228 4.752 7.930 459 H ARG 68 H ARG 68 -4.015 8.507 10.065 460 HA ARG 68 HA ARG 68 -5.661 8.049 12.241 461 1HB ARG 68 1HB ARG 68 -4.615 10.753 11.389 462 2HB ARG 68 2HB ARG 68 -5.048 10.252 13.017 463 1HG ARG 68 1HG ARG 68 -2.752 9.217 11.370 464 2HG ARG 68 2HG ARG 68 -2.655 10.273 12.780 465 1HD ARG 68 1HD ARG 68 -3.682 7.437 12.747 466 2HD ARG 68 2HD ARG 68 -2.119 7.967 13.368 467 HE ARG 68 HE ARG 68 -4.659 8.157 14.687 468 1HH1 ARG 68 1HH1 ARG 68 -1.470 9.531 14.436 469 2HH1 ARG 68 2HH1 ARG 68 -1.485 10.189 16.039 470 1HH2 ARG 68 1HH2 ARG 68 -4.691 9.019 16.799 471 2HH2 ARG 68 2HH2 ARG 68 -3.318 9.896 17.382 472 H ASP 69 H ASP 69 -6.321 9.765 9.284 473 HA ASP 69 HA ASP 69 -8.725 11.016 10.264 474 1HB ASP 69 1HB ASP 69 -7.080 11.665 8.253 475 2HB ASP 69 2HB ASP 69 -8.256 10.720 7.343 476 H ILE 70 H ILE 70 -7.860 8.081 8.590 477 HA ILE 70 HA ILE 70 -10.397 7.389 7.585 478 HB ILE 70 HB ILE 70 -8.244 5.478 8.493 479 1HG1 ILE 70 1HG1 ILE 70 -8.621 6.820 5.807 480 2HG1 ILE 70 2HG1 ILE 70 -7.334 7.167 6.955 481 1HG2 ILE 70 1HG2 ILE 70 -10.528 4.562 7.996 482 2HG2 ILE 70 2HG2 ILE 70 -10.314 5.121 6.338 483 3HG2 ILE 70 3HG2 ILE 70 -9.226 3.904 7.006 484 1HD1 ILE 70 1HD1 ILE 70 -7.777 4.557 5.527 485 2HD1 ILE 70 2HD1 ILE 70 -6.536 5.755 5.161 486 3HD1 ILE 70 3HD1 ILE 70 -6.498 4.885 6.695 487 H ASP 71 H ASP 71 -8.832 6.750 10.689 488 HA ASP 71 HA ASP 71 -11.413 6.342 11.924 489 1HB ASP 71 1HB ASP 71 -9.757 4.098 11.163 490 2HB ASP 71 2HB ASP 71 -9.956 4.157 12.913 491 HA PRO 72 HA PRO 72 -9.441 8.086 15.432 492 1HB PRO 72 1HB PRO 72 -10.670 6.813 17.490 493 2HB PRO 72 2HB PRO 72 -11.479 8.026 16.490 494 1HG PRO 72 1HG PRO 72 -11.620 5.040 16.332 495 2HG PRO 72 2HG PRO 72 -12.928 6.230 16.202 496 1HD PRO 72 1HD PRO 72 -11.813 5.049 14.036 497 2HD PRO 72 2HD PRO 72 -12.444 6.707 13.999 498 H GLN 73 H GLN 73 -9.801 4.557 15.830 499 HA GLN 73 HA GLN 73 -7.050 4.493 16.884 500 1HB GLN 73 1HB GLN 73 -9.360 2.696 17.640 501 2HB GLN 73 2HB GLN 73 -7.714 2.548 18.240 502 1HG GLN 73 1HG GLN 73 -7.951 4.862 19.175 503 2HG GLN 73 2HG GLN 73 -9.660 4.777 18.754 504 1HE2 GLN 73 1HE2 GLN 73 -10.551 4.749 20.736 505 2HE2 GLN 73 2HE2 GLN 73 -10.272 3.521 21.918 506 H ASN 74 H ASN 74 -5.807 3.751 15.284 507 HA ASN 74 HA ASN 74 -6.419 1.143 14.152 508 1HB ASN 74 1HB ASN 74 -5.716 2.164 11.841 509 2HB ASN 74 2HB ASN 74 -7.383 2.301 12.391 510 1HD2 ASN 74 1HD2 ASN 74 -7.810 4.125 11.201 511 2HD2 ASN 74 2HD2 ASN 74 -7.127 5.668 11.573 512 H ASP 75 H ASP 75 -4.531 0.444 12.677 513 HA ASP 75 HA ASP 75 -1.979 1.650 13.178 514 1HB ASP 75 1HB ASP 75 -2.933 -0.277 15.052 515 2HB ASP 75 2HB ASP 75 -1.613 -1.007 14.141 516 H LEU 76 H LEU 76 -0.992 1.427 11.292 517 HA LEU 76 HA LEU 76 -1.763 -0.529 9.371 518 1HB LEU 76 1HB LEU 76 -0.193 1.850 9.442 519 2HB LEU 76 2HB LEU 76 0.753 0.570 8.685 520 HG LEU 76 HG LEU 76 -0.351 1.775 6.956 521 1HD1 LEU 76 1HD1 LEU 76 -2.233 -0.485 7.058 522 2HD1 LEU 76 2HD1 LEU 76 -0.527 -0.901 7.220 523 3HD1 LEU 76 3HD1 LEU 76 -1.087 -0.011 5.804 524 1HD2 LEU 76 1HD2 LEU 76 -2.122 2.687 8.549 525 2HD2 LEU 76 2HD2 LEU 76 -3.019 1.206 8.212 526 3HD2 LEU 76 3HD2 LEU 76 -2.631 2.320 6.900 527 H THR 77 H THR 77 -0.727 -2.364 8.693 528 HA THR 77 HA THR 77 1.772 -3.139 9.995 529 HB THR 77 HB THR 77 0.032 -4.077 11.440 530 HG1 THR 77 HG1 THR 77 1.514 -5.587 11.545 531 1HG2 THR 77 1HG2 THR 77 -1.910 -4.654 10.492 532 2HG2 THR 77 2HG2 THR 77 -1.104 -6.131 9.962 533 3HG2 THR 77 3HG2 THR 77 -1.185 -4.736 8.887 534 H PHE 78 H PHE 78 0.601 -2.484 7.235 535 HA PHE 78 HA PHE 78 2.221 -4.280 5.765 536 1HB PHE 78 1HB PHE 78 -0.133 -5.464 6.366 537 2HB PHE 78 2HB PHE 78 -0.578 -4.646 4.872 538 HD1 PHE 78 HD1 PHE 78 2.448 -6.482 6.061 539 HD2 PHE 78 HD2 PHE 78 -0.553 -6.057 3.074 540 HE1 PHE 78 HE1 PHE 78 3.488 -8.296 4.764 541 HE2 PHE 78 HE2 PHE 78 0.480 -7.872 1.772 542 HZ PHE 78 HZ PHE 78 2.503 -8.994 2.618 543 H LEU 79 H LEU 79 2.938 -3.142 4.095 544 HA LEU 79 HA LEU 79 1.131 -1.220 2.800 545 1HB LEU 79 1HB LEU 79 3.497 -0.640 4.310 546 2HB LEU 79 2HB LEU 79 3.742 -0.180 2.626 547 HG LEU 79 HG LEU 79 1.859 1.313 2.703 548 1HD1 LEU 79 1HD1 LEU 79 1.429 0.242 5.486 549 2HD1 LEU 79 2HD1 LEU 79 0.349 0.082 4.101 550 3HD1 LEU 79 3HD1 LEU 79 0.623 1.666 4.827 551 1HD2 LEU 79 1HD2 LEU 79 3.152 1.979 5.284 552 2HD2 LEU 79 2HD2 LEU 79 2.889 2.977 3.854 553 3HD2 LEU 79 3HD2 LEU 79 4.200 1.797 3.877 554 H ARG 80 H ARG 80 0.816 -2.280 0.917 555 HA ARG 80 HA ARG 80 3.206 -3.117 -0.589 556 1HB ARG 80 1HB ARG 80 0.368 -4.142 -0.677 557 2HB ARG 80 2HB ARG 80 1.581 -4.562 -1.878 558 1HG ARG 80 1HG ARG 80 2.990 -5.452 -0.005 559 2HG ARG 80 2HG ARG 80 1.599 -5.217 1.055 560 1HD ARG 80 1HD ARG 80 1.672 -6.941 -1.419 561 2HD ARG 80 2HD ARG 80 1.729 -7.520 0.246 562 HE ARG 80 HE ARG 80 -0.562 -6.055 0.131 563 1HH1 ARG 80 1HH1 ARG 80 0.728 -8.718 -1.704 564 2HH1 ARG 80 2HH1 ARG 80 -0.828 -9.377 -2.087 565 1HH2 ARG 80 1HH2 ARG 80 -2.616 -6.913 -0.367 566 2HH2 ARG 80 2HH2 ARG 80 -2.729 -8.350 -1.327 567 H ILE 81 H ILE 81 3.423 -2.516 -2.735 568 HA ILE 81 HA ILE 81 1.384 -0.787 -3.910 569 HB ILE 81 HB ILE 81 4.264 0.095 -3.826 570 1HG1 ILE 81 1HG1 ILE 81 1.958 1.027 -2.102 571 2HG1 ILE 81 2HG1 ILE 81 3.356 0.113 -1.547 572 1HG2 ILE 81 1HG2 ILE 81 3.593 1.999 -4.917 573 2HG2 ILE 81 2HG2 ILE 81 2.499 0.812 -5.624 574 3HG2 ILE 81 3HG2 ILE 81 1.932 1.877 -4.338 575 1HD1 ILE 81 1HD1 ILE 81 4.312 2.416 -2.879 576 2HD1 ILE 81 2HD1 ILE 81 3.042 2.918 -1.763 577 3HD1 ILE 81 3HD1 ILE 81 4.427 2.003 -1.169 578 H ARG 82 H ARG 82 1.016 -2.379 -5.453 579 HA ARG 82 HA ARG 82 3.032 -3.668 -6.943 580 1HB ARG 82 1HB ARG 82 0.388 -4.062 -6.675 581 2HB ARG 82 2HB ARG 82 0.390 -3.217 -8.217 582 1HG ARG 82 1HG ARG 82 1.252 -4.966 -9.318 583 2HG ARG 82 2HG ARG 82 2.367 -5.368 -8.010 584 1HD ARG 82 1HD ARG 82 -0.580 -6.005 -8.103 585 2HD ARG 82 2HD ARG 82 0.739 -7.149 -8.349 586 HE ARG 82 HE ARG 82 -0.234 -6.132 -5.840 587 1HH1 ARG 82 1HH1 ARG 82 2.476 -7.545 -7.507 588 2HH1 ARG 82 2HH1 ARG 82 3.192 -8.190 -6.067 589 1HH2 ARG 82 1HH2 ARG 82 0.699 -6.976 -3.938 590 2HH2 ARG 82 2HH2 ARG 82 2.180 -7.867 -4.038 591 H SER 83 H SER 83 4.397 -2.777 -8.329 592 HA SER 83 HA SER 83 3.457 -0.522 -9.979 593 1HB SER 83 1HB SER 83 6.280 -0.412 -9.812 594 2HB SER 83 2HB SER 83 5.115 0.722 -9.130 595 HG SER 83 HG SER 83 6.739 -0.891 -7.829 596 H LYS 84 H LYS 84 4.704 -0.263 -12.025 597 HA LYS 84 HA LYS 84 4.704 -2.703 -13.475 598 1HB LYS 84 1HB LYS 84 5.789 0.004 -14.275 599 2HB LYS 84 2HB LYS 84 5.477 -1.338 -15.368 600 1HG LYS 84 1HG LYS 84 3.060 -1.208 -14.527 601 2HG LYS 84 2HG LYS 84 3.514 0.376 -13.894 602 1HD LYS 84 1HD LYS 84 2.815 1.045 -15.946 603 2HD LYS 84 2HD LYS 84 4.472 0.619 -16.380 604 1HE LYS 84 1HE LYS 84 3.593 -1.690 -16.925 605 2HE LYS 84 2HE LYS 84 1.973 -1.014 -16.766 606 1HZ LYS 84 1HZ LYS 84 2.223 0.265 -18.636 607 2HZ LYS 84 2HZ LYS 84 3.122 -1.099 -19.073 608 3HZ LYS 84 3HZ LYS 84 3.912 0.300 -18.541 609 H LYS 85 H LYS 85 7.224 -0.719 -12.047 610 HA LYS 85 HA LYS 85 9.413 -2.052 -13.280 611 1HB LYS 85 1HB LYS 85 9.128 -0.224 -10.915 612 2HB LYS 85 2HB LYS 85 10.663 -1.012 -11.252 613 1HG LYS 85 1HG LYS 85 9.174 0.756 -13.182 614 2HG LYS 85 2HG LYS 85 10.526 1.267 -12.168 615 1HD LYS 85 1HD LYS 85 11.949 0.544 -13.714 616 2HD LYS 85 2HD LYS 85 11.311 -1.092 -13.534 617 1HE LYS 85 1HE LYS 85 9.973 -0.917 -15.369 618 2HE LYS 85 2HE LYS 85 9.730 0.817 -15.162 619 1HZ LYS 85 1HZ LYS 85 12.128 1.053 -15.858 620 2HZ LYS 85 2HZ LYS 85 11.047 0.576 -17.069 621 3HZ LYS 85 3HZ LYS 85 12.064 -0.567 -16.345 622 H ASN 86 H ASN 86 7.976 -2.288 -10.029 623 HA ASN 86 HA ASN 86 8.265 -5.070 -9.846 624 1HB ASN 86 1HB ASN 86 10.061 -5.007 -7.991 625 2HB ASN 86 2HB ASN 86 10.598 -4.898 -9.665 626 1HD2 ASN 86 1HD2 ASN 86 11.667 -3.128 -10.337 627 2HD2 ASN 86 2HD2 ASN 86 12.037 -1.772 -9.332 628 H GLU 87 H GLU 87 7.713 -5.902 -7.697 629 HA GLU 87 HA GLU 87 5.897 -4.067 -6.345 630 1HB GLU 87 1HB GLU 87 5.038 -6.086 -5.226 631 2HB GLU 87 2HB GLU 87 5.017 -6.244 -6.977 632 1HG GLU 87 1HG GLU 87 6.146 -8.130 -6.803 633 2HG GLU 87 2HG GLU 87 7.498 -7.245 -6.097 634 H ILE 88 H ILE 88 6.462 -3.032 -4.560 635 HA ILE 88 HA ILE 88 8.615 -4.166 -2.896 636 HB ILE 88 HB ILE 88 7.877 -1.248 -3.133 637 1HG1 ILE 88 1HG1 ILE 88 10.248 -2.698 -4.328 638 2HG1 ILE 88 2HG1 ILE 88 8.830 -2.185 -5.236 639 1HG2 ILE 88 1HG2 ILE 88 9.302 -0.851 -1.467 640 2HG2 ILE 88 2HG2 ILE 88 9.249 -2.583 -1.143 641 3HG2 ILE 88 3HG2 ILE 88 10.527 -1.914 -2.158 642 1HD1 ILE 88 1HD1 ILE 88 10.694 -0.644 -5.514 643 2HD1 ILE 88 2HD1 ILE 88 9.327 0.136 -4.718 644 3HD1 ILE 88 3HD1 ILE 88 10.729 -0.367 -3.773 645 H MET 89 H MET 89 7.526 -5.220 -1.319 646 HA MET 89 HA MET 89 5.299 -3.872 0.017 647 1HB MET 89 1HB MET 89 5.011 -6.091 1.164 648 2HB MET 89 2HB MET 89 4.800 -6.127 -0.581 649 1HG MET 89 1HG MET 89 6.940 -7.117 -0.897 650 2HG MET 89 2HG MET 89 7.365 -6.873 0.795 651 1HE MET 89 1HE MET 89 6.595 -9.933 2.436 652 2HE MET 89 2HE MET 89 7.868 -9.839 1.219 653 3HE MET 89 3HE MET 89 7.511 -8.439 2.232 654 H VAL 90 H VAL 90 5.476 -2.989 1.981 655 HA VAL 90 HA VAL 90 7.738 -3.737 3.691 656 HB VAL 90 HB VAL 90 6.985 -0.886 3.031 657 1HG1 VAL 90 1HG1 VAL 90 7.702 -0.533 5.135 658 2HG1 VAL 90 2HG1 VAL 90 8.522 -2.093 5.228 659 3HG1 VAL 90 3HG1 VAL 90 9.302 -0.732 4.420 660 1HG2 VAL 90 1HG2 VAL 90 9.676 -1.246 2.532 661 2HG2 VAL 90 2HG2 VAL 90 8.941 -2.733 1.933 662 3HG2 VAL 90 3HG2 VAL 90 8.394 -1.172 1.323 663 H ALA 91 H ALA 91 7.359 -3.586 5.883 664 HA ALA 91 HA ALA 91 4.876 -2.417 6.840 665 1HB ALA 91 1HB ALA 91 3.730 -4.295 7.123 666 2HB ALA 91 2HB ALA 91 4.993 -5.154 6.240 667 3HB ALA 91 3HB ALA 91 5.072 -5.034 7.998 668 HA PRO 92 HA PRO 92 7.229 -1.552 10.442 669 1HB PRO 92 1HB PRO 92 5.347 -1.697 12.392 670 2HB PRO 92 2HB PRO 92 5.414 -0.377 11.218 671 1HG PRO 92 1HG PRO 92 3.676 -2.815 11.231 672 2HG PRO 92 2HG PRO 92 3.247 -1.137 10.851 673 1HD PRO 92 1HD PRO 92 3.702 -2.994 8.934 674 2HD PRO 92 2HD PRO 92 4.085 -1.275 8.708 675 H ASP 93 H ASP 93 8.697 -3.137 10.857 676 HA ASP 93 HA ASP 93 7.901 -5.730 11.832 677 1HB ASP 93 1HB ASP 93 10.150 -4.709 10.534 678 2HB ASP 93 2HB ASP 93 10.723 -5.125 12.147 679 H LYS 94 H LYS 94 9.792 -6.353 13.706 680 HA LYS 94 HA LYS 94 8.648 -5.613 16.098 681 1HB LYS 94 1HB LYS 94 10.950 -7.092 15.260 682 2HB LYS 94 2HB LYS 94 11.403 -6.065 16.613 683 1HG LYS 94 1HG LYS 94 9.778 -7.047 18.024 684 2HG LYS 94 2HG LYS 94 9.001 -7.870 16.669 685 1HD LYS 94 1HD LYS 94 10.226 -9.629 17.375 686 2HD LYS 94 2HD LYS 94 11.513 -8.843 16.457 687 1HE LYS 94 1HE LYS 94 12.425 -7.859 18.412 688 2HE LYS 94 2HE LYS 94 11.007 -8.284 19.370 689 1HZ LYS 94 1HZ LYS 94 11.655 -10.680 18.795 690 2HZ LYS 94 2HZ LYS 94 12.565 -9.868 19.966 691 3HZ LYS 94 3HZ LYS 94 13.168 -10.039 18.394 692 H ASP 95 H ASP 95 11.618 -4.269 14.660 693 HA ASP 95 HA ASP 95 11.036 -1.702 15.896 694 1HB ASP 95 1HB ASP 95 12.894 -3.503 17.061 695 2HB ASP 95 2HB ASP 95 13.823 -2.198 16.328 696 H TYR 96 H TYR 96 11.469 -3.129 13.196 697 HA TYR 96 HA TYR 96 12.989 -0.936 12.011 698 1HB TYR 96 1HB TYR 96 14.113 -2.692 10.493 699 2HB TYR 96 2HB TYR 96 14.744 -2.486 12.123 700 HD1 TYR 96 HD1 TYR 96 13.089 -4.743 9.808 701 HD2 TYR 96 HD2 TYR 96 14.266 -4.183 13.858 702 HE1 TYR 96 HE1 TYR 96 12.770 -7.146 10.226 703 HE2 TYR 96 HE2 TYR 96 13.952 -6.584 14.287 704 HH TYR 96 HH TYR 96 13.981 -8.729 12.859 705 H PHE 97 H PHE 97 12.927 -1.288 9.480 706 HA PHE 97 HA PHE 97 10.168 -2.058 8.787 707 1HB PHE 97 1HB PHE 97 11.842 0.266 7.859 708 2HB PHE 97 2HB PHE 97 10.463 -0.305 6.926 709 HD1 PHE 97 HD1 PHE 97 8.264 -0.640 8.410 710 HD2 PHE 97 HD2 PHE 97 11.482 1.996 9.311 711 HE1 PHE 97 HE1 PHE 97 6.758 0.717 9.805 712 HE2 PHE 97 HE2 PHE 97 9.982 3.356 10.708 713 HZ PHE 97 HZ PHE 97 7.616 2.717 10.957 714 H LEU 98 H LEU 98 10.341 -3.982 7.806 715 HA LEU 98 HA LEU 98 12.592 -4.726 6.208 716 1HB LEU 98 1HB LEU 98 10.833 -6.157 7.573 717 2HB LEU 98 2HB LEU 98 10.005 -6.180 6.018 718 HG LEU 98 HG LEU 98 12.876 -6.981 6.135 719 1HD1 LEU 98 1HD1 LEU 98 12.359 -9.213 6.763 720 2HD1 LEU 98 2HD1 LEU 98 10.628 -8.877 6.778 721 3HD1 LEU 98 3HD1 LEU 98 11.677 -8.155 7.998 722 1HD2 LEU 98 1HD2 LEU 98 11.018 -6.808 4.137 723 2HD2 LEU 98 2HD2 LEU 98 10.935 -8.514 4.576 724 3HD2 LEU 98 3HD2 LEU 98 12.475 -7.801 4.092 725 H ILE 99 H ILE 99 12.838 -4.721 4.035 726 HA ILE 99 HA ILE 99 10.572 -3.787 2.403 727 HB ILE 99 HB ILE 99 13.438 -2.946 1.973 728 1HG1 ILE 99 1HG1 ILE 99 11.780 -0.735 2.609 729 2HG1 ILE 99 2HG1 ILE 99 11.498 -1.960 3.841 730 1HG2 ILE 99 1HG2 ILE 99 10.846 -2.101 0.690 731 2HG2 ILE 99 2HG2 ILE 99 12.395 -1.299 0.434 732 3HG2 ILE 99 3HG2 ILE 99 12.176 -2.975 -0.070 733 1HD1 ILE 99 1HD1 ILE 99 13.278 -0.345 4.415 734 2HD1 ILE 99 2HD1 ILE 99 13.827 -2.021 4.390 735 3HD1 ILE 99 3HD1 ILE 99 14.215 -0.946 3.047 736 H VAL 100 H VAL 100 10.038 -5.542 1.255 737 HA VAL 100 HA VAL 100 12.160 -7.220 0.125 738 HB VAL 100 HB VAL 100 9.182 -7.712 0.281 739 1HG1 VAL 100 1HG1 VAL 100 10.080 -10.113 -0.236 740 2HG1 VAL 100 2HG1 VAL 100 9.801 -8.966 -1.547 741 3HG1 VAL 100 3HG1 VAL 100 11.437 -9.236 -0.943 742 1HG2 VAL 100 1HG2 VAL 100 10.071 -9.580 1.847 743 2HG2 VAL 100 2HG2 VAL 100 11.500 -8.555 1.976 744 3HG2 VAL 100 3HG2 VAL 100 9.923 -7.935 2.466 745 H ILE 101 H ILE 101 12.828 -6.670 -1.838 746 HA ILE 101 HA ILE 101 10.861 -5.589 -3.747 747 HB ILE 101 HB ILE 101 13.861 -5.237 -3.732 748 1HG1 ILE 101 1HG1 ILE 101 12.094 -2.889 -3.560 749 2HG1 ILE 101 2HG1 ILE 101 12.031 -3.951 -2.157 750 1HG2 ILE 101 1HG2 ILE 101 11.771 -4.090 -5.579 751 2HG2 ILE 101 2HG2 ILE 101 13.486 -3.683 -5.587 752 3HG2 ILE 101 3HG2 ILE 101 12.966 -5.318 -5.995 753 1HD1 ILE 101 1HD1 ILE 101 14.662 -3.783 -2.384 754 2HD1 ILE 101 2HD1 ILE 101 14.238 -2.258 -3.162 755 3HD1 ILE 101 3HD1 ILE 101 13.712 -2.581 -1.510 756 H GLN 102 H GLN 102 10.345 -6.804 -5.439 757 HA GLN 102 HA GLN 102 12.226 -8.424 -6.835 758 1HB GLN 102 1HB GLN 102 11.319 -10.605 -6.383 759 2HB GLN 102 2HB GLN 102 11.764 -9.861 -4.853 760 1HG GLN 102 1HG GLN 102 9.417 -9.265 -4.472 761 2HG GLN 102 2HG GLN 102 8.984 -10.048 -5.991 762 1HE2 GLN 102 1HE2 GLN 102 8.975 -10.451 -2.775 763 2HE2 GLN 102 2HE2 GLN 102 9.059 -12.174 -2.677 764 H ASN 103 H ASN 103 10.963 -9.895 -8.464 765 HA ASN 103 HA ASN 103 9.505 -8.273 -10.158 766 1HB ASN 103 1HB ASN 103 10.060 -11.157 -9.958 767 2HB ASN 103 2HB ASN 103 8.590 -10.758 -10.843 768 1HD2 ASN 103 1HD2 ASN 103 12.052 -10.435 -10.736 769 2HD2 ASN 103 2HD2 ASN 103 12.255 -9.927 -12.375 770 HA PRO 104 HA PRO 104 5.360 -8.105 -8.732 771 1HB PRO 104 1HB PRO 104 3.934 -8.334 -11.031 772 2HB PRO 104 2HB PRO 104 4.859 -6.886 -10.614 773 1HG PRO 104 1HG PRO 104 5.596 -9.146 -12.434 774 2HG PRO 104 2HG PRO 104 5.818 -7.402 -12.669 775 1HD PRO 104 1HD PRO 104 7.828 -9.032 -11.870 776 2HD PRO 104 2HD PRO 104 7.709 -7.338 -11.352 777 H THR 105 H THR 105 3.601 -9.354 -8.140 778 HA THR 105 HA THR 105 3.759 -12.197 -8.896 779 HB THR 105 HB THR 105 2.536 -12.630 -6.749 780 HG1 THR 105 HG1 THR 105 2.032 -11.001 -5.461 781 1HG2 THR 105 1HG2 THR 105 5.258 -12.080 -7.182 782 2HG2 THR 105 2HG2 THR 105 4.550 -13.052 -5.892 783 3HG2 THR 105 3HG2 THR 105 4.847 -11.332 -5.639 784 H GLU 106 H GLU 106 1.605 -9.458 -8.426 785 HA GLU 106 HA GLU 106 -0.701 -11.024 -9.285 786 1HB GLU 106 1HB GLU 106 -0.418 -8.924 -7.515 787 2HB GLU 106 2HB GLU 106 -1.108 -8.151 -8.935 788 1HG GLU 106 1HG GLU 106 -3.073 -8.779 -8.105 789 2HG GLU 106 2HG GLU 106 -2.655 -10.387 -8.695 790 H MET 11 H MET 11 -18.695 3.542 -16.018 791 HA MET 11 HA MET 11 -18.866 3.261 -13.291 792 1HB MET 11 1HB MET 11 -20.195 4.839 -14.712 793 2HB MET 11 2HB MET 11 -21.241 3.494 -15.145 794 1HG MET 11 1HG MET 11 -22.365 4.624 -13.437 795 2HG MET 11 2HG MET 11 -21.660 3.206 -12.665 796 1HE MET 11 1HE MET 11 -21.411 3.426 -10.593 797 2HE MET 11 2HE MET 11 -19.684 3.698 -10.363 798 3HE MET 11 3HE MET 11 -20.856 4.784 -9.614 799 H ALA 12 H ALA 12 -20.573 1.311 -15.734 800 HA ALA 12 HA ALA 12 -21.972 -0.381 -14.063 801 1HB ALA 12 1HB ALA 12 -21.108 -0.411 -16.834 802 2HB ALA 12 2HB ALA 12 -21.206 -2.030 -16.141 803 3HB ALA 12 3HB ALA 12 -22.616 -0.972 -16.113 804 H GLU 13 H GLU 13 -18.606 -0.610 -15.121 805 HA GLU 13 HA GLU 13 -17.968 -3.137 -14.200 806 1HB GLU 13 1HB GLU 13 -16.564 -1.130 -15.351 807 2HB GLU 13 2HB GLU 13 -15.935 -1.046 -13.711 808 1HG GLU 13 1HG GLU 13 -15.175 -3.298 -13.802 809 2HG GLU 13 2HG GLU 13 -16.009 -3.577 -15.330 810 H VAL 14 H VAL 14 -17.730 -0.062 -12.418 811 HA VAL 14 HA VAL 14 -16.895 -1.196 -9.979 812 HB VAL 14 HB VAL 14 -18.469 1.360 -10.287 813 1HG1 VAL 14 1HG1 VAL 14 -16.556 1.722 -8.354 814 2HG1 VAL 14 2HG1 VAL 14 -18.254 1.341 -8.061 815 3HG1 VAL 14 3HG1 VAL 14 -17.053 0.050 -8.099 816 1HG2 VAL 14 1HG2 VAL 14 -16.796 1.917 -11.702 817 2HG2 VAL 14 2HG2 VAL 14 -15.913 2.190 -10.200 818 3HG2 VAL 14 3HG2 VAL 14 -15.709 0.675 -11.079 819 H GLU 15 H GLU 15 -20.079 -0.570 -11.337 820 HA GLU 15 HA GLU 15 -21.571 -1.039 -8.985 821 1HB GLU 15 1HB GLU 15 -22.265 -1.177 -11.913 822 2HB GLU 15 2HB GLU 15 -23.446 -1.528 -10.659 823 1HG GLU 15 1HG GLU 15 -23.210 0.698 -9.757 824 2HG GLU 15 2HG GLU 15 -21.933 1.060 -10.917 825 H GLU 16 H GLU 16 -20.403 -3.159 -11.547 826 HA GLU 16 HA GLU 16 -21.823 -5.471 -10.766 827 1HB GLU 16 1HB GLU 16 -20.190 -4.809 -12.864 828 2HB GLU 16 2HB GLU 16 -19.178 -5.926 -11.960 829 1HG GLU 16 1HG GLU 16 -20.722 -7.679 -12.185 830 2HG GLU 16 2HG GLU 16 -22.004 -6.590 -12.709 831 H THR 17 H THR 17 -18.748 -4.103 -9.767 832 HA THR 17 HA THR 17 -18.014 -6.403 -8.189 833 HB THR 17 HB THR 17 -16.807 -3.632 -8.300 834 HG1 THR 17 HG1 THR 17 -16.696 -5.128 -10.196 835 1HG2 THR 17 1HG2 THR 17 -14.851 -4.720 -7.208 836 2HG2 THR 17 2HG2 THR 17 -15.841 -6.158 -6.958 837 3HG2 THR 17 3HG2 THR 17 -16.278 -4.640 -6.176 838 H LEU 18 H LEU 18 -19.689 -3.398 -7.701 839 HA LEU 18 HA LEU 18 -19.464 -3.377 -4.848 840 1HB LEU 18 1HB LEU 18 -20.658 -1.735 -6.916 841 2HB LEU 18 2HB LEU 18 -21.716 -1.897 -5.515 842 HG LEU 18 HG LEU 18 -19.499 -1.244 -4.221 843 1HD1 LEU 18 1HD1 LEU 18 -19.108 -0.120 -6.985 844 2HD1 LEU 18 2HD1 LEU 18 -18.008 -1.152 -6.073 845 3HD1 LEU 18 3HD1 LEU 18 -18.300 0.506 -5.548 846 1HD2 LEU 18 1HD2 LEU 18 -21.226 0.748 -5.687 847 2HD2 LEU 18 2HD2 LEU 18 -20.258 1.069 -4.249 848 3HD2 LEU 18 3HD2 LEU 18 -21.629 -0.037 -4.160 849 H LYS 19 H LYS 19 -21.957 -4.377 -7.158 850 HA LYS 19 HA LYS 19 -23.980 -5.020 -5.357 851 1HB LYS 19 1HB LYS 19 -24.463 -4.964 -7.699 852 2HB LYS 19 2HB LYS 19 -23.266 -6.208 -8.038 853 1HG LYS 19 1HG LYS 19 -24.754 -7.818 -7.724 854 2HG LYS 19 2HG LYS 19 -25.212 -7.167 -6.148 855 1HD LYS 19 1HD LYS 19 -27.204 -6.846 -7.164 856 2HD LYS 19 2HD LYS 19 -26.421 -5.385 -7.771 857 1HE LYS 19 1HE LYS 19 -25.673 -7.429 -9.529 858 2HE LYS 19 2HE LYS 19 -27.389 -7.684 -9.213 859 1HZ LYS 19 1HZ LYS 19 -27.915 -5.927 -10.439 860 2HZ LYS 19 2HZ LYS 19 -26.310 -5.887 -10.971 861 3HZ LYS 19 3HZ LYS 19 -26.791 -4.932 -9.660 862 H ARG 20 H ARG 20 -21.447 -7.133 -6.700 863 HA ARG 20 HA ARG 20 -22.171 -9.443 -5.281 864 1HB ARG 20 1HB ARG 20 -20.538 -9.167 -7.263 865 2HB ARG 20 2HB ARG 20 -19.333 -8.801 -6.035 866 1HG ARG 20 1HG ARG 20 -18.968 -11.018 -6.151 867 2HG ARG 20 2HG ARG 20 -20.322 -11.075 -5.021 868 1HD ARG 20 1HD ARG 20 -21.496 -12.276 -6.472 869 2HD ARG 20 2HD ARG 20 -21.368 -10.981 -7.661 870 HE ARG 20 HE ARG 20 -18.976 -12.385 -7.725 871 1HH1 ARG 20 1HH1 ARG 20 -22.346 -12.978 -8.362 872 2HH1 ARG 20 2HH1 ARG 20 -22.041 -14.191 -9.561 873 1HH2 ARG 20 1HH2 ARG 20 -18.560 -13.980 -9.301 874 2HH2 ARG 20 2HH2 ARG 20 -19.887 -14.761 -10.094 875 H LEU 21 H LEU 21 -19.930 -6.822 -4.490 876 HA LEU 21 HA LEU 21 -18.878 -7.940 -2.136 877 1HB LEU 21 1HB LEU 21 -18.945 -5.303 -3.416 878 2HB LEU 21 2HB LEU 21 -18.796 -5.258 -1.660 879 HG LEU 21 HG LEU 21 -16.761 -6.567 -1.766 880 1HD1 LEU 21 1HD1 LEU 21 -17.727 -7.207 -4.388 881 2HD1 LEU 21 2HD1 LEU 21 -16.420 -7.948 -3.465 882 3HD1 LEU 21 3HD1 LEU 21 -16.093 -6.549 -4.488 883 1HD2 LEU 21 1HD2 LEU 21 -16.217 -4.330 -1.856 884 2HD2 LEU 21 2HD2 LEU 21 -16.978 -4.096 -3.429 885 3HD2 LEU 21 3HD2 LEU 21 -15.434 -4.942 -3.313 886 H GLN 22 H GLN 22 -21.427 -5.471 -2.509 887 HA GLN 22 HA GLN 22 -22.155 -5.370 0.192 888 1HB GLN 22 1HB GLN 22 -23.065 -4.242 -2.266 889 2HB GLN 22 2HB GLN 22 -24.460 -4.873 -1.400 890 1HG GLN 22 1HG GLN 22 -24.087 -2.548 -0.849 891 2HG GLN 22 2HG GLN 22 -23.835 -3.569 0.565 892 1HE2 GLN 22 1HE2 GLN 22 -22.583 -1.105 -1.291 893 2HE2 GLN 22 2HE2 GLN 22 -20.963 -1.113 -0.692 894 H SER 23 H SER 23 -22.774 -7.735 -2.208 895 HA SER 23 HA SER 23 -25.122 -8.833 -0.939 896 1HB SER 23 1HB SER 23 -23.579 -9.335 -3.393 897 2HB SER 23 2HB SER 23 -24.244 -10.788 -2.646 898 HG SER 23 HG SER 23 -25.507 -8.950 -4.098 899 H GLN 24 H GLN 24 -21.703 -9.222 -0.716 900 HA GLN 24 HA GLN 24 -22.004 -11.707 0.814 901 1HB GLN 24 1HB GLN 24 -19.570 -11.931 0.592 902 2HB GLN 24 2HB GLN 24 -20.348 -11.772 -0.977 903 1HG GLN 24 1HG GLN 24 -19.514 -9.650 -1.328 904 2HG GLN 24 2HG GLN 24 -19.250 -9.359 0.390 905 1HE2 GLN 24 1HE2 GLN 24 -17.247 -8.700 -1.191 906 2HE2 GLN 24 2HE2 GLN 24 -15.952 -9.840 -1.099 907 H LYS 25 H LYS 25 -20.791 -11.933 2.822 908 HA LYS 25 HA LYS 25 -21.133 -9.611 4.492 909 1HB LYS 25 1HB LYS 25 -21.154 -12.387 4.883 910 2HB LYS 25 2HB LYS 25 -19.758 -11.806 5.781 911 1HG LYS 25 1HG LYS 25 -21.678 -11.864 7.224 912 2HG LYS 25 2HG LYS 25 -21.210 -10.186 6.938 913 1HD LYS 25 1HD LYS 25 -23.092 -9.722 5.746 914 2HD LYS 25 2HD LYS 25 -23.214 -11.359 5.097 915 1HE LYS 25 1HE LYS 25 -23.579 -11.479 7.916 916 2HE LYS 25 2HE LYS 25 -24.619 -10.207 7.277 917 1HZ LYS 25 1HZ LYS 25 -24.701 -13.087 6.806 918 2HZ LYS 25 2HZ LYS 25 -25.122 -12.084 5.512 919 3HZ LYS 25 3HZ LYS 25 -25.971 -11.981 6.971 920 H GLY 26 H GLY 26 -19.420 -8.910 6.016 921 1HA GLY 26 1HA GLY 26 -17.120 -8.643 6.571 922 2HA GLY 26 2HA GLY 26 -16.695 -9.280 4.990 923 H VAL 27 H VAL 27 -18.208 -7.719 3.315 924 HA VAL 27 HA VAL 27 -16.652 -5.462 2.954 925 HB VAL 27 HB VAL 27 -19.508 -5.881 2.059 926 1HG1 VAL 27 1HG1 VAL 27 -19.223 -3.633 1.686 927 2HG1 VAL 27 2HG1 VAL 27 -17.481 -3.782 1.447 928 3HG1 VAL 27 3HG1 VAL 27 -18.593 -4.299 0.180 929 1HG2 VAL 27 1HG2 VAL 27 -16.970 -7.010 1.219 930 2HG2 VAL 27 2HG2 VAL 27 -18.613 -7.491 0.798 931 3HG2 VAL 27 3HG2 VAL 27 -17.814 -6.203 -0.103 932 H GLN 28 H GLN 28 -16.640 -3.437 3.733 933 HA GLN 28 HA GLN 28 -18.638 -2.765 5.772 934 1HB GLN 28 1HB GLN 28 -15.779 -2.222 5.424 935 2HB GLN 28 2HB GLN 28 -16.709 -0.813 5.918 936 1HG GLN 28 1HG GLN 28 -15.724 -2.138 7.786 937 2HG GLN 28 2HG GLN 28 -17.467 -1.893 7.885 938 1HE2 GLN 28 1HE2 GLN 28 -14.940 -4.150 7.792 939 2HE2 GLN 28 2HE2 GLN 28 -15.900 -5.586 7.763 940 H GLY 29 H GLY 29 -17.315 -1.728 2.713 941 1HA GLY 29 1HA GLY 29 -19.467 -0.344 1.792 942 2HA GLY 29 2HA GLY 29 -18.605 0.848 2.754 943 H ILE 30 H ILE 30 -19.131 0.539 -0.203 944 HA ILE 30 HA ILE 30 -16.325 0.718 -1.088 945 HB ILE 30 HB ILE 30 -18.648 -0.013 -2.864 946 1HG1 ILE 30 1HG1 ILE 30 -17.023 -2.264 -2.539 947 2HG1 ILE 30 2HG1 ILE 30 -17.235 -1.630 -0.911 948 1HG2 ILE 30 1HG2 ILE 30 -16.795 -0.875 -4.309 949 2HG2 ILE 30 2HG2 ILE 30 -16.806 0.874 -4.090 950 3HG2 ILE 30 3HG2 ILE 30 -15.657 -0.120 -3.195 951 1HD1 ILE 30 1HD1 ILE 30 -19.758 -1.590 -2.194 952 2HD1 ILE 30 2HD1 ILE 30 -19.029 -3.174 -2.458 953 3HD1 ILE 30 3HD1 ILE 30 -19.233 -2.559 -0.818 954 H ILE 31 H ILE 31 -15.724 2.693 -1.652 955 HA ILE 31 HA ILE 31 -17.788 4.600 -2.531 956 HB ILE 31 HB ILE 31 -15.082 5.226 -1.346 957 1HG1 ILE 31 1HG1 ILE 31 -17.325 6.081 0.240 958 2HG1 ILE 31 2HG1 ILE 31 -17.442 4.352 -0.064 959 1HG2 ILE 31 1HG2 ILE 31 -15.783 6.991 -2.790 960 2HG2 ILE 31 2HG2 ILE 31 -17.415 6.963 -2.123 961 3HG2 ILE 31 3HG2 ILE 31 -16.066 7.515 -1.130 962 1HD1 ILE 31 1HD1 ILE 31 -14.821 5.422 0.808 963 2HD1 ILE 31 2HD1 ILE 31 -16.120 5.330 1.998 964 3HD1 ILE 31 3HD1 ILE 31 -15.590 3.874 1.156 965 H VAL 32 H VAL 32 -17.448 5.864 -4.345 966 HA VAL 32 HA VAL 32 -15.092 5.195 -5.982 967 HB VAL 32 HB VAL 32 -17.853 5.660 -7.106 968 1HG1 VAL 32 1HG1 VAL 32 -15.384 4.496 -8.386 969 2HG1 VAL 32 2HG1 VAL 32 -16.920 4.860 -9.174 970 3HG1 VAL 32 3HG1 VAL 32 -15.909 6.170 -8.562 971 1HG2 VAL 32 1HG2 VAL 32 -17.791 3.604 -5.744 972 2HG2 VAL 32 2HG2 VAL 32 -18.016 3.270 -7.461 973 3HG2 VAL 32 3HG2 VAL 32 -16.437 3.025 -6.715 974 H VAL 33 H VAL 33 -13.912 7.003 -5.984 975 HA VAL 33 HA VAL 33 -15.281 9.588 -6.298 976 HB VAL 33 HB VAL 33 -12.393 9.236 -5.529 977 1HG1 VAL 33 1HG1 VAL 33 -14.397 11.466 -5.349 978 2HG1 VAL 33 2HG1 VAL 33 -12.906 11.464 -4.405 979 3HG1 VAL 33 3HG1 VAL 33 -12.835 11.453 -6.168 980 1HG2 VAL 33 1HG2 VAL 33 -13.605 7.982 -3.890 981 2HG2 VAL 33 2HG2 VAL 33 -13.157 9.528 -3.168 982 3HG2 VAL 33 3HG2 VAL 33 -14.809 9.260 -3.726 983 H ASN 34 H ASN 34 -14.358 11.169 -7.735 984 HA ASN 34 HA ASN 34 -13.130 9.916 -10.088 985 1HB ASN 34 1HB ASN 34 -14.275 12.682 -10.124 986 2HB ASN 34 2HB ASN 34 -14.194 11.490 -11.418 987 1HD2 ASN 34 1HD2 ASN 34 -16.421 13.092 -10.217 988 2HD2 ASN 34 2HD2 ASN 34 -17.641 11.927 -9.844 989 H THR 35 H THR 35 -12.079 12.061 -11.380 990 HA THR 35 HA THR 35 -9.632 12.470 -9.944 991 HB THR 35 HB THR 35 -9.069 13.930 -11.970 992 HG1 THR 35 HG1 THR 35 -10.593 14.234 -13.406 993 1HG2 THR 35 1HG2 THR 35 -9.706 11.393 -13.210 994 2HG2 THR 35 2HG2 THR 35 -9.047 11.171 -11.589 995 3HG2 THR 35 3HG2 THR 35 -8.135 12.078 -12.795 996 H GLU 36 H GLU 36 -12.556 14.248 -10.386 997 HA GLU 36 HA GLU 36 -11.426 16.811 -9.710 998 1HB GLU 36 1HB GLU 36 -14.138 15.761 -10.335 999 2HB GLU 36 2HB GLU 36 -14.042 17.239 -9.389 1000 1HG GLU 36 1HG GLU 36 -12.262 17.663 -11.459 1001 2HG GLU 36 2HG GLU 36 -13.608 16.814 -12.217 1002 H GLY 37 H GLY 37 -13.154 14.233 -8.053 1003 1HA GLY 37 1HA GLY 37 -12.491 13.967 -5.673 1004 2HA GLY 37 2HA GLY 37 -12.743 15.699 -5.520 1005 H ILE 38 H ILE 38 -14.966 14.045 -7.528 1006 HA ILE 38 HA ILE 38 -17.023 14.341 -5.453 1007 HB ILE 38 HB ILE 38 -17.458 13.980 -8.417 1008 1HG1 ILE 38 1HG1 ILE 38 -17.391 16.532 -6.792 1009 2HG1 ILE 38 2HG1 ILE 38 -16.202 16.046 -7.995 1010 1HG2 ILE 38 1HG2 ILE 38 -19.332 15.091 -6.341 1011 2HG2 ILE 38 2HG2 ILE 38 -19.701 14.637 -8.004 1012 3HG2 ILE 38 3HG2 ILE 38 -19.308 13.394 -6.818 1013 1HD1 ILE 38 1HD1 ILE 38 -19.060 16.842 -8.433 1014 2HD1 ILE 38 2HD1 ILE 38 -17.599 17.624 -9.037 1015 3HD1 ILE 38 3HD1 ILE 38 -18.084 16.051 -9.671 1016 HA PRO 39 HA PRO 39 -16.934 9.871 -5.229 1017 1HB PRO 39 1HB PRO 39 -18.743 9.691 -3.213 1018 2HB PRO 39 2HB PRO 39 -17.050 10.125 -2.949 1019 1HG PRO 39 1HG PRO 39 -19.453 11.900 -3.137 1020 2HG PRO 39 2HG PRO 39 -18.095 11.973 -1.999 1021 1HD PRO 39 1HD PRO 39 -18.274 13.594 -4.160 1022 2HD PRO 39 2HD PRO 39 -16.719 13.031 -3.515 1023 H ILE 40 H ILE 40 -17.969 9.786 -7.361 1024 HA ILE 40 HA ILE 40 -20.632 10.149 -7.938 1025 HB ILE 40 HB ILE 40 -20.310 8.194 -9.582 1026 1HG1 ILE 40 1HG1 ILE 40 -17.429 8.526 -8.735 1027 2HG1 ILE 40 2HG1 ILE 40 -18.444 7.191 -8.199 1028 1HG2 ILE 40 1HG2 ILE 40 -19.983 9.984 -10.858 1029 2HG2 ILE 40 2HG2 ILE 40 -19.247 10.871 -9.525 1030 3HG2 ILE 40 3HG2 ILE 40 -18.257 9.819 -10.537 1031 1HD1 ILE 40 1HD1 ILE 40 -16.845 6.983 -10.281 1032 2HD1 ILE 40 2HD1 ILE 40 -18.411 6.174 -10.230 1033 3HD1 ILE 40 3HD1 ILE 40 -18.230 7.689 -11.113 1034 H LYS 41 H LYS 41 -19.097 7.427 -6.323 1035 HA LYS 41 HA LYS 41 -21.777 6.339 -5.759 1036 1HB LYS 41 1HB LYS 41 -19.759 5.068 -7.169 1037 2HB LYS 41 2HB LYS 41 -19.603 4.404 -5.548 1038 1HG LYS 41 1HG LYS 41 -22.075 4.382 -7.266 1039 2HG LYS 41 2HG LYS 41 -21.045 3.004 -6.872 1040 1HD LYS 41 1HD LYS 41 -21.588 3.526 -4.428 1041 2HD LYS 41 2HD LYS 41 -22.873 4.557 -5.062 1042 1HE LYS 41 1HE LYS 41 -22.869 1.947 -6.316 1043 2HE LYS 41 2HE LYS 41 -23.012 1.825 -4.563 1044 1HZ LYS 41 1HZ LYS 41 -25.187 2.065 -5.171 1045 2HZ LYS 41 2HZ LYS 41 -24.843 3.061 -6.494 1046 3HZ LYS 41 3HZ LYS 41 -24.778 3.688 -4.924 1047 H SER 42 H SER 42 -22.237 5.786 -3.677 1048 HA SER 42 HA SER 42 -20.140 5.687 -1.677 1049 1HB SER 42 1HB SER 42 -20.690 8.113 -1.881 1050 2HB SER 42 2HB SER 42 -22.356 7.737 -1.441 1051 HG SER 42 HG SER 42 -21.619 7.010 0.561 1052 H THR 43 H THR 43 -20.652 3.754 -0.857 1053 HA THR 43 HA THR 43 -23.458 3.100 -0.339 1054 HB THR 43 HB THR 43 -22.813 0.828 -0.138 1055 HG1 THR 43 HG1 THR 43 -20.989 0.807 1.065 1056 1HG2 THR 43 1HG2 THR 43 -22.255 2.294 -2.432 1057 2HG2 THR 43 2HG2 THR 43 -22.437 0.543 -2.323 1058 3HG2 THR 43 3HG2 THR 43 -20.836 1.272 -2.212 1059 H MET 44 H MET 44 -20.926 4.497 1.265 1060 HA MET 44 HA MET 44 -21.628 3.343 3.866 1061 1HB MET 44 1HB MET 44 -19.186 4.091 2.761 1062 2HB MET 44 2HB MET 44 -19.549 5.374 3.909 1063 1HG MET 44 1HG MET 44 -19.740 3.796 5.702 1064 2HG MET 44 2HG MET 44 -19.581 2.444 4.584 1065 1HE MET 44 1HE MET 44 -17.778 2.672 2.784 1066 2HE MET 44 2HE MET 44 -16.150 3.300 3.038 1067 3HE MET 44 3HE MET 44 -16.598 1.722 3.687 1068 H ASP 45 H ASP 45 -21.027 5.413 5.549 1069 HA ASP 45 HA ASP 45 -23.412 6.938 5.486 1070 1HB ASP 45 1HB ASP 45 -21.528 6.306 7.403 1071 2HB ASP 45 2HB ASP 45 -21.287 8.035 7.169 1072 H ASN 46 H ASN 46 -23.636 9.238 5.348 1073 HA ASN 46 HA ASN 46 -22.445 10.380 3.101 1074 1HB ASN 46 1HB ASN 46 -24.473 11.081 4.924 1075 2HB ASN 46 2HB ASN 46 -23.331 12.422 4.938 1076 1HD2 ASN 46 1HD2 ASN 46 -22.439 12.339 2.325 1077 2HD2 ASN 46 2HD2 ASN 46 -23.742 12.759 1.271 1078 HA PRO 47 HA PRO 47 -19.670 12.978 6.090 1079 1HB PRO 47 1HB PRO 47 -19.585 12.201 8.690 1080 2HB PRO 47 2HB PRO 47 -20.757 13.373 8.075 1081 1HG PRO 47 1HG PRO 47 -21.107 10.449 8.617 1082 2HG PRO 47 2HG PRO 47 -22.202 11.794 8.986 1083 1HD PRO 47 1HD PRO 47 -22.558 10.171 6.849 1084 2HD PRO 47 2HD PRO 47 -23.020 11.885 6.834 1085 H THR 48 H THR 48 -19.996 9.525 6.510 1086 HA THR 48 HA THR 48 -17.264 9.078 7.267 1087 HB THR 48 HB THR 48 -19.375 7.149 6.282 1088 HG1 THR 48 HG1 THR 48 -19.529 6.643 8.498 1089 1HG2 THR 48 1HG2 THR 48 -16.652 6.621 7.476 1090 2HG2 THR 48 2HG2 THR 48 -17.172 6.241 5.834 1091 3HG2 THR 48 3HG2 THR 48 -17.892 5.397 7.205 1092 H THR 49 H THR 49 -19.111 9.003 4.273 1093 HA THR 49 HA THR 49 -16.945 7.922 2.718 1094 HB THR 49 HB THR 49 -19.585 9.150 1.915 1095 HG1 THR 49 HG1 THR 49 -18.616 6.566 2.372 1096 1HG2 THR 49 1HG2 THR 49 -18.619 9.499 -0.085 1097 2HG2 THR 49 2HG2 THR 49 -18.705 7.747 -0.263 1098 3HG2 THR 49 3HG2 THR 49 -17.220 8.503 0.313 1099 H THR 50 H THR 50 -18.460 11.112 3.093 1100 HA THR 50 HA THR 50 -16.987 12.525 1.215 1101 HB THR 50 HB THR 50 -17.933 13.572 3.890 1102 HG1 THR 50 HG1 THR 50 -19.429 12.515 2.149 1103 1HG2 THR 50 1HG2 THR 50 -16.461 15.162 2.900 1104 2HG2 THR 50 2HG2 THR 50 -18.103 15.723 2.582 1105 3HG2 THR 50 3HG2 THR 50 -17.179 14.930 1.307 1106 H GLN 51 H GLN 51 -16.150 11.617 4.512 1107 HA GLN 51 HA GLN 51 -13.769 13.187 4.625 1108 1HB GLN 51 1HB GLN 51 -14.907 12.521 6.668 1109 2HB GLN 51 2HB GLN 51 -14.667 10.823 6.281 1110 1HG GLN 51 1HG GLN 51 -12.126 12.028 6.235 1111 2HG GLN 51 2HG GLN 51 -12.946 12.615 7.681 1112 1HE2 GLN 51 1HE2 GLN 51 -11.742 9.814 6.001 1113 2HE2 GLN 51 2HE2 GLN 51 -11.784 8.738 7.351 1114 H TYR 52 H TYR 52 -14.457 9.773 3.965 1115 HA TYR 52 HA TYR 52 -11.782 8.934 3.714 1116 1HB TYR 52 1HB TYR 52 -14.427 7.852 2.844 1117 2HB TYR 52 2HB TYR 52 -12.965 7.136 2.176 1118 HD1 TYR 52 HD1 TYR 52 -12.588 5.098 3.192 1119 HD2 TYR 52 HD2 TYR 52 -13.825 8.385 5.593 1120 HE1 TYR 52 HE1 TYR 52 -12.341 3.710 5.207 1121 HE2 TYR 52 HE2 TYR 52 -13.582 7.006 7.615 1122 HH TYR 52 HH TYR 52 -13.669 4.384 8.076 1123 H ALA 53 H ALA 53 -14.157 9.890 1.241 1124 HA ALA 53 HA ALA 53 -12.515 9.578 -0.995 1125 1HB ALA 53 1HB ALA 53 -14.060 11.323 -2.026 1126 2HB ALA 53 2HB ALA 53 -14.810 9.856 -1.397 1127 3HB ALA 53 3HB ALA 53 -14.880 11.351 -0.465 1128 H SER 54 H SER 54 -12.492 11.977 1.470 1129 HA SER 54 HA SER 54 -11.160 14.009 -0.058 1130 1HB SER 54 1HB SER 54 -12.553 14.065 2.263 1131 2HB SER 54 2HB SER 54 -10.905 14.043 2.892 1132 HG SER 54 HG SER 54 -11.381 16.159 2.566 1133 H LEU 55 H LEU 55 -10.075 12.075 2.740 1134 HA LEU 55 HA LEU 55 -7.342 12.673 2.384 1135 1HB LEU 55 1HB LEU 55 -6.963 11.350 4.198 1136 2HB LEU 55 2HB LEU 55 -8.681 11.680 4.413 1137 HG LEU 55 HG LEU 55 -8.885 9.408 3.040 1138 1HD1 LEU 55 1HD1 LEU 55 -7.042 8.186 2.885 1139 2HD1 LEU 55 2HD1 LEU 55 -6.728 8.355 4.612 1140 3HD1 LEU 55 3HD1 LEU 55 -6.124 9.568 3.483 1141 1HD2 LEU 55 1HD2 LEU 55 -9.602 8.497 4.990 1142 2HD2 LEU 55 2HD2 LEU 55 -9.470 10.172 5.525 1143 3HD2 LEU 55 3HD2 LEU 55 -8.181 9.025 5.891 1144 H MET 56 H MET 56 -9.433 10.378 0.889 1145 HA MET 56 HA MET 56 -7.572 8.430 0.100 1146 1HB MET 56 1HB MET 56 -10.267 9.288 -0.820 1147 2HB MET 56 2HB MET 56 -9.320 8.293 -1.917 1148 1HG MET 56 1HG MET 56 -9.940 7.555 0.933 1149 2HG MET 56 2HG MET 56 -10.874 7.022 -0.463 1150 1HE MET 56 1HE MET 56 -8.135 6.861 1.753 1151 2HE MET 56 2HE MET 56 -8.107 5.098 1.777 1152 3HE MET 56 3HE MET 56 -6.798 5.990 1.000 1153 H HIS 57 H HIS 57 -8.892 11.140 -1.814 1154 HA HIS 57 HA HIS 57 -7.266 10.858 -4.039 1155 1HB HIS 57 1HB HIS 57 -9.193 12.362 -3.992 1156 2HB HIS 57 2HB HIS 57 -8.368 13.410 -2.842 1157 HD1 HIS 57 HD1 HIS 57 -6.304 14.771 -3.774 1158 HD2 HIS 57 HD2 HIS 57 -8.563 12.785 -6.641 1159 HE1 HIS 57 HE1 HIS 57 -5.630 15.778 -5.978 1160 H SER 58 H SER 58 -6.584 12.341 -0.943 1161 HA SER 58 HA SER 58 -4.138 13.579 -1.789 1162 1HB SER 58 1HB SER 58 -5.623 14.293 0.175 1163 2HB SER 58 2HB SER 58 -4.896 12.955 1.064 1164 HG SER 58 HG SER 58 -3.647 14.714 1.491 1165 H PHE 59 H PHE 59 -5.076 10.475 -0.572 1166 HA PHE 59 HA PHE 59 -2.567 9.616 0.404 1167 1HB PHE 59 1HB PHE 59 -4.816 8.534 0.839 1168 2HB PHE 59 2HB PHE 59 -4.708 7.845 -0.777 1169 HD1 PHE 59 HD1 PHE 59 -2.552 6.480 -1.285 1170 HD2 PHE 59 HD2 PHE 59 -3.963 7.365 2.632 1171 HE1 PHE 59 HE1 PHE 59 -1.252 4.590 -0.393 1172 HE2 PHE 59 HE2 PHE 59 -2.665 5.477 3.530 1173 HZ PHE 59 HZ PHE 59 -1.307 4.088 2.017 1174 H ILE 60 H ILE 60 -4.206 8.868 -2.675 1175 HA ILE 60 HA ILE 60 -2.132 7.472 -3.877 1176 HB ILE 60 HB ILE 60 -4.167 9.250 -5.226 1177 1HG1 ILE 60 1HG1 ILE 60 -5.221 7.534 -3.854 1178 2HG1 ILE 60 2HG1 ILE 60 -5.416 7.140 -5.559 1179 1HG2 ILE 60 1HG2 ILE 60 -2.212 7.240 -6.272 1180 2HG2 ILE 60 2HG2 ILE 60 -3.729 7.544 -7.118 1181 3HG2 ILE 60 3HG2 ILE 60 -2.579 8.858 -6.871 1182 1HD1 ILE 60 1HD1 ILE 60 -3.058 5.877 -4.780 1183 2HD1 ILE 60 2HD1 ILE 60 -4.196 5.616 -3.457 1184 3HD1 ILE 60 3HD1 ILE 60 -4.623 5.130 -5.097 1185 H LEU 61 H LEU 61 -2.825 10.953 -3.969 1186 HA LEU 61 HA LEU 61 -0.718 11.663 -5.692 1187 1HB LEU 61 1HB LEU 61 -2.709 12.992 -4.116 1188 2HB LEU 61 2HB LEU 61 -1.157 13.803 -3.918 1189 HG LEU 61 HG LEU 61 -1.008 14.194 -6.295 1190 1HD1 LEU 61 1HD1 LEU 61 -3.105 12.172 -6.379 1191 2HD1 LEU 61 2HD1 LEU 61 -1.950 12.664 -7.618 1192 3HD1 LEU 61 3HD1 LEU 61 -3.443 13.576 -7.392 1193 1HD2 LEU 61 1HD2 LEU 61 -3.557 14.982 -4.932 1194 2HD2 LEU 61 2HD2 LEU 61 -3.205 15.512 -6.577 1195 3HD2 LEU 61 3HD2 LEU 61 -2.120 15.953 -5.257 1196 H LYS 62 H LYS 62 -0.801 10.887 -2.326 1197 HA LYS 62 HA LYS 62 1.694 12.139 -1.657 1198 1HB LYS 62 1HB LYS 62 -0.427 10.845 -0.259 1199 2HB LYS 62 2HB LYS 62 1.076 10.036 0.165 1200 1HG LYS 62 1HG LYS 62 0.638 11.793 1.742 1201 2HG LYS 62 2HG LYS 62 2.047 12.221 0.769 1202 1HD LYS 62 1HD LYS 62 1.058 14.081 0.049 1203 2HD LYS 62 2HD LYS 62 -0.369 13.182 -0.470 1204 1HE LYS 62 1HE LYS 62 -1.137 14.742 1.124 1205 2HE LYS 62 2HE LYS 62 -1.087 13.190 1.959 1206 1HZ LYS 62 1HZ LYS 62 -0.009 15.441 2.911 1207 2HZ LYS 62 2HZ LYS 62 1.336 14.764 2.142 1208 3HZ LYS 62 3HZ LYS 62 0.518 13.891 3.338 1209 H ALA 63 H ALA 63 0.665 8.752 -2.082 1210 HA ALA 63 HA ALA 63 3.277 7.676 -1.872 1211 1HB ALA 63 1HB ALA 63 0.636 6.680 -2.187 1212 2HB ALA 63 2HB ALA 63 1.655 5.947 -3.426 1213 3HB ALA 63 3HB ALA 63 2.096 5.806 -1.724 1214 H ARG 64 H ARG 64 1.250 8.563 -4.641 1215 HA ARG 64 HA ARG 64 2.860 7.597 -6.690 1216 1HB ARG 64 1HB ARG 64 0.524 8.609 -6.847 1217 2HB ARG 64 2HB ARG 64 1.315 10.180 -6.853 1218 1HG ARG 64 1HG ARG 64 2.640 8.678 -8.797 1219 2HG ARG 64 2HG ARG 64 0.925 8.320 -9.005 1220 1HD ARG 64 1HD ARG 64 1.972 11.125 -8.734 1221 2HD ARG 64 2HD ARG 64 1.849 10.308 -10.292 1222 HE ARG 64 HE ARG 64 -0.291 11.434 -8.763 1223 1HH1 ARG 64 1HH1 ARG 64 0.540 8.959 -11.067 1224 2HH1 ARG 64 2HH1 ARG 64 -1.060 8.847 -11.721 1225 1HH2 ARG 64 1HH2 ARG 64 -2.402 11.296 -9.616 1226 2HH2 ARG 64 2HH2 ARG 64 -2.732 10.178 -10.896 1227 H SER 65 H SER 65 3.092 10.576 -4.837 1228 HA SER 65 HA SER 65 5.059 11.821 -6.455 1229 1HB SER 65 1HB SER 65 3.525 12.823 -4.588 1230 2HB SER 65 2HB SER 65 4.836 12.347 -3.509 1231 HG SER 65 HG SER 65 6.101 13.838 -4.359 1232 H THR 66 H THR 66 5.185 9.479 -3.880 1233 HA THR 66 HA THR 66 8.036 9.744 -3.487 1234 HB THR 66 HB THR 66 6.648 7.323 -2.490 1235 HG1 THR 66 HG1 THR 66 5.861 8.836 -0.713 1236 1HG2 THR 66 1HG2 THR 66 8.958 7.837 -1.869 1237 2HG2 THR 66 2HG2 THR 66 7.902 7.877 -0.457 1238 3HG2 THR 66 3HG2 THR 66 8.440 9.383 -1.199 1239 H VAL 67 H VAL 67 5.833 7.647 -5.233 1240 HA VAL 67 HA VAL 67 7.457 5.493 -5.822 1241 HB VAL 67 HB VAL 67 5.458 6.817 -7.661 1242 1HG1 VAL 67 1HG1 VAL 67 6.225 5.367 -9.176 1243 2HG1 VAL 67 2HG1 VAL 67 7.176 4.490 -7.977 1244 3HG1 VAL 67 3HG1 VAL 67 5.466 4.114 -8.194 1245 1HG2 VAL 67 1HG2 VAL 67 4.992 5.702 -5.205 1246 2HG2 VAL 67 2HG2 VAL 67 3.805 5.845 -6.502 1247 3HG2 VAL 67 3HG2 VAL 67 4.709 4.345 -6.295 1248 H ARG 68 H ARG 68 7.274 8.629 -7.459 1249 HA ARG 68 HA ARG 68 8.950 8.109 -9.610 1250 1HB ARG 68 1HB ARG 68 8.689 10.694 -8.063 1251 2HB ARG 68 2HB ARG 68 9.348 10.532 -9.685 1252 1HG ARG 68 1HG ARG 68 6.517 9.904 -8.873 1253 2HG ARG 68 2HG ARG 68 7.054 11.362 -9.711 1254 1HD ARG 68 1HD ARG 68 8.032 9.671 -11.436 1255 2HD ARG 68 2HD ARG 68 6.880 8.550 -10.710 1256 HE ARG 68 HE ARG 68 5.171 9.691 -11.729 1257 1HH1 ARG 68 1HH1 ARG 68 8.087 11.585 -11.893 1258 2HH1 ARG 68 2HH1 ARG 68 7.417 12.762 -12.974 1259 1HH2 ARG 68 1HH2 ARG 68 4.277 11.233 -13.152 1260 2HH2 ARG 68 2HH2 ARG 68 5.249 12.561 -13.689 1261 H ASP 69 H ASP 69 9.703 8.567 -6.262 1262 HA ASP 69 HA ASP 69 12.503 9.096 -6.689 1263 1HB ASP 69 1HB ASP 69 10.681 9.231 -4.497 1264 2HB ASP 69 2HB ASP 69 12.022 8.188 -4.032 1265 H ILE 70 H ILE 70 10.480 6.315 -6.225 1266 HA ILE 70 HA ILE 70 12.528 4.503 -5.433 1267 HB ILE 70 HB ILE 70 9.943 3.792 -6.816 1268 1HG1 ILE 70 1HG1 ILE 70 10.452 4.186 -3.858 1269 2HG1 ILE 70 2HG1 ILE 70 9.525 5.276 -4.883 1270 1HG2 ILE 70 1HG2 ILE 70 10.191 1.655 -5.876 1271 2HG2 ILE 70 2HG2 ILE 70 11.789 2.070 -6.494 1272 3HG2 ILE 70 3HG2 ILE 70 11.452 2.196 -4.768 1273 1HD1 ILE 70 1HD1 ILE 70 8.211 2.992 -5.356 1274 2HD1 ILE 70 2HD1 ILE 70 8.782 2.680 -3.716 1275 3HD1 ILE 70 3HD1 ILE 70 7.798 4.105 -4.052 1276 H ASP 71 H ASP 71 11.179 5.495 -8.526 1277 HA ASP 71 HA ASP 71 13.490 4.398 -9.887 1278 1HB ASP 71 1HB ASP 71 10.932 3.048 -9.904 1279 2HB ASP 71 2HB ASP 71 11.376 3.559 -11.530 1280 HA PRO 72 HA PRO 72 12.975 7.857 -12.532 1281 1HB PRO 72 1HB PRO 72 13.787 6.888 -14.934 1282 2HB PRO 72 2HB PRO 72 14.903 7.208 -13.601 1283 1HG PRO 72 1HG PRO 72 13.697 4.613 -14.480 1284 2HG PRO 72 2HG PRO 72 15.363 4.962 -13.984 1285 1HD PRO 72 1HD PRO 72 13.562 3.806 -12.326 1286 2HD PRO 72 2HD PRO 72 14.846 4.883 -11.740 1287 H GLN 73 H GLN 73 11.800 4.886 -14.123 1288 HA GLN 73 HA GLN 73 9.399 6.379 -14.937 1289 1HB GLN 73 1HB GLN 73 11.039 4.472 -16.605 1290 2HB GLN 73 2HB GLN 73 9.409 4.972 -17.035 1291 1HG GLN 73 1HG GLN 73 10.405 7.377 -16.776 1292 2HG GLN 73 2HG GLN 73 11.936 6.541 -17.034 1293 1HE2 GLN 73 1HE2 GLN 73 12.575 6.478 -19.054 1294 2HE2 GLN 73 2HE2 GLN 73 11.559 6.490 -20.451 1295 H ASN 74 H ASN 74 7.911 5.545 -13.589 1296 HA ASN 74 HA ASN 74 7.429 2.660 -13.752 1297 1HB ASN 74 1HB ASN 74 6.821 2.801 -11.243 1298 2HB ASN 74 2HB ASN 74 8.524 2.718 -11.682 1299 1HD2 ASN 74 1HD2 ASN 74 9.076 3.660 -9.695 1300 2HD2 ASN 74 2HD2 ASN 74 8.877 5.353 -9.415 1301 H ASP 75 H ASP 75 5.254 2.303 -12.320 1302 HA ASP 75 HA ASP 75 3.339 4.437 -12.709 1303 1HB ASP 75 1HB ASP 75 3.695 2.562 -14.765 1304 2HB ASP 75 2HB ASP 75 2.232 2.057 -13.924 1305 H LEU 76 H LEU 76 1.321 4.045 -11.668 1306 HA LEU 76 HA LEU 76 1.536 2.036 -9.543 1307 1HB LEU 76 1HB LEU 76 0.777 4.735 -9.566 1308 2HB LEU 76 2HB LEU 76 -0.700 3.824 -9.262 1309 HG LEU 76 HG LEU 76 0.213 4.432 -7.155 1310 1HD1 LEU 76 1HD1 LEU 76 1.006 1.565 -7.618 1311 2HD1 LEU 76 2HD1 LEU 76 -0.659 2.110 -7.422 1312 3HD1 LEU 76 3HD1 LEU 76 0.494 2.309 -6.103 1313 1HD2 LEU 76 1HD2 LEU 76 2.471 3.965 -6.471 1314 2HD2 LEU 76 2HD2 LEU 76 2.509 4.886 -7.974 1315 3HD2 LEU 76 3HD2 LEU 76 2.807 3.147 -7.997 1316 H THR 77 H THR 77 0.161 0.370 -9.374 1317 HA THR 77 HA THR 77 -2.328 0.391 -10.913 1318 HB THR 77 HB THR 77 -0.665 -0.714 -12.358 1319 HG1 THR 77 HG1 THR 77 -2.634 -1.574 -12.692 1320 1HG2 THR 77 1HG2 THR 77 -0.406 -2.655 -10.058 1321 2HG2 THR 77 2HG2 THR 77 0.850 -1.577 -10.668 1322 3HG2 THR 77 3HG2 THR 77 0.259 -2.901 -11.672 1323 H PHE 78 H PHE 78 -1.231 0.312 -8.014 1324 HA PHE 78 HA PHE 78 -3.377 -1.052 -6.860 1325 1HB PHE 78 1HB PHE 78 -1.549 -2.881 -7.756 1326 2HB PHE 78 2HB PHE 78 -1.022 -2.640 -6.094 1327 HD1 PHE 78 HD1 PHE 78 -3.581 -4.009 -8.265 1328 HD2 PHE 78 HD2 PHE 78 -2.529 -3.169 -4.227 1329 HE1 PHE 78 HE1 PHE 78 -5.351 -5.533 -7.490 1330 HE2 PHE 78 HE2 PHE 78 -4.296 -4.692 -3.446 1331 HZ PHE 78 HZ PHE 78 -5.709 -5.877 -5.078 1332 H LEU 79 H LEU 79 -3.549 -0.603 -4.698 1333 HA LEU 79 HA LEU 79 -1.279 0.226 -3.138 1334 1HB LEU 79 1HB LEU 79 -2.056 2.217 -4.592 1335 2HB LEU 79 2HB LEU 79 -3.429 2.282 -3.489 1336 HG LEU 79 HG LEU 79 -1.908 2.674 -1.615 1337 1HD1 LEU 79 1HD1 LEU 79 0.191 1.968 -1.807 1338 2HD1 LEU 79 2HD1 LEU 79 0.491 3.394 -2.800 1339 3HD1 LEU 79 3HD1 LEU 79 0.071 1.862 -3.564 1340 1HD2 LEU 79 1HD2 LEU 79 -0.945 4.902 -2.529 1341 2HD2 LEU 79 2HD2 LEU 79 -2.693 4.675 -2.468 1342 3HD2 LEU 79 3HD2 LEU 79 -1.831 4.482 -3.995 1343 H ARG 80 H ARG 80 -1.786 -1.158 -1.525 1344 HA ARG 80 HA ARG 80 -4.397 -0.775 -0.214 1345 1HB ARG 80 1HB ARG 80 -3.970 -3.017 -1.422 1346 2HB ARG 80 2HB ARG 80 -2.860 -3.357 -0.101 1347 1HG ARG 80 1HG ARG 80 -4.677 -3.115 1.504 1348 2HG ARG 80 2HG ARG 80 -5.794 -2.744 0.188 1349 1HD ARG 80 1HD ARG 80 -6.222 -4.940 0.171 1350 2HD ARG 80 2HD ARG 80 -4.667 -5.094 -0.646 1351 HE ARG 80 HE ARG 80 -3.980 -5.166 1.959 1352 1HH1 ARG 80 1HH1 ARG 80 -6.346 -6.900 0.085 1353 2HH1 ARG 80 2HH1 ARG 80 -6.263 -8.329 1.062 1354 1HH2 ARG 80 1HH2 ARG 80 -3.861 -7.041 3.252 1355 2HH2 ARG 80 2HH2 ARG 80 -4.850 -8.408 2.863 1356 H ILE 81 H ILE 81 -4.397 -1.282 2.114 1357 HA ILE 81 HA ILE 81 -1.812 -1.185 3.447 1358 HB ILE 81 HB ILE 81 -2.731 0.715 4.930 1359 1HG1 ILE 81 1HG1 ILE 81 -4.355 1.160 2.415 1360 2HG1 ILE 81 2HG1 ILE 81 -5.002 0.729 3.994 1361 1HG2 ILE 81 1HG2 ILE 81 -1.210 1.986 3.904 1362 2HG2 ILE 81 2HG2 ILE 81 -1.030 0.651 2.766 1363 3HG2 ILE 81 3HG2 ILE 81 -2.115 1.990 2.390 1364 1HD1 ILE 81 1HD1 ILE 81 -4.241 3.316 2.935 1365 2HD1 ILE 81 2HD1 ILE 81 -5.273 2.908 4.307 1366 3HD1 ILE 81 3HD1 ILE 81 -3.523 2.988 4.512 1367 H ARG 82 H ARG 82 -2.315 -3.196 4.315 1368 HA ARG 82 HA ARG 82 -4.736 -3.853 5.585 1369 1HB ARG 82 1HB ARG 82 -2.675 -5.323 4.824 1370 2HB ARG 82 2HB ARG 82 -2.171 -5.083 6.491 1371 1HG ARG 82 1HG ARG 82 -4.593 -5.873 7.042 1372 2HG ARG 82 2HG ARG 82 -4.524 -6.561 5.418 1373 1HD ARG 82 1HD ARG 82 -3.256 -8.249 6.119 1374 2HD ARG 82 2HD ARG 82 -2.106 -7.141 6.866 1375 HE ARG 82 HE ARG 82 -4.439 -7.431 8.460 1376 1HH1 ARG 82 1HH1 ARG 82 -1.481 -9.030 7.559 1377 2HH1 ARG 82 2HH1 ARG 82 -1.369 -9.935 9.032 1378 1HH2 ARG 82 1HH2 ARG 82 -4.303 -8.618 10.403 1379 2HH2 ARG 82 2HH2 ARG 82 -2.975 -9.701 10.649 1380 H SER 83 H SER 83 -5.568 -2.930 7.330 1381 HA SER 83 HA SER 83 -3.740 -1.908 9.399 1382 1HB SER 83 1HB SER 83 -6.493 -1.024 9.670 1383 2HB SER 83 2HB SER 83 -5.019 -0.066 9.533 1384 HG SER 83 HG SER 83 -6.699 -1.042 7.492 1385 H LYS 84 H LYS 84 -5.416 -1.661 11.517 1386 HA LYS 84 HA LYS 84 -5.792 -4.443 12.287 1387 1HB LYS 84 1HB LYS 84 -5.768 -1.853 13.829 1388 2HB LYS 84 2HB LYS 84 -6.226 -3.382 14.568 1389 1HG LYS 84 1HG LYS 84 -3.935 -4.197 13.622 1390 2HG LYS 84 2HG LYS 84 -3.563 -2.472 13.587 1391 1HD LYS 84 1HD LYS 84 -2.868 -2.905 15.703 1392 2HD LYS 84 2HD LYS 84 -4.576 -2.639 16.057 1393 1HE LYS 84 1HE LYS 84 -5.013 -4.967 16.133 1394 2HE LYS 84 2HE LYS 84 -3.441 -5.355 15.434 1395 1HZ LYS 84 1HZ LYS 84 -4.113 -4.563 18.174 1396 2HZ LYS 84 2HZ LYS 84 -2.600 -4.119 17.564 1397 3HZ LYS 84 3HZ LYS 84 -3.040 -5.752 17.629 1398 H LYS 85 H LYS 85 -7.659 -1.662 11.448 1399 HA LYS 85 HA LYS 85 -10.106 -2.614 12.643 1400 1HB LYS 85 1HB LYS 85 -9.191 -0.202 11.281 1401 2HB LYS 85 2HB LYS 85 -10.806 -0.685 10.780 1402 1HG LYS 85 1HG LYS 85 -10.380 -0.761 13.672 1403 2HG LYS 85 2HG LYS 85 -10.228 0.844 12.953 1404 1HD LYS 85 1HD LYS 85 -12.499 0.658 13.505 1405 2HD LYS 85 2HD LYS 85 -12.437 0.325 11.772 1406 1HE LYS 85 1HE LYS 85 -12.884 -1.912 12.050 1407 2HE LYS 85 2HE LYS 85 -12.225 -1.950 13.685 1408 1HZ LYS 85 1HZ LYS 85 -14.596 -2.165 13.775 1409 2HZ LYS 85 2HZ LYS 85 -14.816 -0.764 12.852 1410 3HZ LYS 85 3HZ LYS 85 -14.171 -0.657 14.413 1411 H ASN 86 H ASN 86 -8.891 -2.217 9.319 1412 HA ASN 86 HA ASN 86 -10.011 -4.631 8.400 1413 1HB ASN 86 1HB ASN 86 -11.645 -3.347 6.767 1414 2HB ASN 86 2HB ASN 86 -12.174 -3.837 8.374 1415 1HD2 ASN 86 1HD2 ASN 86 -10.323 -1.131 7.005 1416 2HD2 ASN 86 2HD2 ASN 86 -11.232 0.108 7.794 1417 H GLU 87 H GLU 87 -9.928 -4.769 5.956 1418 HA GLU 87 HA GLU 87 -7.435 -3.632 5.081 1419 1HB GLU 87 1HB GLU 87 -7.649 -5.047 3.159 1420 2HB GLU 87 2HB GLU 87 -8.148 -5.973 4.567 1421 1HG GLU 87 1HG GLU 87 -10.082 -6.419 3.606 1422 2HG GLU 87 2HG GLU 87 -10.444 -4.697 3.503 1423 H ILE 88 H ILE 88 -7.116 -2.336 3.228 1424 HA ILE 88 HA ILE 88 -9.493 -0.952 2.200 1425 HB ILE 88 HB ILE 88 -6.967 0.508 2.964 1426 1HG1 ILE 88 1HG1 ILE 88 -8.112 -0.381 4.970 1427 2HG1 ILE 88 2HG1 ILE 88 -8.178 1.377 4.892 1428 1HG2 ILE 88 1HG2 ILE 88 -7.904 1.920 1.469 1429 2HG2 ILE 88 2HG2 ILE 88 -9.517 1.235 1.669 1430 3HG2 ILE 88 3HG2 ILE 88 -8.890 2.375 2.859 1431 1HD1 ILE 88 1HD1 ILE 88 -10.378 1.314 5.047 1432 2HD1 ILE 88 2HD1 ILE 88 -10.478 0.314 3.597 1433 3HD1 ILE 88 3HD1 ILE 88 -10.305 -0.442 5.181 1434 H MET 89 H MET 89 -9.418 -1.793 0.172 1435 HA MET 89 HA MET 89 -6.906 -1.833 -1.295 1436 1HB MET 89 1HB MET 89 -9.615 -3.001 -1.674 1437 2HB MET 89 2HB MET 89 -8.668 -2.677 -3.120 1438 1HG MET 89 1HG MET 89 -6.814 -3.939 -1.666 1439 2HG MET 89 2HG MET 89 -8.265 -4.681 -0.994 1440 1HE MET 89 1HE MET 89 -9.971 -5.978 -4.315 1441 2HE MET 89 2HE MET 89 -10.272 -5.182 -2.770 1442 3HE MET 89 3HE MET 89 -9.879 -4.220 -4.196 1443 H VAL 90 H VAL 90 -6.282 -0.300 -2.669 1444 HA VAL 90 HA VAL 90 -8.261 1.385 -3.991 1445 HB VAL 90 HB VAL 90 -5.975 2.616 -2.450 1446 1HG1 VAL 90 1HG1 VAL 90 -8.360 3.981 -3.673 1447 2HG1 VAL 90 2HG1 VAL 90 -6.874 4.712 -3.065 1448 3HG1 VAL 90 3HG1 VAL 90 -6.844 3.749 -4.543 1449 1HG2 VAL 90 1HG2 VAL 90 -7.639 3.438 -0.881 1450 2HG2 VAL 90 2HG2 VAL 90 -8.914 2.598 -1.763 1451 3HG2 VAL 90 3HG2 VAL 90 -7.663 1.675 -0.930 1452 H ALA 91 H ALA 91 -7.722 1.723 -6.049 1453 HA ALA 91 HA ALA 91 -4.926 1.859 -6.844 1454 1HB ALA 91 1HB ALA 91 -6.402 0.099 -8.636 1455 2HB ALA 91 2HB ALA 91 -4.789 -0.079 -7.945 1456 3HB ALA 91 3HB ALA 91 -6.205 -0.565 -7.014 1457 HA PRO 92 HA PRO 92 -6.426 4.833 -9.706 1458 1HB PRO 92 1HB PRO 92 -4.604 4.597 -11.705 1459 2HB PRO 92 2HB PRO 92 -4.228 5.339 -10.145 1460 1HG PRO 92 1HG PRO 92 -3.647 2.566 -11.113 1461 2HG PRO 92 2HG PRO 92 -2.604 3.675 -10.206 1462 1HD PRO 92 1HD PRO 92 -3.946 1.642 -9.023 1463 2HD PRO 92 2HD PRO 92 -3.609 3.175 -8.193 1464 H ASP 93 H ASP 93 -8.249 4.560 -10.822 1465 HA ASP 93 HA ASP 93 -8.500 2.295 -12.658 1466 1HB ASP 93 1HB ASP 93 -10.666 4.233 -11.838 1467 2HB ASP 93 2HB ASP 93 -10.865 2.646 -12.577 1468 H LYS 94 H LYS 94 -10.377 3.216 -14.420 1469 HA LYS 94 HA LYS 94 -8.911 4.371 -16.440 1470 1HB LYS 94 1HB LYS 94 -11.648 3.657 -15.999 1471 2HB LYS 94 2HB LYS 94 -11.595 5.228 -16.789 1472 1HG LYS 94 1HG LYS 94 -9.990 2.924 -17.828 1473 2HG LYS 94 2HG LYS 94 -11.693 3.121 -18.248 1474 1HD LYS 94 1HD LYS 94 -10.633 5.636 -18.662 1475 2HD LYS 94 2HD LYS 94 -9.352 4.556 -19.216 1476 1HE LYS 94 1HE LYS 94 -11.221 3.334 -20.489 1477 2HE LYS 94 2HE LYS 94 -12.181 4.783 -20.192 1478 1HZ LYS 94 1HZ LYS 94 -10.193 6.008 -21.198 1479 2HZ LYS 94 2HZ LYS 94 -11.214 5.164 -22.249 1480 3HZ LYS 94 3HZ LYS 94 -9.725 4.499 -21.803 1481 H ASP 95 H ASP 95 -11.207 6.029 -14.277 1482 HA ASP 95 HA ASP 95 -9.603 8.435 -14.392 1483 1HB ASP 95 1HB ASP 95 -11.569 9.848 -15.061 1484 2HB ASP 95 2HB ASP 95 -10.943 8.817 -16.345 1485 H TYR 96 H TYR 96 -10.800 6.364 -12.497 1486 HA TYR 96 HA TYR 96 -11.663 8.310 -10.491 1487 1HB TYR 96 1HB TYR 96 -13.402 6.574 -9.736 1488 2HB TYR 96 2HB TYR 96 -13.780 7.539 -11.159 1489 HD1 TYR 96 HD1 TYR 96 -13.071 4.203 -9.893 1490 HD2 TYR 96 HD2 TYR 96 -13.690 6.524 -13.404 1491 HE1 TYR 96 HE1 TYR 96 -13.438 2.142 -11.183 1492 HE2 TYR 96 HE2 TYR 96 -14.059 4.470 -14.704 1493 HH TYR 96 HH TYR 96 -13.130 1.624 -13.949 1494 H PHE 97 H PHE 97 -11.845 7.147 -8.281 1495 HA PHE 97 HA PHE 97 -9.591 5.262 -8.048 1496 1HB PHE 97 1HB PHE 97 -10.382 7.616 -6.365 1497 2HB PHE 97 2HB PHE 97 -9.483 6.284 -5.646 1498 HD1 PHE 97 HD1 PHE 97 -9.009 9.413 -6.718 1499 HD2 PHE 97 HD2 PHE 97 -7.544 5.505 -7.556 1500 HE1 PHE 97 HE1 PHE 97 -6.910 10.383 -7.558 1501 HE2 PHE 97 HE2 PHE 97 -5.443 6.469 -8.397 1502 HZ PHE 97 HZ PHE 97 -5.123 8.911 -8.398 1503 H LEU 98 H LEU 98 -10.494 3.311 -7.780 1504 HA LEU 98 HA LEU 98 -12.971 2.914 -6.405 1505 1HB LEU 98 1HB LEU 98 -11.720 1.516 -8.287 1506 2HB LEU 98 2HB LEU 98 -11.103 0.655 -6.878 1507 HG LEU 98 HG LEU 98 -13.999 1.001 -6.824 1508 1HD1 LEU 98 1HD1 LEU 98 -13.872 0.825 -9.204 1509 2HD1 LEU 98 2HD1 LEU 98 -14.393 -0.735 -8.568 1510 3HD1 LEU 98 3HD1 LEU 98 -12.726 -0.512 -9.097 1511 1HD2 LEU 98 1HD2 LEU 98 -13.955 -1.116 -5.931 1512 2HD2 LEU 98 2HD2 LEU 98 -12.351 -0.530 -5.489 1513 3HD2 LEU 98 3HD2 LEU 98 -12.547 -1.605 -6.874 1514 H ILE 99 H ILE 99 -13.339 2.358 -4.337 1515 HA ILE 99 HA ILE 99 -11.020 1.711 -2.641 1516 HB ILE 99 HB ILE 99 -13.329 3.435 -1.749 1517 1HG1 ILE 99 1HG1 ILE 99 -10.934 4.925 -1.781 1518 2HG1 ILE 99 2HG1 ILE 99 -11.028 4.121 -3.343 1519 1HG2 ILE 99 1HG2 ILE 99 -12.014 3.854 0.207 1520 2HG2 ILE 99 2HG2 ILE 99 -12.108 2.109 -0.028 1521 3HG2 ILE 99 3HG2 ILE 99 -10.639 2.980 -0.470 1522 1HD1 ILE 99 1HD1 ILE 99 -12.053 6.428 -3.164 1523 2HD1 ILE 99 2HD1 ILE 99 -13.059 5.164 -3.873 1524 3HD1 ILE 99 3HD1 ILE 99 -13.327 5.673 -2.206 1525 H VAL 100 H VAL 100 -11.302 -0.344 -2.062 1526 HA VAL 100 HA VAL 100 -14.010 -1.261 -1.366 1527 HB VAL 100 HB VAL 100 -11.578 -2.922 -2.042 1528 1HG1 VAL 100 1HG1 VAL 100 -12.913 -4.240 -0.644 1529 2HG1 VAL 100 2HG1 VAL 100 -14.412 -3.621 -1.340 1530 3HG1 VAL 100 3HG1 VAL 100 -13.390 -4.715 -2.273 1531 1HG2 VAL 100 1HG2 VAL 100 -13.344 -3.439 -4.007 1532 2HG2 VAL 100 2HG2 VAL 100 -13.733 -1.750 -3.682 1533 3HG2 VAL 100 3HG2 VAL 100 -12.088 -2.206 -4.124 1534 H ILE 101 H ILE 101 -14.408 -1.216 0.742 1535 HA ILE 101 HA ILE 101 -12.207 -1.792 2.611 1536 HB ILE 101 HB ILE 101 -14.797 -0.335 3.148 1537 1HG1 ILE 101 1HG1 ILE 101 -12.302 1.129 3.520 1538 2HG1 ILE 101 2HG1 ILE 101 -12.524 0.599 1.857 1539 1HG2 ILE 101 1HG2 ILE 101 -14.399 -0.783 5.287 1540 2HG2 ILE 101 2HG2 ILE 101 -12.863 -1.554 4.893 1541 3HG2 ILE 101 3HG2 ILE 101 -12.932 0.187 5.162 1542 1HD1 ILE 101 1HD1 ILE 101 -14.059 2.563 3.447 1543 2HD1 ILE 101 2HD1 ILE 101 -13.582 2.595 1.749 1544 3HD1 ILE 101 3HD1 ILE 101 -14.942 1.598 2.264 1545 H GLN 102 H GLN 102 -12.310 -3.533 3.890 1546 HA GLN 102 HA GLN 102 -14.734 -4.711 4.783 1547 1HB GLN 102 1HB GLN 102 -14.673 -6.798 3.585 1548 2HB GLN 102 2HB GLN 102 -14.726 -5.484 2.418 1549 1HG GLN 102 1HG GLN 102 -12.286 -5.697 2.120 1550 2HG GLN 102 2HG GLN 102 -12.303 -7.080 3.214 1551 1HE2 GLN 102 1HE2 GLN 102 -11.972 -6.418 0.143 1552 2HE2 GLN 102 2HE2 GLN 102 -12.787 -7.751 -0.594 1553 H ASN 103 H ASN 103 -14.290 -6.850 5.911 1554 HA ASN 103 HA ASN 103 -12.333 -6.545 7.831 1555 1HB ASN 103 1HB ASN 103 -14.046 -8.783 6.919 1556 2HB ASN 103 2HB ASN 103 -12.634 -9.230 7.872 1557 1HD2 ASN 103 1HD2 ASN 103 -15.771 -7.910 7.904 1558 2HD2 ASN 103 2HD2 ASN 103 -15.867 -7.580 9.598 1559 HA PRO 104 HA PRO 104 -8.490 -7.850 6.165 1560 1HB PRO 104 1HB PRO 104 -7.411 -9.271 8.211 1561 2HB PRO 104 2HB PRO 104 -7.577 -7.512 8.246 1562 1HG PRO 104 1HG PRO 104 -9.318 -9.604 9.493 1563 2HG PRO 104 2HG PRO 104 -8.750 -8.068 10.175 1564 1HD PRO 104 1HD PRO 104 -11.240 -8.379 9.157 1565 2HD PRO 104 2HD PRO 104 -10.359 -6.840 9.073 1566 H THR 105 H THR 105 -7.440 -9.546 5.146 1567 HA THR 105 HA THR 105 -8.906 -12.098 5.130 1568 HB THR 105 HB THR 105 -7.790 -12.464 2.902 1569 HG1 THR 105 HG1 THR 105 -6.222 -10.631 3.480 1570 1HG2 THR 105 1HG2 THR 105 -9.265 -9.967 2.471 1571 2HG2 THR 105 2HG2 THR 105 -10.091 -11.121 3.518 1572 3HG2 THR 105 3HG2 THR 105 -9.603 -11.598 1.892 1573 H GLU 106 H GLU 106 -5.724 -10.632 5.376 1574 HA GLU 106 HA GLU 106 -4.413 -13.214 5.590 1575 1HB GLU 106 1HB GLU 106 -3.463 -11.071 4.475 1576 2HB GLU 106 2HB GLU 106 -3.093 -10.569 6.118 1577 1HG GLU 106 1HG GLU 106 -1.726 -12.555 6.435 1578 2HG GLU 106 2HG GLU 106 -2.118 -13.094 4.803 Start of MODEL 5 1 H MET 11 H MET 11 19.344 -8.556 14.377 2 HA MET 11 HA MET 11 19.160 -8.260 11.653 3 1HB MET 11 1HB MET 11 21.428 -8.686 13.534 4 2HB MET 11 2HB MET 11 21.759 -8.825 11.812 5 1HG MET 11 1HG MET 11 20.232 -6.450 12.659 6 2HG MET 11 2HG MET 11 21.914 -6.529 13.177 7 1HE MET 11 1HE MET 11 20.101 -5.643 9.214 8 2HE MET 11 2HE MET 11 20.201 -7.400 9.334 9 3HE MET 11 3HE MET 11 19.363 -6.476 10.582 10 H ALA 12 H ALA 12 20.362 -11.111 13.410 11 HA ALA 12 HA ALA 12 21.047 -12.715 11.272 12 1HB ALA 12 1HB ALA 12 21.538 -13.349 13.549 13 2HB ALA 12 2HB ALA 12 19.820 -13.541 13.899 14 3HB ALA 12 3HB ALA 12 20.616 -14.632 12.765 15 H GLU 13 H GLU 13 17.858 -12.190 12.706 16 HA GLU 13 HA GLU 13 16.402 -14.149 11.409 17 1HB GLU 13 1HB GLU 13 15.443 -12.740 13.150 18 2HB GLU 13 2HB GLU 13 15.552 -11.333 12.103 19 1HG GLU 13 1HG GLU 13 13.501 -11.755 11.405 20 2HG GLU 13 2HG GLU 13 14.099 -13.237 10.660 21 H VAL 14 H VAL 14 17.016 -10.821 10.298 22 HA VAL 14 HA VAL 14 15.704 -11.090 7.820 23 HB VAL 14 HB VAL 14 18.011 -9.235 8.414 24 1HG1 VAL 14 1HG1 VAL 14 16.343 -9.641 6.134 25 2HG1 VAL 14 2HG1 VAL 14 16.014 -8.045 6.812 26 3HG1 VAL 14 3HG1 VAL 14 17.659 -8.488 6.354 27 1HG2 VAL 14 1HG2 VAL 14 15.954 -7.654 8.861 28 2HG2 VAL 14 2HG2 VAL 14 15.162 -9.173 9.280 29 3HG2 VAL 14 3HG2 VAL 14 16.616 -8.669 10.142 30 H GLU 15 H GLU 15 19.035 -11.673 8.818 31 HA GLU 15 HA GLU 15 20.149 -12.024 6.261 32 1HB GLU 15 1HB GLU 15 20.925 -13.051 8.983 33 2HB GLU 15 2HB GLU 15 21.859 -13.440 7.545 34 1HG GLU 15 1HG GLU 15 22.332 -11.118 7.157 35 2HG GLU 15 2HG GLU 15 21.270 -10.643 8.481 36 H GLU 16 H GLU 16 18.588 -14.289 8.480 37 HA GLU 16 HA GLU 16 19.134 -16.646 7.050 38 1HB GLU 16 1HB GLU 16 17.955 -16.095 9.430 39 2HB GLU 16 2HB GLU 16 16.545 -16.508 8.465 40 1HG GLU 16 1HG GLU 16 18.969 -18.270 8.631 41 2HG GLU 16 2HG GLU 16 17.619 -18.387 9.758 42 H THR 17 H THR 17 16.511 -14.302 6.810 43 HA THR 17 HA THR 17 15.068 -15.829 4.843 44 HB THR 17 HB THR 17 14.724 -12.960 5.735 45 HG1 THR 17 HG1 THR 17 14.285 -14.625 7.318 46 1HG2 THR 17 1HG2 THR 17 13.209 -14.677 3.805 47 2HG2 THR 17 2HG2 THR 17 13.686 -12.985 3.660 48 3HG2 THR 17 3HG2 THR 17 12.368 -13.441 4.739 49 H LEU 18 H LEU 18 17.547 -13.410 4.836 50 HA LEU 18 HA LEU 18 17.167 -12.497 2.166 51 1HB LEU 18 1HB LEU 18 18.919 -11.954 4.352 52 2HB LEU 18 2HB LEU 18 19.885 -12.226 2.903 53 HG LEU 18 HG LEU 18 17.993 -10.504 1.971 54 1HD1 LEU 18 1HD1 LEU 18 16.922 -9.989 3.982 55 2HD1 LEU 18 2HD1 LEU 18 18.048 -8.655 3.736 56 3HD1 LEU 18 3HD1 LEU 18 18.437 -9.937 4.883 57 1HD2 LEU 18 1HD2 LEU 18 20.568 -9.671 3.296 58 2HD2 LEU 18 2HD2 LEU 18 19.733 -8.864 1.969 59 3HD2 LEU 18 3HD2 LEU 18 20.475 -10.444 1.713 60 H LYS 19 H LYS 19 19.154 -15.004 3.656 61 HA LYS 19 HA LYS 19 20.710 -15.688 1.437 62 1HB LYS 19 1HB LYS 19 19.729 -17.350 3.758 63 2HB LYS 19 2HB LYS 19 20.870 -17.949 2.562 64 1HG LYS 19 1HG LYS 19 21.580 -15.381 3.805 65 2HG LYS 19 2HG LYS 19 21.579 -16.779 4.882 66 1HD LYS 19 1HD LYS 19 22.964 -16.845 2.218 67 2HD LYS 19 2HD LYS 19 23.760 -16.208 3.659 68 1HE LYS 19 1HE LYS 19 22.738 -18.575 4.566 69 2HE LYS 19 2HE LYS 19 23.157 -18.972 2.901 70 1HZ LYS 19 1HZ LYS 19 25.031 -19.418 4.277 71 2HZ LYS 19 2HZ LYS 19 24.966 -17.884 4.986 72 3HZ LYS 19 3HZ LYS 19 25.395 -18.045 3.358 73 H ARG 20 H ARG 20 17.631 -17.090 2.551 74 HA ARG 20 HA ARG 20 17.358 -18.889 0.390 75 1HB ARG 20 1HB ARG 20 16.149 -18.925 2.644 76 2HB ARG 20 2HB ARG 20 15.067 -17.720 1.957 77 1HG ARG 20 1HG ARG 20 13.846 -19.457 1.287 78 2HG ARG 20 2HG ARG 20 15.069 -19.660 0.031 79 1HD ARG 20 1HD ARG 20 15.274 -20.942 2.746 80 2HD ARG 20 2HD ARG 20 14.493 -21.725 1.373 81 HE ARG 20 HE ARG 20 16.913 -21.070 0.384 82 1HH1 ARG 20 1HH1 ARG 20 15.910 -22.720 3.281 83 2HH1 ARG 20 2HH1 ARG 20 17.331 -23.708 3.367 84 1HH2 ARG 20 1HH2 ARG 20 18.788 -22.365 0.486 85 2HH2 ARG 20 2HH2 ARG 20 18.968 -23.504 1.777 86 H LEU 21 H LEU 21 16.447 -15.541 0.845 87 HA LEU 21 HA LEU 21 14.702 -15.348 -1.385 88 1HB LEU 21 1HB LEU 21 15.938 -13.539 0.548 89 2HB LEU 21 2HB LEU 21 15.716 -12.822 -1.046 90 HG LEU 21 HG LEU 21 13.341 -13.193 -0.941 91 1HD1 LEU 21 1HD1 LEU 21 14.077 -15.116 1.059 92 2HD1 LEU 21 2HD1 LEU 21 12.544 -14.910 0.212 93 3HD1 LEU 21 3HD1 LEU 21 12.861 -14.006 1.693 94 1HD2 LEU 21 1HD2 LEU 21 12.794 -11.836 1.093 95 2HD2 LEU 21 2HD2 LEU 21 14.042 -11.146 0.055 96 3HD2 LEU 21 3HD2 LEU 21 14.491 -11.960 1.555 97 H GLN 22 H GLN 22 18.083 -14.305 -0.939 98 HA GLN 22 HA GLN 22 18.481 -13.535 -3.622 99 1HB GLN 22 1HB GLN 22 19.963 -13.473 -1.249 100 2HB GLN 22 2HB GLN 22 20.914 -14.458 -2.353 101 1HG GLN 22 1HG GLN 22 21.589 -12.673 -3.469 102 2HG GLN 22 2HG GLN 22 19.931 -12.119 -3.697 103 1HE2 GLN 22 1HE2 GLN 22 18.961 -11.199 -1.594 104 2HE2 GLN 22 2HE2 GLN 22 19.966 -10.079 -0.745 105 H SER 23 H SER 23 18.460 -16.608 -2.073 106 HA SER 23 HA SER 23 20.021 -17.963 -4.076 107 1HB SER 23 1HB SER 23 19.863 -18.736 -1.699 108 2HB SER 23 2HB SER 23 18.180 -19.167 -1.997 109 HG SER 23 HG SER 23 18.832 -20.919 -2.946 110 H GLN 24 H GLN 24 16.729 -17.056 -3.669 111 HA GLN 24 HA GLN 24 15.860 -18.903 -5.774 112 1HB GLN 24 1HB GLN 24 13.592 -18.372 -5.112 113 2HB GLN 24 2HB GLN 24 14.526 -18.824 -3.692 114 1HG GLN 24 1HG GLN 24 14.652 -16.599 -2.939 115 2HG GLN 24 2HG GLN 24 14.100 -15.963 -4.487 116 1HE2 GLN 24 1HE2 GLN 24 12.773 -14.958 -2.534 117 2HE2 GLN 24 2HE2 GLN 24 11.224 -15.689 -2.305 118 H LYS 25 H LYS 25 14.736 -18.150 -7.610 119 HA LYS 25 HA LYS 25 15.733 -15.675 -8.643 120 1HB LYS 25 1HB LYS 25 14.837 -18.037 -9.751 121 2HB LYS 25 2HB LYS 25 13.545 -16.910 -10.142 122 1HG LYS 25 1HG LYS 25 15.697 -15.432 -10.819 123 2HG LYS 25 2HG LYS 25 16.302 -17.057 -11.151 124 1HD LYS 25 1HD LYS 25 13.997 -17.348 -12.354 125 2HD LYS 25 2HD LYS 25 14.020 -15.584 -12.398 126 1HE LYS 25 1HE LYS 25 16.552 -16.764 -13.210 127 2HE LYS 25 2HE LYS 25 15.207 -17.284 -14.223 128 1HZ LYS 25 1HZ LYS 25 14.879 -15.205 -15.022 129 2HZ LYS 25 2HZ LYS 25 16.532 -15.068 -14.689 130 3HZ LYS 25 3HZ LYS 25 15.396 -14.437 -13.605 131 H GLY 26 H GLY 26 14.528 -13.857 -9.317 132 1HA GLY 26 1HA GLY 26 12.383 -12.728 -9.520 133 2HA GLY 26 2HA GLY 26 11.841 -13.635 -8.115 134 H VAL 27 H VAL 27 13.841 -13.289 -6.321 135 HA VAL 27 HA VAL 27 13.305 -10.837 -5.166 136 HB VAL 27 HB VAL 27 15.788 -12.521 -4.813 137 1HG1 VAL 27 1HG1 VAL 27 14.763 -10.105 -3.402 138 2HG1 VAL 27 2HG1 VAL 27 15.603 -11.348 -2.473 139 3HG1 VAL 27 3HG1 VAL 27 16.418 -10.550 -3.819 140 1HG2 VAL 27 1HG2 VAL 27 14.608 -13.405 -2.842 141 2HG2 VAL 27 2HG2 VAL 27 13.182 -12.471 -3.293 142 3HG2 VAL 27 3HG2 VAL 27 13.758 -13.765 -4.344 143 H GLN 28 H GLN 28 13.802 -8.839 -5.753 144 HA GLN 28 HA GLN 28 15.978 -8.380 -7.633 145 1HB GLN 28 1HB GLN 28 13.472 -7.081 -6.991 146 2HB GLN 28 2HB GLN 28 14.796 -5.925 -6.998 147 1HG GLN 28 1HG GLN 28 14.675 -5.840 -9.200 148 2HG GLN 28 2HG GLN 28 15.134 -7.541 -9.273 149 1HE2 GLN 28 1HE2 GLN 28 12.936 -8.763 -8.226 150 2HE2 GLN 28 2HE2 GLN 28 11.572 -8.504 -9.253 151 H GLY 29 H GLY 29 15.168 -7.837 -4.293 152 1HA GLY 29 1HA GLY 29 17.702 -7.517 -3.334 153 2HA GLY 29 2HA GLY 29 17.235 -5.895 -3.822 154 H ILE 30 H ILE 30 17.782 -7.110 -1.149 155 HA ILE 30 HA ILE 30 15.192 -6.496 0.119 156 HB ILE 30 HB ILE 30 17.402 -8.136 1.349 157 1HG1 ILE 30 1HG1 ILE 30 15.389 -9.907 0.863 158 2HG1 ILE 30 2HG1 ILE 30 15.278 -8.876 -0.560 159 1HG2 ILE 30 1HG2 ILE 30 16.121 -7.427 3.112 160 2HG2 ILE 30 2HG2 ILE 30 14.647 -7.342 2.149 161 3HG2 ILE 30 3HG2 ILE 30 15.269 -8.907 2.673 162 1HD1 ILE 30 1HD1 ILE 30 17.019 -11.011 -0.132 163 2HD1 ILE 30 2HD1 ILE 30 17.031 -9.864 -1.472 164 3HD1 ILE 30 3HD1 ILE 30 18.014 -9.558 -0.040 165 H ILE 31 H ILE 31 15.099 -4.827 1.489 166 HA ILE 31 HA ILE 31 17.640 -3.621 2.371 167 HB ILE 31 HB ILE 31 15.073 -2.191 1.674 168 1HG1 ILE 31 1HG1 ILE 31 17.673 -1.652 0.322 169 2HG1 ILE 31 2HG1 ILE 31 16.818 -3.126 -0.114 170 1HG2 ILE 31 1HG2 ILE 31 16.103 -1.054 3.499 171 2HG2 ILE 31 2HG2 ILE 31 17.694 -1.173 2.750 172 3HG2 ILE 31 3HG2 ILE 31 16.458 -0.138 2.035 173 1HD1 ILE 31 1HD1 ILE 31 14.889 -1.115 -0.162 174 2HD1 ILE 31 2HD1 ILE 31 16.322 -0.420 -0.920 175 3HD1 ILE 31 3HD1 ILE 31 15.637 -1.922 -1.540 176 H VAL 32 H VAL 32 17.778 -2.869 4.465 177 HA VAL 32 HA VAL 32 15.446 -3.295 6.204 178 HB VAL 32 HB VAL 32 18.234 -4.070 7.042 179 1HG1 VAL 32 1HG1 VAL 32 15.521 -4.746 8.174 180 2HG1 VAL 32 2HG1 VAL 32 17.078 -5.256 8.827 181 3HG1 VAL 32 3HG1 VAL 32 16.637 -3.548 8.827 182 1HG2 VAL 32 1HG2 VAL 32 17.594 -5.483 5.163 183 2HG2 VAL 32 2HG2 VAL 32 17.587 -6.404 6.667 184 3HG2 VAL 32 3HG2 VAL 32 16.066 -5.866 5.956 185 H VAL 33 H VAL 33 15.130 -1.765 7.729 186 HA VAL 33 HA VAL 33 17.289 0.099 8.369 187 HB VAL 33 HB VAL 33 14.573 1.159 7.619 188 1HG1 VAL 33 1HG1 VAL 33 15.512 3.264 7.783 189 2HG1 VAL 33 2HG1 VAL 33 16.330 2.398 9.084 190 3HG1 VAL 33 3HG1 VAL 33 17.153 2.665 7.547 191 1HG2 VAL 33 1HG2 VAL 33 17.011 0.942 5.855 192 2HG2 VAL 33 2HG2 VAL 33 15.485 0.084 5.639 193 3HG2 VAL 33 3HG2 VAL 33 15.543 1.838 5.464 194 H ASN 34 H ASN 34 17.212 0.887 10.421 195 HA ASN 34 HA ASN 34 15.568 -0.434 12.309 196 1HB ASN 34 1HB ASN 34 17.066 2.114 12.879 197 2HB ASN 34 2HB ASN 34 16.744 0.764 13.962 198 1HD2 ASN 34 1HD2 ASN 34 19.101 2.246 12.324 199 2HD2 ASN 34 2HD2 ASN 34 20.179 0.923 12.057 200 H THR 35 H THR 35 14.760 1.402 14.139 201 HA THR 35 HA THR 35 12.355 2.412 12.926 202 HB THR 35 HB THR 35 12.565 3.394 15.571 203 HG1 THR 35 HG1 THR 35 13.067 0.631 15.647 204 1HG2 THR 35 1HG2 THR 35 10.543 2.564 14.376 205 2HG2 THR 35 2HG2 THR 35 10.727 1.894 15.997 206 3HG2 THR 35 3HG2 THR 35 11.143 0.920 14.587 207 H GLU 36 H GLU 36 15.405 3.720 13.974 208 HA GLU 36 HA GLU 36 14.602 6.442 14.123 209 1HB GLU 36 1HB GLU 36 17.197 4.980 14.044 210 2HB GLU 36 2HB GLU 36 17.212 6.698 13.669 211 1HG GLU 36 1HG GLU 36 15.736 6.720 15.918 212 2HG GLU 36 2HG GLU 36 16.761 5.319 16.227 213 H GLY 37 H GLY 37 15.789 4.376 11.542 214 1HA GLY 37 1HA GLY 37 14.908 5.008 9.301 215 2HA GLY 37 2HA GLY 37 15.441 6.640 9.673 216 H ILE 38 H ILE 38 17.536 4.224 10.816 217 HA ILE 38 HA ILE 38 19.413 4.833 8.641 218 HB ILE 38 HB ILE 38 20.059 3.620 11.327 219 1HG1 ILE 38 1HG1 ILE 38 20.238 6.507 10.439 220 2HG1 ILE 38 2HG1 ILE 38 19.101 5.862 11.618 221 1HG2 ILE 38 1HG2 ILE 38 22.350 4.293 10.788 222 2HG2 ILE 38 2HG2 ILE 38 21.702 3.175 9.589 223 3HG2 ILE 38 3HG2 ILE 38 21.802 4.898 9.224 224 1HD1 ILE 38 1HD1 ILE 38 22.006 6.406 11.879 225 2HD1 ILE 38 2HD1 ILE 38 20.684 6.732 13.001 226 3HD1 ILE 38 3HD1 ILE 38 21.305 5.091 12.822 227 HA PRO 39 HA PRO 39 18.936 0.696 7.139 228 1HB PRO 39 1HB PRO 39 21.062 0.703 5.451 229 2HB PRO 39 2HB PRO 39 19.549 1.544 5.093 230 1HG PRO 39 1HG PRO 39 22.117 2.642 6.171 231 2HG PRO 39 2HG PRO 39 21.046 3.316 4.929 232 1HD PRO 39 1HD PRO 39 21.041 4.195 7.490 233 2HD PRO 39 2HD PRO 39 19.579 4.179 6.483 234 H ILE 40 H ILE 40 19.748 -1.299 7.603 235 HA ILE 40 HA ILE 40 22.306 -1.390 9.066 236 HB ILE 40 HB ILE 40 21.242 -3.517 10.112 237 1HG1 ILE 40 1HG1 ILE 40 18.769 -1.972 9.305 238 2HG1 ILE 40 2HG1 ILE 40 19.252 -3.537 8.662 239 1HG2 ILE 40 1HG2 ILE 40 20.149 -0.853 10.984 240 2HG2 ILE 40 2HG2 ILE 40 20.516 -2.257 11.986 241 3HG2 ILE 40 3HG2 ILE 40 21.824 -1.342 11.236 242 1HD1 ILE 40 1HD1 ILE 40 17.632 -3.014 10.881 243 2HD1 ILE 40 2HD1 ILE 40 18.230 -4.576 10.321 244 3HD1 ILE 40 3HD1 ILE 40 19.146 -3.658 11.517 245 H LYS 41 H LYS 41 20.188 -2.969 6.758 246 HA LYS 41 HA LYS 41 22.476 -4.393 5.661 247 1HB LYS 41 1HB LYS 41 20.135 -5.705 6.958 248 2HB LYS 41 2HB LYS 41 20.789 -6.444 5.502 249 1HG LYS 41 1HG LYS 41 22.531 -5.741 7.840 250 2HG LYS 41 2HG LYS 41 21.665 -7.275 7.741 251 1HD LYS 41 1HD LYS 41 22.782 -7.333 5.341 252 2HD LYS 41 2HD LYS 41 23.951 -6.268 6.125 253 1HE LYS 41 1HE LYS 41 23.117 -8.822 7.440 254 2HE LYS 41 2HE LYS 41 24.325 -8.841 6.156 255 1HZ LYS 41 1HZ LYS 41 25.055 -8.596 8.615 256 2HZ LYS 41 2HZ LYS 41 24.632 -6.972 8.405 257 3HZ LYS 41 3HZ LYS 41 25.819 -7.670 7.422 258 H SER 42 H SER 42 22.432 -4.396 3.500 259 HA SER 42 HA SER 42 20.019 -4.531 1.979 260 1HB SER 42 1HB SER 42 20.033 -2.128 2.726 261 2HB SER 42 2HB SER 42 21.535 -1.918 1.826 262 HG SER 42 HG SER 42 20.251 -2.773 -0.017 263 H THR 43 H THR 43 20.678 -5.908 0.472 264 HA THR 43 HA THR 43 23.386 -6.112 -0.392 265 HB THR 43 HB THR 43 22.683 -7.879 -1.810 266 HG1 THR 43 HG1 THR 43 20.242 -8.140 -1.997 267 1HG2 THR 43 1HG2 THR 43 22.035 -7.835 0.877 268 2HG2 THR 43 2HG2 THR 43 22.093 -9.265 -0.153 269 3HG2 THR 43 3HG2 THR 43 20.564 -8.428 0.108 270 H MET 44 H MET 44 20.787 -4.128 -1.319 271 HA MET 44 HA MET 44 21.262 -3.801 -4.064 272 1HB MET 44 1HB MET 44 20.308 -1.621 -2.211 273 2HB MET 44 2HB MET 44 19.942 -1.822 -3.919 274 1HG MET 44 1HG MET 44 19.078 -4.171 -2.659 275 2HG MET 44 2HG MET 44 18.557 -2.838 -1.632 276 1HE MET 44 1HE MET 44 17.474 -3.369 -6.067 277 2HE MET 44 2HE MET 44 18.870 -2.372 -5.658 278 3HE MET 44 3HE MET 44 18.849 -4.081 -5.221 279 H ASP 45 H ASP 45 21.731 -1.168 -4.570 280 HA ASP 45 HA ASP 45 24.585 -1.023 -4.256 281 1HB ASP 45 1HB ASP 45 22.733 -0.062 -6.114 282 2HB ASP 45 2HB ASP 45 23.371 1.382 -5.333 283 H ASN 46 H ASN 46 25.583 1.157 -3.676 284 HA ASN 46 HA ASN 46 25.001 1.732 -0.984 285 1HB ASN 46 1HB ASN 46 27.054 2.338 -2.809 286 2HB ASN 46 2HB ASN 46 26.439 3.892 -2.253 287 1HD2 ASN 46 1HD2 ASN 46 25.705 3.255 0.326 288 2HD2 ASN 46 2HD2 ASN 46 27.119 2.876 1.242 289 HA PRO 47 HA PRO 47 23.135 5.898 -2.580 290 1HB PRO 47 1HB PRO 47 22.661 6.102 -5.245 291 2HB PRO 47 2HB PRO 47 24.192 6.580 -4.502 292 1HG PRO 47 1HG PRO 47 23.493 4.050 -5.941 293 2HG PRO 47 2HG PRO 47 24.962 5.036 -6.061 294 1HD PRO 47 1HD PRO 47 24.848 2.764 -4.591 295 2HD PRO 47 2HD PRO 47 25.868 4.145 -4.138 296 H THR 48 H THR 48 22.239 2.862 -4.057 297 HA THR 48 HA THR 48 19.492 3.545 -4.493 298 HB THR 48 HB THR 48 20.655 0.765 -4.286 299 HG1 THR 48 HG1 THR 48 20.860 1.000 -6.614 300 1HG2 THR 48 1HG2 THR 48 18.800 0.333 -5.973 301 2HG2 THR 48 2HG2 THR 48 18.170 1.921 -5.533 302 3HG2 THR 48 3HG2 THR 48 18.293 0.652 -4.315 303 H THR 49 H THR 49 21.318 1.960 -1.937 304 HA THR 49 HA THR 49 19.074 1.038 -0.462 305 HB THR 49 HB THR 49 21.910 1.587 0.428 306 HG1 THR 49 HG1 THR 49 20.514 -0.731 -0.440 307 1HG2 THR 49 1HG2 THR 49 20.618 1.652 2.406 308 2HG2 THR 49 2HG2 THR 49 21.259 0.011 2.318 309 3HG2 THR 49 3HG2 THR 49 19.584 0.329 1.866 310 H THR 50 H THR 50 21.219 3.849 -0.032 311 HA THR 50 HA THR 50 19.998 4.957 2.200 312 HB THR 50 HB THR 50 20.878 6.966 0.257 313 HG1 THR 50 HG1 THR 50 22.778 6.128 -0.230 314 1HG2 THR 50 1HG2 THR 50 22.406 6.420 2.721 315 2HG2 THR 50 2HG2 THR 50 20.702 6.814 2.950 316 3HG2 THR 50 3HG2 THR 50 21.761 7.938 2.099 317 H GLN 51 H GLN 51 19.349 5.659 -1.232 318 HA GLN 51 HA GLN 51 17.346 7.545 -0.893 319 1HB GLN 51 1HB GLN 51 18.265 7.165 -3.071 320 2HB GLN 51 2HB GLN 51 17.747 5.484 -3.061 321 1HG GLN 51 1HG GLN 51 15.591 7.446 -2.732 322 2HG GLN 51 2HG GLN 51 16.424 7.497 -4.286 323 1HE2 GLN 51 1HE2 GLN 51 14.257 5.774 -2.266 324 2HE2 GLN 51 2HE2 GLN 51 13.873 4.508 -3.378 325 H TYR 52 H TYR 52 16.971 4.027 -1.317 326 HA TYR 52 HA TYR 52 14.195 3.933 -1.062 327 1HB TYR 52 1HB TYR 52 16.394 1.947 -0.638 328 2HB TYR 52 2HB TYR 52 14.754 1.527 -0.157 329 HD1 TYR 52 HD1 TYR 52 16.214 3.307 -3.108 330 HD2 TYR 52 HD2 TYR 52 13.773 0.121 -1.694 331 HE1 TYR 52 HE1 TYR 52 15.701 2.678 -5.429 332 HE2 TYR 52 HE2 TYR 52 13.255 -0.517 -4.012 333 HH TYR 52 HH TYR 52 14.922 0.259 -6.551 334 H ALA 53 H ALA 53 16.677 3.379 1.434 335 HA ALA 53 HA ALA 53 14.908 3.039 3.583 336 1HB ALA 53 1HB ALA 53 16.824 3.415 5.018 337 2HB ALA 53 2HB ALA 53 17.285 2.407 3.645 338 3HB ALA 53 3HB ALA 53 17.724 4.115 3.672 339 H SER 54 H SER 54 15.816 5.850 1.857 340 HA SER 54 HA SER 54 15.340 7.740 3.958 341 1HB SER 54 1HB SER 54 16.777 8.104 1.874 342 2HB SER 54 2HB SER 54 15.263 8.331 0.999 343 HG SER 54 HG SER 54 16.579 10.041 2.643 344 H LEU 55 H LEU 55 13.524 6.790 1.043 345 HA LEU 55 HA LEU 55 11.203 8.283 1.861 346 1HB LEU 55 1HB LEU 55 10.333 7.812 -0.197 347 2HB LEU 55 2HB LEU 55 12.057 7.674 -0.535 348 HG LEU 55 HG LEU 55 11.564 5.119 0.026 349 1HD1 LEU 55 1HD1 LEU 55 9.021 6.128 0.186 350 2HD1 LEU 55 2HD1 LEU 55 9.442 4.440 -0.099 351 3HD1 LEU 55 3HD1 LEU 55 9.087 5.501 -1.461 352 1HD2 LEU 55 1HD2 LEU 55 12.273 6.473 -2.159 353 2HD2 LEU 55 2HD2 LEU 55 10.671 5.943 -2.676 354 3HD2 LEU 55 3HD2 LEU 55 11.881 4.753 -2.191 355 H MET 56 H MET 56 12.451 5.179 2.481 356 HA MET 56 HA MET 56 10.183 3.600 2.731 357 1HB MET 56 1HB MET 56 12.915 3.429 3.466 358 2HB MET 56 2HB MET 56 11.971 3.022 4.893 359 1HG MET 56 1HG MET 56 12.508 1.035 3.628 360 2HG MET 56 2HG MET 56 10.770 1.325 3.618 361 1HE MET 56 1HE MET 56 9.786 0.849 0.337 362 2HE MET 56 2HE MET 56 9.444 1.275 2.015 363 3HE MET 56 3HE MET 56 9.631 2.544 0.803 364 H HIS 57 H HIS 57 11.777 5.501 5.296 365 HA HIS 57 HA HIS 57 9.749 5.050 7.217 366 1HB HIS 57 1HB HIS 57 12.172 5.831 7.591 367 2HB HIS 57 2HB HIS 57 11.577 7.445 7.211 368 HD1 HIS 57 HD1 HIS 57 9.353 5.182 9.147 369 HD2 HIS 57 HD2 HIS 57 12.078 8.232 9.880 370 HE1 HIS 57 HE1 HIS 57 8.989 5.848 11.545 371 H SER 58 H SER 58 10.455 7.842 5.127 372 HA SER 58 HA SER 58 8.394 9.505 5.971 373 1HB SER 58 1HB SER 58 10.383 9.754 4.160 374 2HB SER 58 2HB SER 58 9.011 9.542 3.072 375 HG SER 58 HG SER 58 9.723 11.749 4.218 376 H PHE 59 H PHE 59 8.304 6.673 3.990 377 HA PHE 59 HA PHE 59 5.779 7.186 2.760 378 1HB PHE 59 1HB PHE 59 7.281 5.647 1.686 379 2HB PHE 59 2HB PHE 59 7.372 4.646 3.131 380 HD1 PHE 59 HD1 PHE 59 4.433 6.120 1.387 381 HD2 PHE 59 HD2 PHE 59 6.497 2.588 2.562 382 HE1 PHE 59 HE1 PHE 59 2.564 4.755 0.553 383 HE2 PHE 59 HE2 PHE 59 4.632 1.217 1.729 384 HZ PHE 59 HZ PHE 59 2.663 2.300 0.722 385 H ILE 60 H ILE 60 6.782 5.001 5.392 386 HA ILE 60 HA ILE 60 4.287 4.031 6.094 387 HB ILE 60 HB ILE 60 6.592 4.625 7.954 388 1HG1 ILE 60 1HG1 ILE 60 7.242 3.170 6.098 389 2HG1 ILE 60 2HG1 ILE 60 7.182 2.258 7.603 390 1HG2 ILE 60 1HG2 ILE 60 5.266 2.422 8.922 391 2HG2 ILE 60 2HG2 ILE 60 5.132 4.065 9.548 392 3HG2 ILE 60 3HG2 ILE 60 3.953 3.468 8.381 393 1HD1 ILE 60 1HD1 ILE 60 5.786 1.810 5.146 394 2HD1 ILE 60 2HD1 ILE 60 5.888 0.789 6.581 395 3HD1 ILE 60 3HD1 ILE 60 4.637 2.027 6.466 396 H LEU 61 H LEU 61 5.996 6.781 7.595 397 HA LEU 61 HA LEU 61 3.953 7.587 9.301 398 1HB LEU 61 1HB LEU 61 6.475 8.570 8.455 399 2HB LEU 61 2HB LEU 61 5.318 9.894 8.344 400 HG LEU 61 HG LEU 61 4.789 9.689 10.688 401 1HD1 LEU 61 1HD1 LEU 61 6.351 7.175 10.442 402 2HD1 LEU 61 2HD1 LEU 61 4.868 7.506 11.337 403 3HD1 LEU 61 3HD1 LEU 61 6.420 8.055 11.969 404 1HD2 LEU 61 1HD2 LEU 61 7.446 9.726 11.413 405 2HD2 LEU 61 2HD2 LEU 61 6.504 11.107 10.848 406 3HD2 LEU 61 3HD2 LEU 61 7.484 10.181 9.709 407 H LYS 62 H LYS 62 4.293 7.983 5.885 408 HA LYS 62 HA LYS 62 2.549 10.185 5.529 409 1HB LYS 62 1HB LYS 62 4.137 8.562 3.890 410 2HB LYS 62 2HB LYS 62 2.494 8.327 3.309 411 1HG LYS 62 1HG LYS 62 3.352 10.103 2.048 412 2HG LYS 62 2HG LYS 62 2.306 10.856 3.254 413 1HD LYS 62 1HD LYS 62 4.038 12.159 3.779 414 2HD LYS 62 2HD LYS 62 4.789 10.727 4.488 415 1HE LYS 62 1HE LYS 62 5.978 10.261 2.480 416 2HE LYS 62 2HE LYS 62 5.057 11.464 1.580 417 1HZ LYS 62 1HZ LYS 62 6.248 12.748 3.753 418 2HZ LYS 62 2HZ LYS 62 6.584 12.955 2.108 419 3HZ LYS 62 3HZ LYS 62 7.445 11.811 3.009 420 H ALA 63 H ALA 63 2.009 6.681 5.156 421 HA ALA 63 HA ALA 63 -0.781 6.926 4.700 422 1HB ALA 63 1HB ALA 63 -0.005 4.939 3.884 423 2HB ALA 63 2HB ALA 63 1.090 4.680 5.243 424 3HB ALA 63 3HB ALA 63 -0.640 4.399 5.439 425 H ARG 64 H ARG 64 1.169 6.281 7.578 426 HA ARG 64 HA ARG 64 -0.894 5.643 9.349 427 1HB ARG 64 1HB ARG 64 1.690 5.566 9.652 428 2HB ARG 64 2HB ARG 64 1.506 7.219 10.222 429 1HG ARG 64 1HG ARG 64 -0.430 5.768 11.599 430 2HG ARG 64 2HG ARG 64 1.002 4.737 11.589 431 1HD ARG 64 1HD ARG 64 1.111 7.646 12.339 432 2HD ARG 64 2HD ARG 64 0.770 6.381 13.519 433 HE ARG 64 HE ARG 64 3.127 5.792 12.057 434 1HH1 ARG 64 1HH1 ARG 64 1.893 7.825 14.599 435 2HH1 ARG 64 2HH1 ARG 64 3.425 7.991 15.390 436 1HH2 ARG 64 1HH2 ARG 64 5.151 6.003 13.088 437 2HH2 ARG 64 2HH2 ARG 64 5.279 6.954 14.529 438 H SER 65 H SER 65 0.122 8.693 8.047 439 HA SER 65 HA SER 65 -1.239 10.290 10.017 440 1HB SER 65 1HB SER 65 0.784 10.845 8.326 441 2HB SER 65 2HB SER 65 -0.565 11.470 7.378 442 HG SER 65 HG SER 65 0.642 12.592 9.462 443 H THR 66 H THR 66 -2.024 8.788 7.001 444 HA THR 66 HA THR 66 -4.389 10.385 6.541 445 HB THR 66 HB THR 66 -4.520 8.012 5.004 446 HG1 THR 66 HG1 THR 66 -1.973 9.172 4.647 447 1HG2 THR 66 1HG2 THR 66 -4.293 9.495 3.151 448 2HG2 THR 66 2HG2 THR 66 -3.454 10.695 4.134 449 3HG2 THR 66 3HG2 THR 66 -5.166 10.373 4.407 450 H VAL 67 H VAL 67 -3.666 7.063 7.567 451 HA VAL 67 HA VAL 67 -6.220 6.043 7.761 452 HB VAL 67 HB VAL 67 -5.321 4.630 9.658 453 1HG1 VAL 67 1HG1 VAL 67 -4.777 3.285 7.980 454 2HG1 VAL 67 2HG1 VAL 67 -4.653 4.673 6.897 455 3HG1 VAL 67 3HG1 VAL 67 -3.238 4.128 7.800 456 1HG2 VAL 67 1HG2 VAL 67 -2.800 6.180 9.071 457 2HG2 VAL 67 2HG2 VAL 67 -3.738 6.256 10.562 458 3HG2 VAL 67 3HG2 VAL 67 -2.919 4.760 10.110 459 H ARG 68 H ARG 68 -4.529 8.190 9.971 460 HA ARG 68 HA ARG 68 -6.124 8.030 12.217 461 1HB ARG 68 1HB ARG 68 -4.987 10.596 11.101 462 2HB ARG 68 2HB ARG 68 -5.363 10.244 12.782 463 1HG ARG 68 1HG ARG 68 -3.542 8.279 11.782 464 2HG ARG 68 2HG ARG 68 -2.921 9.896 11.446 465 1HD ARG 68 1HD ARG 68 -2.540 10.330 13.616 466 2HD ARG 68 2HD ARG 68 -4.047 9.571 14.129 467 HE ARG 68 HE ARG 68 -2.408 7.497 13.400 468 1HH1 ARG 68 1HH1 ARG 68 -2.252 10.126 15.677 469 2HH1 ARG 68 2HH1 ARG 68 -1.263 9.260 16.807 470 1HH2 ARG 68 1HH2 ARG 68 -1.107 6.347 14.879 471 2HH2 ARG 68 2HH2 ARG 68 -0.612 7.112 16.351 472 H ASP 69 H ASP 69 -6.773 9.589 9.158 473 HA ASP 69 HA ASP 69 -9.109 10.982 10.118 474 1HB ASP 69 1HB ASP 69 -7.444 11.376 7.996 475 2HB ASP 69 2HB ASP 69 -8.813 10.592 7.212 476 H ILE 70 H ILE 70 -8.386 7.963 8.513 477 HA ILE 70 HA ILE 70 -11.007 7.352 7.645 478 HB ILE 70 HB ILE 70 -8.842 5.382 8.382 479 1HG1 ILE 70 1HG1 ILE 70 -9.374 6.679 5.701 480 2HG1 ILE 70 2HG1 ILE 70 -8.064 7.133 6.785 481 1HG2 ILE 70 1HG2 ILE 70 -11.156 4.505 8.042 482 2HG2 ILE 70 2HG2 ILE 70 -11.083 5.112 6.389 483 3HG2 ILE 70 3HG2 ILE 70 -9.959 3.861 6.918 484 1HD1 ILE 70 1HD1 ILE 70 -8.425 4.590 5.248 485 2HD1 ILE 70 2HD1 ILE 70 -7.078 5.728 5.211 486 3HD1 ILE 70 3HD1 ILE 70 -7.324 4.700 6.622 487 H ASP 71 H ASP 71 -9.282 6.804 10.660 488 HA ASP 71 HA ASP 71 -11.789 6.309 12.016 489 1HB ASP 71 1HB ASP 71 -9.771 4.173 11.534 490 2HB ASP 71 2HB ASP 71 -10.529 4.232 13.123 491 HA PRO 72 HA PRO 72 -9.788 8.296 15.374 492 1HB PRO 72 1HB PRO 72 -10.859 7.034 17.526 493 2HB PRO 72 2HB PRO 72 -11.776 8.160 16.517 494 1HG PRO 72 1HG PRO 72 -11.748 5.167 16.472 495 2HG PRO 72 2HG PRO 72 -13.127 6.274 16.353 496 1HD PRO 72 1HD PRO 72 -12.029 5.077 14.187 497 2HD PRO 72 2HD PRO 72 -12.758 6.694 14.117 498 H GLN 73 H GLN 73 -9.581 4.809 15.199 499 HA GLN 73 HA GLN 73 -6.910 4.937 16.373 500 1HB GLN 73 1HB GLN 73 -9.125 3.135 17.347 501 2HB GLN 73 2HB GLN 73 -7.426 2.841 17.693 502 1HG GLN 73 1HG GLN 73 -7.554 5.345 18.545 503 2HG GLN 73 2HG GLN 73 -9.252 4.917 18.755 504 1HE2 GLN 73 1HE2 GLN 73 -9.304 4.871 20.942 505 2HE2 GLN 73 2HE2 GLN 73 -8.416 3.746 21.907 506 H ASN 74 H ASN 74 -6.059 4.532 14.335 507 HA ASN 74 HA ASN 74 -6.551 1.815 13.309 508 1HB ASN 74 1HB ASN 74 -7.524 3.463 11.782 509 2HB ASN 74 2HB ASN 74 -5.981 4.308 11.691 510 1HD2 ASN 74 1HD2 ASN 74 -7.931 2.228 10.114 511 2HD2 ASN 74 2HD2 ASN 74 -6.766 1.403 9.141 512 H ASP 75 H ASP 75 -4.789 0.609 12.752 513 HA ASP 75 HA ASP 75 -2.145 1.872 12.927 514 1HB ASP 75 1HB ASP 75 -3.180 0.295 14.952 515 2HB ASP 75 2HB ASP 75 -2.189 -0.831 14.029 516 H LEU 76 H LEU 76 -1.115 1.517 11.085 517 HA LEU 76 HA LEU 76 -1.916 -0.602 9.304 518 1HB LEU 76 1HB LEU 76 -0.585 1.888 9.085 519 2HB LEU 76 2HB LEU 76 0.505 0.649 8.466 520 HG LEU 76 HG LEU 76 -0.707 1.511 6.617 521 1HD1 LEU 76 1HD1 LEU 76 -0.575 -1.097 7.128 522 2HD1 LEU 76 2HD1 LEU 76 -1.351 -0.452 5.682 523 3HD1 LEU 76 3HD1 LEU 76 -2.330 -0.924 7.071 524 1HD2 LEU 76 1HD2 LEU 76 -2.809 2.256 6.686 525 2HD2 LEU 76 2HD2 LEU 76 -2.697 2.058 8.435 526 3HD2 LEU 76 3HD2 LEU 76 -3.400 0.778 7.445 527 H THR 77 H THR 77 -0.991 -2.535 9.058 528 HA THR 77 HA THR 77 1.606 -3.009 10.371 529 HB THR 77 HB THR 77 0.035 -4.186 11.690 530 HG1 THR 77 HG1 THR 77 1.346 -5.834 11.557 531 1HG2 THR 77 1HG2 THR 77 -1.574 -5.818 10.640 532 2HG2 THR 77 2HG2 THR 77 -1.169 -5.100 9.081 533 3HG2 THR 77 3HG2 THR 77 -1.924 -4.117 10.335 534 H PHE 78 H PHE 78 -0.026 -2.920 7.474 535 HA PHE 78 HA PHE 78 2.113 -4.402 6.155 536 1HB PHE 78 1HB PHE 78 -0.330 -5.616 6.547 537 2HB PHE 78 2HB PHE 78 -0.494 -4.937 4.931 538 HD1 PHE 78 HD1 PHE 78 -0.016 -7.884 6.300 539 HD2 PHE 78 HD2 PHE 78 2.166 -5.203 3.816 540 HE1 PHE 78 HE1 PHE 78 1.259 -9.778 5.381 541 HE2 PHE 78 HE2 PHE 78 3.443 -7.093 2.892 542 HZ PHE 78 HZ PHE 78 2.990 -9.383 3.674 543 H LEU 79 H LEU 79 2.842 -3.355 4.415 544 HA LEU 79 HA LEU 79 1.072 -1.462 3.041 545 1HB LEU 79 1HB LEU 79 3.308 -0.790 4.686 546 2HB LEU 79 2HB LEU 79 3.679 -0.370 3.015 547 HG LEU 79 HG LEU 79 1.767 1.085 2.900 548 1HD1 LEU 79 1HD1 LEU 79 0.172 -0.124 4.212 549 2HD1 LEU 79 2HD1 LEU 79 0.374 1.477 4.924 550 3HD1 LEU 79 3HD1 LEU 79 1.144 0.077 5.670 551 1HD2 LEU 79 1HD2 LEU 79 2.866 1.835 5.552 552 2HD2 LEU 79 2HD2 LEU 79 2.661 2.805 4.093 553 3HD2 LEU 79 3HD2 LEU 79 4.000 1.662 4.212 554 H ARG 80 H ARG 80 0.888 -2.552 1.157 555 HA ARG 80 HA ARG 80 3.382 -3.299 -0.224 556 1HB ARG 80 1HB ARG 80 0.608 -4.461 -0.529 557 2HB ARG 80 2HB ARG 80 2.000 -4.913 -1.504 558 1HG ARG 80 1HG ARG 80 3.009 -6.054 0.216 559 2HG ARG 80 2HG ARG 80 2.165 -5.133 1.463 560 1HD ARG 80 1HD ARG 80 0.929 -7.189 -0.366 561 2HD ARG 80 2HD ARG 80 1.336 -7.428 1.334 562 HE ARG 80 HE ARG 80 -0.381 -5.209 1.067 563 1HH1 ARG 80 1HH1 ARG 80 -0.387 -8.684 0.852 564 2HH1 ARG 80 2HH1 ARG 80 -2.056 -8.838 1.293 565 1HH2 ARG 80 1HH2 ARG 80 -2.579 -5.399 1.648 566 2HH2 ARG 80 2HH2 ARG 80 -3.302 -6.970 1.745 567 H ILE 81 H ILE 81 3.573 -2.841 -2.443 568 HA ILE 81 HA ILE 81 1.526 -1.145 -3.656 569 HB ILE 81 HB ILE 81 4.410 -0.278 -3.676 570 1HG1 ILE 81 1HG1 ILE 81 2.180 0.698 -1.879 571 2HG1 ILE 81 2HG1 ILE 81 3.600 -0.205 -1.363 572 1HG2 ILE 81 1HG2 ILE 81 3.729 1.535 -4.860 573 2HG2 ILE 81 2HG2 ILE 81 2.475 0.407 -5.373 574 3HG2 ILE 81 3HG2 ILE 81 2.140 1.576 -4.096 575 1HD1 ILE 81 1HD1 ILE 81 3.269 2.611 -1.712 576 2HD1 ILE 81 2HD1 ILE 81 4.626 1.720 -1.022 577 3HD1 ILE 81 3HD1 ILE 81 4.562 2.025 -2.758 578 H ARG 82 H ARG 82 1.125 -2.791 -5.133 579 HA ARG 82 HA ARG 82 3.118 -4.143 -6.605 580 1HB ARG 82 1HB ARG 82 0.405 -4.404 -6.302 581 2HB ARG 82 2HB ARG 82 0.531 -3.813 -7.954 582 1HG ARG 82 1HG ARG 82 1.989 -5.649 -8.539 583 2HG ARG 82 2HG ARG 82 1.985 -6.216 -6.867 584 1HD ARG 82 1HD ARG 82 0.431 -7.581 -7.978 585 2HD ARG 82 2HD ARG 82 -0.542 -6.398 -7.104 586 HE ARG 82 HE ARG 82 -1.338 -5.664 -9.108 587 1HH1 ARG 82 1HH1 ARG 82 1.664 -7.340 -9.656 588 2HH1 ARG 82 2HH1 ARG 82 1.559 -7.233 -11.382 589 1HH2 ARG 82 1HH2 ARG 82 -1.488 -5.517 -11.379 590 2HH2 ARG 82 2HH2 ARG 82 -0.233 -6.195 -12.361 591 H SER 83 H SER 83 4.522 -3.144 -7.892 592 HA SER 83 HA SER 83 3.582 -0.903 -9.547 593 1HB SER 83 1HB SER 83 6.454 -1.291 -9.577 594 2HB SER 83 2HB SER 83 5.524 0.126 -9.090 595 HG SER 83 HG SER 83 6.810 -1.628 -7.547 596 H LYS 84 H LYS 84 5.463 -0.840 -11.502 597 HA LYS 84 HA LYS 84 4.690 -3.125 -13.122 598 1HB LYS 84 1HB LYS 84 6.038 -0.501 -13.733 599 2HB LYS 84 2HB LYS 84 5.910 -1.782 -14.932 600 1HG LYS 84 1HG LYS 84 3.379 -1.705 -14.371 601 2HG LYS 84 2HG LYS 84 3.757 -0.113 -13.710 602 1HD LYS 84 1HD LYS 84 3.461 0.635 -15.799 603 2HD LYS 84 2HD LYS 84 5.040 -0.076 -16.137 604 1HE LYS 84 1HE LYS 84 3.675 -2.248 -16.557 605 2HE LYS 84 2HE LYS 84 2.310 -1.146 -16.731 606 1HZ LYS 84 1HZ LYS 84 3.629 0.052 -18.430 607 2HZ LYS 84 2HZ LYS 84 3.249 -1.536 -18.871 608 3HZ LYS 84 3HZ LYS 84 4.807 -1.157 -18.333 609 H LYS 85 H LYS 85 7.715 -1.463 -12.237 610 HA LYS 85 HA LYS 85 9.454 -3.332 -13.405 611 1HB LYS 85 1HB LYS 85 11.147 -2.369 -11.787 612 2HB LYS 85 2HB LYS 85 10.340 -1.207 -12.833 613 1HG LYS 85 1HG LYS 85 8.916 -0.491 -11.051 614 2HG LYS 85 2HG LYS 85 9.509 -1.777 -9.997 615 1HD LYS 85 1HD LYS 85 11.275 0.379 -11.142 616 2HD LYS 85 2HD LYS 85 10.482 0.505 -9.570 617 1HE LYS 85 1HE LYS 85 12.202 -0.583 -8.680 618 2HE LYS 85 2HE LYS 85 11.725 -2.007 -9.604 619 1HZ LYS 85 1HZ LYS 85 13.430 -1.755 -10.996 620 2HZ LYS 85 2HZ LYS 85 14.086 -0.714 -9.837 621 3HZ LYS 85 3HZ LYS 85 13.211 -0.084 -11.140 622 H ASN 86 H ASN 86 8.000 -3.167 -10.198 623 HA ASN 86 HA ASN 86 8.081 -5.925 -9.765 624 1HB ASN 86 1HB ASN 86 9.813 -5.950 -7.912 625 2HB ASN 86 2HB ASN 86 10.451 -5.820 -9.548 626 1HD2 ASN 86 1HD2 ASN 86 12.368 -4.979 -8.587 627 2HD2 ASN 86 2HD2 ASN 86 12.449 -3.320 -8.110 628 H GLU 87 H GLU 87 7.568 -6.493 -7.450 629 HA GLU 87 HA GLU 87 5.718 -4.496 -6.413 630 1HB GLU 87 1HB GLU 87 5.021 -6.877 -6.782 631 2HB GLU 87 2HB GLU 87 6.122 -7.345 -5.494 632 1HG GLU 87 1HG GLU 87 4.863 -6.139 -3.873 633 2HG GLU 87 2HG GLU 87 3.862 -5.400 -5.122 634 H ILE 88 H ILE 88 5.907 -3.484 -4.486 635 HA ILE 88 HA ILE 88 8.298 -4.107 -2.876 636 HB ILE 88 HB ILE 88 6.983 -1.414 -3.258 637 1HG1 ILE 88 1HG1 ILE 88 9.766 -2.213 -4.092 638 2HG1 ILE 88 2HG1 ILE 88 8.387 -2.419 -5.165 639 1HG2 ILE 88 1HG2 ILE 88 9.533 -1.165 -2.101 640 2HG2 ILE 88 2HG2 ILE 88 7.970 -0.820 -1.363 641 3HG2 ILE 88 3HG2 ILE 88 8.690 -2.421 -1.193 642 1HD1 ILE 88 1HD1 ILE 88 8.049 0.150 -4.474 643 2HD1 ILE 88 2HD1 ILE 88 9.804 0.022 -4.348 644 3HD1 ILE 88 3HD1 ILE 88 8.997 -0.376 -5.865 645 H MET 89 H MET 89 7.798 -4.974 -0.983 646 HA MET 89 HA MET 89 5.294 -4.141 0.329 647 1HB MET 89 1HB MET 89 5.437 -6.376 1.503 648 2HB MET 89 2HB MET 89 5.088 -6.443 -0.220 649 1HG MET 89 1HG MET 89 7.524 -6.867 -0.604 650 2HG MET 89 2HG MET 89 7.703 -7.020 1.142 651 1HE MET 89 1HE MET 89 8.014 -9.553 1.938 652 2HE MET 89 2HE MET 89 6.603 -8.715 2.583 653 3HE MET 89 3HE MET 89 6.464 -10.388 2.040 654 H VAL 90 H VAL 90 5.403 -3.313 2.334 655 HA VAL 90 HA VAL 90 7.784 -3.727 3.964 656 HB VAL 90 HB VAL 90 6.826 -0.964 3.202 657 1HG1 VAL 90 1HG1 VAL 90 8.379 -1.958 5.455 658 2HG1 VAL 90 2HG1 VAL 90 9.217 -0.704 4.538 659 3HG1 VAL 90 3HG1 VAL 90 7.617 -0.387 5.209 660 1HG2 VAL 90 1HG2 VAL 90 9.015 -0.701 2.173 661 2HG2 VAL 90 2HG2 VAL 90 9.443 -2.352 2.623 662 3HG2 VAL 90 3HG2 VAL 90 8.155 -2.062 1.454 663 H ALA 91 H ALA 91 7.309 -3.877 6.073 664 HA ALA 91 HA ALA 91 4.829 -2.689 7.079 665 1HB ALA 91 1HB ALA 91 5.512 -5.604 7.110 666 2HB ALA 91 2HB ALA 91 4.479 -4.904 8.356 667 3HB ALA 91 3HB ALA 91 3.999 -4.817 6.662 668 HA PRO 92 HA PRO 92 7.194 -1.687 10.638 669 1HB PRO 92 1HB PRO 92 5.329 -1.853 12.604 670 2HB PRO 92 2HB PRO 92 5.351 -0.551 11.408 671 1HG PRO 92 1HG PRO 92 3.684 -3.037 11.473 672 2HG PRO 92 2HG PRO 92 3.204 -1.378 11.069 673 1HD PRO 92 1HD PRO 92 3.699 -3.253 9.179 674 2HD PRO 92 2HD PRO 92 4.032 -1.528 8.923 675 H ASP 93 H ASP 93 8.687 -3.312 10.937 676 HA ASP 93 HA ASP 93 7.978 -5.878 11.997 677 1HB ASP 93 1HB ASP 93 10.187 -4.812 10.672 678 2HB ASP 93 2HB ASP 93 10.785 -5.182 12.287 679 H LYS 94 H LYS 94 9.904 -6.428 13.864 680 HA LYS 94 HA LYS 94 8.752 -5.710 16.258 681 1HB LYS 94 1HB LYS 94 11.099 -7.112 15.414 682 2HB LYS 94 2HB LYS 94 11.527 -6.057 16.755 683 1HG LYS 94 1HG LYS 94 9.698 -7.043 18.079 684 2HG LYS 94 2HG LYS 94 9.356 -8.145 16.742 685 1HD LYS 94 1HD LYS 94 10.741 -9.504 17.911 686 2HD LYS 94 2HD LYS 94 11.981 -8.606 17.032 687 1HE LYS 94 1HE LYS 94 12.802 -8.371 19.140 688 2HE LYS 94 2HE LYS 94 11.727 -6.974 19.109 689 1HZ LYS 94 1HZ LYS 94 10.595 -7.826 20.791 690 2HZ LYS 94 2HZ LYS 94 11.676 -9.123 20.872 691 3HZ LYS 94 3HZ LYS 94 10.279 -9.245 19.926 692 H ASP 95 H ASP 95 11.663 -4.270 14.792 693 HA ASP 95 HA ASP 95 10.992 -1.713 15.998 694 1HB ASP 95 1HB ASP 95 13.322 -3.381 16.819 695 2HB ASP 95 2HB ASP 95 13.563 -1.641 16.684 696 H TYR 96 H TYR 96 11.477 -3.147 13.318 697 HA TYR 96 HA TYR 96 12.945 -0.926 12.119 698 1HB TYR 96 1HB TYR 96 14.108 -2.672 10.614 699 2HB TYR 96 2HB TYR 96 14.737 -2.429 12.240 700 HD1 TYR 96 HD1 TYR 96 14.304 -4.115 13.998 701 HD2 TYR 96 HD2 TYR 96 13.138 -4.757 9.957 702 HE1 TYR 96 HE1 TYR 96 14.050 -6.518 14.459 703 HE2 TYR 96 HE2 TYR 96 12.879 -7.161 10.407 704 HH TYR 96 HH TYR 96 12.400 -8.593 12.544 705 H PHE 97 H PHE 97 12.868 -1.225 9.609 706 HA PHE 97 HA PHE 97 10.132 -2.073 8.915 707 1HB PHE 97 1HB PHE 97 11.791 0.237 7.915 708 2HB PHE 97 2HB PHE 97 10.373 -0.343 7.047 709 HD1 PHE 97 HD1 PHE 97 8.206 -0.574 8.539 710 HD2 PHE 97 HD2 PHE 97 11.523 1.941 9.427 711 HE1 PHE 97 HE1 PHE 97 6.763 0.821 9.963 712 HE2 PHE 97 HE2 PHE 97 10.086 3.339 10.853 713 HZ PHE 97 HZ PHE 97 7.703 2.779 11.123 714 H LEU 98 H LEU 98 10.360 -4.029 7.997 715 HA LEU 98 HA LEU 98 12.607 -4.753 6.387 716 1HB LEU 98 1HB LEU 98 10.804 -6.164 7.788 717 2HB LEU 98 2HB LEU 98 10.101 -6.307 6.179 718 HG LEU 98 HG LEU 98 12.983 -6.935 6.426 719 1HD1 LEU 98 1HD1 LEU 98 12.782 -8.924 7.546 720 2HD1 LEU 98 2HD1 LEU 98 11.057 -9.067 7.212 721 3HD1 LEU 98 3HD1 LEU 98 11.626 -7.932 8.435 722 1HD2 LEU 98 1HD2 LEU 98 10.617 -8.053 4.939 723 2HD2 LEU 98 2HD2 LEU 98 12.215 -8.799 4.913 724 3HD2 LEU 98 3HD2 LEU 98 11.993 -7.165 4.285 725 H ILE 99 H ILE 99 12.803 -4.867 4.198 726 HA ILE 99 HA ILE 99 10.502 -4.042 2.566 727 HB ILE 99 HB ILE 99 13.303 -3.027 2.093 728 1HG1 ILE 99 1HG1 ILE 99 11.675 -0.863 2.744 729 2HG1 ILE 99 2HG1 ILE 99 11.242 -2.096 3.924 730 1HG2 ILE 99 1HG2 ILE 99 10.669 -2.681 0.749 731 2HG2 ILE 99 2HG2 ILE 99 11.816 -1.342 0.735 732 3HG2 ILE 99 3HG2 ILE 99 12.273 -2.901 0.049 733 1HD1 ILE 99 1HD1 ILE 99 13.524 -2.275 4.645 734 2HD1 ILE 99 2HD1 ILE 99 14.050 -1.170 3.375 735 3HD1 ILE 99 3HD1 ILE 99 13.029 -0.583 4.688 736 H VAL 100 H VAL 100 10.090 -5.871 1.478 737 HA VAL 100 HA VAL 100 12.334 -7.351 0.293 738 HB VAL 100 HB VAL 100 9.460 -8.203 0.671 739 1HG1 VAL 100 1HG1 VAL 100 11.713 -9.348 -0.832 740 2HG1 VAL 100 2HG1 VAL 100 10.848 -10.479 0.210 741 3HG1 VAL 100 3HG1 VAL 100 9.977 -9.580 -1.034 742 1HG2 VAL 100 1HG2 VAL 100 11.875 -8.421 2.331 743 2HG2 VAL 100 2HG2 VAL 100 10.172 -8.480 2.789 744 3HG2 VAL 100 3HG2 VAL 100 10.961 -9.917 2.138 745 H ILE 101 H ILE 101 12.794 -6.798 -1.728 746 HA ILE 101 HA ILE 101 10.602 -5.964 -3.505 747 HB ILE 101 HB ILE 101 13.566 -5.456 -3.780 748 1HG1 ILE 101 1HG1 ILE 101 11.733 -3.179 -3.540 749 2HG1 ILE 101 2HG1 ILE 101 11.782 -4.197 -2.105 750 1HG2 ILE 101 1HG2 ILE 101 11.346 -5.240 -5.647 751 2HG2 ILE 101 2HG2 ILE 101 12.232 -3.728 -5.458 752 3HG2 ILE 101 3HG2 ILE 101 13.084 -5.194 -5.944 753 1HD1 ILE 101 1HD1 ILE 101 14.445 -3.843 -2.847 754 2HD1 ILE 101 2HD1 ILE 101 13.683 -2.264 -3.041 755 3HD1 ILE 101 3HD1 ILE 101 13.598 -3.100 -1.490 756 H GLN 102 H GLN 102 10.041 -7.224 -5.157 757 HA GLN 102 HA GLN 102 11.902 -8.859 -6.576 758 1HB GLN 102 1HB GLN 102 11.122 -11.022 -5.996 759 2HB GLN 102 2HB GLN 102 11.431 -10.193 -4.476 760 1HG GLN 102 1HG GLN 102 9.026 -9.699 -4.290 761 2HG GLN 102 2HG GLN 102 8.748 -10.615 -5.770 762 1HE2 GLN 102 1HE2 GLN 102 8.759 -10.762 -2.471 763 2HE2 GLN 102 2HE2 GLN 102 8.861 -12.474 -2.266 764 H ASN 103 H ASN 103 10.657 -10.329 -8.170 765 HA ASN 103 HA ASN 103 9.099 -8.770 -9.829 766 1HB ASN 103 1HB ASN 103 9.725 -11.646 -9.621 767 2HB ASN 103 2HB ASN 103 8.250 -11.267 -10.505 768 1HD2 ASN 103 1HD2 ASN 103 11.706 -10.924 -10.407 769 2HD2 ASN 103 2HD2 ASN 103 11.903 -10.402 -12.042 770 HA PRO 104 HA PRO 104 4.989 -8.732 -8.296 771 1HB PRO 104 1HB PRO 104 3.513 -9.016 -10.557 772 2HB PRO 104 2HB PRO 104 4.400 -7.537 -10.168 773 1HG PRO 104 1HG PRO 104 5.164 -9.779 -11.999 774 2HG PRO 104 2HG PRO 104 5.323 -8.029 -12.245 775 1HD PRO 104 1HD PRO 104 7.404 -9.590 -11.494 776 2HD PRO 104 2HD PRO 104 7.244 -7.899 -10.978 777 H THR 105 H THR 105 3.281 -10.034 -7.661 778 HA THR 105 HA THR 105 3.561 -12.882 -8.340 779 HB THR 105 HB THR 105 2.236 -13.273 -6.234 780 HG1 THR 105 HG1 THR 105 2.413 -11.346 -4.768 781 1HG2 THR 105 1HG2 THR 105 4.121 -13.236 -4.877 782 2HG2 THR 105 2HG2 THR 105 4.710 -11.723 -5.564 783 3HG2 THR 105 3HG2 THR 105 4.822 -13.217 -6.494 784 H GLU 106 H GLU 106 1.276 -10.225 -8.111 785 HA GLU 106 HA GLU 106 -1.129 -11.541 -8.425 786 1HB GLU 106 1HB GLU 106 -0.910 -9.114 -8.039 787 2HB GLU 106 2HB GLU 106 -0.326 -8.913 -9.685 788 1HG GLU 106 1HG GLU 106 -2.387 -9.196 -10.605 789 2HG GLU 106 2HG GLU 106 -2.949 -10.241 -9.301 790 H MET 11 H MET 11 -19.046 3.993 -15.924 791 HA MET 11 HA MET 11 -18.746 3.832 -13.105 792 1HB MET 11 1HB MET 11 -20.475 5.160 -14.976 793 2HB MET 11 2HB MET 11 -21.441 4.426 -13.703 794 1HG MET 11 1HG MET 11 -19.091 6.236 -13.209 795 2HG MET 11 2HG MET 11 -20.768 6.773 -13.263 796 1HE MET 11 1HE MET 11 -22.340 4.422 -10.718 797 2HE MET 11 2HE MET 11 -22.478 6.174 -10.576 798 3HE MET 11 3HE MET 11 -22.519 5.412 -12.166 799 H ALA 12 H ALA 12 -21.003 2.266 -15.369 800 HA ALA 12 HA ALA 12 -22.487 0.782 -13.575 801 1HB ALA 12 1HB ALA 12 -23.450 0.204 -15.486 802 2HB ALA 12 2HB ALA 12 -22.066 0.810 -16.397 803 3HB ALA 12 3HB ALA 12 -22.087 -0.860 -15.833 804 H GLU 13 H GLU 13 -19.338 0.030 -14.997 805 HA GLU 13 HA GLU 13 -19.039 -2.594 -14.181 806 1HB GLU 13 1HB GLU 13 -17.469 -1.095 -15.586 807 2HB GLU 13 2HB GLU 13 -16.762 -0.636 -14.043 808 1HG GLU 13 1HG GLU 13 -15.986 -2.799 -13.622 809 2HG GLU 13 2HG GLU 13 -17.037 -3.509 -14.846 810 H VAL 14 H VAL 14 -18.098 0.343 -12.399 811 HA VAL 14 HA VAL 14 -17.217 -0.989 -10.078 812 HB VAL 14 HB VAL 14 -18.352 1.805 -10.193 813 1HG1 VAL 14 1HG1 VAL 14 -16.505 2.068 -8.397 814 2HG1 VAL 14 2HG1 VAL 14 -18.031 1.302 -7.952 815 3HG1 VAL 14 3HG1 VAL 14 -16.607 0.312 -8.274 816 1HG2 VAL 14 1HG2 VAL 14 -15.631 0.767 -10.944 817 2HG2 VAL 14 2HG2 VAL 14 -16.733 1.746 -11.912 818 3HG2 VAL 14 3HG2 VAL 14 -15.921 2.453 -10.516 819 H GLU 15 H GLU 15 -20.374 0.167 -11.094 820 HA GLU 15 HA GLU 15 -21.664 -0.120 -8.586 821 1HB GLU 15 1HB GLU 15 -22.695 -0.013 -11.417 822 2HB GLU 15 2HB GLU 15 -23.765 -0.176 -10.031 823 1HG GLU 15 1HG GLU 15 -23.027 1.936 -9.149 824 2HG GLU 15 2HG GLU 15 -21.822 2.087 -10.427 825 H GLU 16 H GLU 16 -21.205 -2.276 -11.341 826 HA GLU 16 HA GLU 16 -22.911 -4.342 -10.472 827 1HB GLU 16 1HB GLU 16 -21.357 -3.871 -12.702 828 2HB GLU 16 2HB GLU 16 -20.553 -5.241 -11.949 829 1HG GLU 16 1HG GLU 16 -22.648 -6.486 -11.958 830 2HG GLU 16 2HG GLU 16 -23.466 -5.111 -12.696 831 H THR 17 H THR 17 -19.597 -3.529 -9.707 832 HA THR 17 HA THR 17 -19.060 -6.015 -8.354 833 HB THR 17 HB THR 17 -17.515 -3.415 -8.364 834 HG1 THR 17 HG1 THR 17 -17.660 -4.595 -10.388 835 1HG2 THR 17 1HG2 THR 17 -15.671 -5.209 -7.703 836 2HG2 THR 17 2HG2 THR 17 -17.071 -6.022 -7.005 837 3HG2 THR 17 3HG2 THR 17 -16.650 -4.391 -6.486 838 H LEU 18 H LEU 18 -20.366 -2.921 -7.524 839 HA LEU 18 HA LEU 18 -19.891 -3.110 -4.707 840 1HB LEU 18 1HB LEU 18 -21.063 -1.224 -6.553 841 2HB LEU 18 2HB LEU 18 -22.062 -1.405 -5.112 842 HG LEU 18 HG LEU 18 -19.786 -1.021 -3.863 843 1HD1 LEU 18 1HD1 LEU 18 -18.432 0.666 -5.163 844 2HD1 LEU 18 2HD1 LEU 18 -19.283 0.110 -6.604 845 3HD1 LEU 18 3HD1 LEU 18 -18.281 -1.012 -5.684 846 1HD2 LEU 18 1HD2 LEU 18 -21.880 0.417 -3.939 847 2HD2 LEU 18 2HD2 LEU 18 -21.074 1.337 -5.210 848 3HD2 LEU 18 3HD2 LEU 18 -20.360 1.245 -3.600 849 H LYS 19 H LYS 19 -22.432 -4.093 -6.892 850 HA LYS 19 HA LYS 19 -24.444 -4.555 -4.955 851 1HB LYS 19 1HB LYS 19 -23.981 -5.392 -7.783 852 2HB LYS 19 2HB LYS 19 -25.207 -6.241 -6.850 853 1HG LYS 19 1HG LYS 19 -25.280 -3.282 -6.799 854 2HG LYS 19 2HG LYS 19 -25.744 -4.083 -8.303 855 1HD LYS 19 1HD LYS 19 -26.892 -4.902 -5.649 856 2HD LYS 19 2HD LYS 19 -27.592 -3.592 -6.602 857 1HE LYS 19 1HE LYS 19 -27.386 -5.492 -8.497 858 2HE LYS 19 2HE LYS 19 -27.607 -6.507 -7.072 859 1HZ LYS 19 1HZ LYS 19 -29.758 -6.060 -7.137 860 2HZ LYS 19 2HZ LYS 19 -29.544 -5.075 -8.495 861 3HZ LYS 19 3HZ LYS 19 -29.449 -4.407 -6.943 862 H ARG 20 H ARG 20 -22.120 -6.743 -6.530 863 HA ARG 20 HA ARG 20 -22.910 -9.043 -5.078 864 1HB ARG 20 1HB ARG 20 -20.998 -10.113 -6.023 865 2HB ARG 20 2HB ARG 20 -21.642 -9.031 -7.250 866 1HG ARG 20 1HG ARG 20 -19.918 -7.357 -6.557 867 2HG ARG 20 2HG ARG 20 -19.215 -8.605 -5.527 868 1HD ARG 20 1HD ARG 20 -19.721 -9.383 -8.324 869 2HD ARG 20 2HD ARG 20 -18.476 -8.159 -8.085 870 HE ARG 20 HE ARG 20 -17.955 -10.184 -6.272 871 1HH1 ARG 20 1HH1 ARG 20 -18.129 -9.809 -9.729 872 2HH1 ARG 20 2HH1 ARG 20 -16.961 -11.048 -10.053 873 1HH2 ARG 20 1HH2 ARG 20 -16.417 -11.817 -6.685 874 2HH2 ARG 20 2HH2 ARG 20 -15.989 -12.190 -8.321 875 H LEU 21 H LEU 21 -20.564 -6.504 -4.495 876 HA LEU 21 HA LEU 21 -19.191 -7.781 -2.369 877 1HB LEU 21 1HB LEU 21 -19.281 -5.122 -3.586 878 2HB LEU 21 2HB LEU 21 -18.924 -5.107 -1.861 879 HG LEU 21 HG LEU 21 -16.964 -6.448 -2.192 880 1HD1 LEU 21 1HD1 LEU 21 -17.077 -7.981 -3.810 881 2HD1 LEU 21 2HD1 LEU 21 -16.525 -6.695 -4.882 882 3HD1 LEU 21 3HD1 LEU 21 -18.247 -7.047 -4.743 883 1HD2 LEU 21 1HD2 LEU 21 -16.277 -4.294 -2.490 884 2HD2 LEU 21 2HD2 LEU 21 -17.337 -4.026 -3.874 885 3HD2 LEU 21 3HD2 LEU 21 -15.850 -4.955 -4.068 886 H GLN 22 H GLN 22 -21.827 -5.397 -2.436 887 HA GLN 22 HA GLN 22 -22.148 -4.980 0.271 888 1HB GLN 22 1HB GLN 22 -23.571 -4.355 -2.056 889 2HB GLN 22 2HB GLN 22 -24.723 -5.204 -1.034 890 1HG GLN 22 1HG GLN 22 -25.068 -3.299 0.031 891 2HG GLN 22 2HG GLN 22 -23.429 -3.423 0.668 892 1HE2 GLN 22 1HE2 GLN 22 -21.717 -2.417 -0.559 893 2HE2 GLN 22 2HE2 GLN 22 -22.060 -1.016 -1.510 894 H SER 23 H SER 23 -23.027 -7.752 -1.642 895 HA SER 23 HA SER 23 -24.742 -8.918 0.344 896 1HB SER 23 1HB SER 23 -25.160 -9.520 -1.936 897 2HB SER 23 2HB SER 23 -23.485 -10.016 -2.177 898 HG SER 23 HG SER 23 -23.828 -11.786 -0.904 899 H GLN 24 H GLN 24 -21.374 -9.271 -0.635 900 HA GLN 24 HA GLN 24 -20.661 -11.541 0.766 901 1HB GLN 24 1HB GLN 24 -19.057 -9.029 0.272 902 2HB GLN 24 2HB GLN 24 -18.372 -10.532 0.877 903 1HG GLN 24 1HG GLN 24 -19.082 -11.669 -1.174 904 2HG GLN 24 2HG GLN 24 -19.731 -10.147 -1.781 905 1HE2 GLN 24 1HE2 GLN 24 -17.817 -8.361 -1.119 906 2HE2 GLN 24 2HE2 GLN 24 -16.339 -8.728 -1.935 907 H LYS 25 H LYS 25 -19.785 -11.921 2.823 908 HA LYS 25 HA LYS 25 -20.805 -10.113 4.876 909 1HB LYS 25 1HB LYS 25 -21.043 -12.754 4.735 910 2HB LYS 25 2HB LYS 25 -19.483 -12.701 5.546 911 1HG LYS 25 1HG LYS 25 -20.971 -10.913 6.996 912 2HG LYS 25 2HG LYS 25 -22.151 -12.158 6.577 913 1HD LYS 25 1HD LYS 25 -20.566 -13.868 7.437 914 2HD LYS 25 2HD LYS 25 -19.501 -12.562 7.963 915 1HE LYS 25 1HE LYS 25 -20.626 -12.546 9.883 916 2HE LYS 25 2HE LYS 25 -21.998 -11.894 8.989 917 1HZ LYS 25 1HZ LYS 25 -21.531 -14.804 9.114 918 2HZ LYS 25 2HZ LYS 25 -22.972 -13.972 8.810 919 3HZ LYS 25 3HZ LYS 25 -22.330 -14.007 10.375 920 H GLY 26 H GLY 26 -19.282 -8.450 4.836 921 1HA GLY 26 1HA GLY 26 -17.262 -8.355 6.586 922 2HA GLY 26 2HA GLY 26 -16.469 -9.091 5.201 923 H VAL 27 H VAL 27 -18.415 -7.431 3.488 924 HA VAL 27 HA VAL 27 -16.609 -5.295 2.984 925 HB VAL 27 HB VAL 27 -19.429 -5.710 1.980 926 1HG1 VAL 27 1HG1 VAL 27 -17.602 -3.498 1.695 927 2HG1 VAL 27 2HG1 VAL 27 -17.961 -4.227 0.129 928 3HG1 VAL 27 3HG1 VAL 27 -19.274 -3.651 1.156 929 1HG2 VAL 27 1HG2 VAL 27 -18.014 -7.533 1.317 930 2HG2 VAL 27 2HG2 VAL 27 -18.269 -6.488 -0.081 931 3HG2 VAL 27 3HG2 VAL 27 -16.745 -6.422 0.804 932 H GLN 28 H GLN 28 -16.392 -3.575 4.248 933 HA GLN 28 HA GLN 28 -18.503 -2.701 5.998 934 1HB GLN 28 1HB GLN 28 -15.654 -2.288 5.749 935 2HB GLN 28 2HB GLN 28 -16.484 -0.755 5.979 936 1HG GLN 28 1HG GLN 28 -17.358 -1.404 8.047 937 2HG GLN 28 2HG GLN 28 -17.023 -3.109 7.750 938 1HE2 GLN 28 1HE2 GLN 28 -15.177 -3.940 8.478 939 2HE2 GLN 28 2HE2 GLN 28 -13.870 -3.032 9.150 940 H GLY 29 H GLY 29 -17.154 -1.720 2.929 941 1HA GLY 29 1HA GLY 29 -19.303 -0.366 1.957 942 2HA GLY 29 2HA GLY 29 -18.459 0.849 2.906 943 H ILE 30 H ILE 30 -18.947 0.574 -0.027 944 HA ILE 30 HA ILE 30 -16.141 0.577 -0.930 945 HB ILE 30 HB ILE 30 -18.547 0.233 -2.711 946 1HG1 ILE 30 1HG1 ILE 30 -17.414 -2.228 -2.655 947 2HG1 ILE 30 2HG1 ILE 30 -17.131 -1.717 -0.994 948 1HG2 ILE 30 1HG2 ILE 30 -16.607 0.970 -3.894 949 2HG2 ILE 30 2HG2 ILE 30 -15.594 -0.225 -3.085 950 3HG2 ILE 30 3HG2 ILE 30 -16.826 -0.746 -4.235 951 1HD1 ILE 30 1HD1 ILE 30 -19.419 -2.881 -1.985 952 2HD1 ILE 30 2HD1 ILE 30 -19.256 -2.041 -0.443 953 3HD1 ILE 30 3HD1 ILE 30 -19.841 -1.173 -1.863 954 H ILE 31 H ILE 31 -15.326 2.360 -1.882 955 HA ILE 31 HA ILE 31 -17.171 4.613 -2.345 956 HB ILE 31 HB ILE 31 -14.314 4.743 -1.374 957 1HG1 ILE 31 1HG1 ILE 31 -16.625 5.852 0.147 958 2HG1 ILE 31 2HG1 ILE 31 -16.397 4.107 0.160 959 1HG2 ILE 31 1HG2 ILE 31 -16.248 6.837 -2.278 960 2HG2 ILE 31 2HG2 ILE 31 -15.025 7.217 -1.066 961 3HG2 ILE 31 3HG2 ILE 31 -14.537 6.652 -2.663 962 1HD1 ILE 31 1HD1 ILE 31 -14.388 4.251 1.285 963 2HD1 ILE 31 2HD1 ILE 31 -14.123 5.928 0.808 964 3HD1 ILE 31 3HD1 ILE 31 -15.340 5.538 2.023 965 H VAL 32 H VAL 32 -16.880 5.860 -4.166 966 HA VAL 32 HA VAL 32 -14.756 5.040 -6.029 967 HB VAL 32 HB VAL 32 -17.518 5.693 -7.015 968 1HG1 VAL 32 1HG1 VAL 32 -15.337 4.022 -8.250 969 2HG1 VAL 32 2HG1 VAL 32 -16.802 4.629 -9.026 970 3HG1 VAL 32 3HG1 VAL 32 -15.530 5.751 -8.538 971 1HG2 VAL 32 1HG2 VAL 32 -17.940 3.267 -7.186 972 2HG2 VAL 32 2HG2 VAL 32 -16.462 2.966 -6.273 973 3HG2 VAL 32 3HG2 VAL 32 -17.808 3.815 -5.515 974 H VAL 33 H VAL 33 -13.511 6.800 -6.150 975 HA VAL 33 HA VAL 33 -14.811 9.429 -6.408 976 HB VAL 33 HB VAL 33 -11.908 8.986 -5.747 977 1HG1 VAL 33 1HG1 VAL 33 -12.628 11.215 -6.549 978 2HG1 VAL 33 2HG1 VAL 33 -13.747 11.310 -5.188 979 3HG1 VAL 33 3HG1 VAL 33 -12.009 11.240 -4.898 980 1HG2 VAL 33 1HG2 VAL 33 -14.300 8.859 -3.972 981 2HG2 VAL 33 2HG2 VAL 33 -12.816 7.908 -3.930 982 3HG2 VAL 33 3HG2 VAL 33 -12.811 9.575 -3.356 983 H ASN 34 H ASN 34 -14.383 10.734 -8.128 984 HA ASN 34 HA ASN 34 -13.083 9.476 -10.407 985 1HB ASN 34 1HB ASN 34 -13.995 11.456 -11.657 986 2HB ASN 34 2HB ASN 34 -15.221 10.469 -10.865 987 1HD2 ASN 34 1HD2 ASN 34 -16.607 12.298 -11.003 988 2HD2 ASN 34 2HD2 ASN 34 -16.477 13.584 -9.856 989 H THR 35 H THR 35 -12.062 11.427 -11.882 990 HA THR 35 HA THR 35 -9.570 11.969 -10.675 991 HB THR 35 HB THR 35 -9.888 13.752 -12.845 992 HG1 THR 35 HG1 THR 35 -10.936 12.579 -14.364 993 1HG2 THR 35 1HG2 THR 35 -7.968 12.180 -12.079 994 2HG2 THR 35 2HG2 THR 35 -8.168 12.514 -13.799 995 3HG2 THR 35 3HG2 THR 35 -8.752 10.994 -13.122 996 H GLU 36 H GLU 36 -12.543 13.738 -10.805 997 HA GLU 36 HA GLU 36 -11.409 16.298 -10.189 998 1HB GLU 36 1HB GLU 36 -14.145 15.171 -10.463 999 2HB GLU 36 2HB GLU 36 -13.972 16.620 -9.483 1000 1HG GLU 36 1HG GLU 36 -12.541 17.318 -11.666 1001 2HG GLU 36 2HG GLU 36 -13.754 16.262 -12.387 1002 H GLY 37 H GLY 37 -12.414 13.529 -8.379 1003 1HA GLY 37 1HA GLY 37 -11.589 13.248 -6.132 1004 2HA GLY 37 2HA GLY 37 -11.765 14.981 -5.899 1005 H ILE 38 H ILE 38 -14.439 14.126 -7.545 1006 HA ILE 38 HA ILE 38 -16.058 14.150 -5.141 1007 HB ILE 38 HB ILE 38 -16.937 14.081 -8.029 1008 1HG1 ILE 38 1HG1 ILE 38 -16.752 16.446 -6.152 1009 2HG1 ILE 38 2HG1 ILE 38 -15.570 16.080 -7.404 1010 1HG2 ILE 38 1HG2 ILE 38 -19.094 14.799 -7.198 1011 2HG2 ILE 38 2HG2 ILE 38 -18.623 13.290 -6.418 1012 3HG2 ILE 38 3HG2 ILE 38 -18.480 14.816 -5.545 1013 1HD1 ILE 38 1HD1 ILE 38 -16.794 17.121 -8.919 1014 2HD1 ILE 38 2HD1 ILE 38 -18.199 16.128 -8.533 1015 3HD1 ILE 38 3HD1 ILE 38 -17.895 17.613 -7.633 1016 HA PRO 39 HA PRO 39 -16.560 9.756 -5.014 1017 1HB PRO 39 1HB PRO 39 -18.633 9.696 -3.263 1018 2HB PRO 39 2HB PRO 39 -16.969 10.032 -2.770 1019 1HG PRO 39 1HG PRO 39 -19.215 11.944 -3.281 1020 2HG PRO 39 2HG PRO 39 -18.022 11.944 -1.969 1021 1HD PRO 39 1HD PRO 39 -17.809 13.558 -4.133 1022 2HD PRO 39 2HD PRO 39 -16.392 12.909 -3.283 1023 H ILE 40 H ILE 40 -17.305 9.781 -7.286 1024 HA ILE 40 HA ILE 40 -19.855 10.269 -8.187 1025 HB ILE 40 HB ILE 40 -19.407 8.335 -9.825 1026 1HG1 ILE 40 1HG1 ILE 40 -16.654 8.516 -8.591 1027 2HG1 ILE 40 2HG1 ILE 40 -17.785 7.210 -8.253 1028 1HG2 ILE 40 1HG2 ILE 40 -17.126 9.998 -10.283 1029 2HG2 ILE 40 2HG2 ILE 40 -18.687 9.999 -11.102 1030 3HG2 ILE 40 3HG2 ILE 40 -18.451 10.976 -9.653 1031 1HD1 ILE 40 1HD1 ILE 40 -17.451 6.225 -10.253 1032 2HD1 ILE 40 2HD1 ILE 40 -17.217 7.758 -11.095 1033 3HD1 ILE 40 3HD1 ILE 40 -15.907 7.069 -10.136 1034 H LYS 41 H LYS 41 -18.654 7.450 -6.460 1035 HA LYS 41 HA LYS 41 -21.425 6.611 -6.016 1036 1HB LYS 41 1HB LYS 41 -19.448 5.173 -7.568 1037 2HB LYS 41 2HB LYS 41 -19.973 4.224 -6.184 1038 1HG LYS 41 1HG LYS 41 -22.122 5.519 -7.721 1039 2HG LYS 41 2HG LYS 41 -21.230 4.250 -8.563 1040 1HD LYS 41 1HD LYS 41 -22.980 3.108 -7.520 1041 2HD LYS 41 2HD LYS 41 -21.608 2.854 -6.440 1042 1HE LYS 41 1HE LYS 41 -22.781 3.728 -4.771 1043 2HE LYS 41 2HE LYS 41 -22.869 5.256 -5.647 1044 1HZ LYS 41 1HZ LYS 41 -24.749 3.601 -6.806 1045 2HZ LYS 41 2HZ LYS 41 -25.040 4.927 -5.799 1046 3HZ LYS 41 3HZ LYS 41 -24.923 3.375 -5.138 1047 H SER 42 H SER 42 -21.830 5.787 -4.010 1048 HA SER 42 HA SER 42 -19.801 4.825 -2.261 1049 1HB SER 42 1HB SER 42 -19.388 7.318 -2.222 1050 2HB SER 42 2HB SER 42 -20.986 7.500 -1.497 1051 HG SER 42 HG SER 42 -18.902 5.901 -0.420 1052 H THR 43 H THR 43 -20.644 3.839 -0.439 1053 HA THR 43 HA THR 43 -23.586 3.859 -0.236 1054 HB THR 43 HB THR 43 -23.587 1.550 0.342 1055 HG1 THR 43 HG1 THR 43 -21.648 0.396 0.650 1056 1HG2 THR 43 1HG2 THR 43 -22.727 2.448 -2.127 1057 2HG2 THR 43 2HG2 THR 43 -23.306 0.824 -1.757 1058 3HG2 THR 43 3HG2 THR 43 -21.577 1.172 -1.729 1059 H MET 44 H MET 44 -20.665 4.470 1.348 1060 HA MET 44 HA MET 44 -21.400 3.822 4.013 1061 1HB MET 44 1HB MET 44 -19.111 4.788 2.706 1062 2HB MET 44 2HB MET 44 -19.547 6.033 3.869 1063 1HG MET 44 1HG MET 44 -19.447 4.467 5.676 1064 2HG MET 44 2HG MET 44 -19.214 3.126 4.558 1065 1HE MET 44 1HE MET 44 -17.195 4.235 2.457 1066 2HE MET 44 2HE MET 44 -15.637 3.805 3.162 1067 3HE MET 44 3HE MET 44 -16.980 2.663 3.227 1068 H ASP 45 H ASP 45 -20.948 6.055 5.518 1069 HA ASP 45 HA ASP 45 -23.471 7.318 5.498 1070 1HB ASP 45 1HB ASP 45 -21.035 7.420 7.118 1071 2HB ASP 45 2HB ASP 45 -21.873 8.966 7.026 1072 H ASN 46 H ASN 46 -23.868 9.648 5.332 1073 HA ASN 46 HA ASN 46 -23.020 10.682 2.861 1074 1HB ASN 46 1HB ASN 46 -24.951 11.335 4.810 1075 2HB ASN 46 2HB ASN 46 -23.964 12.778 4.595 1076 1HD2 ASN 46 1HD2 ASN 46 -23.306 12.556 1.931 1077 2HD2 ASN 46 2HD2 ASN 46 -24.735 12.731 0.975 1078 HA PRO 47 HA PRO 47 -20.304 13.778 5.392 1079 1HB PRO 47 1HB PRO 47 -19.946 13.245 8.030 1080 2HB PRO 47 2HB PRO 47 -21.275 14.241 7.423 1081 1HG PRO 47 1HG PRO 47 -21.282 11.356 8.224 1082 2HG PRO 47 2HG PRO 47 -22.478 12.618 8.574 1083 1HD PRO 47 1HD PRO 47 -22.826 10.786 6.611 1084 2HD PRO 47 2HD PRO 47 -23.460 12.440 6.497 1085 H THR 48 H THR 48 -20.242 10.363 6.144 1086 HA THR 48 HA THR 48 -17.439 10.237 6.709 1087 HB THR 48 HB THR 48 -19.381 8.034 5.989 1088 HG1 THR 48 HG1 THR 48 -19.119 7.667 8.340 1089 1HG2 THR 48 1HG2 THR 48 -17.653 6.561 7.054 1090 2HG2 THR 48 2HG2 THR 48 -16.548 7.935 7.019 1091 3HG2 THR 48 3HG2 THR 48 -17.166 7.262 5.511 1092 H THR 49 H THR 49 -19.455 9.688 3.868 1093 HA THR 49 HA THR 49 -17.511 8.558 2.195 1094 HB THR 49 HB THR 49 -19.908 10.255 1.475 1095 HG1 THR 49 HG1 THR 49 -19.479 7.542 2.010 1096 1HG2 THR 49 1HG2 THR 49 -19.696 9.254 -0.768 1097 2HG2 THR 49 2HG2 THR 49 -18.177 8.504 -0.276 1098 3HG2 THR 49 3HG2 THR 49 -18.308 10.261 -0.359 1099 H THR 50 H THR 50 -18.291 11.912 2.928 1100 HA THR 50 HA THR 50 -16.687 13.090 0.917 1101 HB THR 50 HB THR 50 -16.717 14.926 2.996 1102 HG1 THR 50 HG1 THR 50 -18.312 14.414 4.277 1103 1HG2 THR 50 1HG2 THR 50 -18.184 14.437 0.500 1104 2HG2 THR 50 2HG2 THR 50 -17.409 15.907 1.091 1105 3HG2 THR 50 3HG2 THR 50 -19.024 15.476 1.651 1106 H GLN 51 H GLN 51 -16.081 12.535 4.385 1107 HA GLN 51 HA GLN 51 -13.467 13.539 4.427 1108 1HB GLN 51 1HB GLN 51 -14.695 13.164 6.477 1109 2HB GLN 51 2HB GLN 51 -14.777 11.437 6.156 1110 1HG GLN 51 1HG GLN 51 -12.048 12.240 6.118 1111 2HG GLN 51 2HG GLN 51 -12.807 12.868 7.580 1112 1HE2 GLN 51 1HE2 GLN 51 -11.758 10.067 5.876 1113 2HE2 GLN 51 2HE2 GLN 51 -12.058 8.922 7.134 1114 H TYR 52 H TYR 52 -14.676 10.252 3.886 1115 HA TYR 52 HA TYR 52 -12.209 8.944 3.763 1116 1HB TYR 52 1HB TYR 52 -14.970 8.372 2.887 1117 2HB TYR 52 2HB TYR 52 -13.712 7.495 2.024 1118 HD1 TYR 52 HD1 TYR 52 -12.939 5.499 2.906 1119 HD2 TYR 52 HD2 TYR 52 -14.769 8.325 5.508 1120 HE1 TYR 52 HE1 TYR 52 -12.791 3.883 4.755 1121 HE2 TYR 52 HE2 TYR 52 -14.626 6.717 7.364 1122 HH TYR 52 HH TYR 52 -14.298 3.631 7.101 1123 H ALA 53 H ALA 53 -14.204 10.213 1.095 1124 HA ALA 53 HA ALA 53 -12.315 9.657 -0.932 1125 1HB ALA 53 1HB ALA 53 -14.752 11.376 -0.758 1126 2HB ALA 53 2HB ALA 53 -13.699 11.477 -2.170 1127 3HB ALA 53 3HB ALA 53 -14.458 9.943 -1.743 1128 H SER 54 H SER 54 -12.494 12.127 1.430 1129 HA SER 54 HA SER 54 -11.041 14.135 0.009 1130 1HB SER 54 1HB SER 54 -12.279 13.852 2.603 1131 2HB SER 54 2HB SER 54 -10.671 14.557 2.765 1132 HG SER 54 HG SER 54 -12.943 15.558 1.493 1133 H LEU 55 H LEU 55 -10.193 11.504 2.178 1134 HA LEU 55 HA LEU 55 -7.371 12.264 2.078 1135 1HB LEU 55 1HB LEU 55 -7.036 10.990 3.944 1136 2HB LEU 55 2HB LEU 55 -8.715 11.471 4.177 1137 HG LEU 55 HG LEU 55 -9.141 9.158 2.931 1138 1HD1 LEU 55 1HD1 LEU 55 -7.486 7.648 2.980 1139 2HD1 LEU 55 2HD1 LEU 55 -6.895 8.194 4.549 1140 3HD1 LEU 55 3HD1 LEU 55 -6.430 9.057 3.083 1141 1HD2 LEU 55 1HD2 LEU 55 -9.909 8.443 4.932 1142 2HD2 LEU 55 2HD2 LEU 55 -9.555 10.104 5.407 1143 3HD2 LEU 55 3HD2 LEU 55 -8.403 8.818 5.770 1144 H MET 56 H MET 56 -9.607 10.044 0.700 1145 HA MET 56 HA MET 56 -7.844 7.961 -0.010 1146 1HB MET 56 1HB MET 56 -10.580 8.729 -0.584 1147 2HB MET 56 2HB MET 56 -9.787 8.079 -2.013 1148 1HG MET 56 1HG MET 56 -10.959 6.354 -0.747 1149 2HG MET 56 2HG MET 56 -9.224 6.055 -0.822 1150 1HE MET 56 1HE MET 56 -7.995 5.317 0.868 1151 2HE MET 56 2HE MET 56 -8.336 5.318 2.598 1152 3HE MET 56 3HE MET 56 -9.294 4.311 1.510 1153 H HIS 57 H HIS 57 -9.175 10.552 -2.076 1154 HA HIS 57 HA HIS 57 -7.626 10.106 -4.315 1155 1HB HIS 57 1HB HIS 57 -9.552 11.726 -4.083 1156 2HB HIS 57 2HB HIS 57 -8.423 12.850 -3.332 1157 HD1 HIS 57 HD1 HIS 57 -6.452 13.725 -4.891 1158 HD2 HIS 57 HD2 HIS 57 -9.505 11.678 -6.827 1159 HE1 HIS 57 HE1 HIS 57 -6.188 14.274 -7.330 1160 H SER 58 H SER 58 -6.836 11.943 -1.410 1161 HA SER 58 HA SER 58 -4.358 12.948 -2.408 1162 1HB SER 58 1HB SER 58 -5.504 14.124 -0.619 1163 2HB SER 58 2HB SER 58 -5.410 12.702 0.420 1164 HG SER 58 HG SER 58 -3.462 14.563 -0.231 1165 H PHE 59 H PHE 59 -5.348 10.096 -0.633 1166 HA PHE 59 HA PHE 59 -2.904 9.212 0.339 1167 1HB PHE 59 1HB PHE 59 -5.108 8.177 0.851 1168 2HB PHE 59 2HB PHE 59 -5.127 7.483 -0.766 1169 HD1 PHE 59 HD1 PHE 59 -3.046 7.588 2.318 1170 HD2 PHE 59 HD2 PHE 59 -4.264 5.371 -1.105 1171 HE1 PHE 59 HE1 PHE 59 -1.809 5.630 3.150 1172 HE2 PHE 59 HE2 PHE 59 -3.030 3.410 -0.278 1173 HZ PHE 59 HZ PHE 59 -1.801 3.537 1.852 1174 H ILE 60 H ILE 60 -4.443 8.326 -2.754 1175 HA ILE 60 HA ILE 60 -2.353 6.794 -3.772 1176 HB ILE 60 HB ILE 60 -4.301 8.500 -5.326 1177 1HG1 ILE 60 1HG1 ILE 60 -5.391 6.889 -3.806 1178 2HG1 ILE 60 2HG1 ILE 60 -5.645 6.468 -5.497 1179 1HG2 ILE 60 1HG2 ILE 60 -3.641 6.228 -6.792 1180 2HG2 ILE 60 2HG2 ILE 60 -3.132 7.884 -7.113 1181 3HG2 ILE 60 3HG2 ILE 60 -2.108 6.818 -6.151 1182 1HD1 ILE 60 1HD1 ILE 60 -4.688 4.825 -3.465 1183 2HD1 ILE 60 2HD1 ILE 60 -4.742 4.474 -5.192 1184 3HD1 ILE 60 3HD1 ILE 60 -3.290 5.177 -4.479 1185 H LEU 61 H LEU 61 -3.052 10.242 -4.339 1186 HA LEU 61 HA LEU 61 -0.805 10.763 -5.936 1187 1HB LEU 61 1HB LEU 61 -2.956 12.222 -4.827 1188 2HB LEU 61 2HB LEU 61 -1.474 13.065 -4.383 1189 HG LEU 61 HG LEU 61 -0.861 13.269 -6.726 1190 1HD1 LEU 61 1HD1 LEU 61 -3.354 11.655 -7.172 1191 2HD1 LEU 61 2HD1 LEU 61 -1.714 11.320 -7.726 1192 3HD1 LEU 61 3HD1 LEU 61 -2.630 12.649 -8.436 1193 1HD2 LEU 61 1HD2 LEU 61 -2.054 15.131 -6.042 1194 2HD2 LEU 61 2HD2 LEU 61 -3.557 14.227 -5.851 1195 3HD2 LEU 61 3HD2 LEU 61 -2.953 14.606 -7.465 1196 H LYS 62 H LYS 62 -1.118 10.294 -2.550 1197 HA LYS 62 HA LYS 62 1.226 11.730 -1.758 1198 1HB LYS 62 1HB LYS 62 -0.873 10.230 -0.478 1199 2HB LYS 62 2HB LYS 62 0.691 9.711 0.138 1200 1HG LYS 62 1HG LYS 62 -0.364 12.531 0.097 1201 2HG LYS 62 2HG LYS 62 -0.215 11.483 1.509 1202 1HD LYS 62 1HD LYS 62 1.880 12.164 1.806 1203 2HD LYS 62 2HD LYS 62 2.308 11.583 0.195 1204 1HE LYS 62 1HE LYS 62 1.397 13.752 -0.704 1205 2HE LYS 62 2HE LYS 62 1.282 14.309 0.964 1206 1HZ LYS 62 1HZ LYS 62 3.336 15.079 0.423 1207 2HZ LYS 62 2HZ LYS 62 3.657 13.836 -0.678 1208 3HZ LYS 62 3HZ LYS 62 3.779 13.546 0.984 1209 H ALA 63 H ALA 63 0.498 8.258 -2.118 1210 HA ALA 63 HA ALA 63 3.201 7.450 -1.709 1211 1HB ALA 63 1HB ALA 63 2.393 5.235 -2.510 1212 2HB ALA 63 2HB ALA 63 1.444 5.911 -1.186 1213 3HB ALA 63 3HB ALA 63 0.827 5.977 -2.836 1214 H ARG 64 H ARG 64 1.291 8.326 -4.496 1215 HA ARG 64 HA ARG 64 2.936 7.200 -6.493 1216 1HB ARG 64 1HB ARG 64 0.545 8.197 -6.663 1217 2HB ARG 64 2HB ARG 64 1.373 9.731 -6.896 1218 1HG ARG 64 1HG ARG 64 2.548 7.797 -8.621 1219 2HG ARG 64 2HG ARG 64 0.794 7.742 -8.810 1220 1HD ARG 64 1HD ARG 64 2.040 10.423 -8.703 1221 2HD ARG 64 2HD ARG 64 2.364 9.458 -10.142 1222 HE ARG 64 HE ARG 64 -0.058 10.780 -9.506 1223 1HH1 ARG 64 1HH1 ARG 64 1.187 7.865 -10.947 1224 2HH1 ARG 64 2HH1 ARG 64 -0.190 7.629 -11.972 1225 1HH2 ARG 64 1HH2 ARG 64 -1.876 10.480 -10.850 1226 2HH2 ARG 64 2HH2 ARG 64 -1.931 9.117 -11.917 1227 H SER 65 H SER 65 3.008 10.280 -4.794 1228 HA SER 65 HA SER 65 4.976 11.504 -6.432 1229 1HB SER 65 1HB SER 65 3.330 12.409 -4.472 1230 2HB SER 65 2HB SER 65 4.855 12.319 -3.592 1231 HG SER 65 HG SER 65 4.164 14.284 -5.025 1232 H THR 66 H THR 66 5.106 9.264 -3.789 1233 HA THR 66 HA THR 66 7.913 9.695 -3.253 1234 HB THR 66 HB THR 66 6.633 7.212 -2.279 1235 HG1 THR 66 HG1 THR 66 5.631 8.714 -0.592 1236 1HG2 THR 66 1HG2 THR 66 8.862 7.952 -1.544 1237 2HG2 THR 66 2HG2 THR 66 7.723 7.869 -0.200 1238 3HG2 THR 66 3HG2 THR 66 8.149 9.430 -0.900 1239 H VAL 67 H VAL 67 5.922 7.424 -5.045 1240 HA VAL 67 HA VAL 67 7.711 5.372 -5.513 1241 HB VAL 67 HB VAL 67 5.707 6.512 -7.467 1242 1HG1 VAL 67 1HG1 VAL 67 6.952 5.131 -8.811 1243 2HG1 VAL 67 2HG1 VAL 67 7.397 4.058 -7.483 1244 3HG1 VAL 67 3HG1 VAL 67 5.775 3.984 -8.172 1245 1HG2 VAL 67 1HG2 VAL 67 5.293 5.305 -4.983 1246 2HG2 VAL 67 2HG2 VAL 67 4.094 5.583 -6.246 1247 3HG2 VAL 67 3HG2 VAL 67 4.959 4.048 -6.174 1248 H ARG 68 H ARG 68 7.453 8.500 -7.127 1249 HA ARG 68 HA ARG 68 9.171 8.080 -9.265 1250 1HB ARG 68 1HB ARG 68 8.802 10.603 -7.639 1251 2HB ARG 68 2HB ARG 68 9.542 10.522 -9.232 1252 1HG ARG 68 1HG ARG 68 6.770 9.491 -8.827 1253 2HG ARG 68 2HG ARG 68 7.059 11.224 -8.993 1254 1HD ARG 68 1HD ARG 68 7.439 11.057 -11.191 1255 2HD ARG 68 2HD ARG 68 8.460 9.634 -10.992 1256 HE ARG 68 HE ARG 68 5.652 9.102 -10.676 1257 1HH1 ARG 68 1HH1 ARG 68 8.280 9.385 -12.942 1258 2HH1 ARG 68 2HH1 ARG 68 7.531 8.378 -14.136 1259 1HH2 ARG 68 1HH2 ARG 68 4.656 7.774 -12.240 1260 2HH2 ARG 68 2HH2 ARG 68 5.469 7.462 -13.736 1261 H ASP 69 H ASP 69 9.872 8.471 -5.893 1262 HA ASP 69 HA ASP 69 12.666 9.058 -6.270 1263 1HB ASP 69 1HB ASP 69 10.816 9.109 -4.102 1264 2HB ASP 69 2HB ASP 69 12.159 8.064 -3.645 1265 H ILE 70 H ILE 70 10.695 6.222 -5.674 1266 HA ILE 70 HA ILE 70 12.734 4.429 -4.955 1267 HB ILE 70 HB ILE 70 10.190 3.784 -6.449 1268 1HG1 ILE 70 1HG1 ILE 70 10.667 3.761 -3.464 1269 2HG1 ILE 70 2HG1 ILE 70 9.879 5.084 -4.316 1270 1HG2 ILE 70 1HG2 ILE 70 11.882 2.043 -4.662 1271 2HG2 ILE 70 2HG2 ILE 70 10.433 1.562 -5.544 1272 3HG2 ILE 70 3HG2 ILE 70 11.898 1.996 -6.425 1273 1HD1 ILE 70 1HD1 ILE 70 8.395 3.018 -5.180 1274 2HD1 ILE 70 2HD1 ILE 70 8.861 2.429 -3.584 1275 3HD1 ILE 70 3HD1 ILE 70 8.020 3.970 -3.745 1276 H ASP 71 H ASP 71 11.644 5.607 -8.061 1277 HA ASP 71 HA ASP 71 14.022 4.770 -9.360 1278 1HB ASP 71 1HB ASP 71 11.657 3.004 -9.518 1279 2HB ASP 71 2HB ASP 71 12.434 3.371 -11.056 1280 HA PRO 72 HA PRO 72 12.836 7.903 -12.190 1281 1HB PRO 72 1HB PRO 72 13.900 7.020 -14.526 1282 2HB PRO 72 2HB PRO 72 14.885 7.640 -13.196 1283 1HG PRO 72 1HG PRO 72 14.296 4.805 -13.955 1284 2HG PRO 72 2HG PRO 72 15.833 5.533 -13.454 1285 1HD PRO 72 1HD PRO 72 14.284 4.092 -11.763 1286 2HD PRO 72 2HD PRO 72 15.287 5.451 -11.216 1287 H GLN 73 H GLN 73 12.375 4.673 -13.639 1288 HA GLN 73 HA GLN 73 9.850 5.653 -14.797 1289 1HB GLN 73 1HB GLN 73 11.641 3.419 -15.767 1290 2HB GLN 73 2HB GLN 73 10.111 3.883 -16.499 1291 1HG GLN 73 1HG GLN 73 11.120 6.174 -16.842 1292 2HG GLN 73 2HG GLN 73 12.666 5.454 -16.395 1293 1HE2 GLN 73 1HE2 GLN 73 13.821 5.207 -18.166 1294 2HE2 GLN 73 2HE2 GLN 73 13.262 4.547 -19.661 1295 H ASN 74 H ASN 74 8.040 4.811 -14.013 1296 HA ASN 74 HA ASN 74 7.726 2.070 -13.361 1297 1HB ASN 74 1HB ASN 74 9.023 3.212 -11.360 1298 2HB ASN 74 2HB ASN 74 7.411 3.770 -10.923 1299 1HD2 ASN 74 1HD2 ASN 74 8.650 2.212 -9.169 1300 2HD2 ASN 74 2HD2 ASN 74 7.975 0.621 -9.151 1301 H ASP 75 H ASP 75 5.557 1.817 -12.035 1302 HA ASP 75 HA ASP 75 3.641 3.926 -12.454 1303 1HB ASP 75 1HB ASP 75 4.056 2.157 -14.575 1304 2HB ASP 75 2HB ASP 75 2.602 1.562 -13.780 1305 H LEU 76 H LEU 76 1.727 3.613 -11.315 1306 HA LEU 76 HA LEU 76 1.854 1.481 -9.323 1307 1HB LEU 76 1HB LEU 76 1.048 4.200 -9.305 1308 2HB LEU 76 2HB LEU 76 -0.362 3.218 -8.912 1309 HG LEU 76 HG LEU 76 0.682 3.884 -6.871 1310 1HD1 LEU 76 1HD1 LEU 76 1.645 1.073 -7.183 1311 2HD1 LEU 76 2HD1 LEU 76 -0.077 1.438 -7.281 1312 3HD1 LEU 76 3HD1 LEU 76 0.826 1.834 -5.819 1313 1HD2 LEU 76 1HD2 LEU 76 3.232 2.658 -7.915 1314 2HD2 LEU 76 2HD2 LEU 76 2.996 3.420 -6.342 1315 3HD2 LEU 76 3HD2 LEU 76 2.904 4.388 -7.815 1316 H THR 77 H THR 77 0.440 -0.162 -9.209 1317 HA THR 77 HA THR 77 -2.003 -0.057 -10.827 1318 HB THR 77 HB THR 77 -0.352 -1.229 -12.206 1319 HG1 THR 77 HG1 THR 77 -2.052 -2.357 -12.744 1320 1HG2 THR 77 1HG2 THR 77 1.195 -2.112 -10.656 1321 2HG2 THR 77 2HG2 THR 77 0.401 -3.516 -11.369 1322 3HG2 THR 77 3HG2 THR 77 -0.064 -2.961 -9.761 1323 H PHE 78 H PHE 78 -0.996 -0.174 -7.879 1324 HA PHE 78 HA PHE 78 -3.247 -1.424 -6.796 1325 1HB PHE 78 1HB PHE 78 -1.371 -3.314 -7.598 1326 2HB PHE 78 2HB PHE 78 -1.093 -3.147 -5.867 1327 HD1 PHE 78 HD1 PHE 78 -3.276 -3.184 -4.397 1328 HD2 PHE 78 HD2 PHE 78 -2.961 -4.805 -8.319 1329 HE1 PHE 78 HE1 PHE 78 -5.205 -4.642 -3.945 1330 HE2 PHE 78 HE2 PHE 78 -4.890 -6.265 -7.875 1331 HZ PHE 78 HZ PHE 78 -6.016 -6.185 -5.686 1332 H LEU 79 H LEU 79 -3.418 -1.097 -4.582 1333 HA LEU 79 HA LEU 79 -1.149 -0.285 -3.012 1334 1HB LEU 79 1HB LEU 79 -1.986 1.730 -4.424 1335 2HB LEU 79 2HB LEU 79 -3.314 1.763 -3.266 1336 HG LEU 79 HG LEU 79 -1.722 2.120 -1.445 1337 1HD1 LEU 79 1HD1 LEU 79 0.155 1.193 -3.344 1338 2HD1 LEU 79 2HD1 LEU 79 0.428 1.635 -1.659 1339 3HD1 LEU 79 3HD1 LEU 79 0.595 2.850 -2.927 1340 1HD2 LEU 79 1HD2 LEU 79 -1.219 4.080 -3.676 1341 2HD2 LEU 79 2HD2 LEU 79 -1.177 4.390 -1.940 1342 3HD2 LEU 79 3HD2 LEU 79 -2.709 4.022 -2.734 1343 H ARG 80 H ARG 80 -1.634 -1.711 -1.429 1344 HA ARG 80 HA ARG 80 -4.287 -1.473 -0.167 1345 1HB ARG 80 1HB ARG 80 -2.485 -3.882 0.023 1346 2HB ARG 80 2HB ARG 80 -4.186 -3.765 0.452 1347 1HG ARG 80 1HG ARG 80 -4.735 -3.441 -1.929 1348 2HG ARG 80 2HG ARG 80 -3.029 -3.654 -2.324 1349 1HD ARG 80 1HD ARG 80 -3.935 -5.804 -0.651 1350 2HD ARG 80 2HD ARG 80 -4.993 -5.640 -2.052 1351 HE ARG 80 HE ARG 80 -2.210 -5.586 -2.732 1352 1HH1 ARG 80 1HH1 ARG 80 -4.929 -7.650 -2.053 1353 2HH1 ARG 80 2HH1 ARG 80 -4.301 -8.992 -2.951 1354 1HH2 ARG 80 1HH2 ARG 80 -1.372 -7.345 -3.918 1355 2HH2 ARG 80 2HH2 ARG 80 -2.278 -8.817 -4.011 1356 H ILE 81 H ILE 81 -4.360 -1.754 2.155 1357 HA ILE 81 HA ILE 81 -1.848 -1.452 3.597 1358 HB ILE 81 HB ILE 81 -2.934 0.481 4.914 1359 1HG1 ILE 81 1HG1 ILE 81 -4.461 0.673 2.308 1360 2HG1 ILE 81 2HG1 ILE 81 -5.156 0.318 3.886 1361 1HG2 ILE 81 1HG2 ILE 81 -1.149 0.378 2.804 1362 2HG2 ILE 81 2HG2 ILE 81 -2.272 1.658 2.349 1363 3HG2 ILE 81 3HG2 ILE 81 -1.413 1.744 3.886 1364 1HD1 ILE 81 1HD1 ILE 81 -5.487 2.483 4.159 1365 2HD1 ILE 81 2HD1 ILE 81 -3.739 2.713 4.186 1366 3HD1 ILE 81 3HD1 ILE 81 -4.623 2.846 2.666 1367 H ARG 82 H ARG 82 -2.283 -3.429 4.571 1368 HA ARG 82 HA ARG 82 -4.725 -4.145 5.766 1369 1HB ARG 82 1HB ARG 82 -2.421 -5.461 5.248 1370 2HB ARG 82 2HB ARG 82 -2.245 -5.209 6.979 1371 1HG ARG 82 1HG ARG 82 -4.158 -6.461 7.473 1372 2HG ARG 82 2HG ARG 82 -4.741 -6.384 5.809 1373 1HD ARG 82 1HD ARG 82 -3.565 -8.186 5.212 1374 2HD ARG 82 2HD ARG 82 -2.108 -7.594 6.009 1375 HE ARG 82 HE ARG 82 -3.998 -9.482 7.045 1376 1HH1 ARG 82 1HH1 ARG 82 -1.645 -7.062 7.895 1377 2HH1 ARG 82 2HH1 ARG 82 -1.325 -7.735 9.459 1378 1HH2 ARG 82 1HH2 ARG 82 -3.585 -10.378 9.101 1379 2HH2 ARG 82 2HH2 ARG 82 -2.429 -9.622 10.144 1380 H SER 83 H SER 83 -5.690 -3.077 7.357 1381 HA SER 83 HA SER 83 -4.052 -1.759 9.402 1382 1HB SER 83 1HB SER 83 -6.986 -1.365 9.411 1383 2HB SER 83 2HB SER 83 -5.687 -0.188 9.604 1384 HG SER 83 HG SER 83 -7.081 -0.853 7.385 1385 H LYS 84 H LYS 84 -5.772 -1.606 11.498 1386 HA LYS 84 HA LYS 84 -5.729 -4.343 12.481 1387 1HB LYS 84 1HB LYS 84 -6.339 -1.752 13.916 1388 2HB LYS 84 2HB LYS 84 -6.164 -3.325 14.681 1389 1HG LYS 84 1HG LYS 84 -3.814 -3.311 13.573 1390 2HG LYS 84 2HG LYS 84 -4.079 -1.569 13.467 1391 1HD LYS 84 1HD LYS 84 -2.908 -2.004 15.504 1392 2HD LYS 84 2HD LYS 84 -4.570 -1.578 15.922 1393 1HE LYS 84 1HE LYS 84 -5.132 -3.866 16.308 1394 2HE LYS 84 2HE LYS 84 -3.593 -4.415 15.647 1395 1HZ LYS 84 1HZ LYS 84 -3.046 -4.478 17.817 1396 2HZ LYS 84 2HZ LYS 84 -4.203 -3.332 18.275 1397 3HZ LYS 84 3HZ LYS 84 -2.739 -2.829 17.593 1398 H LYS 85 H LYS 85 -8.020 -1.831 11.662 1399 HA LYS 85 HA LYS 85 -10.272 -3.292 12.749 1400 1HB LYS 85 1HB LYS 85 -10.025 -0.714 11.206 1401 2HB LYS 85 2HB LYS 85 -11.582 -1.420 11.615 1402 1HG LYS 85 1HG LYS 85 -9.662 -1.072 13.833 1403 2HG LYS 85 2HG LYS 85 -10.356 0.394 13.137 1404 1HD LYS 85 1HD LYS 85 -12.142 -1.894 13.846 1405 2HD LYS 85 2HD LYS 85 -11.555 -0.819 15.118 1406 1HE LYS 85 1HE LYS 85 -12.393 1.091 13.642 1407 2HE LYS 85 2HE LYS 85 -13.255 -0.149 12.733 1408 1HZ LYS 85 1HZ LYS 85 -14.774 -0.371 14.337 1409 2HZ LYS 85 2HZ LYS 85 -14.220 1.125 14.899 1410 3HZ LYS 85 3HZ LYS 85 -13.634 -0.306 15.585 1411 H ASN 86 H ASN 86 -9.088 -2.353 9.531 1412 HA ASN 86 HA ASN 86 -10.009 -4.775 8.351 1413 1HB ASN 86 1HB ASN 86 -11.504 -3.344 6.683 1414 2HB ASN 86 2HB ASN 86 -12.170 -4.024 8.165 1415 1HD2 ASN 86 1HD2 ASN 86 -11.319 -1.168 6.463 1416 2HD2 ASN 86 2HD2 ASN 86 -11.929 -0.034 7.615 1417 H GLU 87 H GLU 87 -9.718 -4.711 5.916 1418 HA GLU 87 HA GLU 87 -7.238 -3.292 5.355 1419 1HB GLU 87 1HB GLU 87 -7.025 -4.765 3.446 1420 2HB GLU 87 2HB GLU 87 -7.416 -5.713 4.875 1421 1HG GLU 87 1HG GLU 87 -9.708 -5.917 4.170 1422 2HG GLU 87 2HG GLU 87 -9.415 -4.850 2.797 1423 H ILE 88 H ILE 88 -6.914 -2.022 3.485 1424 HA ILE 88 HA ILE 88 -9.378 -1.009 2.229 1425 HB ILE 88 HB ILE 88 -6.998 0.718 2.893 1426 1HG1 ILE 88 1HG1 ILE 88 -7.988 -0.026 4.984 1427 2HG1 ILE 88 2HG1 ILE 88 -8.404 1.661 4.705 1428 1HG2 ILE 88 1HG2 ILE 88 -9.573 1.106 1.518 1429 2HG2 ILE 88 2HG2 ILE 88 -9.107 2.378 2.646 1430 3HG2 ILE 88 3HG2 ILE 88 -8.037 1.947 1.313 1431 1HD1 ILE 88 1HD1 ILE 88 -10.490 0.262 3.556 1432 2HD1 ILE 88 2HD1 ILE 88 -10.118 -0.640 5.026 1433 3HD1 ILE 88 3HD1 ILE 88 -10.500 1.078 5.119 1434 H MET 89 H MET 89 -9.193 -2.001 0.278 1435 HA MET 89 HA MET 89 -6.661 -1.982 -1.144 1436 1HB MET 89 1HB MET 89 -9.328 -3.263 -1.571 1437 2HB MET 89 2HB MET 89 -8.242 -3.080 -2.942 1438 1HG MET 89 1HG MET 89 -6.630 -4.479 -2.007 1439 2HG MET 89 2HG MET 89 -7.324 -4.349 -0.392 1440 1HE MET 89 1HE MET 89 -10.002 -4.948 -3.312 1441 2HE MET 89 2HE MET 89 -8.379 -5.130 -3.978 1442 3HE MET 89 3HE MET 89 -9.438 -6.534 -3.838 1443 H VAL 90 H VAL 90 -6.079 -0.483 -2.568 1444 HA VAL 90 HA VAL 90 -8.099 0.968 -4.086 1445 HB VAL 90 HB VAL 90 -6.050 2.396 -2.385 1446 1HG1 VAL 90 1HG1 VAL 90 -8.098 3.501 -4.305 1447 2HG1 VAL 90 2HG1 VAL 90 -7.047 4.453 -3.255 1448 3HG1 VAL 90 3HG1 VAL 90 -6.352 3.478 -4.551 1449 1HG2 VAL 90 1HG2 VAL 90 -7.982 3.345 -1.229 1450 2HG2 VAL 90 2HG2 VAL 90 -9.065 2.379 -2.231 1451 3HG2 VAL 90 3HG2 VAL 90 -7.967 1.586 -1.101 1452 H ALA 91 H ALA 91 -7.399 1.645 -6.069 1453 HA ALA 91 HA ALA 91 -4.590 1.750 -6.719 1454 1HB ALA 91 1HB ALA 91 -5.681 -0.721 -6.907 1455 2HB ALA 91 2HB ALA 91 -5.981 -0.099 -8.530 1456 3HB ALA 91 3HB ALA 91 -4.337 -0.149 -7.895 1457 HA PRO 92 HA PRO 92 -5.976 4.632 -9.725 1458 1HB PRO 92 1HB PRO 92 -4.107 4.339 -11.672 1459 2HB PRO 92 2HB PRO 92 -3.765 5.115 -10.121 1460 1HG PRO 92 1HG PRO 92 -3.178 2.318 -11.010 1461 2HG PRO 92 2HG PRO 92 -2.150 3.442 -10.102 1462 1HD PRO 92 1HD PRO 92 -3.533 1.445 -8.907 1463 2HD PRO 92 2HD PRO 92 -3.208 2.994 -8.104 1464 H ASP 93 H ASP 93 -7.792 4.312 -10.847 1465 HA ASP 93 HA ASP 93 -8.005 2.016 -12.645 1466 1HB ASP 93 1HB ASP 93 -9.804 3.201 -10.889 1467 2HB ASP 93 2HB ASP 93 -10.357 3.725 -12.477 1468 H LYS 94 H LYS 94 -9.838 2.905 -14.471 1469 HA LYS 94 HA LYS 94 -8.315 4.004 -16.483 1470 1HB LYS 94 1HB LYS 94 -11.062 3.302 -16.097 1471 2HB LYS 94 2HB LYS 94 -10.988 4.853 -16.922 1472 1HG LYS 94 1HG LYS 94 -9.348 2.536 -17.867 1473 2HG LYS 94 2HG LYS 94 -11.045 2.701 -18.325 1474 1HD LYS 94 1HD LYS 94 -10.366 5.109 -19.011 1475 2HD LYS 94 2HD LYS 94 -8.721 4.468 -18.996 1476 1HE LYS 94 1HE LYS 94 -9.030 3.523 -20.982 1477 2HE LYS 94 2HE LYS 94 -10.442 2.652 -20.386 1478 1HZ LYS 94 1HZ LYS 94 -10.950 4.090 -22.287 1479 2HZ LYS 94 2HZ LYS 94 -10.475 5.445 -21.394 1480 3HZ LYS 94 3HZ LYS 94 -11.818 4.540 -20.906 1481 H ASP 95 H ASP 95 -10.668 5.718 -14.427 1482 HA ASP 95 HA ASP 95 -9.060 8.126 -14.588 1483 1HB ASP 95 1HB ASP 95 -11.117 7.813 -16.419 1484 2HB ASP 95 2HB ASP 95 -11.850 8.779 -15.141 1485 H TYR 96 H TYR 96 -10.276 6.086 -12.649 1486 HA TYR 96 HA TYR 96 -11.088 8.075 -10.669 1487 1HB TYR 96 1HB TYR 96 -12.927 6.526 -9.898 1488 2HB TYR 96 2HB TYR 96 -13.220 7.327 -11.438 1489 HD1 TYR 96 HD1 TYR 96 -12.823 4.161 -9.744 1490 HD2 TYR 96 HD2 TYR 96 -12.944 6.034 -13.562 1491 HE1 TYR 96 HE1 TYR 96 -13.221 1.975 -10.797 1492 HE2 TYR 96 HE2 TYR 96 -13.343 3.853 -14.626 1493 HH TYR 96 HH TYR 96 -14.471 1.379 -13.383 1494 H PHE 97 H PHE 97 -11.286 6.972 -8.447 1495 HA PHE 97 HA PHE 97 -9.116 4.995 -8.195 1496 1HB PHE 97 1HB PHE 97 -9.831 7.379 -6.516 1497 2HB PHE 97 2HB PHE 97 -8.950 6.028 -5.811 1498 HD1 PHE 97 HD1 PHE 97 -8.417 9.146 -6.865 1499 HD2 PHE 97 HD2 PHE 97 -7.066 5.213 -7.772 1500 HE1 PHE 97 HE1 PHE 97 -6.311 10.074 -7.735 1501 HE2 PHE 97 HE2 PHE 97 -4.957 6.134 -8.642 1502 HZ PHE 97 HZ PHE 97 -4.577 8.567 -8.624 1503 H LEU 98 H LEU 98 -10.089 3.081 -7.909 1504 HA LEU 98 HA LEU 98 -12.586 2.770 -6.566 1505 1HB LEU 98 1HB LEU 98 -11.321 1.291 -8.372 1506 2HB LEU 98 2HB LEU 98 -10.750 0.464 -6.924 1507 HG LEU 98 HG LEU 98 -13.674 0.906 -7.182 1508 1HD1 LEU 98 1HD1 LEU 98 -14.061 -0.514 -8.884 1509 2HD1 LEU 98 2HD1 LEU 98 -12.669 -1.527 -8.499 1510 3HD1 LEU 98 3HD1 LEU 98 -12.445 -0.024 -9.394 1511 1HD2 LEU 98 1HD2 LEU 98 -13.276 -0.259 -5.276 1512 2HD2 LEU 98 2HD2 LEU 98 -11.791 -0.983 -5.893 1513 3HD2 LEU 98 3HD2 LEU 98 -13.357 -1.620 -6.395 1514 H ILE 99 H ILE 99 -13.030 2.086 -4.519 1515 HA ILE 99 HA ILE 99 -10.775 1.479 -2.742 1516 HB ILE 99 HB ILE 99 -12.977 3.441 -2.091 1517 1HG1 ILE 99 1HG1 ILE 99 -10.351 4.501 -1.752 1518 2HG1 ILE 99 2HG1 ILE 99 -10.445 3.784 -3.357 1519 1HG2 ILE 99 1HG2 ILE 99 -10.779 2.239 -0.436 1520 2HG2 ILE 99 2HG2 ILE 99 -11.535 3.775 -0.013 1521 3HG2 ILE 99 3HG2 ILE 99 -12.508 2.306 -0.093 1522 1HD1 ILE 99 1HD1 ILE 99 -11.030 6.128 -3.424 1523 2HD1 ILE 99 2HD1 ILE 99 -12.430 5.134 -3.829 1524 3HD1 ILE 99 3HD1 ILE 99 -12.301 5.866 -2.230 1525 H VAL 100 H VAL 100 -11.171 -0.533 -2.090 1526 HA VAL 100 HA VAL 100 -13.938 -1.280 -1.413 1527 HB VAL 100 HB VAL 100 -11.601 -3.067 -2.104 1528 1HG1 VAL 100 1HG1 VAL 100 -13.433 -4.824 -2.181 1529 2HG1 VAL 100 2HG1 VAL 100 -12.939 -4.269 -0.580 1530 3HG1 VAL 100 3HG1 VAL 100 -14.434 -3.671 -1.299 1531 1HG2 VAL 100 1HG2 VAL 100 -13.669 -1.773 -3.696 1532 2HG2 VAL 100 2HG2 VAL 100 -12.168 -2.548 -4.204 1533 3HG2 VAL 100 3HG2 VAL 100 -13.613 -3.521 -3.925 1534 H ILE 101 H ILE 101 -14.336 -1.175 0.692 1535 HA ILE 101 HA ILE 101 -12.169 -1.790 2.583 1536 HB ILE 101 HB ILE 101 -14.763 -0.326 3.086 1537 1HG1 ILE 101 1HG1 ILE 101 -12.278 1.146 3.472 1538 2HG1 ILE 101 2HG1 ILE 101 -12.469 0.593 1.812 1539 1HG2 ILE 101 1HG2 ILE 101 -13.939 -1.543 5.046 1540 2HG2 ILE 101 2HG2 ILE 101 -12.379 -0.738 4.886 1541 3HG2 ILE 101 3HG2 ILE 101 -13.821 0.202 5.267 1542 1HD1 ILE 101 1HD1 ILE 101 -14.952 1.647 2.585 1543 2HD1 ILE 101 2HD1 ILE 101 -13.722 2.783 3.141 1544 3HD1 ILE 101 3HD1 ILE 101 -13.791 2.320 1.441 1545 H GLN 102 H GLN 102 -12.286 -3.521 3.873 1546 HA GLN 102 HA GLN 102 -14.718 -4.688 4.758 1547 1HB GLN 102 1HB GLN 102 -14.658 -6.783 3.569 1548 2HB GLN 102 2HB GLN 102 -14.707 -5.472 2.397 1549 1HG GLN 102 1HG GLN 102 -12.262 -5.691 2.113 1550 2HG GLN 102 2HG GLN 102 -12.293 -7.078 3.201 1551 1HE2 GLN 102 1HE2 GLN 102 -11.851 -6.486 0.170 1552 2HE2 GLN 102 2HE2 GLN 102 -12.706 -7.781 -0.590 1553 H ASN 103 H ASN 103 -14.310 -6.763 5.956 1554 HA ASN 103 HA ASN 103 -12.315 -6.464 7.838 1555 1HB ASN 103 1HB ASN 103 -14.154 -8.631 7.045 1556 2HB ASN 103 2HB ASN 103 -12.716 -9.158 7.915 1557 1HD2 ASN 103 1HD2 ASN 103 -15.817 -7.974 8.201 1558 2HD2 ASN 103 2HD2 ASN 103 -15.776 -7.518 9.867 1559 HA PRO 104 HA PRO 104 -8.544 -7.950 6.160 1560 1HB PRO 104 1HB PRO 104 -7.481 -9.339 8.236 1561 2HB PRO 104 2HB PRO 104 -7.589 -7.575 8.215 1562 1HG PRO 104 1HG PRO 104 -9.378 -9.566 9.556 1563 2HG PRO 104 2HG PRO 104 -8.750 -8.029 10.178 1564 1HD PRO 104 1HD PRO 104 -11.264 -8.289 9.207 1565 2HD PRO 104 2HD PRO 104 -10.334 -6.784 9.059 1566 H THR 105 H THR 105 -7.560 -9.715 5.190 1567 HA THR 105 HA THR 105 -9.126 -12.206 5.252 1568 HB THR 105 HB THR 105 -8.000 -12.692 3.051 1569 HG1 THR 105 HG1 THR 105 -7.009 -10.912 2.013 1570 1HG2 THR 105 1HG2 THR 105 -9.285 -10.376 2.141 1571 2HG2 THR 105 2HG2 THR 105 -10.106 -10.814 3.640 1572 3HG2 THR 105 3HG2 THR 105 -9.986 -11.983 2.325 1573 H GLU 106 H GLU 106 -5.885 -10.874 5.490 1574 HA GLU 106 HA GLU 106 -3.881 -11.783 6.090 1575 1HB GLU 106 1HB GLU 106 -4.904 -11.988 8.237 1576 2HB GLU 106 2HB GLU 106 -5.800 -13.418 7.745 1577 1HG GLU 106 1HG GLU 106 -4.037 -14.802 8.043 1578 2HG GLU 106 2HG GLU 106 -2.854 -13.576 7.589 Start of MODEL 6 1 H MET 11 H MET 11 18.232 -8.604 14.915 2 HA MET 11 HA MET 11 18.059 -7.699 12.170 3 1HB MET 11 1HB MET 11 20.170 -7.979 14.203 4 2HB MET 11 2HB MET 11 20.691 -8.306 12.556 5 1HG MET 11 1HG MET 11 19.285 -6.014 12.215 6 2HG MET 11 2HG MET 11 19.939 -5.782 13.835 7 1HE MET 11 1HE MET 11 20.932 -7.419 10.560 8 2HE MET 11 2HE MET 11 20.967 -5.778 9.914 9 3HE MET 11 3HE MET 11 22.470 -6.680 10.115 10 H ALA 12 H ALA 12 19.382 -10.551 13.850 11 HA ALA 12 HA ALA 12 20.154 -12.032 11.650 12 1HB ALA 12 1HB ALA 12 19.260 -13.974 13.341 13 2HB ALA 12 2HB ALA 12 20.829 -13.175 13.455 14 3HB ALA 12 3HB ALA 12 19.479 -12.611 14.439 15 H GLU 13 H GLU 13 16.952 -11.763 13.125 16 HA GLU 13 HA GLU 13 15.611 -13.764 11.770 17 1HB GLU 13 1HB GLU 13 14.895 -11.350 13.216 18 2HB GLU 13 2HB GLU 13 13.787 -11.659 11.887 19 1HG GLU 13 1HG GLU 13 12.717 -12.993 13.304 20 2HG GLU 13 2HG GLU 13 14.034 -14.132 13.030 21 H VAL 14 H VAL 14 15.998 -10.365 10.776 22 HA VAL 14 HA VAL 14 14.683 -10.629 8.299 23 HB VAL 14 HB VAL 14 16.873 -8.653 8.940 24 1HG1 VAL 14 1HG1 VAL 14 16.422 -8.397 6.691 25 2HG1 VAL 14 2HG1 VAL 14 14.720 -8.826 6.875 26 3HG1 VAL 14 3HG1 VAL 14 15.296 -7.249 7.416 27 1HG2 VAL 14 1HG2 VAL 14 14.241 -8.969 10.105 28 2HG2 VAL 14 2HG2 VAL 14 15.561 -7.900 10.578 29 3HG2 VAL 14 3HG2 VAL 14 14.428 -7.399 9.323 30 H GLU 15 H GLU 15 18.022 -11.125 9.275 31 HA GLU 15 HA GLU 15 19.122 -11.302 6.672 32 1HB GLU 15 1HB GLU 15 20.041 -12.310 9.359 33 2HB GLU 15 2HB GLU 15 20.971 -12.579 7.891 34 1HG GLU 15 1HG GLU 15 21.206 -10.203 7.554 35 2HG GLU 15 2HG GLU 15 20.171 -9.875 8.942 36 H GLU 16 H GLU 16 17.875 -13.730 8.931 37 HA GLU 16 HA GLU 16 18.544 -16.018 7.479 38 1HB GLU 16 1HB GLU 16 17.266 -15.519 9.851 39 2HB GLU 16 2HB GLU 16 15.956 -16.145 8.860 40 1HG GLU 16 1HG GLU 16 17.851 -17.962 8.307 41 2HG GLU 16 2HG GLU 16 18.335 -17.503 9.938 42 H THR 17 H THR 17 15.832 -13.811 7.169 43 HA THR 17 HA THR 17 14.434 -15.455 5.265 44 HB THR 17 HB THR 17 14.010 -12.565 6.045 45 HG1 THR 17 HG1 THR 17 13.628 -14.399 7.600 46 1HG2 THR 17 1HG2 THR 17 12.678 -14.332 4.070 47 2HG2 THR 17 2HG2 THR 17 12.881 -12.580 4.066 48 3HG2 THR 17 3HG2 THR 17 11.638 -13.322 5.073 49 H LEU 18 H LEU 18 16.858 -12.988 5.161 50 HA LEU 18 HA LEU 18 16.450 -12.216 2.441 51 1HB LEU 18 1HB LEU 18 18.163 -11.482 4.615 52 2HB LEU 18 2HB LEU 18 19.132 -11.744 3.166 53 HG LEU 18 HG LEU 18 17.245 -10.175 2.117 54 1HD1 LEU 18 1HD1 LEU 18 16.899 -8.331 3.857 55 2HD1 LEU 18 2HD1 LEU 18 17.269 -9.572 5.054 56 3HD1 LEU 18 3HD1 LEU 18 15.890 -9.773 3.974 57 1HD2 LEU 18 1HD2 LEU 18 19.706 -9.841 2.132 58 2HD2 LEU 18 2HD2 LEU 18 19.558 -9.102 3.727 59 3HD2 LEU 18 3HD2 LEU 18 18.788 -8.348 2.329 60 H LYS 19 H LYS 19 18.720 -14.394 4.086 61 HA LYS 19 HA LYS 19 20.250 -15.152 1.894 62 1HB LYS 19 1HB LYS 19 19.876 -16.026 4.589 63 2HB LYS 19 2HB LYS 19 19.887 -17.440 3.543 64 1HG LYS 19 1HG LYS 19 22.105 -17.331 3.765 65 2HG LYS 19 2HG LYS 19 22.004 -16.032 2.575 66 1HD LYS 19 1HD LYS 19 22.945 -14.693 4.085 67 2HD LYS 19 2HD LYS 19 21.456 -14.815 5.025 68 1HE LYS 19 1HE LYS 19 22.317 -16.496 6.392 69 2HE LYS 19 2HE LYS 19 23.594 -16.903 5.247 70 1HZ LYS 19 1HZ LYS 19 24.905 -15.221 5.966 71 2HZ LYS 19 2HZ LYS 19 24.046 -15.472 7.401 72 3HZ LYS 19 3HZ LYS 19 23.612 -14.207 6.366 73 H ARG 20 H ARG 20 17.235 -16.569 3.121 74 HA ARG 20 HA ARG 20 17.094 -18.626 1.174 75 1HB ARG 20 1HB ARG 20 15.880 -18.669 3.341 76 2HB ARG 20 2HB ARG 20 14.840 -17.377 2.755 77 1HG ARG 20 1HG ARG 20 13.478 -18.945 1.988 78 2HG ARG 20 2HG ARG 20 14.710 -19.335 0.786 79 1HD ARG 20 1HD ARG 20 14.945 -20.499 3.518 80 2HD ARG 20 2HD ARG 20 13.751 -21.174 2.409 81 HE ARG 20 HE ARG 20 16.351 -20.923 1.234 82 1HH1 ARG 20 1HH1 ARG 20 14.325 -22.920 3.241 83 2HH1 ARG 20 2HH1 ARG 20 15.183 -24.381 2.878 84 1HH2 ARG 20 1HH2 ARG 20 17.488 -22.840 0.748 85 2HH2 ARG 20 2HH2 ARG 20 16.982 -24.334 1.461 86 H LEU 21 H LEU 21 15.526 -15.446 1.426 87 HA LEU 21 HA LEU 21 13.985 -15.576 -0.889 88 1HB LEU 21 1HB LEU 21 15.007 -13.467 0.874 89 2HB LEU 21 2HB LEU 21 14.666 -12.941 -0.773 90 HG LEU 21 HG LEU 21 12.361 -13.599 -0.560 91 1HD1 LEU 21 1HD1 LEU 21 11.860 -15.315 0.758 92 2HD1 LEU 21 2HD1 LEU 21 11.987 -14.208 2.124 93 3HD1 LEU 21 3HD1 LEU 21 13.382 -15.171 1.637 94 1HD2 LEU 21 1HD2 LEU 21 13.309 -12.040 1.841 95 2HD2 LEU 21 2HD2 LEU 21 11.649 -12.089 1.249 96 3HD2 LEU 21 3HD2 LEU 21 12.922 -11.387 0.249 97 H GLN 22 H GLN 22 17.300 -14.378 -0.451 98 HA GLN 22 HA GLN 22 17.774 -13.505 -3.046 99 1HB GLN 22 1HB GLN 22 19.298 -13.932 -0.695 100 2HB GLN 22 2HB GLN 22 20.149 -14.725 -2.013 101 1HG GLN 22 1HG GLN 22 20.951 -12.776 -2.663 102 2HG GLN 22 2HG GLN 22 19.311 -12.199 -2.954 103 1HE2 GLN 22 1HE2 GLN 22 18.271 -10.980 -1.371 104 2HE2 GLN 22 2HE2 GLN 22 19.138 -10.222 -0.084 105 H SER 23 H SER 23 17.578 -16.718 -1.776 106 HA SER 23 HA SER 23 18.895 -17.950 -4.032 107 1HB SER 23 1HB SER 23 18.302 -18.747 -1.423 108 2HB SER 23 2HB SER 23 17.266 -19.752 -2.438 109 HG SER 23 HG SER 23 20.029 -19.406 -2.945 110 H GLN 24 H GLN 24 15.694 -17.012 -3.150 111 HA GLN 24 HA GLN 24 14.248 -18.775 -4.828 112 1HB GLN 24 1HB GLN 24 13.488 -16.024 -3.831 113 2HB GLN 24 2HB GLN 24 12.383 -17.196 -4.536 114 1HG GLN 24 1HG GLN 24 12.872 -18.739 -2.687 115 2HG GLN 24 2HG GLN 24 13.921 -17.518 -1.970 116 1HE2 GLN 24 1HE2 GLN 24 12.458 -15.241 -2.373 117 2HE2 GLN 24 2HE2 GLN 24 10.995 -15.320 -1.458 118 H LYS 25 H LYS 25 12.820 -17.832 -6.642 119 HA LYS 25 HA LYS 25 14.559 -16.281 -8.445 120 1HB LYS 25 1HB LYS 25 13.151 -18.770 -8.794 121 2HB LYS 25 2HB LYS 25 12.577 -17.587 -9.962 122 1HG LYS 25 1HG LYS 25 15.230 -17.221 -10.196 123 2HG LYS 25 2HG LYS 25 15.188 -18.927 -9.746 124 1HD LYS 25 1HD LYS 25 13.790 -19.461 -11.601 125 2HD LYS 25 2HD LYS 25 13.517 -17.755 -11.963 126 1HE LYS 25 1HE LYS 25 16.238 -17.919 -12.056 127 2HE LYS 25 2HE LYS 25 15.764 -19.504 -12.666 128 1HZ LYS 25 1HZ LYS 25 14.119 -17.980 -14.056 129 2HZ LYS 25 2HZ LYS 25 15.678 -18.356 -14.593 130 3HZ LYS 25 3HZ LYS 25 15.377 -16.868 -13.845 131 H GLY 26 H GLY 26 13.780 -14.244 -7.876 132 1HA GLY 26 1HA GLY 26 11.886 -13.015 -9.318 133 2HA GLY 26 2HA GLY 26 10.927 -13.714 -8.022 134 H VAL 27 H VAL 27 13.411 -13.325 -6.256 135 HA VAL 27 HA VAL 27 12.583 -10.846 -5.132 136 HB VAL 27 HB VAL 27 15.025 -12.524 -4.541 137 1HG1 VAL 27 1HG1 VAL 27 14.960 -11.261 -2.351 138 2HG1 VAL 27 2HG1 VAL 27 15.501 -10.343 -3.758 139 3HG1 VAL 27 3HG1 VAL 27 13.863 -10.129 -3.141 140 1HG2 VAL 27 1HG2 VAL 27 13.685 -13.194 -2.540 141 2HG2 VAL 27 2HG2 VAL 27 12.299 -12.378 -3.263 142 3HG2 VAL 27 3HG2 VAL 27 13.031 -13.761 -4.076 143 H GLN 28 H GLN 28 13.162 -8.867 -5.712 144 HA GLN 28 HA GLN 28 15.352 -8.484 -7.576 145 1HB GLN 28 1HB GLN 28 12.988 -6.953 -6.715 146 2HB GLN 28 2HB GLN 28 14.411 -5.977 -7.053 147 1HG GLN 28 1HG GLN 28 12.776 -6.381 -8.958 148 2HG GLN 28 2HG GLN 28 14.489 -6.642 -9.283 149 1HE2 GLN 28 1HE2 GLN 28 11.379 -8.109 -8.940 150 2HE2 GLN 28 2HE2 GLN 28 11.823 -9.679 -9.507 151 H GLY 29 H GLY 29 14.583 -7.833 -4.224 152 1HA GLY 29 1HA GLY 29 17.111 -7.738 -3.232 153 2HA GLY 29 2HA GLY 29 16.849 -6.099 -3.809 154 H ILE 30 H ILE 30 17.170 -7.317 -1.066 155 HA ILE 30 HA ILE 30 14.662 -6.317 0.114 156 HB ILE 30 HB ILE 30 16.654 -8.110 1.493 157 1HG1 ILE 30 1HG1 ILE 30 14.558 -9.742 1.019 158 2HG1 ILE 30 2HG1 ILE 30 14.488 -8.745 -0.430 159 1HG2 ILE 30 1HG2 ILE 30 15.325 -7.051 3.097 160 2HG2 ILE 30 2HG2 ILE 30 13.875 -7.162 2.101 161 3HG2 ILE 30 3HG2 ILE 30 14.542 -8.612 2.851 162 1HD1 ILE 30 1HD1 ILE 30 16.121 -10.962 0.054 163 2HD1 ILE 30 2HD1 ILE 30 16.155 -9.876 -1.335 164 3HD1 ILE 30 3HD1 ILE 30 17.187 -9.558 0.058 165 H ILE 31 H ILE 31 14.751 -4.897 1.857 166 HA ILE 31 HA ILE 31 17.398 -3.762 2.467 167 HB ILE 31 HB ILE 31 14.856 -2.192 2.019 168 1HG1 ILE 31 1HG1 ILE 31 17.310 -1.657 0.452 169 2HG1 ILE 31 2HG1 ILE 31 16.486 -3.171 0.095 170 1HG2 ILE 31 1HG2 ILE 31 17.539 -1.455 3.102 171 2HG2 ILE 31 2HG2 ILE 31 16.602 -0.269 2.195 172 3HG2 ILE 31 3HG2 ILE 31 15.934 -0.984 3.662 173 1HD1 ILE 31 1HD1 ILE 31 15.910 -0.928 -1.164 174 2HD1 ILE 31 2HD1 ILE 31 14.675 -2.131 -0.794 175 3HD1 ILE 31 3HD1 ILE 31 14.851 -0.704 0.227 176 H VAL 32 H VAL 32 17.733 -3.069 4.561 177 HA VAL 32 HA VAL 32 15.529 -3.455 6.469 178 HB VAL 32 HB VAL 32 18.337 -4.307 7.125 179 1HG1 VAL 32 1HG1 VAL 32 16.704 -3.849 8.948 180 2HG1 VAL 32 2HG1 VAL 32 15.689 -5.140 8.301 181 3HG1 VAL 32 3HG1 VAL 32 17.298 -5.509 8.921 182 1HG2 VAL 32 1HG2 VAL 32 16.136 -5.986 5.932 183 2HG2 VAL 32 2HG2 VAL 32 17.723 -5.658 5.237 184 3HG2 VAL 32 3HG2 VAL 32 17.585 -6.640 6.695 185 H VAL 33 H VAL 33 15.177 -1.421 7.133 186 HA VAL 33 HA VAL 33 17.505 0.197 7.939 187 HB VAL 33 HB VAL 33 14.754 1.274 7.345 188 1HG1 VAL 33 1HG1 VAL 33 15.951 3.393 7.090 189 2HG1 VAL 33 2HG1 VAL 33 16.204 2.700 8.693 190 3HG1 VAL 33 3HG1 VAL 33 17.470 2.582 7.470 191 1HG2 VAL 33 1HG2 VAL 33 15.270 0.437 5.263 192 2HG2 VAL 33 2HG2 VAL 33 15.993 2.043 5.176 193 3HG2 VAL 33 3HG2 VAL 33 17.007 0.635 5.494 194 H ASN 34 H ASN 34 17.579 1.096 9.956 195 HA ASN 34 HA ASN 34 16.042 -0.148 12.003 196 1HB ASN 34 1HB ASN 34 17.936 2.210 12.122 197 2HB ASN 34 2HB ASN 34 17.274 1.380 13.527 198 1HD2 ASN 34 1HD2 ASN 34 20.006 1.654 13.008 199 2HD2 ASN 34 2HD2 ASN 34 20.667 0.083 12.723 200 H THR 35 H THR 35 15.372 1.651 13.847 201 HA THR 35 HA THR 35 12.927 2.709 12.888 202 HB THR 35 HB THR 35 13.496 3.996 15.322 203 HG1 THR 35 HG1 THR 35 14.046 1.876 16.466 204 1HG2 THR 35 1HG2 THR 35 11.771 1.844 14.308 205 2HG2 THR 35 2HG2 THR 35 11.377 3.229 15.327 206 3HG2 THR 35 3HG2 THR 35 12.084 1.780 16.042 207 H GLU 36 H GLU 36 16.117 3.995 13.111 208 HA GLU 36 HA GLU 36 15.250 6.758 12.951 209 1HB GLU 36 1HB GLU 36 17.804 5.340 13.360 210 2HB GLU 36 2HB GLU 36 17.922 6.839 12.450 211 1HG GLU 36 1HG GLU 36 16.324 7.565 14.541 212 2HG GLU 36 2HG GLU 36 17.415 6.399 15.288 213 H GLY 37 H GLY 37 17.595 4.962 10.956 214 1HA GLY 37 1HA GLY 37 16.326 5.023 8.522 215 2HA GLY 37 2HA GLY 37 17.062 6.611 8.677 216 H ILE 38 H ILE 38 18.392 3.596 9.923 217 HA ILE 38 HA ILE 38 20.655 3.933 8.068 218 HB ILE 38 HB ILE 38 20.733 2.457 10.695 219 1HG1 ILE 38 1HG1 ILE 38 21.511 5.322 10.106 220 2HG1 ILE 38 2HG1 ILE 38 20.178 4.799 11.131 221 1HG2 ILE 38 1HG2 ILE 38 23.054 3.664 9.240 222 2HG2 ILE 38 2HG2 ILE 38 23.036 2.356 10.422 223 3HG2 ILE 38 3HG2 ILE 38 22.432 2.077 8.789 224 1HD1 ILE 38 1HD1 ILE 38 21.807 3.744 12.648 225 2HD1 ILE 38 2HD1 ILE 38 23.112 4.378 11.644 226 3HD1 ILE 38 3HD1 ILE 38 22.033 5.486 12.492 227 HA PRO 39 HA PRO 39 19.172 0.093 6.332 228 1HB PRO 39 1HB PRO 39 21.065 -0.060 4.392 229 2HB PRO 39 2HB PRO 39 19.660 1.005 4.280 230 1HG PRO 39 1HG PRO 39 22.468 1.653 5.089 231 2HG PRO 39 2HG PRO 39 21.369 2.563 4.035 232 1HD PRO 39 1HD PRO 39 21.791 3.232 6.625 233 2HD PRO 39 2HD PRO 39 20.235 3.495 5.812 234 H ILE 40 H ILE 40 19.963 -0.846 8.452 235 HA ILE 40 HA ILE 40 22.521 -1.733 8.958 236 HB ILE 40 HB ILE 40 21.364 -3.700 10.138 237 1HG1 ILE 40 1HG1 ILE 40 18.902 -2.065 9.506 238 2HG1 ILE 40 2HG1 ILE 40 19.320 -3.554 8.666 239 1HG2 ILE 40 1HG2 ILE 40 22.101 -1.649 11.256 240 2HG2 ILE 40 2HG2 ILE 40 20.566 -0.881 10.853 241 3HG2 ILE 40 3HG2 ILE 40 20.600 -2.263 11.948 242 1HD1 ILE 40 1HD1 ILE 40 19.291 -3.785 11.580 243 2HD1 ILE 40 2HD1 ILE 40 17.731 -3.394 10.855 244 3HD1 ILE 40 3HD1 ILE 40 18.604 -4.839 10.345 245 H LYS 41 H LYS 41 20.080 -3.148 6.857 246 HA LYS 41 HA LYS 41 22.146 -4.916 5.754 247 1HB LYS 41 1HB LYS 41 19.758 -5.729 7.163 248 2HB LYS 41 2HB LYS 41 19.726 -6.316 5.505 249 1HG LYS 41 1HG LYS 41 22.137 -6.697 7.240 250 2HG LYS 41 2HG LYS 41 20.767 -7.808 7.306 251 1HD LYS 41 1HD LYS 41 21.083 -8.521 5.110 252 2HD LYS 41 2HD LYS 41 22.044 -7.101 4.688 253 1HE LYS 41 1HE LYS 41 23.254 -8.601 6.844 254 2HE LYS 41 2HE LYS 41 22.992 -9.614 5.425 255 1HZ LYS 41 1HZ LYS 41 25.090 -8.666 5.125 256 2HZ LYS 41 2HZ LYS 41 24.588 -7.133 5.633 257 3HZ LYS 41 3HZ LYS 41 24.077 -7.738 4.138 258 H SER 42 H SER 42 22.099 -5.169 3.563 259 HA SER 42 HA SER 42 19.838 -4.537 1.952 260 1HB SER 42 1HB SER 42 20.666 -2.246 2.655 261 2HB SER 42 2HB SER 42 22.135 -2.584 1.740 262 HG SER 42 HG SER 42 20.764 -2.898 -0.106 263 H THR 43 H THR 43 20.082 -5.242 -0.142 264 HA THR 43 HA THR 43 22.708 -6.404 -0.815 265 HB THR 43 HB THR 43 21.658 -8.246 -1.890 266 HG1 THR 43 HG1 THR 43 19.140 -7.021 -1.350 267 1HG2 THR 43 1HG2 THR 43 21.324 -7.746 0.836 268 2HG2 THR 43 2HG2 THR 43 21.238 -9.311 0.026 269 3HG2 THR 43 3HG2 THR 43 19.768 -8.374 0.293 270 H MET 44 H MET 44 20.351 -4.171 -1.680 271 HA MET 44 HA MET 44 20.602 -4.308 -4.522 272 1HB MET 44 1HB MET 44 18.980 -2.931 -2.684 273 2HB MET 44 2HB MET 44 19.844 -1.689 -3.580 274 1HG MET 44 1HG MET 44 18.986 -2.453 -5.646 275 2HG MET 44 2HG MET 44 18.364 -3.932 -4.918 276 1HE MET 44 1HE MET 44 17.059 -2.713 -2.174 277 2HE MET 44 2HE MET 44 15.396 -2.622 -2.756 278 3HE MET 44 3HE MET 44 16.408 -4.000 -3.190 279 H ASP 45 H ASP 45 21.068 -1.755 -5.358 280 HA ASP 45 HA ASP 45 23.909 -1.631 -5.318 281 1HB ASP 45 1HB ASP 45 21.816 -0.539 -6.881 282 2HB ASP 45 2HB ASP 45 22.762 0.819 -6.275 283 H ASN 46 H ASN 46 25.080 0.460 -4.851 284 HA ASN 46 HA ASN 46 24.769 1.109 -2.119 285 1HB ASN 46 1HB ASN 46 26.724 1.497 -4.112 286 2HB ASN 46 2HB ASN 46 26.307 3.103 -3.522 287 1HD2 ASN 46 1HD2 ASN 46 25.725 2.554 -0.891 288 2HD2 ASN 46 2HD2 ASN 46 27.163 2.035 -0.085 289 HA PRO 47 HA PRO 47 23.192 5.406 -3.675 290 1HB PRO 47 1HB PRO 47 22.557 5.616 -6.306 291 2HB PRO 47 2HB PRO 47 24.174 5.958 -5.678 292 1HG PRO 47 1HG PRO 47 23.144 3.484 -7.014 293 2HG PRO 47 2HG PRO 47 24.687 4.325 -7.252 294 1HD PRO 47 1HD PRO 47 24.462 2.096 -5.731 295 2HD PRO 47 2HD PRO 47 25.636 3.379 -5.376 296 H THR 48 H THR 48 21.916 2.453 -5.041 297 HA THR 48 HA THR 48 19.218 3.395 -5.280 298 HB THR 48 HB THR 48 20.306 0.573 -5.273 299 HG1 THR 48 HG1 THR 48 20.224 0.779 -7.494 300 1HG2 THR 48 1HG2 THR 48 17.574 1.632 -6.007 301 2HG2 THR 48 2HG2 THR 48 17.963 0.548 -4.671 302 3HG2 THR 48 3HG2 THR 48 18.140 -0.005 -6.335 303 H THR 49 H THR 49 21.090 1.685 -2.851 304 HA THR 49 HA THR 49 18.882 0.946 -1.215 305 HB THR 49 HB THR 49 21.816 1.229 -0.543 306 HG1 THR 49 HG1 THR 49 20.165 -0.865 -1.456 307 1HG2 THR 49 1HG2 THR 49 19.537 0.074 1.064 308 2HG2 THR 49 2HG2 THR 49 20.576 1.431 1.503 309 3HG2 THR 49 3HG2 THR 49 21.241 -0.201 1.425 310 H THR 50 H THR 50 21.287 3.561 -0.985 311 HA THR 50 HA THR 50 20.370 4.767 1.339 312 HB THR 50 HB THR 50 21.227 6.697 -0.693 313 HG1 THR 50 HG1 THR 50 23.382 5.753 -0.750 314 1HG2 THR 50 1HG2 THR 50 23.142 6.678 1.206 315 2HG2 THR 50 2HG2 THR 50 21.807 5.960 2.107 316 3HG2 THR 50 3HG2 THR 50 21.619 7.550 1.368 317 H GLN 51 H GLN 51 19.368 5.344 -2.018 318 HA GLN 51 HA GLN 51 17.571 7.436 -1.483 319 1HB GLN 51 1HB GLN 51 18.280 7.078 -3.734 320 2HB GLN 51 2HB GLN 51 17.701 5.418 -3.721 321 1HG GLN 51 1HG GLN 51 15.660 7.461 -3.185 322 2HG GLN 51 2HG GLN 51 16.363 7.495 -4.801 323 1HE2 GLN 51 1HE2 GLN 51 14.264 5.874 -2.645 324 2HE2 GLN 51 2HE2 GLN 51 13.747 4.627 -3.723 325 H TYR 52 H TYR 52 17.014 3.941 -1.836 326 HA TYR 52 HA TYR 52 14.245 3.987 -1.420 327 1HB TYR 52 1HB TYR 52 16.372 1.901 -1.173 328 2HB TYR 52 2HB TYR 52 14.767 1.553 -0.539 329 HD1 TYR 52 HD1 TYR 52 13.656 0.133 -1.978 330 HD2 TYR 52 HD2 TYR 52 15.953 3.319 -3.615 331 HE1 TYR 52 HE1 TYR 52 12.894 -0.485 -4.233 332 HE2 TYR 52 HE2 TYR 52 15.196 2.711 -5.875 333 HH TYR 52 HH TYR 52 13.221 -0.159 -6.441 334 H ALA 53 H ALA 53 16.875 3.347 0.895 335 HA ALA 53 HA ALA 53 15.273 3.040 3.168 336 1HB ALA 53 1HB ALA 53 17.365 3.654 4.426 337 2HB ALA 53 2HB ALA 53 17.534 2.332 3.270 338 3HB ALA 53 3HB ALA 53 18.128 3.941 2.862 339 H SER 54 H SER 54 16.101 5.850 1.384 340 HA SER 54 HA SER 54 15.749 7.738 3.513 341 1HB SER 54 1HB SER 54 16.621 7.809 0.799 342 2HB SER 54 2HB SER 54 15.305 8.969 0.978 343 HG SER 54 HG SER 54 17.388 9.848 1.474 344 H LEU 55 H LEU 55 13.802 6.934 0.633 345 HA LEU 55 HA LEU 55 11.538 8.414 1.569 346 1HB LEU 55 1HB LEU 55 10.575 7.948 -0.443 347 2HB LEU 55 2HB LEU 55 12.276 7.744 -0.857 348 HG LEU 55 HG LEU 55 11.721 5.218 -0.231 349 1HD1 LEU 55 1HD1 LEU 55 9.197 5.642 -1.612 350 2HD1 LEU 55 2HD1 LEU 55 9.219 6.333 0.010 351 3HD1 LEU 55 3HD1 LEU 55 9.574 4.622 -0.224 352 1HD2 LEU 55 1HD2 LEU 55 10.745 6.069 -2.902 353 2HD2 LEU 55 2HD2 LEU 55 11.884 4.795 -2.463 354 3HD2 LEU 55 3HD2 LEU 55 12.401 6.482 -2.459 355 H MET 56 H MET 56 12.772 5.321 2.212 356 HA MET 56 HA MET 56 10.513 3.753 2.563 357 1HB MET 56 1HB MET 56 13.254 3.582 3.209 358 2HB MET 56 2HB MET 56 12.376 3.268 4.700 359 1HG MET 56 1HG MET 56 12.825 1.203 3.539 360 2HG MET 56 2HG MET 56 11.092 1.521 3.572 361 1HE MET 56 1HE MET 56 9.970 0.669 0.601 362 2HE MET 56 2HE MET 56 9.697 1.641 2.046 363 3HE MET 56 3HE MET 56 9.898 2.427 0.479 364 H HIS 57 H HIS 57 12.196 5.602 5.113 365 HA HIS 57 HA HIS 57 10.133 5.261 7.020 366 1HB HIS 57 1HB HIS 57 12.489 5.787 7.601 367 2HB HIS 57 2HB HIS 57 12.269 7.402 6.934 368 HD1 HIS 57 HD1 HIS 57 12.916 8.203 9.400 369 HD2 HIS 57 HD2 HIS 57 9.275 6.238 9.024 370 HE1 HIS 57 HE1 HIS 57 11.646 8.732 11.506 371 H SER 58 H SER 58 10.998 7.972 4.895 372 HA SER 58 HA SER 58 9.092 9.802 5.756 373 1HB SER 58 1HB SER 58 10.954 10.308 4.179 374 2HB SER 58 2HB SER 58 10.077 9.445 2.915 375 HG SER 58 HG SER 58 9.571 11.591 2.710 376 H PHE 59 H PHE 59 8.733 6.946 3.838 377 HA PHE 59 HA PHE 59 6.210 7.629 2.680 378 1HB PHE 59 1HB PHE 59 7.541 5.982 1.559 379 2HB PHE 59 2HB PHE 59 7.657 4.999 3.014 380 HD1 PHE 59 HD1 PHE 59 4.699 6.611 1.438 381 HD2 PHE 59 HD2 PHE 59 6.653 2.982 2.501 382 HE1 PHE 59 HE1 PHE 59 2.714 5.339 0.731 383 HE2 PHE 59 HE2 PHE 59 4.672 1.705 1.795 384 HZ PHE 59 HZ PHE 59 2.700 2.883 0.908 385 H ILE 60 H ILE 60 7.120 5.323 5.247 386 HA ILE 60 HA ILE 60 4.545 4.644 6.050 387 HB ILE 60 HB ILE 60 7.024 4.805 7.769 388 1HG1 ILE 60 1HG1 ILE 60 7.285 3.373 5.775 389 2HG1 ILE 60 2HG1 ILE 60 7.287 2.430 7.262 390 1HG2 ILE 60 1HG2 ILE 60 5.120 4.675 9.193 391 2HG2 ILE 60 2HG2 ILE 60 4.380 3.430 8.190 392 3HG2 ILE 60 3HG2 ILE 60 5.831 3.063 9.121 393 1HD1 ILE 60 1HD1 ILE 60 5.671 2.099 4.982 394 2HD1 ILE 60 2HD1 ILE 60 5.635 1.187 6.491 395 3HD1 ILE 60 3HD1 ILE 60 4.616 2.613 6.298 396 H LEU 61 H LEU 61 6.587 7.350 7.017 397 HA LEU 61 HA LEU 61 4.963 8.267 9.140 398 1HB LEU 61 1HB LEU 61 7.354 9.067 7.823 399 2HB LEU 61 2HB LEU 61 6.280 10.462 7.915 400 HG LEU 61 HG LEU 61 6.186 10.285 10.321 401 1HD1 LEU 61 1HD1 LEU 61 6.239 8.006 10.800 402 2HD1 LEU 61 2HD1 LEU 61 7.786 8.599 11.403 403 3HD1 LEU 61 3HD1 LEU 61 7.710 7.745 9.862 404 1HD2 LEU 61 1HD2 LEU 61 8.013 11.577 9.423 405 2HD2 LEU 61 2HD2 LEU 61 8.998 10.124 9.241 406 3HD2 LEU 61 3HD2 LEU 61 8.566 10.701 10.852 407 H LYS 62 H LYS 62 4.727 8.554 5.707 408 HA LYS 62 HA LYS 62 2.981 10.832 5.702 409 1HB LYS 62 1HB LYS 62 4.378 9.278 3.765 410 2HB LYS 62 2HB LYS 62 2.675 9.289 3.324 411 1HG LYS 62 1HG LYS 62 3.856 11.107 2.244 412 2HG LYS 62 2HG LYS 62 2.671 11.732 3.393 413 1HD LYS 62 1HD LYS 62 4.250 12.739 4.613 414 2HD LYS 62 2HD LYS 62 5.273 11.300 4.613 415 1HE LYS 62 1HE LYS 62 6.330 11.908 2.625 416 2HE LYS 62 2HE LYS 62 5.051 13.036 2.179 417 1HZ LYS 62 1HZ LYS 62 7.423 13.549 3.597 418 2HZ LYS 62 2HZ LYS 62 6.111 13.889 4.609 419 3HZ LYS 62 3HZ LYS 62 6.233 14.645 3.100 420 H ALA 63 H ALA 63 2.507 7.355 5.078 421 HA ALA 63 HA ALA 63 -0.312 7.513 4.890 422 1HB ALA 63 1HB ALA 63 -0.043 4.962 5.459 423 2HB ALA 63 2HB ALA 63 0.485 5.606 3.904 424 3HB ALA 63 3HB ALA 63 1.665 5.306 5.180 425 H ARG 64 H ARG 64 1.862 6.634 7.555 426 HA ARG 64 HA ARG 64 -0.018 5.877 9.442 427 1HB ARG 64 1HB ARG 64 2.522 5.782 9.609 428 2HB ARG 64 2HB ARG 64 2.456 7.468 10.104 429 1HG ARG 64 1HG ARG 64 0.605 6.144 11.725 430 2HG ARG 64 2HG ARG 64 2.020 5.091 11.652 431 1HD ARG 64 1HD ARG 64 2.177 8.037 12.255 432 2HD ARG 64 2HD ARG 64 2.019 6.802 13.504 433 HE ARG 64 HE ARG 64 4.382 7.485 12.051 434 1HH1 ARG 64 1HH1 ARG 64 2.719 4.888 13.666 435 2HH1 ARG 64 2HH1 ARG 64 4.168 4.006 14.020 436 1HH2 ARG 64 1HH2 ARG 64 6.297 6.334 12.512 437 2HH2 ARG 64 2HH2 ARG 64 6.203 4.830 13.364 438 H SER 65 H SER 65 0.829 9.052 8.298 439 HA SER 65 HA SER 65 -0.461 10.458 10.449 440 1HB SER 65 1HB SER 65 1.455 11.251 8.825 441 2HB SER 65 2HB SER 65 0.104 11.737 7.801 442 HG SER 65 HG SER 65 -0.043 13.423 9.028 443 H THR 66 H THR 66 -1.358 9.240 7.314 444 HA THR 66 HA THR 66 -3.830 10.731 7.200 445 HB THR 66 HB THR 66 -3.491 8.370 5.448 446 HG1 THR 66 HG1 THR 66 -1.748 9.109 4.418 447 1HG2 THR 66 1HG2 THR 66 -5.299 10.138 5.290 448 2HG2 THR 66 2HG2 THR 66 -4.415 9.806 3.800 449 3HG2 THR 66 3HG2 THR 66 -4.041 11.247 4.745 450 H VAL 67 H VAL 67 -2.780 7.489 8.057 451 HA VAL 67 HA VAL 67 -5.177 6.124 8.110 452 HB VAL 67 HB VAL 67 -2.900 5.886 10.082 453 1HG1 VAL 67 1HG1 VAL 67 -4.063 3.406 9.821 454 2HG1 VAL 67 2HG1 VAL 67 -4.281 4.513 11.178 455 3HG1 VAL 67 3HG1 VAL 67 -5.449 4.496 9.856 456 1HG2 VAL 67 1HG2 VAL 67 -2.733 5.518 7.423 457 2HG2 VAL 67 2HG2 VAL 67 -1.794 4.592 8.594 458 3HG2 VAL 67 3HG2 VAL 67 -3.276 3.915 7.918 459 H ARG 68 H ARG 68 -3.864 8.380 10.478 460 HA ARG 68 HA ARG 68 -5.587 7.946 12.601 461 1HB ARG 68 1HB ARG 68 -4.327 10.503 11.606 462 2HB ARG 68 2HB ARG 68 -5.205 10.389 13.126 463 1HG ARG 68 1HG ARG 68 -3.387 9.660 14.148 464 2HG ARG 68 2HG ARG 68 -3.279 8.297 13.032 465 1HD ARG 68 1HD ARG 68 -2.100 9.764 11.424 466 2HD ARG 68 2HD ARG 68 -2.137 11.057 12.622 467 HE ARG 68 HE ARG 68 -0.365 8.806 12.565 468 1HH1 ARG 68 1HH1 ARG 68 -1.930 11.136 14.624 469 2HH1 ARG 68 2HH1 ARG 68 -0.735 11.029 15.874 470 1HH2 ARG 68 1HH2 ARG 68 1.215 8.657 14.203 471 2HH2 ARG 68 2HH2 ARG 68 1.055 9.619 15.632 472 H ASP 69 H ASP 69 -6.181 9.495 9.548 473 HA ASP 69 HA ASP 69 -8.628 10.766 10.361 474 1HB ASP 69 1HB ASP 69 -6.923 11.182 8.292 475 2HB ASP 69 2HB ASP 69 -8.182 10.250 7.485 476 H ILE 70 H ILE 70 -7.706 7.752 8.816 477 HA ILE 70 HA ILE 70 -10.197 6.930 7.865 478 HB ILE 70 HB ILE 70 -7.983 5.198 8.969 479 1HG1 ILE 70 1HG1 ILE 70 -8.556 5.963 6.101 480 2HG1 ILE 70 2HG1 ILE 70 -7.352 6.763 7.105 481 1HG2 ILE 70 1HG2 ILE 70 -10.271 4.508 7.130 482 2HG2 ILE 70 2HG2 ILE 70 -8.958 3.426 7.593 483 3HG2 ILE 70 3HG2 ILE 70 -10.098 3.999 8.810 484 1HD1 ILE 70 1HD1 ILE 70 -7.345 3.984 6.011 485 2HD1 ILE 70 2HD1 ILE 70 -6.115 5.242 5.880 486 3HD1 ILE 70 3HD1 ILE 70 -6.366 4.409 7.414 487 H ASP 71 H ASP 71 -8.718 6.524 11.056 488 HA ASP 71 HA ASP 71 -11.323 6.278 12.268 489 1HB ASP 71 1HB ASP 71 -9.769 3.918 11.656 490 2HB ASP 71 2HB ASP 71 -9.985 4.085 13.396 491 HA PRO 72 HA PRO 72 -9.312 8.119 15.703 492 1HB PRO 72 1HB PRO 72 -10.625 7.021 17.810 493 2HB PRO 72 2HB PRO 72 -11.363 8.213 16.734 494 1HG PRO 72 1HG PRO 72 -11.645 5.233 16.737 495 2HG PRO 72 2HG PRO 72 -12.893 6.474 16.523 496 1HD PRO 72 1HD PRO 72 -11.809 5.123 14.441 497 2HD PRO 72 2HD PRO 72 -12.360 6.805 14.305 498 H GLN 73 H GLN 73 -9.844 4.638 16.288 499 HA GLN 73 HA GLN 73 -7.131 4.513 17.432 500 1HB GLN 73 1HB GLN 73 -9.462 2.709 18.098 501 2HB GLN 73 2HB GLN 73 -7.875 2.699 18.856 502 1HG GLN 73 1HG GLN 73 -8.284 4.941 19.739 503 2HG GLN 73 2HG GLN 73 -9.879 4.941 18.988 504 1HE2 GLN 73 1HE2 GLN 73 -11.060 5.081 20.836 505 2HE2 GLN 73 2HE2 GLN 73 -11.122 3.836 22.031 506 H ASN 74 H ASN 74 -5.717 3.324 16.345 507 HA ASN 74 HA ASN 74 -6.220 0.801 15.240 508 1HB ASN 74 1HB ASN 74 -7.186 2.856 13.601 509 2HB ASN 74 2HB ASN 74 -5.663 2.365 12.866 510 1HD2 ASN 74 1HD2 ASN 74 -6.701 1.477 11.090 511 2HD2 ASN 74 2HD2 ASN 74 -7.575 -0.011 11.182 512 H ASP 75 H ASP 75 -4.392 0.477 13.330 513 HA ASP 75 HA ASP 75 -1.987 1.910 13.599 514 1HB ASP 75 1HB ASP 75 -2.487 0.163 15.760 515 2HB ASP 75 2HB ASP 75 -1.253 -0.613 14.771 516 H LEU 76 H LEU 76 -1.147 1.623 11.652 517 HA LEU 76 HA LEU 76 -1.846 -0.492 9.926 518 1HB LEU 76 1HB LEU 76 -0.434 1.938 9.760 519 2HB LEU 76 2HB LEU 76 0.659 0.684 9.178 520 HG LEU 76 HG LEU 76 -0.546 1.699 7.333 521 1HD1 LEU 76 1HD1 LEU 76 0.041 -0.671 7.189 522 2HD1 LEU 76 2HD1 LEU 76 -1.451 -0.318 6.318 523 3HD1 LEU 76 3HD1 LEU 76 -1.516 -1.100 7.897 524 1HD2 LEU 76 1HD2 LEU 76 -2.846 1.858 7.168 525 2HD2 LEU 76 2HD2 LEU 76 -2.574 2.196 8.878 526 3HD2 LEU 76 3HD2 LEU 76 -3.125 0.598 8.371 527 H THR 77 H THR 77 -0.694 -2.281 9.213 528 HA THR 77 HA THR 77 1.824 -2.948 10.520 529 HB THR 77 HB THR 77 0.113 -3.862 12.036 530 HG1 THR 77 HG1 THR 77 2.174 -5.026 11.345 531 1HG2 THR 77 1HG2 THR 77 -1.509 -5.423 11.385 532 2HG2 THR 77 2HG2 THR 77 -0.720 -5.734 9.839 533 3HG2 THR 77 3HG2 THR 77 -1.556 -4.206 10.111 534 H PHE 78 H PHE 78 0.531 -2.465 7.763 535 HA PHE 78 HA PHE 78 2.190 -4.244 6.322 536 1HB PHE 78 1HB PHE 78 -0.271 -5.366 7.033 537 2HB PHE 78 2HB PHE 78 -0.468 -4.878 5.353 538 HD1 PHE 78 HD1 PHE 78 1.899 -5.408 3.994 539 HD2 PHE 78 HD2 PHE 78 0.246 -7.578 7.261 540 HE1 PHE 78 HE1 PHE 78 3.113 -7.422 3.267 541 HE2 PHE 78 HE2 PHE 78 1.457 -9.594 6.540 542 HZ PHE 78 HZ PHE 78 2.894 -9.518 4.541 543 H LEU 79 H LEU 79 2.720 -3.266 4.477 544 HA LEU 79 HA LEU 79 0.792 -1.425 3.240 545 1HB LEU 79 1HB LEU 79 3.278 -0.750 4.497 546 2HB LEU 79 2HB LEU 79 3.369 -0.391 2.773 547 HG LEU 79 HG LEU 79 1.481 1.094 2.932 548 1HD1 LEU 79 1HD1 LEU 79 0.117 -0.035 4.539 549 2HD1 LEU 79 2HD1 LEU 79 0.466 1.581 5.152 550 3HD1 LEU 79 3HD1 LEU 79 1.330 0.187 5.800 551 1HD2 LEU 79 1HD2 LEU 79 3.947 1.586 3.973 552 2HD2 LEU 79 2HD2 LEU 79 2.898 2.034 5.319 553 3HD2 LEU 79 3HD2 LEU 79 2.688 2.800 3.744 554 H ARG 80 H ARG 80 0.318 -2.595 1.459 555 HA ARG 80 HA ARG 80 2.505 -3.759 -0.102 556 1HB ARG 80 1HB ARG 80 -0.309 -4.391 0.310 557 2HB ARG 80 2HB ARG 80 0.124 -4.368 -1.394 558 1HG ARG 80 1HG ARG 80 1.914 -5.831 0.462 559 2HG ARG 80 2HG ARG 80 0.344 -6.545 0.088 560 1HD ARG 80 1HD ARG 80 1.666 -5.546 -2.287 561 2HD ARG 80 2HD ARG 80 2.663 -6.723 -1.431 562 HE ARG 80 HE ARG 80 0.328 -7.264 -2.945 563 1HH1 ARG 80 1HH1 ARG 80 2.041 -8.243 -0.076 564 2HH1 ARG 80 2HH1 ARG 80 1.417 -9.859 -0.097 565 1HH2 ARG 80 1HH2 ARG 80 -0.501 -9.389 -2.983 566 2HH2 ARG 80 2HH2 ARG 80 -0.029 -10.510 -1.751 567 H ILE 81 H ILE 81 3.026 -3.106 -2.136 568 HA ILE 81 HA ILE 81 1.386 -1.081 -3.453 569 HB ILE 81 HB ILE 81 4.341 -0.637 -3.045 570 1HG1 ILE 81 1HG1 ILE 81 2.009 0.660 -1.617 571 2HG1 ILE 81 2HG1 ILE 81 3.166 -0.453 -0.896 572 1HG2 ILE 81 1HG2 ILE 81 2.211 1.260 -4.012 573 2HG2 ILE 81 2HG2 ILE 81 3.954 1.526 -3.988 574 3HG2 ILE 81 3HG2 ILE 81 3.260 0.324 -5.077 575 1HD1 ILE 81 1HD1 ILE 81 3.322 2.364 -1.133 576 2HD1 ILE 81 2HD1 ILE 81 4.465 1.253 -0.377 577 3HD1 ILE 81 3HD1 ILE 81 4.627 1.657 -2.086 578 H ARG 82 H ARG 82 0.942 -2.593 -5.057 579 HA ARG 82 HA ARG 82 3.061 -3.962 -6.441 580 1HB ARG 82 1HB ARG 82 0.514 -4.615 -6.081 581 2HB ARG 82 2HB ARG 82 0.319 -3.738 -7.592 582 1HG ARG 82 1HG ARG 82 2.377 -5.893 -7.332 583 2HG ARG 82 2HG ARG 82 0.689 -6.282 -7.666 584 1HD ARG 82 1HD ARG 82 1.757 -4.141 -9.342 585 2HD ARG 82 2HD ARG 82 2.594 -5.680 -9.544 586 HE ARG 82 HE ARG 82 -0.280 -5.873 -9.622 587 1HH1 ARG 82 1HH1 ARG 82 2.626 -5.347 -11.465 588 2HH1 ARG 82 2HH1 ARG 82 1.918 -5.841 -12.967 589 1HH2 ARG 82 1HH2 ARG 82 -1.223 -6.527 -11.593 590 2HH2 ARG 82 2HH2 ARG 82 -0.271 -6.511 -13.039 591 H SER 83 H SER 83 4.136 -3.309 -8.194 592 HA SER 83 HA SER 83 3.156 -0.912 -9.603 593 1HB SER 83 1HB SER 83 6.042 -1.498 -9.774 594 2HB SER 83 2HB SER 83 5.214 0.040 -9.532 595 HG SER 83 HG SER 83 6.141 -1.798 -7.670 596 H LYS 84 H LYS 84 4.824 -0.857 -11.737 597 HA LYS 84 HA LYS 84 3.833 -3.084 -13.308 598 1HB LYS 84 1HB LYS 84 5.356 -0.588 -14.073 599 2HB LYS 84 2HB LYS 84 4.814 -1.802 -15.225 600 1HG LYS 84 1HG LYS 84 2.499 -1.268 -13.935 601 2HG LYS 84 2HG LYS 84 3.304 0.300 -13.839 602 1HD LYS 84 1HD LYS 84 2.087 0.375 -15.844 603 2HD LYS 84 2HD LYS 84 3.746 0.031 -16.340 604 1HE LYS 84 1HE LYS 84 3.142 -2.394 -16.386 605 2HE LYS 84 2HE LYS 84 1.467 -1.928 -16.090 606 1HZ LYS 84 1HZ LYS 84 1.220 -1.586 -18.248 607 2HZ LYS 84 2HZ LYS 84 2.827 -2.031 -18.531 608 3HZ LYS 84 3HZ LYS 84 2.439 -0.412 -18.233 609 H LYS 85 H LYS 85 6.834 -1.953 -11.961 610 HA LYS 85 HA LYS 85 8.438 -3.799 -13.521 611 1HB LYS 85 1HB LYS 85 8.982 -1.643 -11.539 612 2HB LYS 85 2HB LYS 85 10.190 -2.908 -11.723 613 1HG LYS 85 1HG LYS 85 9.963 -2.381 -14.260 614 2HG LYS 85 2HG LYS 85 9.281 -0.856 -13.688 615 1HD LYS 85 1HD LYS 85 11.409 -0.156 -13.601 616 2HD LYS 85 2HD LYS 85 11.510 -1.114 -12.122 617 1HE LYS 85 1HE LYS 85 12.640 -2.830 -13.152 618 2HE LYS 85 2HE LYS 85 11.977 -2.455 -14.742 619 1HZ LYS 85 1HZ LYS 85 14.272 -1.273 -13.358 620 2HZ LYS 85 2HZ LYS 85 13.380 -0.287 -14.403 621 3HZ LYS 85 3HZ LYS 85 14.099 -1.703 -14.986 622 H ASN 86 H ASN 86 7.318 -3.433 -10.186 623 HA ASN 86 HA ASN 86 7.215 -6.200 -9.707 624 1HB ASN 86 1HB ASN 86 9.061 -6.429 -8.084 625 2HB ASN 86 2HB ASN 86 9.652 -6.082 -9.706 626 1HD2 ASN 86 1HD2 ASN 86 11.383 -4.861 -9.565 627 2HD2 ASN 86 2HD2 ASN 86 11.580 -3.487 -8.537 628 H GLU 87 H GLU 87 6.962 -6.649 -7.272 629 HA GLU 87 HA GLU 87 5.248 -4.542 -6.197 630 1HB GLU 87 1HB GLU 87 4.473 -6.313 -4.629 631 2HB GLU 87 2HB GLU 87 4.230 -6.720 -6.322 632 1HG GLU 87 1HG GLU 87 5.909 -8.318 -6.314 633 2HG GLU 87 2HG GLU 87 6.671 -7.651 -4.871 634 H ILE 88 H ILE 88 5.548 -3.581 -4.226 635 HA ILE 88 HA ILE 88 8.096 -4.174 -2.866 636 HB ILE 88 HB ILE 88 6.707 -1.501 -3.092 637 1HG1 ILE 88 1HG1 ILE 88 9.423 -1.659 -4.095 638 2HG1 ILE 88 2HG1 ILE 88 8.374 -2.807 -4.919 639 1HG2 ILE 88 1HG2 ILE 88 8.934 -2.496 -1.422 640 2HG2 ILE 88 2HG2 ILE 88 9.141 -0.907 -2.156 641 3HG2 ILE 88 3HG2 ILE 88 7.759 -1.220 -1.106 642 1HD1 ILE 88 1HD1 ILE 88 8.278 -0.866 -6.206 643 2HD1 ILE 88 2HD1 ILE 88 6.788 -0.845 -5.262 644 3HD1 ILE 88 3HD1 ILE 88 8.146 0.175 -4.789 645 H MET 89 H MET 89 7.518 -5.372 -1.145 646 HA MET 89 HA MET 89 5.158 -4.643 0.407 647 1HB MET 89 1HB MET 89 6.963 -7.033 0.319 648 2HB MET 89 2HB MET 89 5.956 -6.752 1.733 649 1HG MET 89 1HG MET 89 3.990 -7.066 0.559 650 2HG MET 89 2HG MET 89 4.750 -6.740 -0.997 651 1HE MET 89 1HE MET 89 5.039 -9.200 2.078 652 2HE MET 89 2HE MET 89 5.890 -10.548 1.324 653 3HE MET 89 3HE MET 89 6.688 -8.984 1.490 654 H VAL 90 H VAL 90 5.244 -3.532 2.249 655 HA VAL 90 HA VAL 90 7.674 -3.536 3.858 656 HB VAL 90 HB VAL 90 6.443 -0.983 2.814 657 1HG1 VAL 90 1HG1 VAL 90 8.223 -1.564 5.090 658 2HG1 VAL 90 2HG1 VAL 90 8.700 -0.209 4.064 659 3HG1 VAL 90 3HG1 VAL 90 7.111 -0.220 4.830 660 1HG2 VAL 90 1HG2 VAL 90 8.816 -0.667 1.946 661 2HG2 VAL 90 2HG2 VAL 90 9.041 -2.388 2.256 662 3HG2 VAL 90 3HG2 VAL 90 7.813 -1.852 1.110 663 H ALA 91 H ALA 91 7.302 -3.276 6.011 664 HA ALA 91 HA ALA 91 4.815 -2.187 6.991 665 1HB ALA 91 1HB ALA 91 4.718 -4.826 6.369 666 2HB ALA 91 2HB ALA 91 5.215 -4.890 8.060 667 3HB ALA 91 3HB ALA 91 3.730 -4.053 7.609 668 HA PRO 92 HA PRO 92 7.245 -1.226 10.517 669 1HB PRO 92 1HB PRO 92 5.429 -1.383 12.529 670 2HB PRO 92 2HB PRO 92 5.428 -0.081 11.334 671 1HG PRO 92 1HG PRO 92 3.748 -2.556 11.437 672 2HG PRO 92 2HG PRO 92 3.269 -0.894 11.047 673 1HD PRO 92 1HD PRO 92 3.705 -2.770 9.143 674 2HD PRO 92 2HD PRO 92 4.041 -1.047 8.881 675 H ASP 93 H ASP 93 8.717 -2.391 11.568 676 HA ASP 93 HA ASP 93 7.994 -5.095 12.473 677 1HB ASP 93 1HB ASP 93 10.102 -4.262 10.887 678 2HB ASP 93 2HB ASP 93 10.843 -4.449 12.474 679 H LYS 94 H LYS 94 10.012 -5.609 14.233 680 HA LYS 94 HA LYS 94 9.081 -4.654 16.642 681 1HB LYS 94 1HB LYS 94 11.279 -6.251 15.743 682 2HB LYS 94 2HB LYS 94 11.860 -5.133 16.971 683 1HG LYS 94 1HG LYS 94 9.387 -6.258 17.839 684 2HG LYS 94 2HG LYS 94 10.472 -7.556 17.333 685 1HD LYS 94 1HD LYS 94 12.245 -6.322 18.741 686 2HD LYS 94 2HD LYS 94 10.871 -5.484 19.466 687 1HE LYS 94 1HE LYS 94 10.350 -8.301 19.365 688 2HE LYS 94 2HE LYS 94 11.910 -8.013 20.135 689 1HZ LYS 94 1HZ LYS 94 10.898 -6.605 21.734 690 2HZ LYS 94 2HZ LYS 94 9.971 -8.018 21.672 691 3HZ LYS 94 3HZ LYS 94 9.416 -6.610 20.917 692 H ASP 95 H ASP 95 11.947 -3.501 14.865 693 HA ASP 95 HA ASP 95 11.502 -0.819 15.864 694 1HB ASP 95 1HB ASP 95 13.824 -0.610 16.744 695 2HB ASP 95 2HB ASP 95 12.822 -1.717 17.680 696 H TYR 96 H TYR 96 11.780 -2.490 13.318 697 HA TYR 96 HA TYR 96 13.385 -0.517 11.889 698 1HB TYR 96 1HB TYR 96 14.382 -2.448 10.523 699 2HB TYR 96 2HB TYR 96 15.048 -2.164 12.128 700 HD1 TYR 96 HD1 TYR 96 14.488 -3.695 13.989 701 HD2 TYR 96 HD2 TYR 96 13.229 -4.477 10.000 702 HE1 TYR 96 HE1 TYR 96 14.031 -6.034 14.597 703 HE2 TYR 96 HE2 TYR 96 12.768 -6.817 10.598 704 HH TYR 96 HH TYR 96 12.915 -7.932 13.908 705 H PHE 97 H PHE 97 13.203 -1.028 9.419 706 HA PHE 97 HA PHE 97 10.403 -1.762 8.866 707 1HB PHE 97 1HB PHE 97 12.104 0.463 7.779 708 2HB PHE 97 2HB PHE 97 10.738 -0.154 6.856 709 HD1 PHE 97 HD1 PHE 97 11.583 2.496 8.695 710 HD2 PHE 97 HD2 PHE 97 8.656 -0.594 8.734 711 HE1 PHE 97 HE1 PHE 97 10.068 3.952 9.975 712 HE2 PHE 97 HE2 PHE 97 7.136 0.858 10.013 713 HZ PHE 97 HZ PHE 97 7.841 3.134 10.635 714 H LEU 98 H LEU 98 10.318 -3.636 7.828 715 HA LEU 98 HA LEU 98 12.551 -4.560 6.230 716 1HB LEU 98 1HB LEU 98 10.943 -5.900 7.832 717 2HB LEU 98 2HB LEU 98 9.957 -6.017 6.376 718 HG LEU 98 HG LEU 98 12.834 -6.872 6.381 719 1HD1 LEU 98 1HD1 LEU 98 10.457 -8.586 7.089 720 2HD1 LEU 98 2HD1 LEU 98 11.711 -8.059 8.210 721 3HD1 LEU 98 3HD1 LEU 98 12.119 -9.137 6.876 722 1HD2 LEU 98 1HD2 LEU 98 11.185 -8.465 4.756 723 2HD2 LEU 98 2HD2 LEU 98 12.374 -7.267 4.247 724 3HD2 LEU 98 3HD2 LEU 98 10.691 -6.794 4.483 725 H ILE 99 H ILE 99 12.633 -4.703 4.052 726 HA ILE 99 HA ILE 99 10.223 -4.067 2.506 727 HB ILE 99 HB ILE 99 12.898 -2.816 1.893 728 1HG1 ILE 99 1HG1 ILE 99 11.280 -0.736 2.580 729 2HG1 ILE 99 2HG1 ILE 99 10.731 -1.970 3.708 730 1HG2 ILE 99 1HG2 ILE 99 10.206 -2.782 0.647 731 2HG2 ILE 99 2HG2 ILE 99 11.144 -1.290 0.617 732 3HG2 ILE 99 3HG2 ILE 99 11.802 -2.759 -0.102 733 1HD1 ILE 99 1HD1 ILE 99 13.517 -0.889 3.400 734 2HD1 ILE 99 2HD1 ILE 99 12.427 -0.692 4.773 735 3HD1 ILE 99 3HD1 ILE 99 13.102 -2.279 4.403 736 H VAL 100 H VAL 100 9.949 -5.983 1.513 737 HA VAL 100 HA VAL 100 12.268 -7.195 0.164 738 HB VAL 100 HB VAL 100 10.785 -9.241 0.015 739 1HG1 VAL 100 1HG1 VAL 100 10.954 -9.435 2.717 740 2HG1 VAL 100 2HG1 VAL 100 12.309 -9.671 1.611 741 3HG1 VAL 100 3HG1 VAL 100 12.073 -8.110 2.399 742 1HG2 VAL 100 1HG2 VAL 100 8.837 -7.471 0.907 743 2HG2 VAL 100 2HG2 VAL 100 8.686 -9.222 0.764 744 3HG2 VAL 100 3HG2 VAL 100 9.171 -8.501 2.299 745 H ILE 101 H ILE 101 12.395 -6.682 -1.915 746 HA ILE 101 HA ILE 101 9.929 -6.183 -3.425 747 HB ILE 101 HB ILE 101 12.788 -5.565 -4.179 748 1HG1 ILE 101 1HG1 ILE 101 11.089 -3.268 -3.868 749 2HG1 ILE 101 2HG1 ILE 101 11.032 -4.240 -2.401 750 1HG2 ILE 101 1HG2 ILE 101 10.202 -4.775 -5.513 751 2HG2 ILE 101 2HG2 ILE 101 11.818 -4.267 -6.002 752 3HG2 ILE 101 3HG2 ILE 101 11.355 -5.965 -6.118 753 1HD1 ILE 101 1HD1 ILE 101 13.039 -3.544 -1.782 754 2HD1 ILE 101 2HD1 ILE 101 13.736 -3.951 -3.351 755 3HD1 ILE 101 3HD1 ILE 101 12.964 -2.384 -3.108 756 H GLN 102 H GLN 102 9.339 -7.389 -5.157 757 HA GLN 102 HA GLN 102 11.091 -9.151 -6.537 758 1HB GLN 102 1HB GLN 102 10.209 -11.277 -5.838 759 2HB GLN 102 2HB GLN 102 10.769 -10.414 -4.412 760 1HG GLN 102 1HG GLN 102 8.437 -9.739 -3.954 761 2HG GLN 102 2HG GLN 102 7.918 -10.716 -5.326 762 1HE2 GLN 102 1HE2 GLN 102 7.891 -10.733 -2.156 763 2HE2 GLN 102 2HE2 GLN 102 8.100 -12.414 -1.817 764 H ASN 103 H ASN 103 9.820 -10.605 -8.064 765 HA ASN 103 HA ASN 103 8.152 -9.100 -9.665 766 1HB ASN 103 1HB ASN 103 8.782 -11.994 -9.438 767 2HB ASN 103 2HB ASN 103 7.345 -11.568 -10.362 768 1HD2 ASN 103 1HD2 ASN 103 10.530 -12.194 -10.611 769 2HD2 ASN 103 2HD2 ASN 103 10.896 -11.329 -12.061 770 HA PRO 104 HA PRO 104 4.110 -9.160 -7.961 771 1HB PRO 104 1HB PRO 104 2.549 -9.502 -10.155 772 2HB PRO 104 2HB PRO 104 3.411 -7.997 -9.815 773 1HG PRO 104 1HG PRO 104 4.158 -10.232 -11.661 774 2HG PRO 104 2HG PRO 104 4.259 -8.482 -11.925 775 1HD PRO 104 1HD PRO 104 6.412 -9.979 -11.252 776 2HD PRO 104 2HD PRO 104 6.227 -8.289 -10.742 777 H THR 105 H THR 105 2.466 -10.501 -7.246 778 HA THR 105 HA THR 105 2.774 -13.344 -7.945 779 HB THR 105 HB THR 105 1.615 -13.775 -5.750 780 HG1 THR 105 HG1 THR 105 2.155 -11.002 -5.350 781 1HG2 THR 105 1HG2 THR 105 3.664 -12.981 -4.376 782 2HG2 THR 105 2HG2 THR 105 4.292 -12.436 -5.931 783 3HG2 THR 105 3HG2 THR 105 3.914 -14.140 -5.682 784 H GLU 106 H GLU 106 0.459 -10.735 -7.527 785 HA GLU 106 HA GLU 106 -1.916 -12.188 -7.748 786 1HB GLU 106 1HB GLU 106 -1.187 -9.487 -7.604 787 2HB GLU 106 2HB GLU 106 -2.097 -9.638 -9.101 788 1HG GLU 106 1HG GLU 106 -3.545 -9.040 -7.250 789 2HG GLU 106 2HG GLU 106 -3.957 -10.630 -7.889 790 H MET 11 H MET 11 -17.968 4.233 -15.825 791 HA MET 11 HA MET 11 -18.283 3.753 -13.199 792 1HB MET 11 1HB MET 11 -20.296 4.642 -15.243 793 2HB MET 11 2HB MET 11 -20.746 4.490 -13.550 794 1HG MET 11 1HG MET 11 -18.423 5.939 -13.426 795 2HG MET 11 2HG MET 11 -19.183 6.540 -14.898 796 1HE MET 11 1HE MET 11 -19.257 7.419 -10.946 797 2HE MET 11 2HE MET 11 -20.778 6.574 -10.656 798 3HE MET 11 3HE MET 11 -19.400 5.703 -11.330 799 H ALA 12 H ALA 12 -20.247 2.182 -15.723 800 HA ALA 12 HA ALA 12 -21.829 0.583 -14.122 801 1HB ALA 12 1HB ALA 12 -20.759 0.221 -16.896 802 2HB ALA 12 2HB ALA 12 -21.763 -1.017 -16.141 803 3HB ALA 12 3HB ALA 12 -22.398 0.611 -16.375 804 H GLU 13 H GLU 13 -18.540 -0.007 -15.276 805 HA GLU 13 HA GLU 13 -18.217 -2.648 -14.526 806 1HB GLU 13 1HB GLU 13 -16.553 -1.310 -15.789 807 2HB GLU 13 2HB GLU 13 -16.145 -0.458 -14.306 808 1HG GLU 13 1HG GLU 13 -15.246 -2.416 -13.322 809 2HG GLU 13 2HG GLU 13 -15.894 -3.436 -14.606 810 H VAL 14 H VAL 14 -17.552 0.252 -12.567 811 HA VAL 14 HA VAL 14 -16.840 -1.144 -10.222 812 HB VAL 14 HB VAL 14 -18.020 1.632 -10.376 813 1HG1 VAL 14 1HG1 VAL 14 -16.421 0.154 -8.309 814 2HG1 VAL 14 2HG1 VAL 14 -16.480 1.917 -8.355 815 3HG1 VAL 14 3HG1 VAL 14 -17.962 0.990 -8.123 816 1HG2 VAL 14 1HG2 VAL 14 -15.499 2.234 -10.304 817 2HG2 VAL 14 2HG2 VAL 14 -15.266 0.608 -10.946 818 3HG2 VAL 14 3HG2 VAL 14 -16.231 1.780 -11.843 819 H GLU 15 H GLU 15 -19.922 -0.005 -11.472 820 HA GLU 15 HA GLU 15 -21.423 -0.423 -9.106 821 1HB GLU 15 1HB GLU 15 -22.217 -0.246 -12.010 822 2HB GLU 15 2HB GLU 15 -23.388 -0.443 -10.714 823 1HG GLU 15 1HG GLU 15 -22.738 1.656 -9.739 824 2HG GLU 15 2HG GLU 15 -21.437 1.839 -10.915 825 H GLU 16 H GLU 16 -20.525 -2.483 -11.799 826 HA GLU 16 HA GLU 16 -22.297 -4.617 -11.169 827 1HB GLU 16 1HB GLU 16 -20.597 -4.010 -13.268 828 2HB GLU 16 2HB GLU 16 -19.835 -5.408 -12.522 829 1HG GLU 16 1HG GLU 16 -22.734 -5.634 -12.925 830 2HG GLU 16 2HG GLU 16 -21.771 -5.537 -14.398 831 H THR 17 H THR 17 -19.083 -3.721 -10.138 832 HA THR 17 HA THR 17 -18.546 -6.248 -8.856 833 HB THR 17 HB THR 17 -17.089 -3.605 -8.658 834 HG1 THR 17 HG1 THR 17 -17.196 -5.018 -10.707 835 1HG2 THR 17 1HG2 THR 17 -15.271 -5.513 -8.012 836 2HG2 THR 17 2HG2 THR 17 -16.733 -6.188 -7.293 837 3HG2 THR 17 3HG2 THR 17 -16.187 -4.577 -6.832 838 H LEU 18 H LEU 18 -19.922 -3.179 -7.976 839 HA LEU 18 HA LEU 18 -19.628 -3.407 -5.167 840 1HB LEU 18 1HB LEU 18 -20.956 -1.645 -7.050 841 2HB LEU 18 2HB LEU 18 -21.919 -1.908 -5.598 842 HG LEU 18 HG LEU 18 -19.669 -1.303 -4.381 843 1HD1 LEU 18 1HD1 LEU 18 -18.430 0.426 -5.643 844 2HD1 LEU 18 2HD1 LEU 18 -19.345 -0.012 -7.085 845 3HD1 LEU 18 3HD1 LEU 18 -18.268 -1.189 -6.334 846 1HD2 LEU 18 1HD2 LEU 18 -21.441 0.738 -5.720 847 2HD2 LEU 18 2HD2 LEU 18 -20.378 1.045 -4.346 848 3HD2 LEU 18 3HD2 LEU 18 -21.746 -0.057 -4.175 849 H LYS 19 H LYS 19 -22.002 -4.579 -7.453 850 HA LYS 19 HA LYS 19 -24.041 -5.248 -5.629 851 1HB LYS 19 1HB LYS 19 -23.520 -5.588 -8.419 852 2HB LYS 19 2HB LYS 19 -24.036 -7.133 -7.756 853 1HG LYS 19 1HG LYS 19 -26.018 -6.141 -8.428 854 2HG LYS 19 2HG LYS 19 -25.961 -5.801 -6.696 855 1HD LYS 19 1HD LYS 19 -26.023 -3.612 -7.084 856 2HD LYS 19 2HD LYS 19 -24.607 -3.722 -8.132 857 1HE LYS 19 1HE LYS 19 -26.509 -4.724 -9.767 858 2HE LYS 19 2HE LYS 19 -27.472 -3.597 -8.813 859 1HZ LYS 19 1HZ LYS 19 -25.134 -2.274 -9.502 860 2HZ LYS 19 2HZ LYS 19 -26.695 -1.977 -10.081 861 3HZ LYS 19 3HZ LYS 19 -25.673 -3.040 -10.911 862 H ARG 20 H ARG 20 -21.442 -7.238 -7.033 863 HA ARG 20 HA ARG 20 -22.077 -9.563 -5.548 864 1HB ARG 20 1HB ARG 20 -20.666 -9.369 -7.681 865 2HB ARG 20 2HB ARG 20 -19.342 -8.906 -6.621 866 1HG ARG 20 1HG ARG 20 -18.900 -11.094 -6.570 867 2HG ARG 20 2HG ARG 20 -20.230 -11.173 -5.413 868 1HD ARG 20 1HD ARG 20 -20.760 -11.365 -8.352 869 2HD ARG 20 2HD ARG 20 -20.213 -12.778 -7.450 870 HE ARG 20 HE ARG 20 -22.325 -11.783 -6.013 871 1HH1 ARG 20 1HH1 ARG 20 -21.827 -12.910 -9.269 872 2HH1 ARG 20 2HH1 ARG 20 -23.452 -13.480 -9.460 873 1HH2 ARG 20 1HH2 ARG 20 -24.468 -12.529 -6.252 874 2HH2 ARG 20 2HH2 ARG 20 -24.953 -13.262 -7.743 875 H LEU 21 H LEU 21 -20.068 -6.773 -4.914 876 HA LEU 21 HA LEU 21 -18.653 -7.864 -2.705 877 1HB LEU 21 1HB LEU 21 -18.976 -5.243 -3.978 878 2HB LEU 21 2HB LEU 21 -18.667 -5.177 -2.244 879 HG LEU 21 HG LEU 21 -16.578 -6.339 -2.519 880 1HD1 LEU 21 1HD1 LEU 21 -16.131 -6.449 -5.262 881 2HD1 LEU 21 2HD1 LEU 21 -17.748 -7.117 -5.039 882 3HD1 LEU 21 3HD1 LEU 21 -16.380 -7.811 -4.169 883 1HD2 LEU 21 1HD2 LEU 21 -16.979 -4.075 -4.464 884 2HD2 LEU 21 2HD2 LEU 21 -15.398 -4.727 -4.035 885 3HD2 LEU 21 3HD2 LEU 21 -16.410 -3.981 -2.798 886 H GLN 22 H GLN 22 -21.392 -5.586 -2.869 887 HA GLN 22 HA GLN 22 -21.852 -5.545 -0.082 888 1HB GLN 22 1HB GLN 22 -22.852 -4.201 -2.308 889 2HB GLN 22 2HB GLN 22 -24.242 -5.060 -1.659 890 1HG GLN 22 1HG GLN 22 -24.342 -3.784 0.188 891 2HG GLN 22 2HG GLN 22 -22.589 -3.642 0.317 892 1HE2 GLN 22 1HE2 GLN 22 -21.604 -2.314 -1.523 893 2HE2 GLN 22 2HE2 GLN 22 -22.413 -0.833 -1.897 894 H SER 23 H SER 23 -22.635 -7.821 -2.519 895 HA SER 23 HA SER 23 -24.858 -9.005 -1.110 896 1HB SER 23 1HB SER 23 -24.712 -9.056 -3.586 897 2HB SER 23 2HB SER 23 -23.280 -10.079 -3.462 898 HG SER 23 HG SER 23 -25.606 -10.993 -3.678 899 H GLN 24 H GLN 24 -21.428 -9.344 -1.174 900 HA GLN 24 HA GLN 24 -21.544 -11.926 0.201 901 1HB GLN 24 1HB GLN 24 -19.152 -12.053 -0.159 902 2HB GLN 24 2HB GLN 24 -19.955 -11.664 -1.675 903 1HG GLN 24 1HG GLN 24 -19.228 -9.436 -1.615 904 2HG GLN 24 2HG GLN 24 -18.774 -9.544 0.085 905 1HE2 GLN 24 1HE2 GLN 24 -16.943 -8.524 -1.514 906 2HE2 GLN 24 2HE2 GLN 24 -15.666 -9.644 -1.828 907 H LYS 25 H LYS 25 -20.496 -12.259 2.209 908 HA LYS 25 HA LYS 25 -20.786 -10.057 4.024 909 1HB LYS 25 1HB LYS 25 -20.994 -12.764 4.283 910 2HB LYS 25 2HB LYS 25 -19.409 -12.477 4.990 911 1HG LYS 25 1HG LYS 25 -21.095 -10.514 6.064 912 2HG LYS 25 2HG LYS 25 -22.009 -12.024 6.105 913 1HD LYS 25 1HD LYS 25 -19.733 -12.980 7.032 914 2HD LYS 25 2HD LYS 25 -19.471 -11.294 7.486 915 1HE LYS 25 1HE LYS 25 -20.916 -11.438 9.180 916 2HE LYS 25 2HE LYS 25 -22.141 -12.197 8.164 917 1HZ LYS 25 1HZ LYS 25 -20.106 -13.437 9.863 918 2HZ LYS 25 2HZ LYS 25 -20.556 -14.250 8.450 919 3HZ LYS 25 3HZ LYS 25 -21.721 -13.877 9.618 920 H GLY 26 H GLY 26 -19.216 -8.938 5.130 921 1HA GLY 26 1HA GLY 26 -16.857 -8.855 5.861 922 2HA GLY 26 2HA GLY 26 -16.435 -9.420 4.251 923 H VAL 27 H VAL 27 -18.003 -7.820 2.660 924 HA VAL 27 HA VAL 27 -16.487 -5.496 2.432 925 HB VAL 27 HB VAL 27 -19.279 -5.997 1.391 926 1HG1 VAL 27 1HG1 VAL 27 -17.306 -3.807 0.939 927 2HG1 VAL 27 2HG1 VAL 27 -18.352 -4.315 -0.388 928 3HG1 VAL 27 3HG1 VAL 27 -19.058 -3.725 1.117 929 1HG2 VAL 27 1HG2 VAL 27 -17.733 -7.681 0.615 930 2HG2 VAL 27 2HG2 VAL 27 -18.107 -6.578 -0.709 931 3HG2 VAL 27 3HG2 VAL 27 -16.569 -6.443 0.143 932 H GLN 28 H GLN 28 -16.458 -3.680 3.569 933 HA GLN 28 HA GLN 28 -18.605 -3.130 5.454 934 1HB GLN 28 1HB GLN 28 -15.772 -2.451 5.223 935 2HB GLN 28 2HB GLN 28 -16.767 -1.086 5.712 936 1HG GLN 28 1HG GLN 28 -17.424 -2.099 7.681 937 2HG GLN 28 2HG GLN 28 -17.059 -3.719 7.088 938 1HE2 GLN 28 1HE2 GLN 28 -15.455 -4.567 8.188 939 2HE2 GLN 28 2HE2 GLN 28 -14.025 -3.748 8.709 940 H GLY 29 H GLY 29 -17.270 -1.879 2.482 941 1HA GLY 29 1HA GLY 29 -19.455 -0.579 1.546 942 2HA GLY 29 2HA GLY 29 -18.727 0.610 2.616 943 H ILE 30 H ILE 30 -19.066 0.212 -0.438 944 HA ILE 30 HA ILE 30 -16.251 0.584 -1.194 945 HB ILE 30 HB ILE 30 -18.570 0.177 -3.076 946 1HG1 ILE 30 1HG1 ILE 30 -17.276 -2.190 -3.145 947 2HG1 ILE 30 2HG1 ILE 30 -17.024 -1.766 -1.455 948 1HG2 ILE 30 1HG2 ILE 30 -16.824 -0.462 -4.659 949 2HG2 ILE 30 2HG2 ILE 30 -16.564 1.170 -4.048 950 3HG2 ILE 30 3HG2 ILE 30 -15.595 -0.167 -3.430 951 1HD1 ILE 30 1HD1 ILE 30 -19.764 -1.338 -2.239 952 2HD1 ILE 30 2HD1 ILE 30 -19.247 -2.995 -2.559 953 3HD1 ILE 30 3HD1 ILE 30 -19.101 -2.323 -0.935 954 H ILE 31 H ILE 31 -15.546 2.430 -2.172 955 HA ILE 31 HA ILE 31 -17.517 4.556 -2.661 956 HB ILE 31 HB ILE 31 -14.859 4.997 -1.298 957 1HG1 ILE 31 1HG1 ILE 31 -17.041 5.761 0.345 958 2HG1 ILE 31 2HG1 ILE 31 -17.374 4.130 -0.229 959 1HG2 ILE 31 1HG2 ILE 31 -17.153 6.869 -1.868 960 2HG2 ILE 31 2HG2 ILE 31 -15.714 7.271 -0.933 961 3HG2 ILE 31 3HG2 ILE 31 -15.572 6.884 -2.647 962 1HD1 ILE 31 1HD1 ILE 31 -14.658 4.241 0.571 963 2HD1 ILE 31 2HD1 ILE 31 -15.645 4.953 1.848 964 3HD1 ILE 31 3HD1 ILE 31 -15.984 3.319 1.279 965 H VAL 32 H VAL 32 -17.053 5.957 -4.336 966 HA VAL 32 HA VAL 32 -14.616 5.390 -5.889 967 HB VAL 32 HB VAL 32 -17.251 6.037 -7.191 968 1HG1 VAL 32 1HG1 VAL 32 -14.782 4.691 -8.278 969 2HG1 VAL 32 2HG1 VAL 32 -16.198 5.221 -9.189 970 3HG1 VAL 32 3HG1 VAL 32 -15.133 6.411 -8.439 971 1HG2 VAL 32 1HG2 VAL 32 -17.637 3.989 -6.004 972 2HG2 VAL 32 2HG2 VAL 32 -17.415 3.605 -7.710 973 3HG2 VAL 32 3HG2 VAL 32 -16.105 3.319 -6.565 974 H VAL 33 H VAL 33 -13.409 7.164 -5.877 975 HA VAL 33 HA VAL 33 -14.740 9.789 -5.921 976 HB VAL 33 HB VAL 33 -11.849 9.332 -5.225 977 1HG1 VAL 33 1HG1 VAL 33 -13.729 11.590 -5.213 978 2HG1 VAL 33 2HG1 VAL 33 -12.717 11.450 -3.775 979 3HG1 VAL 33 3HG1 VAL 33 -11.973 11.574 -5.369 980 1HG2 VAL 33 1HG2 VAL 33 -14.236 9.232 -3.386 981 2HG2 VAL 33 2HG2 VAL 33 -13.072 7.944 -3.695 982 3HG2 VAL 33 3HG2 VAL 33 -12.567 9.401 -2.840 983 H ASN 34 H ASN 34 -14.312 11.247 -7.504 984 HA ASN 34 HA ASN 34 -12.930 10.253 -9.856 985 1HB ASN 34 1HB ASN 34 -13.812 12.339 -10.920 986 2HB ASN 34 2HB ASN 34 -15.064 11.306 -10.235 987 1HD2 ASN 34 1HD2 ASN 34 -16.417 13.168 -10.228 988 2HD2 ASN 34 2HD2 ASN 34 -16.281 14.342 -8.967 989 H THR 35 H THR 35 -11.875 12.358 -11.083 990 HA THR 35 HA THR 35 -9.417 12.760 -9.738 991 HB THR 35 HB THR 35 -9.002 14.449 -11.610 992 HG1 THR 35 HG1 THR 35 -10.590 14.857 -12.964 993 1HG2 THR 35 1HG2 THR 35 -8.134 12.724 -12.736 994 2HG2 THR 35 2HG2 THR 35 -9.730 12.061 -13.087 995 3HG2 THR 35 3HG2 THR 35 -8.929 11.673 -11.565 996 H GLU 36 H GLU 36 -12.382 14.545 -9.833 997 HA GLU 36 HA GLU 36 -11.280 17.042 -8.963 998 1HB GLU 36 1HB GLU 36 -14.016 15.931 -9.362 999 2HB GLU 36 2HB GLU 36 -13.844 17.336 -8.320 1000 1HG GLU 36 1HG GLU 36 -12.346 17.993 -10.540 1001 2HG GLU 36 2HG GLU 36 -13.734 17.136 -11.209 1002 H GLY 37 H GLY 37 -12.236 14.116 -7.423 1003 1HA GLY 37 1HA GLY 37 -11.478 13.672 -5.183 1004 2HA GLY 37 2HA GLY 37 -11.717 15.373 -4.810 1005 H ILE 38 H ILE 38 -14.322 14.643 -6.586 1006 HA ILE 38 HA ILE 38 -15.991 14.346 -4.231 1007 HB ILE 38 HB ILE 38 -16.823 14.632 -7.119 1008 1HG1 ILE 38 1HG1 ILE 38 -16.687 16.760 -4.975 1009 2HG1 ILE 38 2HG1 ILE 38 -15.471 16.546 -6.229 1010 1HG2 ILE 38 1HG2 ILE 38 -18.993 15.240 -6.232 1011 2HG2 ILE 38 2HG2 ILE 38 -18.525 13.648 -5.639 1012 3HG2 ILE 38 3HG2 ILE 38 -18.398 15.054 -4.583 1013 1HD1 ILE 38 1HD1 ILE 38 -17.031 17.111 -7.935 1014 2HD1 ILE 38 2HD1 ILE 38 -18.371 17.100 -6.787 1015 3HD1 ILE 38 3HD1 ILE 38 -17.126 18.344 -6.677 1016 HA PRO 39 HA PRO 39 -16.422 9.967 -4.689 1017 1HB PRO 39 1HB PRO 39 -18.523 9.650 -2.999 1018 2HB PRO 39 2HB PRO 39 -16.872 9.940 -2.436 1019 1HG PRO 39 1HG PRO 39 -19.139 11.873 -2.733 1020 2HG PRO 39 2HG PRO 39 -17.968 11.717 -1.411 1021 1HD PRO 39 1HD PRO 39 -17.745 13.604 -3.340 1022 2HD PRO 39 2HD PRO 39 -16.332 12.867 -2.557 1023 H ILE 40 H ILE 40 -17.123 10.197 -6.938 1024 HA ILE 40 HA ILE 40 -19.629 10.811 -7.866 1025 HB ILE 40 HB ILE 40 -19.169 8.987 -9.638 1026 1HG1 ILE 40 1HG1 ILE 40 -16.434 9.074 -8.358 1027 2HG1 ILE 40 2HG1 ILE 40 -17.576 7.759 -8.097 1028 1HG2 ILE 40 1HG2 ILE 40 -17.033 11.080 -9.361 1029 2HG2 ILE 40 2HG2 ILE 40 -17.771 10.452 -10.833 1030 3HG2 ILE 40 3HG2 ILE 40 -18.705 11.484 -9.750 1031 1HD1 ILE 40 1HD1 ILE 40 -17.279 6.908 -10.177 1032 2HD1 ILE 40 2HD1 ILE 40 -16.933 8.482 -10.895 1033 3HD1 ILE 40 3HD1 ILE 40 -15.697 7.654 -9.949 1034 H LYS 41 H LYS 41 -18.539 7.790 -6.411 1035 HA LYS 41 HA LYS 41 -21.354 6.950 -6.230 1036 1HB LYS 41 1HB LYS 41 -19.167 5.597 -7.546 1037 2HB LYS 41 2HB LYS 41 -19.802 4.609 -6.237 1038 1HG LYS 41 1HG LYS 41 -21.859 5.819 -7.928 1039 2HG LYS 41 2HG LYS 41 -20.794 4.689 -8.768 1040 1HD LYS 41 1HD LYS 41 -21.744 2.931 -7.775 1041 2HD LYS 41 2HD LYS 41 -21.613 3.675 -6.180 1042 1HE LYS 41 1HE LYS 41 -23.745 4.373 -6.203 1043 2HE LYS 41 2HE LYS 41 -23.662 4.874 -7.891 1044 1HZ LYS 41 1HZ LYS 41 -23.968 2.066 -6.974 1045 2HZ LYS 41 2HZ LYS 41 -23.992 2.607 -8.577 1046 3HZ LYS 41 3HZ LYS 41 -25.235 3.048 -7.517 1047 H SER 42 H SER 42 -22.010 6.204 -4.282 1048 HA SER 42 HA SER 42 -20.071 5.413 -2.272 1049 1HB SER 42 1HB SER 42 -20.237 7.895 -2.064 1050 2HB SER 42 2HB SER 42 -21.961 7.717 -1.742 1051 HG SER 42 HG SER 42 -20.167 6.236 -0.195 1052 H THR 43 H THR 43 -20.854 3.811 -1.061 1053 HA THR 43 HA THR 43 -23.774 3.402 -1.025 1054 HB THR 43 HB THR 43 -23.049 1.584 -2.264 1055 HG1 THR 43 HG1 THR 43 -22.575 0.287 0.159 1056 1HG2 THR 43 1HG2 THR 43 -20.789 1.518 -2.420 1057 2HG2 THR 43 2HG2 THR 43 -20.957 0.262 -1.194 1058 3HG2 THR 43 3HG2 THR 43 -20.554 1.911 -0.718 1059 H MET 44 H MET 44 -21.120 4.149 0.829 1060 HA MET 44 HA MET 44 -22.114 2.820 3.238 1061 1HB MET 44 1HB MET 44 -19.557 3.316 2.340 1062 2HB MET 44 2HB MET 44 -19.795 4.583 3.536 1063 1HG MET 44 1HG MET 44 -20.584 2.714 5.089 1064 2HG MET 44 2HG MET 44 -19.868 1.614 3.914 1065 1HE MET 44 1HE MET 44 -17.487 2.736 2.810 1066 2HE MET 44 2HE MET 44 -16.129 2.681 3.934 1067 3HE MET 44 3HE MET 44 -17.136 1.252 3.696 1068 H ASP 45 H ASP 45 -21.316 4.607 5.177 1069 HA ASP 45 HA ASP 45 -23.522 6.320 5.366 1070 1HB ASP 45 1HB ASP 45 -21.173 5.693 6.953 1071 2HB ASP 45 2HB ASP 45 -21.581 7.404 7.051 1072 H ASN 46 H ASN 46 -23.780 8.522 5.098 1073 HA ASN 46 HA ASN 46 -22.497 9.738 2.948 1074 1HB ASN 46 1HB ASN 46 -24.636 10.354 4.654 1075 2HB ASN 46 2HB ASN 46 -23.521 11.709 4.803 1076 1HD2 ASN 46 1HD2 ASN 46 -22.451 11.747 2.254 1077 2HD2 ASN 46 2HD2 ASN 46 -23.686 12.196 1.132 1078 HA PRO 47 HA PRO 47 -19.923 12.320 6.127 1079 1HB PRO 47 1HB PRO 47 -19.941 11.475 8.708 1080 2HB PRO 47 2HB PRO 47 -21.110 12.638 8.069 1081 1HG PRO 47 1HG PRO 47 -21.417 9.694 8.518 1082 2HG PRO 47 2HG PRO 47 -22.558 11.005 8.871 1083 1HD PRO 47 1HD PRO 47 -22.780 9.432 6.678 1084 2HD PRO 47 2HD PRO 47 -23.279 11.136 6.686 1085 H THR 48 H THR 48 -20.190 8.851 6.438 1086 HA THR 48 HA THR 48 -17.500 8.427 7.328 1087 HB THR 48 HB THR 48 -19.471 6.488 6.104 1088 HG1 THR 48 HG1 THR 48 -19.353 5.859 8.510 1089 1HG2 THR 48 1HG2 THR 48 -18.007 4.770 7.199 1090 2HG2 THR 48 2HG2 THR 48 -16.820 6.045 7.472 1091 3HG2 THR 48 3HG2 THR 48 -17.268 5.595 5.827 1092 H THR 49 H THR 49 -19.178 8.199 4.214 1093 HA THR 49 HA THR 49 -16.929 7.282 2.748 1094 HB THR 49 HB THR 49 -19.485 8.623 1.865 1095 HG1 THR 49 HG1 THR 49 -18.577 5.997 2.188 1096 1HG2 THR 49 1HG2 THR 49 -18.439 9.081 -0.065 1097 2HG2 THR 49 2HG2 THR 49 -18.448 7.339 -0.342 1098 3HG2 THR 49 3HG2 THR 49 -17.033 8.111 0.372 1099 H THR 50 H THR 50 -18.392 10.499 3.144 1100 HA THR 50 HA THR 50 -16.723 11.944 1.466 1101 HB THR 50 HB THR 50 -17.723 13.029 4.095 1102 HG1 THR 50 HG1 THR 50 -19.721 13.194 3.224 1103 1HG2 THR 50 1HG2 THR 50 -16.886 14.918 3.250 1104 2HG2 THR 50 2HG2 THR 50 -18.135 14.835 2.008 1105 3HG2 THR 50 3HG2 THR 50 -16.543 14.143 1.704 1106 H GLN 51 H GLN 51 -16.154 10.750 4.706 1107 HA GLN 51 HA GLN 51 -13.808 12.303 5.188 1108 1HB GLN 51 1HB GLN 51 -15.156 11.366 7.018 1109 2HB GLN 51 2HB GLN 51 -14.739 9.740 6.494 1110 1HG GLN 51 1HG GLN 51 -12.297 11.026 6.816 1111 2HG GLN 51 2HG GLN 51 -13.278 11.565 8.177 1112 1HE2 GLN 51 1HE2 GLN 51 -11.808 8.840 6.600 1113 2HE2 GLN 51 2HE2 GLN 51 -11.972 7.732 7.915 1114 H TYR 52 H TYR 52 -14.338 8.894 4.308 1115 HA TYR 52 HA TYR 52 -11.617 8.220 4.070 1116 1HB TYR 52 1HB TYR 52 -14.162 7.020 3.025 1117 2HB TYR 52 2HB TYR 52 -12.605 6.374 2.517 1118 HD1 TYR 52 HD1 TYR 52 -14.064 7.518 5.771 1119 HD2 TYR 52 HD2 TYR 52 -12.039 4.446 3.635 1120 HE1 TYR 52 HE1 TYR 52 -13.962 6.167 7.823 1121 HE2 TYR 52 HE2 TYR 52 -11.934 3.085 5.681 1122 HH TYR 52 HH TYR 52 -13.604 3.151 8.023 1123 H ALA 53 H ALA 53 -14.009 9.047 1.561 1124 HA ALA 53 HA ALA 53 -12.358 8.914 -0.656 1125 1HB ALA 53 1HB ALA 53 -13.934 10.663 -1.627 1126 2HB ALA 53 2HB ALA 53 -14.660 9.163 -1.046 1127 3HB ALA 53 3HB ALA 53 -14.754 10.626 -0.065 1128 H SER 54 H SER 54 -12.518 11.329 1.835 1129 HA SER 54 HA SER 54 -11.108 13.352 0.366 1130 1HB SER 54 1HB SER 54 -12.373 13.103 2.971 1131 2HB SER 54 2HB SER 54 -10.818 13.928 3.082 1132 HG SER 54 HG SER 54 -12.709 15.279 2.615 1133 H LEU 55 H LEU 55 -10.259 11.010 2.891 1134 HA LEU 55 HA LEU 55 -7.494 11.803 2.915 1135 1HB LEU 55 1HB LEU 55 -7.229 10.362 4.672 1136 2HB LEU 55 2HB LEU 55 -8.946 10.739 4.803 1137 HG LEU 55 HG LEU 55 -9.137 8.538 3.314 1138 1HD1 LEU 55 1HD1 LEU 55 -7.104 7.361 4.972 1139 2HD1 LEU 55 2HD1 LEU 55 -6.408 8.584 3.910 1140 3HD1 LEU 55 3HD1 LEU 55 -7.335 7.248 3.227 1141 1HD2 LEU 55 1HD2 LEU 55 -10.088 9.079 5.600 1142 2HD2 LEU 55 2HD2 LEU 55 -8.641 8.329 6.274 1143 3HD2 LEU 55 3HD2 LEU 55 -9.744 7.380 5.277 1144 H MET 56 H MET 56 -9.347 9.982 0.833 1145 HA MET 56 HA MET 56 -7.396 7.965 0.188 1146 1HB MET 56 1HB MET 56 -10.050 8.053 -0.152 1147 2HB MET 56 2HB MET 56 -9.559 8.649 -1.732 1148 1HG MET 56 1HG MET 56 -9.612 6.442 -2.204 1149 2HG MET 56 2HG MET 56 -7.958 6.540 -1.604 1150 1HE MET 56 1HE MET 56 -7.931 6.505 1.470 1151 2HE MET 56 2HE MET 56 -7.964 4.759 1.719 1152 3HE MET 56 3HE MET 56 -7.051 5.441 0.372 1153 H HIS 57 H HIS 57 -8.721 10.781 -1.556 1154 HA HIS 57 HA HIS 57 -7.059 10.713 -3.764 1155 1HB HIS 57 1HB HIS 57 -9.062 12.253 -3.267 1156 2HB HIS 57 2HB HIS 57 -7.891 13.305 -2.478 1157 HD1 HIS 57 HD1 HIS 57 -6.859 11.498 -5.566 1158 HD2 HIS 57 HD2 HIS 57 -8.269 15.253 -4.480 1159 HE1 HIS 57 HE1 HIS 57 -6.484 12.964 -7.574 1160 H SER 58 H SER 58 -6.462 12.069 -0.568 1161 HA SER 58 HA SER 58 -3.968 13.277 -1.278 1162 1HB SER 58 1HB SER 58 -5.412 14.020 0.638 1163 2HB SER 58 2HB SER 58 -4.949 12.547 1.490 1164 HG SER 58 HG SER 58 -3.587 14.862 1.214 1165 H PHE 59 H PHE 59 -4.980 10.129 -0.267 1166 HA PHE 59 HA PHE 59 -2.490 9.202 0.728 1167 1HB PHE 59 1HB PHE 59 -4.794 8.161 1.087 1168 2HB PHE 59 2HB PHE 59 -4.620 7.474 -0.524 1169 HD1 PHE 59 HD1 PHE 59 -2.417 6.128 -0.935 1170 HD2 PHE 59 HD2 PHE 59 -4.056 6.960 2.904 1171 HE1 PHE 59 HE1 PHE 59 -1.163 4.232 0.008 1172 HE2 PHE 59 HE2 PHE 59 -2.804 5.066 3.853 1173 HZ PHE 59 HZ PHE 59 -1.354 3.700 2.405 1174 H ILE 60 H ILE 60 -4.134 8.578 -2.376 1175 HA ILE 60 HA ILE 60 -2.049 7.199 -3.605 1176 HB ILE 60 HB ILE 60 -4.091 8.981 -4.940 1177 1HG1 ILE 60 1HG1 ILE 60 -5.170 7.296 -3.556 1178 2HG1 ILE 60 2HG1 ILE 60 -5.361 6.875 -5.255 1179 1HG2 ILE 60 1HG2 ILE 60 -3.399 6.773 -6.548 1180 2HG2 ILE 60 2HG2 ILE 60 -3.070 8.480 -6.844 1181 3HG2 ILE 60 3HG2 ILE 60 -1.890 7.490 -5.985 1182 1HD1 ILE 60 1HD1 ILE 60 -4.545 4.875 -4.805 1183 2HD1 ILE 60 2HD1 ILE 60 -3.005 5.622 -4.376 1184 3HD1 ILE 60 3HD1 ILE 60 -4.228 5.347 -3.135 1185 H LEU 61 H LEU 61 -2.735 10.669 -3.507 1186 HA LEU 61 HA LEU 61 -0.705 11.469 -5.291 1187 1HB LEU 61 1HB LEU 61 -2.615 12.715 -3.544 1188 2HB LEU 61 2HB LEU 61 -1.053 13.518 -3.402 1189 HG LEU 61 HG LEU 61 -1.045 13.986 -5.782 1190 1HD1 LEU 61 1HD1 LEU 61 -3.385 13.528 -6.906 1191 2HD1 LEU 61 2HD1 LEU 61 -3.418 12.197 -5.750 1192 3HD1 LEU 61 3HD1 LEU 61 -2.104 12.316 -6.920 1193 1HD2 LEU 61 1HD2 LEU 61 -3.188 15.391 -5.851 1194 2HD2 LEU 61 2HD2 LEU 61 -2.026 15.721 -4.566 1195 3HD2 LEU 61 3HD2 LEU 61 -3.480 14.782 -4.222 1196 H LYS 62 H LYS 62 -0.670 10.591 -1.933 1197 HA LYS 62 HA LYS 62 1.885 11.762 -1.353 1198 1HB LYS 62 1HB LYS 62 -0.210 10.516 0.117 1199 2HB LYS 62 2HB LYS 62 1.277 9.640 0.456 1200 1HG LYS 62 1HG LYS 62 0.966 11.386 2.083 1201 2HG LYS 62 2HG LYS 62 2.361 11.762 1.069 1202 1HD LYS 62 1HD LYS 62 1.336 13.544 0.085 1203 2HD LYS 62 2HD LYS 62 -0.273 12.833 0.221 1204 1HE LYS 62 1HE LYS 62 0.084 13.193 2.774 1205 2HE LYS 62 2HE LYS 62 1.314 14.344 2.256 1206 1HZ LYS 62 1HZ LYS 62 -1.080 15.161 2.642 1207 2HZ LYS 62 2HZ LYS 62 -1.406 14.474 1.132 1208 3HZ LYS 62 3HZ LYS 62 -0.251 15.702 1.270 1209 H ALA 63 H ALA 63 0.744 8.414 -1.788 1210 HA ALA 63 HA ALA 63 3.318 7.249 -1.696 1211 1HB ALA 63 1HB ALA 63 0.760 6.290 -1.687 1212 2HB ALA 63 2HB ALA 63 1.339 5.793 -3.278 1213 3HB ALA 63 3HB ALA 63 2.217 5.306 -1.828 1214 H ARG 64 H ARG 64 1.183 8.010 -4.446 1215 HA ARG 64 HA ARG 64 2.848 7.158 -6.495 1216 1HB ARG 64 1HB ARG 64 0.427 7.990 -6.618 1217 2HB ARG 64 2HB ARG 64 1.110 9.608 -6.709 1218 1HG ARG 64 1HG ARG 64 2.490 8.103 -8.619 1219 2HG ARG 64 2HG ARG 64 0.793 7.641 -8.773 1220 1HD ARG 64 1HD ARG 64 1.713 10.504 -8.660 1221 2HD ARG 64 2HD ARG 64 1.547 9.610 -10.170 1222 HE ARG 64 HE ARG 64 -0.565 10.699 -8.564 1223 1HH1 ARG 64 1HH1 ARG 64 0.274 8.237 -10.878 1224 2HH1 ARG 64 2HH1 ARG 64 -1.346 8.052 -11.463 1225 1HH2 ARG 64 1HH2 ARG 64 -2.701 10.465 -9.326 1226 2HH2 ARG 64 2HH2 ARG 64 -3.038 9.321 -10.581 1227 H SER 65 H SER 65 2.899 10.132 -4.643 1228 HA SER 65 HA SER 65 4.717 11.531 -6.323 1229 1HB SER 65 1HB SER 65 3.316 12.766 -4.781 1230 2HB SER 65 2HB SER 65 4.009 11.909 -3.405 1231 HG SER 65 HG SER 65 4.847 14.153 -4.400 1232 H THR 66 H THR 66 5.073 9.216 -3.751 1233 HA THR 66 HA THR 66 7.896 9.720 -3.391 1234 HB THR 66 HB THR 66 6.726 7.189 -2.384 1235 HG1 THR 66 HG1 THR 66 5.861 8.662 -0.588 1236 1HG2 THR 66 1HG2 THR 66 8.385 9.388 -1.142 1237 2HG2 THR 66 2HG2 THR 66 8.984 7.853 -1.773 1238 3HG2 THR 66 3HG2 THR 66 7.943 7.876 -0.350 1239 H VAL 67 H VAL 67 5.857 7.455 -5.124 1240 HA VAL 67 HA VAL 67 7.631 5.434 -5.733 1241 HB VAL 67 HB VAL 67 5.546 6.629 -7.565 1242 1HG1 VAL 67 1HG1 VAL 67 5.561 4.417 -8.656 1243 2HG1 VAL 67 2HG1 VAL 67 7.102 5.263 -8.818 1244 3HG1 VAL 67 3HG1 VAL 67 6.933 3.952 -7.650 1245 1HG2 VAL 67 1HG2 VAL 67 3.964 5.487 -6.451 1246 2HG2 VAL 67 2HG2 VAL 67 5.011 4.092 -6.190 1247 3HG2 VAL 67 3HG2 VAL 67 5.130 5.495 -5.128 1248 H ARG 68 H ARG 68 7.299 8.605 -7.248 1249 HA ARG 68 HA ARG 68 8.912 8.278 -9.468 1250 1HB ARG 68 1HB ARG 68 8.701 10.725 -7.703 1251 2HB ARG 68 2HB ARG 68 9.316 10.703 -9.351 1252 1HG ARG 68 1HG ARG 68 6.609 9.600 -8.952 1253 2HG ARG 68 2HG ARG 68 6.796 11.340 -8.723 1254 1HD ARG 68 1HD ARG 68 7.419 11.695 -10.917 1255 2HD ARG 68 2HD ARG 68 7.978 10.037 -11.134 1256 HE ARG 68 HE ARG 68 5.851 9.430 -11.734 1257 1HH1 ARG 68 1HH1 ARG 68 5.778 12.583 -10.260 1258 2HH1 ARG 68 2HH1 ARG 68 4.120 12.878 -10.667 1259 1HH2 ARG 68 1HH2 ARG 68 3.668 9.807 -12.276 1260 2HH2 ARG 68 2HH2 ARG 68 2.921 11.299 -11.813 1261 H ASP 69 H ASP 69 9.801 8.569 -6.116 1262 HA ASP 69 HA ASP 69 12.593 9.052 -6.656 1263 1HB ASP 69 1HB ASP 69 10.874 9.197 -4.386 1264 2HB ASP 69 2HB ASP 69 12.199 8.104 -3.997 1265 H ILE 70 H ILE 70 10.550 6.308 -5.856 1266 HA ILE 70 HA ILE 70 12.549 4.439 -5.259 1267 HB ILE 70 HB ILE 70 9.889 3.892 -6.580 1268 1HG1 ILE 70 1HG1 ILE 70 10.561 3.852 -3.633 1269 2HG1 ILE 70 2HG1 ILE 70 9.788 5.214 -4.436 1270 1HG2 ILE 70 1HG2 ILE 70 11.617 2.086 -4.896 1271 2HG2 ILE 70 2HG2 ILE 70 10.096 1.666 -5.681 1272 3HG2 ILE 70 3HG2 ILE 70 11.519 2.033 -6.656 1273 1HD1 ILE 70 1HD1 ILE 70 8.153 3.215 -5.195 1274 2HD1 ILE 70 2HD1 ILE 70 8.683 2.622 -3.620 1275 3HD1 ILE 70 3HD1 ILE 70 7.911 4.201 -3.753 1276 H ASP 71 H ASP 71 11.320 5.622 -8.309 1277 HA ASP 71 HA ASP 71 13.572 4.576 -9.721 1278 1HB ASP 71 1HB ASP 71 11.016 3.108 -9.775 1279 2HB ASP 71 2HB ASP 71 11.712 3.442 -11.359 1280 HA PRO 72 HA PRO 72 12.672 7.901 -12.434 1281 1HB PRO 72 1HB PRO 72 13.514 6.949 -14.833 1282 2HB PRO 72 2HB PRO 72 14.625 7.408 -13.537 1283 1HG PRO 72 1HG PRO 72 13.649 4.689 -14.321 1284 2HG PRO 72 2HG PRO 72 15.287 5.204 -13.878 1285 1HD PRO 72 1HD PRO 72 13.642 3.930 -12.146 1286 2HD PRO 72 2HD PRO 72 14.832 5.137 -11.620 1287 H GLN 73 H GLN 73 11.743 4.792 -13.921 1288 HA GLN 73 HA GLN 73 9.240 6.072 -14.802 1289 1HB GLN 73 1HB GLN 73 10.712 3.872 -16.258 1290 2HB GLN 73 2HB GLN 73 9.263 4.708 -16.800 1291 1HG GLN 73 1HG GLN 73 10.496 6.771 -17.035 1292 2HG GLN 73 2HG GLN 73 11.947 6.005 -16.392 1293 1HE2 GLN 73 1HE2 GLN 73 13.024 6.604 -18.323 1294 2HE2 GLN 73 2HE2 GLN 73 12.807 5.695 -19.776 1295 H ASN 74 H ASN 74 7.361 4.984 -14.452 1296 HA ASN 74 HA ASN 74 7.083 2.243 -13.993 1297 1HB ASN 74 1HB ASN 74 8.237 3.528 -11.789 1298 2HB ASN 74 2HB ASN 74 6.545 3.307 -11.352 1299 1HD2 ASN 74 1HD2 ASN 74 6.949 1.763 -9.814 1300 2HD2 ASN 74 2HD2 ASN 74 7.489 0.168 -10.202 1301 H ASP 75 H ASP 75 4.971 2.066 -12.298 1302 HA ASP 75 HA ASP 75 3.048 4.130 -12.599 1303 1HB ASP 75 1HB ASP 75 3.363 2.449 -14.856 1304 2HB ASP 75 2HB ASP 75 1.850 1.987 -14.082 1305 H LEU 76 H LEU 76 1.934 3.924 -10.784 1306 HA LEU 76 HA LEU 76 1.855 1.529 -9.268 1307 1HB LEU 76 1HB LEU 76 1.179 4.256 -8.904 1308 2HB LEU 76 2HB LEU 76 -0.239 3.296 -8.485 1309 HG LEU 76 HG LEU 76 1.167 3.819 -6.536 1310 1HD1 LEU 76 1HD1 LEU 76 0.152 1.302 -7.311 1311 2HD1 LEU 76 2HD1 LEU 76 0.384 1.933 -5.681 1312 3HD1 LEU 76 3HD1 LEU 76 1.672 1.017 -6.464 1313 1HD2 LEU 76 1HD2 LEU 76 3.360 2.893 -6.281 1314 2HD2 LEU 76 2HD2 LEU 76 3.326 3.825 -7.778 1315 3HD2 LEU 76 3HD2 LEU 76 3.245 2.064 -7.833 1316 H THR 77 H THR 77 0.281 0.012 -9.012 1317 HA THR 77 HA THR 77 -2.103 0.255 -10.729 1318 HB THR 77 HB THR 77 -0.759 -1.362 -11.820 1319 HG1 THR 77 HG1 THR 77 -2.011 -3.290 -11.466 1320 1HG2 THR 77 1HG2 THR 77 0.889 -1.811 -10.128 1321 2HG2 THR 77 2HG2 THR 77 0.157 -3.343 -10.605 1322 3HG2 THR 77 3HG2 THR 77 -0.316 -2.573 -9.091 1323 H PHE 78 H PHE 78 -0.706 -1.001 -7.758 1324 HA PHE 78 HA PHE 78 -3.412 -1.152 -6.628 1325 1HB PHE 78 1HB PHE 78 -1.729 -3.378 -7.133 1326 2HB PHE 78 2HB PHE 78 -1.754 -3.135 -5.390 1327 HD1 PHE 78 HD1 PHE 78 -4.279 -2.499 -4.549 1328 HD2 PHE 78 HD2 PHE 78 -3.247 -4.894 -7.913 1329 HE1 PHE 78 HE1 PHE 78 -6.470 -3.611 -4.425 1330 HE2 PHE 78 HE2 PHE 78 -5.436 -6.010 -7.795 1331 HZ PHE 78 HZ PHE 78 -7.052 -5.369 -6.050 1332 H LEU 79 H LEU 79 -3.573 -0.682 -4.423 1333 HA LEU 79 HA LEU 79 -1.231 -0.105 -2.855 1334 1HB LEU 79 1HB LEU 79 -1.491 1.913 -4.291 1335 2HB LEU 79 2HB LEU 79 -3.079 2.166 -3.571 1336 HG LEU 79 HG LEU 79 -1.919 2.371 -1.346 1337 1HD1 LEU 79 1HD1 LEU 79 0.555 3.143 -1.745 1338 2HD1 LEU 79 2HD1 LEU 79 0.439 2.071 -3.140 1339 3HD1 LEU 79 3HD1 LEU 79 0.166 1.437 -1.518 1340 1HD2 LEU 79 1HD2 LEU 79 -1.621 4.286 -3.611 1341 2HD2 LEU 79 2HD2 LEU 79 -0.866 4.663 -2.062 1342 3HD2 LEU 79 3HD2 LEU 79 -2.609 4.405 -2.155 1343 H ARG 80 H ARG 80 -1.946 -1.338 -1.199 1344 HA ARG 80 HA ARG 80 -4.494 -0.543 0.050 1345 1HB ARG 80 1HB ARG 80 -3.317 -3.313 0.213 1346 2HB ARG 80 2HB ARG 80 -4.933 -2.795 0.673 1347 1HG ARG 80 1HG ARG 80 -5.436 -2.345 -1.695 1348 2HG ARG 80 2HG ARG 80 -3.835 -2.950 -2.126 1349 1HD ARG 80 1HD ARG 80 -6.060 -4.494 -0.801 1350 2HD ARG 80 2HD ARG 80 -5.475 -4.692 -2.453 1351 HE ARG 80 HE ARG 80 -4.304 -5.763 -0.063 1352 1HH1 ARG 80 1HH1 ARG 80 -3.681 -4.740 -3.332 1353 2HH1 ARG 80 2HH1 ARG 80 -2.277 -5.738 -3.515 1354 1HH2 ARG 80 1HH2 ARG 80 -2.457 -7.081 -0.292 1355 2HH2 ARG 80 2HH2 ARG 80 -1.582 -7.070 -1.785 1356 H ILE 81 H ILE 81 -4.565 -1.213 2.420 1357 HA ILE 81 HA ILE 81 -1.957 -1.178 3.725 1358 HB ILE 81 HB ILE 81 -2.893 0.629 5.311 1359 1HG1 ILE 81 1HG1 ILE 81 -4.551 1.167 2.837 1360 2HG1 ILE 81 2HG1 ILE 81 -5.174 0.649 4.400 1361 1HG2 ILE 81 1HG2 ILE 81 -1.454 2.032 4.319 1362 2HG2 ILE 81 2HG2 ILE 81 -1.176 0.702 3.196 1363 3HG2 ILE 81 3HG2 ILE 81 -2.316 1.982 2.781 1364 1HD1 ILE 81 1HD1 ILE 81 -4.239 3.303 3.512 1365 2HD1 ILE 81 2HD1 ILE 81 -5.552 2.863 4.605 1366 3HD1 ILE 81 3HD1 ILE 81 -3.884 2.844 5.178 1367 H ARG 82 H ARG 82 -2.342 -3.193 4.584 1368 HA ARG 82 HA ARG 82 -4.743 -4.019 5.792 1369 1HB ARG 82 1HB ARG 82 -2.418 -5.255 5.106 1370 2HB ARG 82 2HB ARG 82 -2.257 -5.194 6.856 1371 1HG ARG 82 1HG ARG 82 -4.393 -6.339 7.104 1372 2HG ARG 82 2HG ARG 82 -4.578 -6.382 5.349 1373 1HD ARG 82 1HD ARG 82 -3.270 -8.177 5.171 1374 2HD ARG 82 2HD ARG 82 -2.022 -7.452 6.184 1375 HE ARG 82 HE ARG 82 -4.060 -9.316 7.001 1376 1HH1 ARG 82 1HH1 ARG 82 -1.824 -6.856 8.034 1377 2HH1 ARG 82 2HH1 ARG 82 -1.751 -7.424 9.669 1378 1HH2 ARG 82 1HH2 ARG 82 -3.973 -10.074 9.151 1379 2HH2 ARG 82 2HH2 ARG 82 -2.973 -9.255 10.303 1380 H SER 83 H SER 83 -5.644 -2.992 7.457 1381 HA SER 83 HA SER 83 -3.912 -2.033 9.632 1382 1HB SER 83 1HB SER 83 -6.658 -1.143 9.832 1383 2HB SER 83 2HB SER 83 -5.183 -0.186 9.702 1384 HG SER 83 HG SER 83 -7.044 -0.632 7.844 1385 H LYS 84 H LYS 84 -5.678 -1.819 11.680 1386 HA LYS 84 HA LYS 84 -6.070 -4.609 12.401 1387 1HB LYS 84 1HB LYS 84 -6.133 -2.030 13.956 1388 2HB LYS 84 2HB LYS 84 -6.650 -3.555 14.664 1389 1HG LYS 84 1HG LYS 84 -4.252 -4.285 13.693 1390 2HG LYS 84 2HG LYS 84 -3.947 -2.578 14.026 1391 1HD LYS 84 1HD LYS 84 -3.657 -3.099 16.169 1392 2HD LYS 84 2HD LYS 84 -5.355 -3.574 16.246 1393 1HE LYS 84 1HE LYS 84 -4.648 -5.833 15.393 1394 2HE LYS 84 2HE LYS 84 -2.978 -5.316 15.620 1395 1HZ LYS 84 1HZ LYS 84 -4.066 -6.618 17.490 1396 2HZ LYS 84 2HZ LYS 84 -4.943 -5.212 17.826 1397 3HZ LYS 84 3HZ LYS 84 -3.254 -5.197 17.919 1398 H LYS 85 H LYS 85 -7.925 -1.856 11.469 1399 HA LYS 85 HA LYS 85 -10.420 -2.902 12.508 1400 1HB LYS 85 1HB LYS 85 -9.545 -0.416 11.136 1401 2HB LYS 85 2HB LYS 85 -11.224 -0.896 10.923 1402 1HG LYS 85 1HG LYS 85 -9.923 -0.611 13.618 1403 2HG LYS 85 2HG LYS 85 -10.776 0.702 12.804 1404 1HD LYS 85 1HD LYS 85 -12.080 -1.963 13.252 1405 2HD LYS 85 2HD LYS 85 -12.073 -0.723 14.508 1406 1HE LYS 85 1HE LYS 85 -12.862 0.676 12.283 1407 2HE LYS 85 2HE LYS 85 -13.627 -0.893 12.040 1408 1HZ LYS 85 1HZ LYS 85 -13.964 0.964 14.320 1409 2HZ LYS 85 2HZ LYS 85 -14.450 -0.654 14.398 1410 3HZ LYS 85 3HZ LYS 85 -15.149 0.385 13.260 1411 H ASN 86 H ASN 86 -8.980 -2.303 9.310 1412 HA ASN 86 HA ASN 86 -9.965 -4.643 8.146 1413 1HB ASN 86 1HB ASN 86 -11.620 -3.350 6.557 1414 2HB ASN 86 2HB ASN 86 -12.172 -3.958 8.115 1415 1HD2 ASN 86 1HD2 ASN 86 -11.199 -1.129 6.324 1416 2HD2 ASN 86 2HD2 ASN 86 -11.897 0.031 7.397 1417 H GLU 87 H GLU 87 -9.677 -4.668 5.761 1418 HA GLU 87 HA GLU 87 -7.379 -3.021 5.057 1419 1HB GLU 87 1HB GLU 87 -7.380 -5.512 4.737 1420 2HB GLU 87 2HB GLU 87 -8.606 -5.297 3.495 1421 1HG GLU 87 1HG GLU 87 -6.575 -3.538 2.789 1422 2HG GLU 87 2HG GLU 87 -5.744 -4.995 3.334 1423 H ILE 88 H ILE 88 -7.466 -1.344 3.713 1424 HA ILE 88 HA ILE 88 -9.969 -0.879 2.240 1425 HB ILE 88 HB ILE 88 -7.842 1.152 2.915 1426 1HG1 ILE 88 1HG1 ILE 88 -10.470 0.597 4.311 1427 2HG1 ILE 88 2HG1 ILE 88 -8.872 0.245 4.960 1428 1HG2 ILE 88 1HG2 ILE 88 -9.216 1.722 0.984 1429 2HG2 ILE 88 2HG2 ILE 88 -10.677 1.466 1.937 1430 3HG2 ILE 88 3HG2 ILE 88 -9.576 2.782 2.347 1431 1HD1 ILE 88 1HD1 ILE 88 -10.248 2.858 4.623 1432 2HD1 ILE 88 2HD1 ILE 88 -9.357 2.218 6.004 1433 3HD1 ILE 88 3HD1 ILE 88 -8.486 2.799 4.585 1434 H MET 89 H MET 89 -9.751 -1.700 0.242 1435 HA MET 89 HA MET 89 -7.274 -1.745 -1.176 1436 1HB MET 89 1HB MET 89 -10.036 -2.645 -1.637 1437 2HB MET 89 2HB MET 89 -9.173 -2.171 -3.094 1438 1HG MET 89 1HG MET 89 -7.452 -3.769 -2.682 1439 2HG MET 89 2HG MET 89 -8.103 -4.133 -1.086 1440 1HE MET 89 1HE MET 89 -10.744 -3.575 -3.947 1441 2HE MET 89 2HE MET 89 -9.223 -3.852 -4.795 1442 3HE MET 89 3HE MET 89 -10.520 -5.044 -4.899 1443 H VAL 90 H VAL 90 -6.433 -0.300 -2.552 1444 HA VAL 90 HA VAL 90 -8.123 1.753 -3.743 1445 HB VAL 90 HB VAL 90 -5.682 2.489 -2.122 1446 1HG1 VAL 90 1HG1 VAL 90 -6.144 3.871 -4.147 1447 2HG1 VAL 90 2HG1 VAL 90 -7.710 4.284 -3.446 1448 3HG1 VAL 90 3HG1 VAL 90 -6.222 4.765 -2.629 1449 1HG2 VAL 90 1HG2 VAL 90 -7.238 3.577 -0.587 1450 2HG2 VAL 90 2HG2 VAL 90 -8.602 2.984 -1.536 1451 3HG2 VAL 90 3HG2 VAL 90 -7.557 1.845 -0.686 1452 H ALA 91 H ALA 91 -7.634 1.807 -5.826 1453 HA ALA 91 HA ALA 91 -4.830 1.677 -6.652 1454 1HB ALA 91 1HB ALA 91 -5.287 -0.543 -7.047 1455 2HB ALA 91 2HB ALA 91 -6.976 -0.235 -7.452 1456 3HB ALA 91 3HB ALA 91 -5.704 0.178 -8.602 1457 HA PRO 92 HA PRO 92 -5.974 4.932 -9.373 1458 1HB PRO 92 1HB PRO 92 -4.124 4.602 -11.332 1459 2HB PRO 92 2HB PRO 92 -3.726 5.240 -9.733 1460 1HG PRO 92 1HG PRO 92 -3.383 2.466 -10.804 1461 2HG PRO 92 2HG PRO 92 -2.266 3.432 -9.822 1462 1HD PRO 92 1HD PRO 92 -3.831 1.492 -8.764 1463 2HD PRO 92 2HD PRO 92 -3.375 2.950 -7.860 1464 H ASP 93 H ASP 93 -7.662 5.029 -10.701 1465 HA ASP 93 HA ASP 93 -8.102 2.831 -12.602 1466 1HB ASP 93 1HB ASP 93 -10.086 4.900 -11.635 1467 2HB ASP 93 2HB ASP 93 -10.441 3.480 -12.614 1468 H LYS 94 H LYS 94 -9.799 3.975 -14.385 1469 HA LYS 94 HA LYS 94 -8.153 5.148 -16.257 1470 1HB LYS 94 1HB LYS 94 -10.939 4.551 -16.016 1471 2HB LYS 94 2HB LYS 94 -10.769 6.162 -16.702 1472 1HG LYS 94 1HG LYS 94 -9.353 5.285 -18.468 1473 2HG LYS 94 2HG LYS 94 -9.453 3.669 -17.764 1474 1HD LYS 94 1HD LYS 94 -11.969 3.862 -18.045 1475 2HD LYS 94 2HD LYS 94 -11.650 5.287 -19.036 1476 1HE LYS 94 1HE LYS 94 -10.503 4.027 -20.659 1477 2HE LYS 94 2HE LYS 94 -10.346 2.636 -19.587 1478 1HZ LYS 94 1HZ LYS 94 -12.995 3.610 -20.461 1479 2HZ LYS 94 2HZ LYS 94 -12.578 2.088 -19.852 1480 3HZ LYS 94 3HZ LYS 94 -12.099 2.535 -21.412 1481 H ASP 95 H ASP 95 -10.489 6.806 -14.138 1482 HA ASP 95 HA ASP 95 -8.767 9.141 -14.072 1483 1HB ASP 95 1HB ASP 95 -11.467 9.111 -15.380 1484 2HB ASP 95 2HB ASP 95 -10.893 10.572 -14.580 1485 H TYR 96 H TYR 96 -10.118 7.006 -12.327 1486 HA TYR 96 HA TYR 96 -10.910 8.873 -10.216 1487 1HB TYR 96 1HB TYR 96 -12.759 7.266 -9.574 1488 2HB TYR 96 2HB TYR 96 -13.036 8.194 -11.044 1489 HD1 TYR 96 HD1 TYR 96 -12.619 4.891 -9.621 1490 HD2 TYR 96 HD2 TYR 96 -12.792 7.087 -13.261 1491 HE1 TYR 96 HE1 TYR 96 -13.016 2.801 -10.856 1492 HE2 TYR 96 HE2 TYR 96 -13.190 5.003 -14.506 1493 HH TYR 96 HH TYR 96 -12.787 1.915 -13.097 1494 H PHE 97 H PHE 97 -11.365 7.365 -8.138 1495 HA PHE 97 HA PHE 97 -9.134 5.451 -7.966 1496 1HB PHE 97 1HB PHE 97 -9.862 7.695 -6.103 1497 2HB PHE 97 2HB PHE 97 -8.974 6.290 -5.520 1498 HD1 PHE 97 HD1 PHE 97 -7.028 5.646 -7.413 1499 HD2 PHE 97 HD2 PHE 97 -8.511 9.510 -6.419 1500 HE1 PHE 97 HE1 PHE 97 -4.922 6.652 -8.194 1501 HE2 PHE 97 HE2 PHE 97 -6.408 10.522 -7.199 1502 HZ PHE 97 HZ PHE 97 -4.611 9.092 -8.088 1503 H LEU 98 H LEU 98 -10.025 3.510 -7.717 1504 HA LEU 98 HA LEU 98 -12.608 3.092 -6.599 1505 1HB LEU 98 1HB LEU 98 -10.915 1.649 -8.194 1506 2HB LEU 98 2HB LEU 98 -10.822 0.776 -6.665 1507 HG LEU 98 HG LEU 98 -12.482 -0.284 -7.993 1508 1HD1 LEU 98 1HD1 LEU 98 -14.039 1.463 -6.109 1509 2HD1 LEU 98 2HD1 LEU 98 -12.964 0.182 -5.551 1510 3HD1 LEU 98 3HD1 LEU 98 -14.352 -0.212 -6.565 1511 1HD2 LEU 98 1HD2 LEU 98 -13.001 2.386 -8.898 1512 2HD2 LEU 98 2HD2 LEU 98 -14.501 1.637 -8.348 1513 3HD2 LEU 98 3HD2 LEU 98 -13.526 0.850 -9.590 1514 H ILE 99 H ILE 99 -13.221 2.482 -4.591 1515 HA ILE 99 HA ILE 99 -11.114 1.972 -2.602 1516 HB ILE 99 HB ILE 99 -13.563 3.654 -2.068 1517 1HG1 ILE 99 1HG1 ILE 99 -10.697 4.567 -2.390 1518 2HG1 ILE 99 2HG1 ILE 99 -11.944 4.754 -3.618 1519 1HG2 ILE 99 1HG2 ILE 99 -12.472 4.167 0.042 1520 2HG2 ILE 99 2HG2 ILE 99 -12.681 2.425 -0.137 1521 3HG2 ILE 99 3HG2 ILE 99 -11.098 3.155 -0.404 1522 1HD1 ILE 99 1HD1 ILE 99 -11.575 6.808 -2.350 1523 2HD1 ILE 99 2HD1 ILE 99 -13.214 6.190 -2.137 1524 3HD1 ILE 99 3HD1 ILE 99 -12.014 5.965 -0.865 1525 H VAL 100 H VAL 100 -11.417 -0.116 -2.123 1526 HA VAL 100 HA VAL 100 -14.159 -1.009 -1.506 1527 HB VAL 100 HB VAL 100 -11.841 -2.677 -2.493 1528 1HG1 VAL 100 1HG1 VAL 100 -13.706 -4.415 -2.708 1529 2HG1 VAL 100 2HG1 VAL 100 -13.082 -4.084 -1.091 1530 3HG1 VAL 100 3HG1 VAL 100 -14.619 -3.387 -1.604 1531 1HG2 VAL 100 1HG2 VAL 100 -12.668 -1.417 -4.318 1532 2HG2 VAL 100 2HG2 VAL 100 -13.387 -3.020 -4.464 1533 3HG2 VAL 100 3HG2 VAL 100 -14.343 -1.679 -3.834 1534 H ILE 101 H ILE 101 -14.450 -1.136 0.616 1535 HA ILE 101 HA ILE 101 -12.188 -1.937 2.317 1536 HB ILE 101 HB ILE 101 -14.749 -0.549 3.118 1537 1HG1 ILE 101 1HG1 ILE 101 -12.357 0.977 3.570 1538 2HG1 ILE 101 2HG1 ILE 101 -12.419 0.480 1.882 1539 1HG2 ILE 101 1HG2 ILE 101 -13.590 -0.197 5.269 1540 2HG2 ILE 101 2HG2 ILE 101 -13.875 -1.901 4.917 1541 3HG2 ILE 101 3HG2 ILE 101 -12.267 -1.212 4.695 1542 1HD1 ILE 101 1HD1 ILE 101 -14.995 1.398 2.607 1543 2HD1 ILE 101 2HD1 ILE 101 -13.812 2.582 3.164 1544 3HD1 ILE 101 3HD1 ILE 101 -13.851 2.105 1.467 1545 H GLN 102 H GLN 102 -12.312 -3.693 3.625 1546 HA GLN 102 HA GLN 102 -14.738 -4.989 4.327 1547 1HB GLN 102 1HB GLN 102 -14.581 -6.993 3.030 1548 2HB GLN 102 2HB GLN 102 -14.535 -5.636 1.914 1549 1HG GLN 102 1HG GLN 102 -12.091 -5.846 1.788 1550 2HG GLN 102 2HG GLN 102 -12.174 -7.243 2.859 1551 1HE2 GLN 102 1HE2 GLN 102 -11.895 -6.347 -0.259 1552 2HE2 GLN 102 2HE2 GLN 102 -12.532 -7.751 -1.037 1553 H ASN 103 H ASN 103 -14.225 -7.253 5.275 1554 HA ASN 103 HA ASN 103 -12.467 -6.978 7.383 1555 1HB ASN 103 1HB ASN 103 -13.978 -9.187 6.172 1556 2HB ASN 103 2HB ASN 103 -12.540 -9.701 7.050 1557 1HD2 ASN 103 1HD2 ASN 103 -15.638 -9.587 7.448 1558 2HD2 ASN 103 2HD2 ASN 103 -15.777 -9.112 9.103 1559 HA PRO 104 HA PRO 104 -8.400 -7.805 5.961 1560 1HB PRO 104 1HB PRO 104 -7.373 -9.325 7.961 1561 2HB PRO 104 2HB PRO 104 -7.696 -7.597 8.138 1562 1HG PRO 104 1HG PRO 104 -9.342 -9.932 9.032 1563 2HG PRO 104 2HG PRO 104 -8.970 -8.429 9.896 1564 1HD PRO 104 1HD PRO 104 -11.331 -8.838 8.634 1565 2HD PRO 104 2HD PRO 104 -10.585 -7.233 8.767 1566 H THR 105 H THR 105 -7.127 -9.303 4.891 1567 HA THR 105 HA THR 105 -8.349 -11.958 4.528 1568 HB THR 105 HB THR 105 -7.063 -12.014 2.368 1569 HG1 THR 105 HG1 THR 105 -6.677 -9.248 2.954 1570 1HG2 THR 105 1HG2 THR 105 -9.107 -11.483 1.640 1571 2HG2 THR 105 2HG2 THR 105 -8.572 -9.802 1.612 1572 3HG2 THR 105 3HG2 THR 105 -9.403 -10.440 3.031 1573 H GLU 106 H GLU 106 -5.339 -10.248 5.135 1574 HA GLU 106 HA GLU 106 -3.892 -12.781 5.360 1575 1HB GLU 106 1HB GLU 106 -3.163 -10.248 4.431 1576 2HB GLU 106 2HB GLU 106 -2.336 -10.413 5.973 1577 1HG GLU 106 1HG GLU 106 -0.983 -12.071 5.235 1578 2HG GLU 106 2HG GLU 106 -2.188 -12.711 4.120 Start of MODEL 7 1 H MET 11 H MET 11 17.839 -8.029 15.316 2 HA MET 11 HA MET 11 17.819 -7.761 12.651 3 1HB MET 11 1HB MET 11 19.909 -7.874 14.664 4 2HB MET 11 2HB MET 11 20.486 -8.440 13.102 5 1HG MET 11 1HG MET 11 19.297 -6.257 12.245 6 2HG MET 11 2HG MET 11 19.535 -5.747 13.915 7 1HE MET 11 1HE MET 11 22.108 -5.337 10.522 8 2HE MET 11 2HE MET 11 22.161 -7.088 10.730 9 3HE MET 11 3HE MET 11 20.607 -6.259 10.616 10 H ALA 12 H ALA 12 19.106 -10.632 14.312 11 HA ALA 12 HA ALA 12 19.933 -12.100 12.128 12 1HB ALA 12 1HB ALA 12 19.760 -14.050 13.496 13 2HB ALA 12 2HB ALA 12 20.251 -12.707 14.528 14 3HB ALA 12 3HB ALA 12 18.580 -13.271 14.551 15 H GLU 13 H GLU 13 16.679 -11.790 13.474 16 HA GLU 13 HA GLU 13 15.360 -13.751 12.039 17 1HB GLU 13 1HB GLU 13 14.306 -12.437 13.822 18 2HB GLU 13 2HB GLU 13 14.330 -11.011 12.795 19 1HG GLU 13 1HG GLU 13 12.725 -11.915 11.328 20 2HG GLU 13 2HG GLU 13 12.889 -13.526 12.023 21 H VAL 14 H VAL 14 15.847 -10.348 11.106 22 HA VAL 14 HA VAL 14 14.630 -10.558 8.574 23 HB VAL 14 HB VAL 14 16.824 -8.628 9.331 24 1HG1 VAL 14 1HG1 VAL 14 15.367 -7.173 7.758 25 2HG1 VAL 14 2HG1 VAL 14 16.461 -8.367 7.056 26 3HG1 VAL 14 3HG1 VAL 14 14.737 -8.718 7.188 27 1HG2 VAL 14 1HG2 VAL 14 14.919 -7.117 9.967 28 2HG2 VAL 14 2HG2 VAL 14 13.867 -8.532 9.900 29 3HG2 VAL 14 3HG2 VAL 14 15.195 -8.474 11.059 30 H GLU 15 H GLU 15 17.902 -11.160 9.688 31 HA GLU 15 HA GLU 15 19.105 -11.319 7.122 32 1HB GLU 15 1HB GLU 15 19.911 -12.356 9.834 33 2HB GLU 15 2HB GLU 15 20.892 -12.622 8.401 34 1HG GLU 15 1HG GLU 15 21.149 -10.238 8.092 35 2HG GLU 15 2HG GLU 15 20.087 -9.924 9.463 36 H GLU 16 H GLU 16 17.635 -13.698 9.277 37 HA GLU 16 HA GLU 16 18.358 -16.003 7.840 38 1HB GLU 16 1HB GLU 16 16.997 -15.486 10.178 39 2HB GLU 16 2HB GLU 16 15.737 -16.136 9.138 40 1HG GLU 16 1HG GLU 16 18.324 -17.583 9.270 41 2HG GLU 16 2HG GLU 16 17.237 -17.686 10.654 42 H THR 17 H THR 17 15.735 -13.717 7.451 43 HA THR 17 HA THR 17 14.328 -15.324 5.518 44 HB THR 17 HB THR 17 13.977 -12.419 6.282 45 HG1 THR 17 HG1 THR 17 13.486 -14.316 7.789 46 1HG2 THR 17 1HG2 THR 17 12.233 -14.225 4.601 47 2HG2 THR 17 2HG2 THR 17 13.130 -12.815 4.037 48 3HG2 THR 17 3HG2 THR 17 11.787 -12.614 5.162 49 H LEU 18 H LEU 18 16.826 -12.928 5.476 50 HA LEU 18 HA LEU 18 16.515 -12.186 2.728 51 1HB LEU 18 1HB LEU 18 18.189 -11.454 4.955 52 2HB LEU 18 2HB LEU 18 19.156 -11.676 3.498 53 HG LEU 18 HG LEU 18 17.330 -10.108 2.436 54 1HD1 LEU 18 1HD1 LEU 18 16.686 -8.371 4.151 55 2HD1 LEU 18 2HD1 LEU 18 17.123 -9.554 5.384 56 3HD1 LEU 18 3HD1 LEU 18 15.824 -9.907 4.245 57 1HD2 LEU 18 1HD2 LEU 18 18.791 -8.282 2.738 58 2HD2 LEU 18 2HD2 LEU 18 19.810 -9.721 2.788 59 3HD2 LEU 18 3HD2 LEU 18 19.369 -8.899 4.285 60 H LYS 19 H LYS 19 18.345 -14.595 4.490 61 HA LYS 19 HA LYS 19 20.118 -15.330 2.419 62 1HB LYS 19 1HB LYS 19 19.108 -16.730 4.880 63 2HB LYS 19 2HB LYS 19 20.167 -17.552 3.742 64 1HG LYS 19 1HG LYS 19 21.044 -14.890 4.673 65 2HG LYS 19 2HG LYS 19 21.061 -16.196 5.860 66 1HD LYS 19 1HD LYS 19 22.286 -16.528 3.139 67 2HD LYS 19 2HD LYS 19 23.185 -15.803 4.474 68 1HE LYS 19 1HE LYS 19 23.333 -17.767 5.619 69 2HE LYS 19 2HE LYS 19 21.800 -18.374 4.994 70 1HZ LYS 19 1HZ LYS 19 22.781 -19.213 3.140 71 2HZ LYS 19 2HZ LYS 19 24.090 -19.352 4.202 72 3HZ LYS 19 3HZ LYS 19 24.018 -18.060 3.112 73 H ARG 20 H ARG 20 17.037 -16.768 3.481 74 HA ARG 20 HA ARG 20 16.942 -18.736 1.460 75 1HB ARG 20 1HB ARG 20 14.706 -19.147 2.163 76 2HB ARG 20 2HB ARG 20 15.616 -18.720 3.605 77 1HG ARG 20 1HG ARG 20 14.736 -16.399 3.390 78 2HG ARG 20 2HG ARG 20 13.710 -16.970 2.072 79 1HD ARG 20 1HD ARG 20 12.734 -18.638 3.637 80 2HD ARG 20 2HD ARG 20 13.675 -17.908 4.937 81 HE ARG 20 HE ARG 20 12.019 -16.035 3.520 82 1HH1 ARG 20 1HH1 ARG 20 12.140 -18.363 6.106 83 2HH1 ARG 20 2HH1 ARG 20 10.825 -17.652 6.982 84 1HH2 ARG 20 1HH2 ARG 20 10.286 -15.090 4.664 85 2HH2 ARG 20 2HH2 ARG 20 9.771 -15.791 6.161 86 H LEU 21 H LEU 21 15.865 -15.404 1.601 87 HA LEU 21 HA LEU 21 14.287 -15.477 -0.765 88 1HB LEU 21 1HB LEU 21 15.235 -13.465 1.134 89 2HB LEU 21 2HB LEU 21 15.083 -12.869 -0.518 90 HG LEU 21 HG LEU 21 12.742 -13.410 -0.557 91 1HD1 LEU 21 1HD1 LEU 21 12.176 -15.244 0.602 92 2HD1 LEU 21 2HD1 LEU 21 11.937 -14.118 1.937 93 3HD1 LEU 21 3HD1 LEU 21 13.452 -15.009 1.796 94 1HD2 LEU 21 1HD2 LEU 21 12.097 -12.113 1.670 95 2HD2 LEU 21 2HD2 LEU 21 12.840 -11.302 0.292 96 3HD2 LEU 21 3HD2 LEU 21 13.829 -11.782 1.671 97 H GLN 22 H GLN 22 17.609 -14.423 -0.083 98 HA GLN 22 HA GLN 22 18.312 -13.463 -2.575 99 1HB GLN 22 1HB GLN 22 19.660 -14.199 -0.184 100 2HB GLN 22 2HB GLN 22 20.528 -14.929 -1.527 101 1HG GLN 22 1HG GLN 22 21.544 -12.983 -1.799 102 2HG GLN 22 2HG GLN 22 20.006 -12.345 -2.377 103 1HE2 GLN 22 1HE2 GLN 22 18.598 -11.343 -0.817 104 2HE2 GLN 22 2HE2 GLN 22 19.272 -10.567 0.572 105 H SER 23 H SER 23 17.866 -16.746 -1.528 106 HA SER 23 HA SER 23 19.207 -17.931 -3.777 107 1HB SER 23 1HB SER 23 18.772 -18.952 -1.419 108 2HB SER 23 2HB SER 23 17.194 -19.379 -2.080 109 HG SER 23 HG SER 23 18.131 -20.974 -3.051 110 H GLN 24 H GLN 24 15.878 -17.181 -2.893 111 HA GLN 24 HA GLN 24 14.504 -18.539 -4.869 112 1HB GLN 24 1HB GLN 24 13.915 -15.828 -3.671 113 2HB GLN 24 2HB GLN 24 12.779 -16.744 -4.652 114 1HG GLN 24 1HG GLN 24 12.815 -18.550 -3.004 115 2HG GLN 24 2HG GLN 24 13.941 -17.619 -2.017 116 1HE2 GLN 24 1HE2 GLN 24 12.924 -15.122 -2.115 117 2HE2 GLN 24 2HE2 GLN 24 11.352 -15.080 -1.398 118 H LYS 25 H LYS 25 13.727 -17.962 -6.929 119 HA LYS 25 HA LYS 25 15.554 -16.221 -8.402 120 1HB LYS 25 1HB LYS 25 14.787 -18.677 -9.029 121 2HB LYS 25 2HB LYS 25 13.423 -17.827 -9.744 122 1HG LYS 25 1HG LYS 25 15.628 -16.422 -10.646 123 2HG LYS 25 2HG LYS 25 16.141 -18.110 -10.698 124 1HD LYS 25 1HD LYS 25 14.472 -18.701 -12.200 125 2HD LYS 25 2HD LYS 25 13.471 -17.307 -11.789 126 1HE LYS 25 1HE LYS 25 14.473 -17.053 -13.999 127 2HE LYS 25 2HE LYS 25 15.074 -15.827 -12.884 128 1HZ LYS 25 1HZ LYS 25 17.118 -16.486 -13.354 129 2HZ LYS 25 2HZ LYS 25 16.539 -17.712 -14.365 130 3HZ LYS 25 3HZ LYS 25 16.784 -18.018 -12.719 131 H GLY 26 H GLY 26 14.762 -14.179 -7.848 132 1HA GLY 26 1HA GLY 26 13.107 -12.840 -9.471 133 2HA GLY 26 2HA GLY 26 11.967 -13.556 -8.341 134 H VAL 27 H VAL 27 14.212 -13.308 -6.254 135 HA VAL 27 HA VAL 27 13.313 -10.829 -5.168 136 HB VAL 27 HB VAL 27 15.568 -12.631 -4.275 137 1HG1 VAL 27 1HG1 VAL 27 16.137 -10.985 -2.893 138 2HG1 VAL 27 2HG1 VAL 27 14.758 -10.007 -3.398 139 3HG1 VAL 27 3HG1 VAL 27 14.574 -11.189 -2.102 140 1HG2 VAL 27 1HG2 VAL 27 13.920 -13.334 -2.544 141 2HG2 VAL 27 2HG2 VAL 27 12.687 -12.417 -3.409 142 3HG2 VAL 27 3HG2 VAL 27 13.470 -13.792 -4.187 143 H GLN 28 H GLN 28 13.936 -8.958 -6.045 144 HA GLN 28 HA GLN 28 16.418 -8.609 -7.403 145 1HB GLN 28 1HB GLN 28 13.989 -7.115 -7.014 146 2HB GLN 28 2HB GLN 28 15.380 -6.075 -6.738 147 1HG GLN 28 1HG GLN 28 16.202 -6.415 -8.909 148 2HG GLN 28 2HG GLN 28 15.142 -7.797 -9.181 149 1HE2 GLN 28 1HE2 GLN 28 13.106 -7.473 -9.913 150 2HE2 GLN 28 2HE2 GLN 28 12.461 -5.924 -10.325 151 H GLY 29 H GLY 29 15.284 -8.037 -4.151 152 1HA GLY 29 1HA GLY 29 17.669 -8.072 -2.860 153 2HA GLY 29 2HA GLY 29 17.546 -6.407 -3.408 154 H ILE 30 H ILE 30 17.612 -7.397 -0.684 155 HA ILE 30 HA ILE 30 14.972 -6.445 0.218 156 HB ILE 30 HB ILE 30 16.734 -8.307 1.801 157 1HG1 ILE 30 1HG1 ILE 30 14.682 -9.887 1.056 158 2HG1 ILE 30 2HG1 ILE 30 14.800 -8.873 -0.377 159 1HG2 ILE 30 1HG2 ILE 30 13.827 -7.540 2.039 160 2HG2 ILE 30 2HG2 ILE 30 14.657 -8.723 3.050 161 3HG2 ILE 30 3HG2 ILE 30 15.138 -7.027 3.102 162 1HD1 ILE 30 1HD1 ILE 30 16.300 -11.135 0.222 163 2HD1 ILE 30 2HD1 ILE 30 16.570 -9.989 -1.092 164 3HD1 ILE 30 3HD1 ILE 30 17.402 -9.776 0.449 165 H ILE 31 H ILE 31 14.961 -4.704 1.492 166 HA ILE 31 HA ILE 31 17.542 -3.760 2.551 167 HB ILE 31 HB ILE 31 15.080 -2.150 1.864 168 1HG1 ILE 31 1HG1 ILE 31 17.648 -1.628 0.508 169 2HG1 ILE 31 2HG1 ILE 31 16.907 -3.177 0.120 170 1HG2 ILE 31 1HG2 ILE 31 16.159 -1.099 3.698 171 2HG2 ILE 31 2HG2 ILE 31 17.753 -1.349 2.989 172 3HG2 ILE 31 3HG2 ILE 31 16.630 -0.207 2.251 173 1HD1 ILE 31 1HD1 ILE 31 16.330 -1.281 -1.408 174 2HD1 ILE 31 2HD1 ILE 31 14.953 -2.130 -0.706 175 3HD1 ILE 31 3HD1 ILE 31 15.443 -0.562 -0.064 176 H VAL 32 H VAL 32 17.698 -3.056 4.661 177 HA VAL 32 HA VAL 32 15.325 -3.410 6.364 178 HB VAL 32 HB VAL 32 18.067 -4.233 7.286 179 1HG1 VAL 32 1HG1 VAL 32 16.198 -3.749 8.908 180 2HG1 VAL 32 2HG1 VAL 32 15.358 -5.145 8.230 181 3HG1 VAL 32 3HG1 VAL 32 16.917 -5.355 9.029 182 1HG2 VAL 32 1HG2 VAL 32 17.607 -5.601 5.351 183 2HG2 VAL 32 2HG2 VAL 32 17.403 -6.571 6.810 184 3HG2 VAL 32 3HG2 VAL 32 15.989 -5.964 5.950 185 H VAL 33 H VAL 33 14.889 -1.429 7.091 186 HA VAL 33 HA VAL 33 17.128 0.283 7.946 187 HB VAL 33 HB VAL 33 14.327 1.236 7.380 188 1HG1 VAL 33 1HG1 VAL 33 16.955 2.499 7.955 189 2HG1 VAL 33 2HG1 VAL 33 15.851 3.332 6.859 190 3HG1 VAL 33 3HG1 VAL 33 15.340 2.947 8.503 191 1HG2 VAL 33 1HG2 VAL 33 14.904 0.370 5.300 192 2HG2 VAL 33 2HG2 VAL 33 15.422 2.052 5.189 193 3HG2 VAL 33 3HG2 VAL 33 16.608 0.783 5.490 194 H ASN 34 H ASN 34 17.182 1.113 9.983 195 HA ASN 34 HA ASN 34 15.395 -0.106 11.922 196 1HB ASN 34 1HB ASN 34 16.946 0.978 13.587 197 2HB ASN 34 2HB ASN 34 17.718 -0.170 12.498 198 1HD2 ASN 34 1HD2 ASN 34 19.692 0.904 13.065 199 2HD2 ASN 34 2HD2 ASN 34 20.133 2.373 12.269 200 H THR 35 H THR 35 15.130 1.599 13.928 201 HA THR 35 HA THR 35 13.057 3.308 13.145 202 HB THR 35 HB THR 35 14.092 4.306 15.582 203 HG1 THR 35 HG1 THR 35 14.276 2.277 16.727 204 1HG2 THR 35 1HG2 THR 35 12.081 3.433 16.508 205 2HG2 THR 35 2HG2 THR 35 11.951 2.212 15.242 206 3HG2 THR 35 3HG2 THR 35 11.706 3.915 14.854 207 H GLU 36 H GLU 36 16.471 3.953 13.799 208 HA GLU 36 HA GLU 36 16.369 6.752 13.692 209 1HB GLU 36 1HB GLU 36 18.481 4.688 13.413 210 2HB GLU 36 2HB GLU 36 18.850 6.280 12.765 211 1HG GLU 36 1HG GLU 36 17.848 6.940 15.189 212 2HG GLU 36 2HG GLU 36 18.592 5.382 15.545 213 H GLY 37 H GLY 37 16.968 4.360 11.133 214 1HA GLY 37 1HA GLY 37 15.780 4.999 8.993 215 2HA GLY 37 2HA GLY 37 16.630 6.528 9.156 216 H ILE 38 H ILE 38 18.664 4.202 10.292 217 HA ILE 38 HA ILE 38 20.227 4.261 7.845 218 HB ILE 38 HB ILE 38 20.929 3.036 10.515 219 1HG1 ILE 38 1HG1 ILE 38 21.755 5.716 9.382 220 2HG1 ILE 38 2HG1 ILE 38 20.499 5.498 10.595 221 1HG2 ILE 38 1HG2 ILE 38 23.212 3.059 9.709 222 2HG2 ILE 38 2HG2 ILE 38 22.191 2.148 8.596 223 3HG2 ILE 38 3HG2 ILE 38 22.694 3.789 8.189 224 1HD1 ILE 38 1HD1 ILE 38 22.601 4.179 11.718 225 2HD1 ILE 38 2HD1 ILE 38 23.399 5.507 10.875 226 3HD1 ILE 38 3HD1 ILE 38 22.139 5.846 12.060 227 HA PRO 39 HA PRO 39 18.873 0.260 6.527 228 1HB PRO 39 1HB PRO 39 20.774 -0.137 4.630 229 2HB PRO 39 2HB PRO 39 19.406 0.959 4.404 230 1HG PRO 39 1HG PRO 39 22.229 1.587 5.179 231 2HG PRO 39 2HG PRO 39 21.170 2.429 4.034 232 1HD PRO 39 1HD PRO 39 21.595 3.324 6.554 233 2HD PRO 39 2HD PRO 39 20.054 3.561 5.703 234 H ILE 40 H ILE 40 19.519 -0.639 8.649 235 HA ILE 40 HA ILE 40 22.023 -1.487 9.396 236 HB ILE 40 HB ILE 40 20.786 -3.449 10.510 237 1HG1 ILE 40 1HG1 ILE 40 18.376 -1.852 9.629 238 2HG1 ILE 40 2HG1 ILE 40 18.879 -3.354 8.862 239 1HG2 ILE 40 1HG2 ILE 40 21.078 -0.762 11.159 240 2HG2 ILE 40 2HG2 ILE 40 19.395 -1.133 11.533 241 3HG2 ILE 40 3HG2 ILE 40 20.690 -2.082 12.262 242 1HD1 ILE 40 1HD1 ILE 40 18.535 -3.438 11.786 243 2HD1 ILE 40 2HD1 ILE 40 17.072 -3.232 10.822 244 3HD1 ILE 40 3HD1 ILE 40 18.117 -4.627 10.554 245 H LYS 41 H LYS 41 19.793 -3.006 7.133 246 HA LYS 41 HA LYS 41 21.981 -4.751 6.250 247 1HB LYS 41 1HB LYS 41 19.519 -5.590 7.498 248 2HB LYS 41 2HB LYS 41 19.610 -6.211 5.855 249 1HG LYS 41 1HG LYS 41 22.124 -6.548 7.224 250 2HG LYS 41 2HG LYS 41 20.798 -7.281 8.130 251 1HD LYS 41 1HD LYS 41 21.752 -8.896 6.591 252 2HD LYS 41 2HD LYS 41 20.107 -8.490 6.099 253 1HE LYS 41 1HE LYS 41 20.816 -7.287 4.258 254 2HE LYS 41 2HE LYS 41 22.411 -6.981 4.943 255 1HZ LYS 41 1HZ LYS 41 21.979 -8.776 3.054 256 2HZ LYS 41 2HZ LYS 41 21.733 -9.762 4.406 257 3HZ LYS 41 3HZ LYS 41 23.203 -8.948 4.210 258 H SER 42 H SER 42 22.001 -5.237 4.058 259 HA SER 42 HA SER 42 19.873 -4.550 2.294 260 1HB SER 42 1HB SER 42 20.497 -2.281 2.584 261 2HB SER 42 2HB SER 42 22.218 -2.666 2.528 262 HG SER 42 HG SER 42 20.385 -2.891 0.370 263 H THR 43 H THR 43 20.197 -5.333 0.221 264 HA THR 43 HA THR 43 22.752 -6.732 -0.234 265 HB THR 43 HB THR 43 21.633 -8.568 -1.245 266 HG1 THR 43 HG1 THR 43 19.431 -6.817 -1.247 267 1HG2 THR 43 1HG2 THR 43 21.051 -9.482 0.707 268 2HG2 THR 43 2HG2 THR 43 19.640 -8.433 0.846 269 3HG2 THR 43 3HG2 THR 43 21.212 -7.880 1.424 270 H MET 44 H MET 44 20.717 -4.332 -1.297 271 HA MET 44 HA MET 44 21.205 -4.692 -4.135 272 1HB MET 44 1HB MET 44 19.254 -3.370 -2.619 273 2HB MET 44 2HB MET 44 20.162 -2.092 -3.415 274 1HG MET 44 1HG MET 44 19.698 -2.995 -5.566 275 2HG MET 44 2HG MET 44 19.009 -4.457 -4.865 276 1HE MET 44 1HE MET 44 15.914 -4.131 -3.803 277 2HE MET 44 2HE MET 44 17.432 -4.141 -2.905 278 3HE MET 44 3HE MET 44 16.291 -2.813 -2.694 279 H ASP 45 H ASP 45 21.611 -2.137 -5.024 280 HA ASP 45 HA ASP 45 24.409 -1.823 -4.631 281 1HB ASP 45 1HB ASP 45 22.582 -1.048 -6.565 282 2HB ASP 45 2HB ASP 45 23.071 0.477 -5.831 283 H ASN 46 H ASN 46 25.408 0.309 -4.068 284 HA ASN 46 HA ASN 46 24.661 1.056 -1.448 285 1HB ASN 46 1HB ASN 46 26.893 1.415 -3.112 286 2HB ASN 46 2HB ASN 46 26.332 3.040 -2.728 287 1HD2 ASN 46 1HD2 ASN 46 25.331 2.630 -0.186 288 2HD2 ASN 46 2HD2 ASN 46 26.637 2.251 0.880 289 HA PRO 47 HA PRO 47 23.197 5.214 -3.438 290 1HB PRO 47 1HB PRO 47 22.940 5.269 -6.140 291 2HB PRO 47 2HB PRO 47 24.438 5.704 -5.308 292 1HG PRO 47 1HG PRO 47 23.689 3.129 -6.640 293 2HG PRO 47 2HG PRO 47 25.223 4.017 -6.702 294 1HD PRO 47 1HD PRO 47 24.853 1.859 -5.110 295 2HD PRO 47 2HD PRO 47 25.922 3.203 -4.662 296 H THR 48 H THR 48 22.223 2.144 -4.789 297 HA THR 48 HA THR 48 19.556 2.973 -5.457 298 HB THR 48 HB THR 48 20.748 0.207 -5.186 299 HG1 THR 48 HG1 THR 48 21.548 1.555 -6.920 300 1HG2 THR 48 1HG2 THR 48 18.344 0.104 -4.857 301 2HG2 THR 48 2HG2 THR 48 18.757 -0.539 -6.447 302 3HG2 THR 48 3HG2 THR 48 18.080 1.082 -6.299 303 H THR 49 H THR 49 21.123 1.416 -2.724 304 HA THR 49 HA THR 49 18.654 0.803 -1.381 305 HB THR 49 HB THR 49 21.517 0.750 -0.417 306 HG1 THR 49 HG1 THR 49 21.444 -1.097 -1.437 307 1HG2 THR 49 1HG2 THR 49 19.045 0.646 1.074 308 2HG2 THR 49 2HG2 THR 49 20.708 0.667 1.661 309 3HG2 THR 49 3HG2 THR 49 19.944 -0.863 1.233 310 H THR 50 H THR 50 21.227 3.217 -0.999 311 HA THR 50 HA THR 50 20.311 4.491 1.287 312 HB THR 50 HB THR 50 21.637 5.829 -1.079 313 HG1 THR 50 HG1 THR 50 22.605 3.873 0.209 314 1HG2 THR 50 1HG2 THR 50 21.685 7.692 0.143 315 2HG2 THR 50 2HG2 THR 50 22.395 6.826 1.506 316 3HG2 THR 50 3HG2 THR 50 20.642 6.899 1.323 317 H GLN 51 H GLN 51 19.233 4.793 -2.037 318 HA GLN 51 HA GLN 51 17.621 7.109 -1.606 319 1HB GLN 51 1HB GLN 51 18.384 6.643 -3.834 320 2HB GLN 51 2HB GLN 51 17.658 5.042 -3.806 321 1HG GLN 51 1HG GLN 51 15.702 7.110 -3.300 322 2HG GLN 51 2HG GLN 51 16.543 7.358 -4.830 323 1HE2 GLN 51 1HE2 GLN 51 14.438 5.282 -3.014 324 2HE2 GLN 51 2HE2 GLN 51 13.930 4.296 -4.339 325 H TYR 52 H TYR 52 16.928 3.634 -1.849 326 HA TYR 52 HA TYR 52 14.146 3.817 -1.524 327 1HB TYR 52 1HB TYR 52 16.179 1.663 -1.245 328 2HB TYR 52 2HB TYR 52 14.602 1.386 -0.513 329 HD1 TYR 52 HD1 TYR 52 15.972 2.695 -3.742 330 HD2 TYR 52 HD2 TYR 52 13.069 0.260 -1.807 331 HE1 TYR 52 HE1 TYR 52 15.080 2.027 -5.934 332 HE2 TYR 52 HE2 TYR 52 12.169 -0.416 -3.994 333 HH TYR 52 HH TYR 52 13.745 0.502 -6.992 334 H ALA 53 H ALA 53 16.673 3.085 0.880 335 HA ALA 53 HA ALA 53 14.967 2.976 3.107 336 1HB ALA 53 1HB ALA 53 17.220 3.646 4.306 337 2HB ALA 53 2HB ALA 53 17.001 2.053 3.581 338 3HB ALA 53 3HB ALA 53 17.895 3.301 2.714 339 H SER 54 H SER 54 16.111 5.634 1.278 340 HA SER 54 HA SER 54 15.902 7.603 3.356 341 1HB SER 54 1HB SER 54 16.633 7.549 0.518 342 2HB SER 54 2HB SER 54 15.745 8.999 0.985 343 HG SER 54 HG SER 54 17.853 8.112 2.605 344 H LEU 55 H LEU 55 14.019 7.070 0.370 345 HA LEU 55 HA LEU 55 11.882 8.750 1.224 346 1HB LEU 55 1HB LEU 55 10.982 8.405 -0.832 347 2HB LEU 55 2HB LEU 55 12.653 7.956 -1.169 348 HG LEU 55 HG LEU 55 11.719 5.543 -0.547 349 1HD1 LEU 55 1HD1 LEU 55 9.338 6.331 -2.035 350 2HD1 LEU 55 2HD1 LEU 55 9.396 6.986 -0.399 351 3HD1 LEU 55 3HD1 LEU 55 9.509 5.245 -0.656 352 1HD2 LEU 55 1HD2 LEU 55 11.987 5.081 -2.744 353 2HD2 LEU 55 2HD2 LEU 55 12.620 6.727 -2.777 354 3HD2 LEU 55 3HD2 LEU 55 10.954 6.413 -3.265 355 H MET 56 H MET 56 12.731 5.519 1.875 356 HA MET 56 HA MET 56 10.243 4.289 2.181 357 1HB MET 56 1HB MET 56 12.988 3.808 3.101 358 2HB MET 56 2HB MET 56 11.754 3.164 4.176 359 1HG MET 56 1HG MET 56 11.927 2.593 1.227 360 2HG MET 56 2HG MET 56 12.547 1.542 2.498 361 1HE MET 56 1HE MET 56 10.033 2.780 0.399 362 2HE MET 56 2HE MET 56 9.052 1.318 0.312 363 3HE MET 56 3HE MET 56 8.481 2.710 1.234 364 H HIS 57 H HIS 57 12.263 5.700 4.766 365 HA HIS 57 HA HIS 57 10.385 5.553 6.803 366 1HB HIS 57 1HB HIS 57 12.914 6.264 6.809 367 2HB HIS 57 2HB HIS 57 12.254 7.890 6.664 368 HD1 HIS 57 HD1 HIS 57 13.417 8.173 9.082 369 HD2 HIS 57 HD2 HIS 57 10.082 5.700 8.909 370 HE1 HIS 57 HE1 HIS 57 12.637 7.927 11.461 371 H SER 58 H SER 58 10.744 7.910 4.243 372 HA SER 58 HA SER 58 8.903 9.797 5.376 373 1HB SER 58 1HB SER 58 10.725 10.445 3.798 374 2HB SER 58 2HB SER 58 9.872 9.588 2.515 375 HG SER 58 HG SER 58 8.783 11.354 2.259 376 H PHE 59 H PHE 59 8.666 6.969 3.417 377 HA PHE 59 HA PHE 59 6.100 7.560 2.289 378 1HB PHE 59 1HB PHE 59 7.562 6.025 1.127 379 2HB PHE 59 2HB PHE 59 7.641 4.971 2.535 380 HD1 PHE 59 HD1 PHE 59 6.646 2.971 1.990 381 HD2 PHE 59 HD2 PHE 59 4.765 6.605 0.818 382 HE1 PHE 59 HE1 PHE 59 4.718 1.697 1.144 383 HE2 PHE 59 HE2 PHE 59 2.835 5.337 -0.029 384 HZ PHE 59 HZ PHE 59 2.809 2.880 0.134 385 H ILE 60 H ILE 60 7.171 5.222 4.762 386 HA ILE 60 HA ILE 60 4.656 4.362 5.570 387 HB ILE 60 HB ILE 60 7.132 4.640 7.278 388 1HG1 ILE 60 1HG1 ILE 60 7.521 3.285 5.278 389 2HG1 ILE 60 2HG1 ILE 60 7.503 2.270 6.715 390 1HG2 ILE 60 1HG2 ILE 60 5.923 3.880 8.974 391 2HG2 ILE 60 2HG2 ILE 60 4.483 3.879 7.958 392 3HG2 ILE 60 3HG2 ILE 60 5.506 2.446 8.037 393 1HD1 ILE 60 1HD1 ILE 60 5.929 2.069 4.355 394 2HD1 ILE 60 2HD1 ILE 60 5.989 0.989 5.749 395 3HD1 ILE 60 3HD1 ILE 60 4.866 2.349 5.734 396 H LEU 61 H LEU 61 6.678 6.879 7.090 397 HA LEU 61 HA LEU 61 4.928 7.697 9.059 398 1HB LEU 61 1HB LEU 61 7.192 8.888 7.620 399 2HB LEU 61 2HB LEU 61 6.080 10.054 8.335 400 HG LEU 61 HG LEU 61 6.467 9.155 10.532 401 1HD1 LEU 61 1HD1 LEU 61 6.689 6.855 10.269 402 2HD1 LEU 61 2HD1 LEU 61 8.309 7.373 10.732 403 3HD1 LEU 61 3HD1 LEU 61 7.947 7.018 9.044 404 1HD2 LEU 61 1HD2 LEU 61 8.894 9.596 10.756 405 2HD2 LEU 61 2HD2 LEU 61 8.049 10.818 9.805 406 3HD2 LEU 61 3HD2 LEU 61 9.026 9.590 8.997 407 H LYS 62 H LYS 62 4.858 8.363 5.639 408 HA LYS 62 HA LYS 62 3.013 10.526 5.740 409 1HB LYS 62 1HB LYS 62 4.473 9.120 3.743 410 2HB LYS 62 2HB LYS 62 2.778 9.104 3.275 411 1HG LYS 62 1HG LYS 62 3.975 11.012 2.330 412 2HG LYS 62 2HG LYS 62 2.685 11.521 3.421 413 1HD LYS 62 1HD LYS 62 4.129 12.583 4.746 414 2HD LYS 62 2HD LYS 62 5.175 11.165 4.842 415 1HE LYS 62 1HE LYS 62 6.632 12.515 3.770 416 2HE LYS 62 2HE LYS 62 5.738 11.988 2.345 417 1HZ LYS 62 1HZ LYS 62 5.168 14.078 1.972 418 2HZ LYS 62 2HZ LYS 62 6.033 14.584 3.334 419 3HZ LYS 62 3HZ LYS 62 4.398 14.172 3.476 420 H ALA 63 H ALA 63 2.614 7.081 4.917 421 HA ALA 63 HA ALA 63 -0.199 7.190 4.680 422 1HB ALA 63 1HB ALA 63 0.822 5.376 3.623 423 2HB ALA 63 2HB ALA 63 1.751 4.943 5.059 424 3HB ALA 63 3HB ALA 63 0.011 4.658 5.015 425 H ARG 64 H ARG 64 1.955 6.599 7.390 426 HA ARG 64 HA ARG 64 0.120 5.554 9.217 427 1HB ARG 64 1HB ARG 64 2.723 5.921 9.354 428 2HB ARG 64 2HB ARG 64 2.262 7.429 10.132 429 1HG ARG 64 1HG ARG 64 0.718 5.577 11.442 430 2HG ARG 64 2HG ARG 64 2.228 4.708 11.157 431 1HD ARG 64 1HD ARG 64 2.113 7.474 12.338 432 2HD ARG 64 2HD ARG 64 2.089 6.008 13.317 433 HE ARG 64 HE ARG 64 4.283 5.691 11.758 434 1HH1 ARG 64 1HH1 ARG 64 3.169 8.231 13.862 435 2HH1 ARG 64 2HH1 ARG 64 4.764 8.756 14.288 436 1HH2 ARG 64 1HH2 ARG 64 6.388 6.373 12.311 437 2HH2 ARG 64 2HH2 ARG 64 6.594 7.699 13.405 438 H SER 65 H SER 65 1.019 8.925 8.561 439 HA SER 65 HA SER 65 -0.655 10.069 10.527 440 1HB SER 65 1HB SER 65 1.298 11.053 8.949 441 2HB SER 65 2HB SER 65 -0.114 11.639 8.070 442 HG SER 65 HG SER 65 0.405 13.171 9.588 443 H THR 66 H THR 66 -1.273 8.798 7.387 444 HA THR 66 HA THR 66 -3.765 10.202 7.005 445 HB THR 66 HB THR 66 -3.387 7.775 5.411 446 HG1 THR 66 HG1 THR 66 -1.543 9.831 4.858 447 1HG2 THR 66 1HG2 THR 66 -4.939 9.746 4.990 448 2HG2 THR 66 2HG2 THR 66 -3.977 9.197 3.617 449 3HG2 THR 66 3HG2 THR 66 -3.501 10.644 4.506 450 H VAL 67 H VAL 67 -2.729 6.996 8.051 451 HA VAL 67 HA VAL 67 -5.148 5.653 8.061 452 HB VAL 67 HB VAL 67 -3.020 5.392 10.188 453 1HG1 VAL 67 1HG1 VAL 67 -3.926 2.906 9.793 454 2HG1 VAL 67 2HG1 VAL 67 -4.633 4.008 10.977 455 3HG1 VAL 67 3HG1 VAL 67 -5.388 3.808 9.395 456 1HG2 VAL 67 1HG2 VAL 67 -2.762 3.401 8.197 457 2HG2 VAL 67 2HG2 VAL 67 -2.836 4.960 7.375 458 3HG2 VAL 67 3HG2 VAL 67 -1.619 4.677 8.620 459 H ARG 68 H ARG 68 -3.717 7.540 10.727 460 HA ARG 68 HA ARG 68 -5.758 7.249 12.576 461 1HB ARG 68 1HB ARG 68 -4.951 9.393 13.543 462 2HB ARG 68 2HB ARG 68 -3.657 8.253 13.199 463 1HG ARG 68 1HG ARG 68 -3.090 9.466 11.177 464 2HG ARG 68 2HG ARG 68 -4.428 10.583 11.454 465 1HD ARG 68 1HD ARG 68 -2.347 11.588 12.175 466 2HD ARG 68 2HD ARG 68 -3.382 11.278 13.569 467 HE ARG 68 HE ARG 68 -1.676 9.085 13.216 468 1HH1 ARG 68 1HH1 ARG 68 -1.544 12.443 14.123 469 2HH1 ARG 68 2HH1 ARG 68 -0.148 12.251 15.130 470 1HH2 ARG 68 1HH2 ARG 68 0.162 8.819 14.540 471 2HH2 ARG 68 2HH2 ARG 68 0.822 10.189 15.366 472 H ASP 69 H ASP 69 -5.619 9.219 9.719 473 HA ASP 69 HA ASP 69 -7.750 10.982 10.393 474 1HB ASP 69 1HB ASP 69 -5.920 10.677 8.252 475 2HB ASP 69 2HB ASP 69 -7.537 10.624 7.555 476 H ILE 70 H ILE 70 -7.550 7.878 8.746 477 HA ILE 70 HA ILE 70 -10.131 7.757 7.693 478 HB ILE 70 HB ILE 70 -8.489 5.461 8.769 479 1HG1 ILE 70 1HG1 ILE 70 -8.682 6.393 5.907 480 2HG1 ILE 70 2HG1 ILE 70 -7.433 6.976 7.001 481 1HG2 ILE 70 1HG2 ILE 70 -10.030 4.647 6.583 482 2HG2 ILE 70 2HG2 ILE 70 -10.251 4.204 8.274 483 3HG2 ILE 70 3HG2 ILE 70 -11.115 5.588 7.606 484 1HD1 ILE 70 1HD1 ILE 70 -7.569 4.524 5.511 485 2HD1 ILE 70 2HD1 ILE 70 -6.213 5.239 6.383 486 3HD1 ILE 70 3HD1 ILE 70 -7.360 4.204 7.233 487 H ASP 71 H ASP 71 -8.978 7.312 10.947 488 HA ASP 71 HA ASP 71 -11.492 7.638 12.120 489 1HB ASP 71 1HB ASP 71 -10.843 4.893 11.341 490 2HB ASP 71 2HB ASP 71 -11.234 5.054 13.051 491 HA PRO 72 HA PRO 72 -9.023 8.224 15.696 492 1HB PRO 72 1HB PRO 72 -10.703 7.496 17.700 493 2HB PRO 72 2HB PRO 72 -10.911 8.980 16.763 494 1HG PRO 72 1HG PRO 72 -12.295 6.343 16.466 495 2HG PRO 72 2HG PRO 72 -12.978 7.978 16.400 496 1HD PRO 72 1HD PRO 72 -12.433 6.536 14.174 497 2HD PRO 72 2HD PRO 72 -12.306 8.306 14.219 498 H GLN 73 H GLN 73 -10.059 5.121 14.814 499 HA GLN 73 HA GLN 73 -8.147 3.916 16.700 500 1HB GLN 73 1HB GLN 73 -10.682 2.581 15.747 501 2HB GLN 73 2HB GLN 73 -9.553 1.983 16.956 502 1HG GLN 73 1HG GLN 73 -10.143 3.872 18.412 503 2HG GLN 73 2HG GLN 73 -11.315 4.410 17.210 504 1HE2 GLN 73 1HE2 GLN 73 -13.201 4.101 18.211 505 2HE2 GLN 73 2HE2 GLN 73 -13.752 2.593 18.847 506 H ASN 74 H ASN 74 -8.112 1.358 15.771 507 HA ASN 74 HA ASN 74 -7.198 0.006 14.186 508 1HB ASN 74 1HB ASN 74 -9.262 0.980 12.922 509 2HB ASN 74 2HB ASN 74 -8.061 1.908 12.030 510 1HD2 ASN 74 1HD2 ASN 74 -9.457 0.365 10.502 511 2HD2 ASN 74 2HD2 ASN 74 -8.619 -1.077 10.050 512 H ASP 75 H ASP 75 -5.451 -0.124 12.573 513 HA ASP 75 HA ASP 75 -3.866 2.244 12.108 514 1HB ASP 75 1HB ASP 75 -3.378 0.912 14.466 515 2HB ASP 75 2HB ASP 75 -2.203 0.188 13.372 516 H LEU 76 H LEU 76 -1.750 1.601 10.971 517 HA LEU 76 HA LEU 76 -2.427 -0.460 9.001 518 1HB LEU 76 1HB LEU 76 -1.346 2.135 8.816 519 2HB LEU 76 2HB LEU 76 -0.066 1.021 8.342 520 HG LEU 76 HG LEU 76 -1.404 1.898 6.443 521 1HD1 LEU 76 1HD1 LEU 76 -0.253 -0.425 6.610 522 2HD1 LEU 76 2HD1 LEU 76 -1.339 -0.083 5.264 523 3HD1 LEU 76 3HD1 LEU 76 -1.905 -1.041 6.632 524 1HD2 LEU 76 1HD2 LEU 76 -3.653 0.098 7.034 525 2HD2 LEU 76 2HD2 LEU 76 -3.639 1.692 6.279 526 3HD2 LEU 76 3HD2 LEU 76 -3.562 1.546 8.036 527 H THR 77 H THR 77 -1.064 -2.144 8.501 528 HA THR 77 HA THR 77 1.475 -2.389 9.911 529 HB THR 77 HB THR 77 -0.238 -3.404 11.413 530 HG1 THR 77 HG1 THR 77 1.679 -4.344 11.744 531 1HG2 THR 77 1HG2 THR 77 -0.514 -5.583 9.362 532 2HG2 THR 77 2HG2 THR 77 -1.638 -4.225 9.427 533 3HG2 THR 77 3HG2 THR 77 -1.476 -5.304 10.812 534 H PHE 78 H PHE 78 0.297 -2.228 7.096 535 HA PHE 78 HA PHE 78 2.169 -3.980 5.871 536 1HB PHE 78 1HB PHE 78 -0.005 -5.374 6.525 537 2HB PHE 78 2HB PHE 78 -0.602 -4.677 5.023 538 HD1 PHE 78 HD1 PHE 78 0.204 -5.413 2.912 539 HD2 PHE 78 HD2 PHE 78 1.963 -6.854 6.510 540 HE1 PHE 78 HE1 PHE 78 1.381 -7.156 1.635 541 HE2 PHE 78 HE2 PHE 78 3.143 -8.599 5.239 542 HZ PHE 78 HZ PHE 78 2.854 -8.751 2.798 543 H LEU 79 H LEU 79 2.850 -2.940 4.125 544 HA LEU 79 HA LEU 79 0.935 -1.272 2.636 545 1HB LEU 79 1HB LEU 79 3.310 -0.473 4.024 546 2HB LEU 79 2HB LEU 79 3.513 -0.188 2.297 547 HG LEU 79 HG LEU 79 1.589 1.254 2.254 548 1HD1 LEU 79 1HD1 LEU 79 1.244 0.498 5.151 549 2HD1 LEU 79 2HD1 LEU 79 0.153 0.122 3.818 550 3HD1 LEU 79 3HD1 LEU 79 0.368 1.794 4.336 551 1HD2 LEU 79 1HD2 LEU 79 2.745 2.373 4.683 552 2HD2 LEU 79 2HD2 LEU 79 2.736 3.003 3.036 553 3HD2 LEU 79 3HD2 LEU 79 3.957 1.827 3.523 554 H ARG 80 H ARG 80 0.611 -2.529 0.880 555 HA ARG 80 HA ARG 80 2.949 -3.633 -0.508 556 1HB ARG 80 1HB ARG 80 0.190 -4.488 -0.150 557 2HB ARG 80 2HB ARG 80 0.675 -4.515 -1.840 558 1HG ARG 80 1HG ARG 80 2.511 -5.720 0.157 559 2HG ARG 80 2HG ARG 80 1.031 -6.590 -0.255 560 1HD ARG 80 1HD ARG 80 1.932 -5.883 -2.717 561 2HD ARG 80 2HD ARG 80 3.451 -6.105 -1.849 562 HE ARG 80 HE ARG 80 3.060 -8.359 -1.816 563 1HH1 ARG 80 1HH1 ARG 80 0.102 -6.701 -2.604 564 2HH1 ARG 80 2HH1 ARG 80 -0.766 -8.153 -2.976 565 1HH2 ARG 80 1HH2 ARG 80 1.928 -10.278 -2.304 566 2HH2 ARG 80 2HH2 ARG 80 0.274 -10.188 -2.804 567 H ILE 81 H ILE 81 3.772 -2.404 -2.059 568 HA ILE 81 HA ILE 81 1.922 -0.930 -3.812 569 HB ILE 81 HB ILE 81 3.868 0.744 -4.055 570 1HG1 ILE 81 1HG1 ILE 81 4.555 -0.498 -1.381 571 2HG1 ILE 81 2HG1 ILE 81 5.539 -0.583 -2.839 572 1HG2 ILE 81 1HG2 ILE 81 2.931 1.302 -1.404 573 2HG2 ILE 81 2HG2 ILE 81 2.480 2.060 -2.930 574 3HG2 ILE 81 3HG2 ILE 81 1.625 0.621 -2.375 575 1HD1 ILE 81 1HD1 ILE 81 5.918 1.791 -2.772 576 2HD1 ILE 81 2HD1 ILE 81 4.827 1.958 -1.396 577 3HD1 ILE 81 3HD1 ILE 81 6.345 1.078 -1.216 578 H ARG 82 H ARG 82 2.018 -2.515 -5.405 579 HA ARG 82 HA ARG 82 4.539 -3.453 -6.426 580 1HB ARG 82 1HB ARG 82 2.478 -4.847 -6.421 581 2HB ARG 82 2HB ARG 82 1.772 -3.755 -7.604 582 1HG ARG 82 1HG ARG 82 4.399 -4.860 -8.323 583 2HG ARG 82 2HG ARG 82 3.078 -6.027 -8.225 584 1HD ARG 82 1HD ARG 82 2.842 -3.451 -9.756 585 2HD ARG 82 2HD ARG 82 3.488 -4.922 -10.483 586 HE ARG 82 HE ARG 82 0.750 -4.328 -9.973 587 1HH1 ARG 82 1HH1 ARG 82 3.064 -6.926 -10.111 588 2HH1 ARG 82 2HH1 ARG 82 1.881 -8.134 -10.486 589 1HH2 ARG 82 1HH2 ARG 82 -0.817 -5.911 -10.466 590 2HH2 ARG 82 2HH2 ARG 82 -0.327 -7.556 -10.688 591 H SER 83 H SER 83 5.694 -2.661 -8.075 592 HA SER 83 HA SER 83 4.554 -0.394 -9.572 593 1HB SER 83 1HB SER 83 7.317 -0.321 -9.930 594 2HB SER 83 2HB SER 83 6.375 0.706 -8.851 595 HG SER 83 HG SER 83 7.758 -1.683 -8.250 596 H LYS 84 H LYS 84 5.429 -0.113 -11.792 597 HA LYS 84 HA LYS 84 4.956 -2.369 -13.366 598 1HB LYS 84 1HB LYS 84 6.270 0.276 -13.944 599 2HB LYS 84 2HB LYS 84 6.106 -0.957 -15.188 600 1HG LYS 84 1HG LYS 84 3.593 -0.926 -14.473 601 2HG LYS 84 2HG LYS 84 4.006 0.670 -13.840 602 1HD LYS 84 1HD LYS 84 3.294 1.139 -16.001 603 2HD LYS 84 2HD LYS 84 5.049 1.064 -16.176 604 1HE LYS 84 1HE LYS 84 4.747 -1.361 -16.826 605 2HE LYS 84 2HE LYS 84 3.018 -1.032 -16.916 606 1HZ LYS 84 1HZ LYS 84 5.187 -0.009 -18.623 607 2HZ LYS 84 2HZ LYS 84 3.755 0.876 -18.463 608 3HZ LYS 84 3HZ LYS 84 3.711 -0.702 -19.072 609 H LYS 85 H LYS 85 7.836 -1.272 -11.811 610 HA LYS 85 HA LYS 85 9.622 -2.856 -13.440 611 1HB LYS 85 1HB LYS 85 10.025 -1.276 -10.898 612 2HB LYS 85 2HB LYS 85 11.312 -2.180 -11.686 613 1HG LYS 85 1HG LYS 85 10.578 -0.767 -13.778 614 2HG LYS 85 2HG LYS 85 9.951 0.321 -12.537 615 1HD LYS 85 1HD LYS 85 12.172 1.024 -13.054 616 2HD LYS 85 2HD LYS 85 12.217 0.257 -11.465 617 1HE LYS 85 1HE LYS 85 13.734 -1.196 -12.184 618 2HE LYS 85 2HE LYS 85 12.644 -1.735 -13.460 619 1HZ LYS 85 1HZ LYS 85 14.929 0.009 -13.614 620 2HZ LYS 85 2HZ LYS 85 13.571 0.608 -14.424 621 3HZ LYS 85 3HZ LYS 85 14.190 -0.915 -14.824 622 H ASN 86 H ASN 86 8.504 -2.949 -10.057 623 HA ASN 86 HA ASN 86 8.260 -5.766 -10.026 624 1HB ASN 86 1HB ASN 86 10.116 -6.019 -8.204 625 2HB ASN 86 2HB ASN 86 10.562 -6.058 -9.907 626 1HD2 ASN 86 1HD2 ASN 86 11.624 -4.291 -10.814 627 2HD2 ASN 86 2HD2 ASN 86 12.408 -3.100 -9.839 628 H GLU 87 H GLU 87 7.790 -6.592 -7.804 629 HA GLU 87 HA GLU 87 6.097 -4.702 -6.440 630 1HB GLU 87 1HB GLU 87 5.645 -7.211 -6.873 631 2HB GLU 87 2HB GLU 87 6.685 -7.490 -5.484 632 1HG GLU 87 1HG GLU 87 5.212 -6.365 -4.028 633 2HG GLU 87 2HG GLU 87 4.285 -5.693 -5.368 634 H ILE 88 H ILE 88 6.277 -4.004 -4.311 635 HA ILE 88 HA ILE 88 8.775 -4.605 -2.899 636 HB ILE 88 HB ILE 88 7.756 -1.789 -3.285 637 1HG1 ILE 88 1HG1 ILE 88 10.222 -3.079 -4.470 638 2HG1 ILE 88 2HG1 ILE 88 8.725 -2.804 -5.355 639 1HG2 ILE 88 1HG2 ILE 88 8.927 -2.308 -1.141 640 2HG2 ILE 88 2HG2 ILE 88 10.351 -2.737 -2.088 641 3HG2 ILE 88 3HG2 ILE 88 9.727 -1.088 -2.131 642 1HD1 ILE 88 1HD1 ILE 88 10.656 -1.124 -5.601 643 2HD1 ILE 88 2HD1 ILE 88 9.017 -0.510 -5.379 644 3HD1 ILE 88 3HD1 ILE 88 10.140 -0.537 -4.020 645 H MET 89 H MET 89 7.828 -5.677 -1.233 646 HA MET 89 HA MET 89 5.478 -4.616 0.080 647 1HB MET 89 1HB MET 89 7.198 -7.045 0.561 648 2HB MET 89 2HB MET 89 5.874 -6.599 1.629 649 1HG MET 89 1HG MET 89 4.282 -7.217 0.147 650 2HG MET 89 2HG MET 89 5.256 -6.775 -1.253 651 1HE MET 89 1HE MET 89 5.597 -8.834 1.838 652 2HE MET 89 2HE MET 89 5.785 -10.505 1.308 653 3HE MET 89 3HE MET 89 7.171 -9.414 1.292 654 H VAL 90 H VAL 90 5.421 -3.455 1.912 655 HA VAL 90 HA VAL 90 7.776 -3.314 3.629 656 HB VAL 90 HB VAL 90 6.498 -0.808 2.531 657 1HG1 VAL 90 1HG1 VAL 90 7.813 -1.146 4.893 658 2HG1 VAL 90 2HG1 VAL 90 9.128 -0.676 3.815 659 3HG1 VAL 90 3HG1 VAL 90 7.719 0.370 3.998 660 1HG2 VAL 90 1HG2 VAL 90 9.191 -2.000 1.879 661 2HG2 VAL 90 2HG2 VAL 90 7.790 -1.997 0.808 662 3HG2 VAL 90 3HG2 VAL 90 8.549 -0.474 1.271 663 H ALA 91 H ALA 91 7.235 -3.241 5.720 664 HA ALA 91 HA ALA 91 4.739 -2.040 6.580 665 1HB ALA 91 1HB ALA 91 5.093 -4.788 7.609 666 2HB ALA 91 2HB ALA 91 3.619 -3.892 7.239 667 3HB ALA 91 3HB ALA 91 4.550 -4.633 5.938 668 HA PRO 92 HA PRO 92 7.042 -1.090 10.194 669 1HB PRO 92 1HB PRO 92 5.109 -1.103 12.101 670 2HB PRO 92 2HB PRO 92 5.243 0.166 10.877 671 1HG PRO 92 1HG PRO 92 3.435 -2.219 10.942 672 2HG PRO 92 2HG PRO 92 3.064 -0.546 10.485 673 1HD PRO 92 1HD PRO 92 3.511 -2.491 8.655 674 2HD PRO 92 2HD PRO 92 3.949 -0.794 8.372 675 H ASP 93 H ASP 93 8.445 -2.433 11.123 676 HA ASP 93 HA ASP 93 7.525 -5.035 12.102 677 1HB ASP 93 1HB ASP 93 9.795 -4.259 10.688 678 2HB ASP 93 2HB ASP 93 10.384 -4.547 12.323 679 H LYS 94 H LYS 94 9.409 -5.608 13.997 680 HA LYS 94 HA LYS 94 8.348 -4.613 16.335 681 1HB LYS 94 1HB LYS 94 10.546 -6.286 15.592 682 2HB LYS 94 2HB LYS 94 11.085 -5.176 16.846 683 1HG LYS 94 1HG LYS 94 10.255 -6.685 18.262 684 2HG LYS 94 2HG LYS 94 8.685 -6.003 17.834 685 1HD LYS 94 1HD LYS 94 8.447 -7.692 16.067 686 2HD LYS 94 2HD LYS 94 10.006 -8.381 16.525 687 1HE LYS 94 1HE LYS 94 8.494 -8.210 18.887 688 2HE LYS 94 2HE LYS 94 7.406 -8.844 17.653 689 1HZ LYS 94 1HZ LYS 94 10.092 -9.992 17.847 690 2HZ LYS 94 2HZ LYS 94 8.636 -10.726 17.398 691 3HZ LYS 94 3HZ LYS 94 8.960 -10.418 19.030 692 H ASP 95 H ASP 95 11.362 -3.558 14.753 693 HA ASP 95 HA ASP 95 10.939 -0.866 15.755 694 1HB ASP 95 1HB ASP 95 12.708 -2.668 17.078 695 2HB ASP 95 2HB ASP 95 13.683 -1.442 16.271 696 H TYR 96 H TYR 96 11.280 -2.540 13.200 697 HA TYR 96 HA TYR 96 12.953 -0.571 11.841 698 1HB TYR 96 1HB TYR 96 13.983 -2.495 10.497 699 2HB TYR 96 2HB TYR 96 14.583 -2.248 12.133 700 HD1 TYR 96 HD1 TYR 96 12.836 -4.501 9.887 701 HD2 TYR 96 HD2 TYR 96 13.907 -3.799 13.944 702 HE1 TYR 96 HE1 TYR 96 12.318 -6.844 10.423 703 HE2 TYR 96 HE2 TYR 96 13.393 -6.141 14.491 704 HH TYR 96 HH TYR 96 12.109 -8.361 12.040 705 H PHE 97 H PHE 97 12.862 -1.104 9.354 706 HA PHE 97 HA PHE 97 10.073 -1.799 8.701 707 1HB PHE 97 1HB PHE 97 11.799 0.464 7.766 708 2HB PHE 97 2HB PHE 97 10.547 -0.167 6.702 709 HD1 PHE 97 HD1 PHE 97 8.191 -0.475 7.917 710 HD2 PHE 97 HD2 PHE 97 11.250 2.233 9.109 711 HE1 PHE 97 HE1 PHE 97 6.513 0.907 9.071 712 HE2 PHE 97 HE2 PHE 97 9.578 3.619 10.266 713 HZ PHE 97 HZ PHE 97 7.206 2.956 10.248 714 H LEU 98 H LEU 98 10.158 -3.761 7.797 715 HA LEU 98 HA LEU 98 12.395 -4.687 6.277 716 1HB LEU 98 1HB LEU 98 10.466 -5.932 7.661 717 2HB LEU 98 2HB LEU 98 9.787 -6.062 6.040 718 HG LEU 98 HG LEU 98 12.611 -6.898 6.398 719 1HD1 LEU 98 1HD1 LEU 98 11.883 -8.014 8.289 720 2HD1 LEU 98 2HD1 LEU 98 11.629 -9.211 7.020 721 3HD1 LEU 98 3HD1 LEU 98 10.265 -8.278 7.638 722 1HD2 LEU 98 1HD2 LEU 98 10.887 -8.729 5.033 723 2HD2 LEU 98 2HD2 LEU 98 12.228 -7.776 4.397 724 3HD2 LEU 98 3HD2 LEU 98 10.601 -7.094 4.438 725 H ILE 99 H ILE 99 12.643 -4.873 4.099 726 HA ILE 99 HA ILE 99 10.449 -3.952 2.376 727 HB ILE 99 HB ILE 99 13.318 -3.077 2.029 728 1HG1 ILE 99 1HG1 ILE 99 11.678 -0.844 2.453 729 2HG1 ILE 99 2HG1 ILE 99 11.191 -2.009 3.679 730 1HG2 ILE 99 1HG2 ILE 99 11.193 -1.617 0.658 731 2HG2 ILE 99 2HG2 ILE 99 12.735 -2.215 0.049 732 3HG2 ILE 99 3HG2 ILE 99 11.347 -3.298 0.147 733 1HD1 ILE 99 1HD1 ILE 99 14.017 -1.101 3.197 734 2HD1 ILE 99 2HD1 ILE 99 12.945 -0.473 4.449 735 3HD1 ILE 99 3HD1 ILE 99 13.453 -2.161 4.489 736 H VAL 100 H VAL 100 9.978 -5.790 1.323 737 HA VAL 100 HA VAL 100 12.178 -7.411 0.247 738 HB VAL 100 HB VAL 100 9.247 -8.091 0.532 739 1HG1 VAL 100 1HG1 VAL 100 10.009 -9.323 -1.310 740 2HG1 VAL 100 2HG1 VAL 100 11.584 -9.620 -0.573 741 3HG1 VAL 100 3HG1 VAL 100 10.149 -10.433 0.052 742 1HG2 VAL 100 1HG2 VAL 100 10.828 -9.838 2.036 743 2HG2 VAL 100 2HG2 VAL 100 11.464 -8.226 2.365 744 3HG2 VAL 100 3HG2 VAL 100 9.758 -8.575 2.643 745 H ILE 101 H ILE 101 12.729 -7.027 -1.787 746 HA ILE 101 HA ILE 101 10.654 -6.102 -3.663 747 HB ILE 101 HB ILE 101 13.644 -5.699 -3.819 748 1HG1 ILE 101 1HG1 ILE 101 12.081 -3.287 -3.761 749 2HG1 ILE 101 2HG1 ILE 101 11.664 -4.289 -2.375 750 1HG2 ILE 101 1HG2 ILE 101 12.690 -5.913 -6.027 751 2HG2 ILE 101 2HG2 ILE 101 11.426 -4.752 -5.627 752 3HG2 ILE 101 3HG2 ILE 101 13.106 -4.226 -5.727 753 1HD1 ILE 101 1HD1 ILE 101 14.020 -2.704 -2.864 754 2HD1 ILE 101 2HD1 ILE 101 13.440 -3.436 -1.368 755 3HD1 ILE 101 3HD1 ILE 101 14.432 -4.376 -2.483 756 H GLN 102 H GLN 102 10.253 -7.235 -5.479 757 HA GLN 102 HA GLN 102 12.092 -9.036 -6.676 758 1HB GLN 102 1HB GLN 102 11.024 -11.140 -6.199 759 2HB GLN 102 2HB GLN 102 11.433 -10.363 -4.676 760 1HG GLN 102 1HG GLN 102 9.097 -9.584 -4.489 761 2HG GLN 102 2HG GLN 102 8.715 -10.478 -5.960 762 1HE2 GLN 102 1HE2 GLN 102 8.196 -10.628 -2.864 763 2HE2 GLN 102 2HE2 GLN 102 8.308 -12.325 -2.563 764 H ASN 103 H ASN 103 11.017 -10.330 -8.448 765 HA ASN 103 HA ASN 103 9.620 -8.686 -10.167 766 1HB ASN 103 1HB ASN 103 10.327 -11.525 -10.071 767 2HB ASN 103 2HB ASN 103 8.847 -11.210 -10.973 768 1HD2 ASN 103 1HD2 ASN 103 11.658 -12.001 -11.725 769 2HD2 ASN 103 2HD2 ASN 103 12.090 -10.890 -12.976 770 HA PRO 104 HA PRO 104 5.380 -8.726 -9.040 771 1HB PRO 104 1HB PRO 104 4.132 -8.889 -11.445 772 2HB PRO 104 2HB PRO 104 4.971 -7.433 -10.894 773 1HG PRO 104 1HG PRO 104 5.920 -9.575 -12.759 774 2HG PRO 104 2HG PRO 104 6.093 -7.815 -12.895 775 1HD PRO 104 1HD PRO 104 8.099 -9.414 -12.029 776 2HD PRO 104 2HD PRO 104 7.881 -7.753 -11.442 777 H THR 105 H THR 105 3.621 -10.057 -8.649 778 HA THR 105 HA THR 105 3.979 -12.866 -9.449 779 HB THR 105 HB THR 105 2.463 -13.370 -7.501 780 HG1 THR 105 HG1 THR 105 1.596 -11.737 -6.486 781 1HG2 THR 105 1HG2 THR 105 5.190 -12.867 -7.566 782 2HG2 THR 105 2HG2 THR 105 4.312 -13.716 -6.293 783 3HG2 THR 105 3HG2 THR 105 4.626 -11.987 -6.145 784 H GLU 106 H GLU 106 1.672 -10.221 -9.293 785 HA GLU 106 HA GLU 106 -0.326 -11.888 -10.659 786 1HB GLU 106 1HB GLU 106 -1.011 -10.720 -8.563 787 2HB GLU 106 2HB GLU 106 -0.705 -9.185 -9.363 788 1HG GLU 106 1HG GLU 106 -2.722 -9.198 -10.260 789 2HG GLU 106 2HG GLU 106 -2.424 -10.770 -11.000 790 H MET 11 H MET 11 -20.014 4.511 -15.593 791 HA MET 11 HA MET 11 -19.720 4.301 -12.716 792 1HB MET 11 1HB MET 11 -21.862 5.175 -14.588 793 2HB MET 11 2HB MET 11 -22.357 4.590 -13.005 794 1HG MET 11 1HG MET 11 -20.470 6.263 -12.206 795 2HG MET 11 2HG MET 11 -20.852 7.031 -13.745 796 1HE MET 11 1HE MET 11 -21.933 7.495 -9.976 797 2HE MET 11 2HE MET 11 -23.418 6.546 -10.043 798 3HE MET 11 3HE MET 11 -21.872 5.795 -10.442 799 H ALA 12 H ALA 12 -21.575 2.644 -15.264 800 HA ALA 12 HA ALA 12 -22.818 0.710 -13.740 801 1HB ALA 12 1HB ALA 12 -23.018 1.209 -16.253 802 2HB ALA 12 2HB ALA 12 -21.694 0.058 -16.440 803 3HB ALA 12 3HB ALA 12 -23.215 -0.459 -15.714 804 H GLU 13 H GLU 13 -19.534 0.712 -15.049 805 HA GLU 13 HA GLU 13 -18.785 -1.894 -14.515 806 1HB GLU 13 1HB GLU 13 -17.505 0.319 -15.453 807 2HB GLU 13 2HB GLU 13 -16.740 0.131 -13.882 808 1HG GLU 13 1HG GLU 13 -16.219 -2.220 -14.479 809 2HG GLU 13 2HG GLU 13 -16.857 -1.905 -16.092 810 H VAL 14 H VAL 14 -18.473 0.927 -12.363 811 HA VAL 14 HA VAL 14 -17.449 -0.498 -10.158 812 HB VAL 14 HB VAL 14 -19.070 2.045 -10.029 813 1HG1 VAL 14 1HG1 VAL 14 -16.970 2.093 -8.196 814 2HG1 VAL 14 2HG1 VAL 14 -18.684 1.861 -7.846 815 3HG1 VAL 14 3HG1 VAL 14 -17.635 0.464 -8.090 816 1HG2 VAL 14 1HG2 VAL 14 -17.450 2.618 -11.577 817 2HG2 VAL 14 2HG2 VAL 14 -16.678 3.059 -10.054 818 3HG2 VAL 14 3HG2 VAL 14 -16.240 1.553 -10.861 819 H GLU 15 H GLU 15 -20.731 0.241 -11.191 820 HA GLU 15 HA GLU 15 -22.045 -0.570 -8.827 821 1HB GLU 15 1HB GLU 15 -22.955 -0.354 -11.692 822 2HB GLU 15 2HB GLU 15 -24.034 -0.859 -10.400 823 1HG GLU 15 1HG GLU 15 -23.783 1.241 -9.282 824 2HG GLU 15 2HG GLU 15 -22.531 1.746 -10.416 825 H GLU 16 H GLU 16 -21.172 -2.302 -11.788 826 HA GLU 16 HA GLU 16 -22.466 -4.718 -11.228 827 1HB GLU 16 1HB GLU 16 -20.956 -3.762 -13.296 828 2HB GLU 16 2HB GLU 16 -19.875 -4.960 -12.599 829 1HG GLU 16 1HG GLU 16 -21.536 -6.682 -12.866 830 2HG GLU 16 2HG GLU 16 -22.714 -5.502 -13.436 831 H THR 17 H THR 17 -19.334 -3.479 -10.225 832 HA THR 17 HA THR 17 -18.524 -5.960 -9.001 833 HB THR 17 HB THR 17 -17.322 -3.192 -8.807 834 HG1 THR 17 HG1 THR 17 -15.705 -4.350 -10.179 835 1HG2 THR 17 1HG2 THR 17 -16.597 -4.351 -6.880 836 2HG2 THR 17 2HG2 THR 17 -15.288 -4.522 -8.049 837 3HG2 THR 17 3HG2 THR 17 -16.400 -5.862 -7.768 838 H LEU 18 H LEU 18 -20.109 -3.016 -8.014 839 HA LEU 18 HA LEU 18 -19.738 -3.323 -5.216 840 1HB LEU 18 1HB LEU 18 -21.138 -1.540 -7.006 841 2HB LEU 18 2HB LEU 18 -22.121 -1.927 -5.596 842 HG LEU 18 HG LEU 18 -19.783 -1.307 -4.397 843 1HD1 LEU 18 1HD1 LEU 18 -18.618 -0.707 -6.401 844 2HD1 LEU 18 2HD1 LEU 18 -18.957 0.765 -5.492 845 3HD1 LEU 18 3HD1 LEU 18 -19.932 0.357 -6.904 846 1HD2 LEU 18 1HD2 LEU 18 -20.790 0.870 -3.922 847 2HD2 LEU 18 2HD2 LEU 18 -21.981 -0.427 -3.825 848 3HD2 LEU 18 3HD2 LEU 18 -21.938 0.628 -5.239 849 H LYS 19 H LYS 19 -22.227 -4.371 -7.479 850 HA LYS 19 HA LYS 19 -24.121 -5.269 -5.615 851 1HB LYS 19 1HB LYS 19 -23.708 -5.428 -8.458 852 2HB LYS 19 2HB LYS 19 -24.235 -6.991 -7.848 853 1HG LYS 19 1HG LYS 19 -26.257 -6.046 -8.258 854 2HG LYS 19 2HG LYS 19 -26.021 -5.503 -6.595 855 1HD LYS 19 1HD LYS 19 -25.849 -3.347 -7.203 856 2HD LYS 19 2HD LYS 19 -24.857 -3.727 -8.613 857 1HE LYS 19 1HE LYS 19 -26.680 -4.008 -9.986 858 2HE LYS 19 2HE LYS 19 -27.753 -4.432 -8.653 859 1HZ LYS 19 1HZ LYS 19 -27.555 -1.988 -9.882 860 2HZ LYS 19 2HZ LYS 19 -26.772 -1.771 -8.398 861 3HZ LYS 19 3HZ LYS 19 -28.370 -2.325 -8.438 862 H ARG 20 H ARG 20 -21.525 -7.044 -7.284 863 HA ARG 20 HA ARG 20 -22.014 -9.522 -6.034 864 1HB ARG 20 1HB ARG 20 -20.594 -9.009 -8.116 865 2HB ARG 20 2HB ARG 20 -19.305 -8.622 -6.985 866 1HG ARG 20 1HG ARG 20 -18.767 -10.779 -7.165 867 2HG ARG 20 2HG ARG 20 -20.128 -11.055 -6.076 868 1HD ARG 20 1HD ARG 20 -20.883 -12.413 -7.692 869 2HD ARG 20 2HD ARG 20 -21.375 -10.921 -8.493 870 HE ARG 20 HE ARG 20 -18.687 -11.610 -9.122 871 1HH1 ARG 20 1HH1 ARG 20 -22.003 -12.372 -9.857 872 2HH1 ARG 20 2HH1 ARG 20 -21.654 -12.943 -11.455 873 1HH2 ARG 20 1HH2 ARG 20 -18.215 -12.359 -11.224 874 2HH2 ARG 20 2HH2 ARG 20 -19.499 -12.936 -12.231 875 H LEU 21 H LEU 21 -20.068 -6.744 -5.124 876 HA LEU 21 HA LEU 21 -18.681 -8.007 -2.991 877 1HB LEU 21 1HB LEU 21 -19.013 -5.284 -4.036 878 2HB LEU 21 2HB LEU 21 -18.710 -5.375 -2.303 879 HG LEU 21 HG LEU 21 -16.613 -6.490 -2.670 880 1HD1 LEU 21 1HD1 LEU 21 -16.128 -6.381 -5.393 881 2HD1 LEU 21 2HD1 LEU 21 -17.764 -7.027 -5.272 882 3HD1 LEU 21 3HD1 LEU 21 -16.435 -7.830 -4.436 883 1HD2 LEU 21 1HD2 LEU 21 -15.436 -4.749 -4.028 884 2HD2 LEU 21 2HD2 LEU 21 -16.469 -4.112 -2.748 885 3HD2 LEU 21 3HD2 LEU 21 -17.017 -4.075 -4.425 886 H GLN 22 H GLN 22 -21.374 -5.664 -2.959 887 HA GLN 22 HA GLN 22 -21.895 -5.869 -0.208 888 1HB GLN 22 1HB GLN 22 -22.972 -4.472 -2.427 889 2HB GLN 22 2HB GLN 22 -24.311 -5.291 -1.634 890 1HG GLN 22 1HG GLN 22 -24.046 -3.063 -0.749 891 2HG GLN 22 2HG GLN 22 -23.676 -4.259 0.492 892 1HE2 GLN 22 1HE2 GLN 22 -22.625 -1.505 -1.091 893 2HE2 GLN 22 2HE2 GLN 22 -20.991 -1.487 -0.528 894 H SER 23 H SER 23 -22.604 -7.986 -2.801 895 HA SER 23 HA SER 23 -24.834 -9.292 -1.516 896 1HB SER 23 1HB SER 23 -24.704 -9.208 -3.966 897 2HB SER 23 2HB SER 23 -23.193 -10.116 -3.925 898 HG SER 23 HG SER 23 -25.801 -10.983 -3.573 899 H GLN 24 H GLN 24 -21.391 -9.609 -1.587 900 HA GLN 24 HA GLN 24 -21.508 -12.255 -0.341 901 1HB GLN 24 1HB GLN 24 -19.104 -12.348 -0.696 902 2HB GLN 24 2HB GLN 24 -19.920 -11.927 -2.195 903 1HG GLN 24 1HG GLN 24 -19.232 -9.682 -2.062 904 2HG GLN 24 2HG GLN 24 -18.737 -9.853 -0.379 905 1HE2 GLN 24 1HE2 GLN 24 -16.909 -8.753 -1.831 906 2HE2 GLN 24 2HE2 GLN 24 -15.646 -9.845 -2.275 907 H LYS 25 H LYS 25 -20.343 -12.685 1.618 908 HA LYS 25 HA LYS 25 -20.687 -10.601 3.566 909 1HB LYS 25 1HB LYS 25 -21.081 -13.131 3.870 910 2HB LYS 25 2HB LYS 25 -19.337 -13.242 4.070 911 1HG LYS 25 1HG LYS 25 -19.663 -11.416 5.868 912 2HG LYS 25 2HG LYS 25 -21.357 -11.911 5.825 913 1HD LYS 25 1HD LYS 25 -20.808 -14.135 6.466 914 2HD LYS 25 2HD LYS 25 -19.083 -13.846 6.227 915 1HE LYS 25 1HE LYS 25 -20.839 -12.579 8.328 916 2HE LYS 25 2HE LYS 25 -19.631 -13.836 8.594 917 1HZ LYS 25 1HZ LYS 25 -18.041 -12.115 7.541 918 2HZ LYS 25 2HZ LYS 25 -18.500 -11.931 9.159 919 3HZ LYS 25 3HZ LYS 25 -19.234 -10.990 7.960 920 H GLY 26 H GLY 26 -19.090 -9.643 4.855 921 1HA GLY 26 1HA GLY 26 -16.742 -9.490 5.505 922 2HA GLY 26 2HA GLY 26 -16.326 -9.945 3.859 923 H VAL 27 H VAL 27 -17.857 -8.305 2.338 924 HA VAL 27 HA VAL 27 -16.428 -5.943 2.231 925 HB VAL 27 HB VAL 27 -19.246 -6.424 1.251 926 1HG1 VAL 27 1HG1 VAL 27 -18.940 -4.087 1.259 927 2HG1 VAL 27 2HG1 VAL 27 -17.273 -4.224 0.694 928 3HG1 VAL 27 3HG1 VAL 27 -18.609 -4.601 -0.396 929 1HG2 VAL 27 1HG2 VAL 27 -18.207 -7.880 -0.096 930 2HG2 VAL 27 2HG2 VAL 27 -17.581 -6.454 -0.923 931 3HG2 VAL 27 3HG2 VAL 27 -16.608 -7.257 0.309 932 H GLN 28 H GLN 28 -16.397 -4.170 3.437 933 HA GLN 28 HA GLN 28 -18.529 -3.744 5.388 934 1HB GLN 28 1HB GLN 28 -15.673 -3.000 5.188 935 2HB GLN 28 2HB GLN 28 -16.721 -1.821 5.964 936 1HG GLN 28 1HG GLN 28 -16.703 -2.987 7.837 937 2HG GLN 28 2HG GLN 28 -17.324 -4.406 6.995 938 1HE2 GLN 28 1HE2 GLN 28 -15.627 -5.617 5.720 939 2HE2 GLN 28 2HE2 GLN 28 -14.098 -5.844 6.491 940 H GLY 29 H GLY 29 -17.139 -2.338 2.522 941 1HA GLY 29 1HA GLY 29 -19.294 -0.853 1.747 942 2HA GLY 29 2HA GLY 29 -18.415 0.220 2.826 943 H ILE 30 H ILE 30 -18.950 0.224 -0.147 944 HA ILE 30 HA ILE 30 -16.151 0.355 -1.059 945 HB ILE 30 HB ILE 30 -18.588 0.144 -2.824 946 1HG1 ILE 30 1HG1 ILE 30 -17.219 -2.249 -3.021 947 2HG1 ILE 30 2HG1 ILE 30 -17.158 -1.900 -1.296 948 1HG2 ILE 30 1HG2 ILE 30 -15.752 -0.534 -3.526 949 2HG2 ILE 30 2HG2 ILE 30 -17.108 -0.199 -4.601 950 3HG2 ILE 30 3HG2 ILE 30 -16.375 1.109 -3.673 951 1HD1 ILE 30 1HD1 ILE 30 -19.799 -1.444 -2.349 952 2HD1 ILE 30 2HD1 ILE 30 -19.240 -3.080 -2.699 953 3HD1 ILE 30 3HD1 ILE 30 -19.272 -2.496 -1.035 954 H ILE 31 H ILE 31 -15.341 2.266 -1.647 955 HA ILE 31 HA ILE 31 -17.211 4.526 -1.938 956 HB ILE 31 HB ILE 31 -14.359 4.584 -0.944 957 1HG1 ILE 31 1HG1 ILE 31 -16.741 5.423 0.661 958 2HG1 ILE 31 2HG1 ILE 31 -16.367 3.709 0.522 959 1HG2 ILE 31 1HG2 ILE 31 -16.368 6.782 -1.389 960 2HG2 ILE 31 2HG2 ILE 31 -14.905 6.973 -0.424 961 3HG2 ILE 31 3HG2 ILE 31 -14.784 6.598 -2.142 962 1HD1 ILE 31 1HD1 ILE 31 -15.417 5.231 2.472 963 2HD1 ILE 31 2HD1 ILE 31 -14.512 3.872 1.805 964 3HD1 ILE 31 3HD1 ILE 31 -14.153 5.516 1.276 965 H VAL 32 H VAL 32 -16.900 5.988 -3.596 966 HA VAL 32 HA VAL 32 -14.745 5.421 -5.511 967 HB VAL 32 HB VAL 32 -17.553 6.015 -6.424 968 1HG1 VAL 32 1HG1 VAL 32 -15.173 4.840 -7.857 969 2HG1 VAL 32 2HG1 VAL 32 -16.744 5.213 -8.568 970 3HG1 VAL 32 3HG1 VAL 32 -15.712 6.515 -7.976 971 1HG2 VAL 32 1HG2 VAL 32 -16.243 3.313 -6.136 972 2HG2 VAL 32 2HG2 VAL 32 -17.614 3.911 -5.202 973 3HG2 VAL 32 3HG2 VAL 32 -17.784 3.625 -6.933 974 H VAL 33 H VAL 33 -13.789 7.187 -6.349 975 HA VAL 33 HA VAL 33 -15.141 9.775 -6.185 976 HB VAL 33 HB VAL 33 -12.304 9.508 -5.217 977 1HG1 VAL 33 1HG1 VAL 33 -13.679 11.695 -5.996 978 2HG1 VAL 33 2HG1 VAL 33 -14.085 11.658 -4.279 979 3HG1 VAL 33 3HG1 VAL 33 -12.396 11.719 -4.786 980 1HG2 VAL 33 1HG2 VAL 33 -13.201 9.674 -2.917 981 2HG2 VAL 33 2HG2 VAL 33 -14.828 9.458 -3.564 982 3HG2 VAL 33 3HG2 VAL 33 -13.638 8.165 -3.718 983 H ASN 34 H ASN 34 -14.598 11.182 -7.793 984 HA ASN 34 HA ASN 34 -13.339 10.139 -10.107 985 1HB ASN 34 1HB ASN 34 -13.841 13.069 -9.623 986 2HB ASN 34 2HB ASN 34 -13.871 12.190 -11.148 987 1HD2 ASN 34 1HD2 ASN 34 -15.751 13.619 -8.900 988 2HD2 ASN 34 2HD2 ASN 34 -17.229 12.763 -9.158 989 H THR 35 H THR 35 -11.797 12.115 -11.161 990 HA THR 35 HA THR 35 -9.314 11.718 -9.761 991 HB THR 35 HB THR 35 -8.931 13.581 -11.855 992 HG1 THR 35 HG1 THR 35 -10.034 12.650 -13.554 993 1HG2 THR 35 1HG2 THR 35 -7.906 11.542 -12.969 994 2HG2 THR 35 2HG2 THR 35 -8.446 10.623 -11.564 995 3HG2 THR 35 3HG2 THR 35 -7.293 11.943 -11.365 996 H GLU 36 H GLU 36 -11.690 14.206 -9.982 997 HA GLU 36 HA GLU 36 -9.989 16.374 -9.207 998 1HB GLU 36 1HB GLU 36 -12.919 15.976 -9.571 999 2HB GLU 36 2HB GLU 36 -12.391 17.334 -8.587 1000 1HG GLU 36 1HG GLU 36 -10.791 17.651 -10.727 1001 2HG GLU 36 2HG GLU 36 -12.195 16.906 -11.490 1002 H GLY 37 H GLY 37 -12.061 14.078 -7.533 1003 1HA GLY 37 1HA GLY 37 -11.211 13.510 -5.253 1004 2HA GLY 37 2HA GLY 37 -11.157 15.244 -4.972 1005 H ILE 38 H ILE 38 -13.807 14.376 -6.861 1006 HA ILE 38 HA ILE 38 -15.577 14.695 -4.546 1007 HB ILE 38 HB ILE 38 -16.319 14.837 -7.468 1008 1HG1 ILE 38 1HG1 ILE 38 -15.692 17.095 -5.553 1009 2HG1 ILE 38 2HG1 ILE 38 -14.661 16.571 -6.880 1010 1HG2 ILE 38 1HG2 ILE 38 -17.783 15.940 -5.082 1011 2HG2 ILE 38 2HG2 ILE 38 -18.362 15.802 -6.741 1012 3HG2 ILE 38 3HG2 ILE 38 -18.111 14.351 -5.772 1013 1HD1 ILE 38 1HD1 ILE 38 -17.213 17.081 -7.962 1014 2HD1 ILE 38 2HD1 ILE 38 -16.801 18.435 -6.909 1015 3HD1 ILE 38 3HD1 ILE 38 -15.713 17.973 -8.218 1016 HA PRO 39 HA PRO 39 -16.617 10.396 -4.711 1017 1HB PRO 39 1HB PRO 39 -18.776 10.507 -3.069 1018 2HB PRO 39 2HB PRO 39 -17.113 10.599 -2.477 1019 1HG PRO 39 1HG PRO 39 -19.069 12.808 -2.978 1020 2HG PRO 39 2HG PRO 39 -17.961 12.584 -1.612 1021 1HD PRO 39 1HD PRO 39 -17.427 14.273 -3.659 1022 2HD PRO 39 2HD PRO 39 -16.152 13.402 -2.783 1023 H ILE 40 H ILE 40 -17.949 9.122 -5.903 1024 HA ILE 40 HA ILE 40 -20.263 10.426 -7.183 1025 HB ILE 40 HB ILE 40 -19.852 8.631 -9.003 1026 1HG1 ILE 40 1HG1 ILE 40 -17.109 8.780 -7.732 1027 2HG1 ILE 40 2HG1 ILE 40 -18.156 7.365 -7.753 1028 1HG2 ILE 40 1HG2 ILE 40 -17.836 10.857 -8.811 1029 2HG2 ILE 40 2HG2 ILE 40 -18.549 10.159 -10.265 1030 3HG2 ILE 40 3HG2 ILE 40 -19.541 11.124 -9.172 1031 1HD1 ILE 40 1HD1 ILE 40 -16.218 8.115 -9.636 1032 2HD1 ILE 40 2HD1 ILE 40 -17.336 6.754 -9.709 1033 3HD1 ILE 40 3HD1 ILE 40 -17.785 8.303 -10.422 1034 H LYS 41 H LYS 41 -18.974 7.447 -5.815 1035 HA LYS 41 HA LYS 41 -21.705 6.574 -5.258 1036 1HB LYS 41 1HB LYS 41 -19.665 5.015 -6.824 1037 2HB LYS 41 2HB LYS 41 -20.934 4.200 -5.920 1038 1HG LYS 41 1HG LYS 41 -22.294 6.123 -7.361 1039 2HG LYS 41 2HG LYS 41 -21.050 5.555 -8.478 1040 1HD LYS 41 1HD LYS 41 -22.656 4.001 -8.918 1041 2HD LYS 41 2HD LYS 41 -21.862 3.193 -7.564 1042 1HE LYS 41 1HE LYS 41 -23.550 3.789 -6.066 1043 2HE LYS 41 2HE LYS 41 -24.156 5.070 -7.115 1044 1HZ LYS 41 1HZ LYS 41 -25.707 3.464 -7.483 1045 2HZ LYS 41 2HZ LYS 41 -24.630 2.183 -7.241 1046 3HZ LYS 41 3HZ LYS 41 -24.604 3.046 -8.696 1047 H SER 42 H SER 42 -21.893 5.911 -3.221 1048 HA SER 42 HA SER 42 -19.826 4.435 -1.885 1049 1HB SER 42 1HB SER 42 -19.266 7.002 -1.754 1050 2HB SER 42 2HB SER 42 -20.520 7.007 -0.514 1051 HG SER 42 HG SER 42 -19.286 5.232 0.459 1052 H THR 43 H THR 43 -21.152 2.876 -1.183 1053 HA THR 43 HA THR 43 -23.832 3.296 -0.357 1054 HB THR 43 HB THR 43 -23.906 0.993 0.204 1055 HG1 THR 43 HG1 THR 43 -22.165 -0.153 0.829 1056 1HG2 THR 43 1HG2 THR 43 -23.523 0.160 -1.857 1057 2HG2 THR 43 2HG2 THR 43 -21.832 0.660 -1.854 1058 3HG2 THR 43 3HG2 THR 43 -23.095 1.824 -2.252 1059 H MET 44 H MET 44 -20.890 3.848 1.202 1060 HA MET 44 HA MET 44 -21.593 3.212 3.873 1061 1HB MET 44 1HB MET 44 -19.319 4.154 2.544 1062 2HB MET 44 2HB MET 44 -19.742 5.430 3.677 1063 1HG MET 44 1HG MET 44 -19.593 3.950 5.528 1064 2HG MET 44 2HG MET 44 -19.457 2.547 4.470 1065 1HE MET 44 1HE MET 44 -17.352 1.885 3.131 1066 2HE MET 44 2HE MET 44 -17.408 3.413 2.253 1067 3HE MET 44 3HE MET 44 -15.899 2.875 2.990 1068 H ASP 45 H ASP 45 -21.103 5.462 5.359 1069 HA ASP 45 HA ASP 45 -23.640 6.790 5.214 1070 1HB ASP 45 1HB ASP 45 -21.794 6.271 7.225 1071 2HB ASP 45 2HB ASP 45 -21.700 8.017 7.010 1072 H ASN 46 H ASN 46 -23.714 9.240 5.463 1073 HA ASN 46 HA ASN 46 -22.646 10.415 3.126 1074 1HB ASN 46 1HB ASN 46 -24.608 11.070 5.031 1075 2HB ASN 46 2HB ASN 46 -23.448 12.394 5.070 1076 1HD2 ASN 46 1HD2 ASN 46 -22.628 12.441 2.445 1077 2HD2 ASN 46 2HD2 ASN 46 -23.954 12.909 1.441 1078 HA PRO 47 HA PRO 47 -19.743 12.868 6.116 1079 1HB PRO 47 1HB PRO 47 -19.588 11.998 8.683 1080 2HB PRO 47 2HB PRO 47 -20.763 13.205 8.147 1081 1HG PRO 47 1HG PRO 47 -21.135 10.268 8.596 1082 2HG PRO 47 2HG PRO 47 -22.199 11.613 9.047 1083 1HD PRO 47 1HD PRO 47 -22.644 10.071 6.866 1084 2HD PRO 47 2HD PRO 47 -23.083 11.790 6.926 1085 H THR 48 H THR 48 -20.102 9.407 6.425 1086 HA THR 48 HA THR 48 -17.375 8.876 7.107 1087 HB THR 48 HB THR 48 -19.304 6.922 5.855 1088 HG1 THR 48 HG1 THR 48 -19.883 8.210 7.950 1089 1HG2 THR 48 1HG2 THR 48 -18.015 5.276 7.143 1090 2HG2 THR 48 2HG2 THR 48 -16.971 6.565 7.741 1091 3HG2 THR 48 3HG2 THR 48 -16.986 6.168 6.023 1092 H THR 49 H THR 49 -19.216 9.082 4.126 1093 HA THR 49 HA THR 49 -17.188 7.974 2.452 1094 HB THR 49 HB THR 49 -19.593 9.680 1.791 1095 HG1 THR 49 HG1 THR 49 -19.851 7.448 2.601 1096 1HG2 THR 49 1HG2 THR 49 -19.216 8.900 -0.547 1097 2HG2 THR 49 2HG2 THR 49 -17.649 8.271 -0.038 1098 3HG2 THR 49 3HG2 THR 49 -17.973 10.003 0.042 1099 H THR 50 H THR 50 -18.234 11.288 3.186 1100 HA THR 50 HA THR 50 -16.540 12.672 1.480 1101 HB THR 50 HB THR 50 -16.827 13.955 4.098 1102 HG1 THR 50 HG1 THR 50 -19.045 13.959 4.138 1103 1HG2 THR 50 1HG2 THR 50 -17.662 14.597 1.273 1104 2HG2 THR 50 2HG2 THR 50 -16.316 15.282 2.184 1105 3HG2 THR 50 3HG2 THR 50 -17.976 15.661 2.643 1106 H GLN 51 H GLN 51 -15.955 11.741 4.869 1107 HA GLN 51 HA GLN 51 -13.410 12.799 5.153 1108 1HB GLN 51 1HB GLN 51 -14.582 11.945 7.066 1109 2HB GLN 51 2HB GLN 51 -14.639 10.328 6.377 1110 1HG GLN 51 1HG GLN 51 -11.931 11.359 6.642 1111 2HG GLN 51 2HG GLN 51 -12.791 11.255 8.177 1112 1HE2 GLN 51 1HE2 GLN 51 -11.393 9.508 5.551 1113 2HE2 GLN 51 2HE2 GLN 51 -11.549 7.930 6.237 1114 H TYR 52 H TYR 52 -14.286 9.488 4.168 1115 HA TYR 52 HA TYR 52 -11.693 8.563 3.709 1116 1HB TYR 52 1HB TYR 52 -14.409 7.751 2.780 1117 2HB TYR 52 2HB TYR 52 -13.012 7.055 1.966 1118 HD1 TYR 52 HD1 TYR 52 -14.157 7.717 5.468 1119 HD2 TYR 52 HD2 TYR 52 -12.259 5.033 2.767 1120 HE1 TYR 52 HE1 TYR 52 -13.936 6.064 7.276 1121 HE2 TYR 52 HE2 TYR 52 -12.034 3.372 4.567 1122 HH TYR 52 HH TYR 52 -13.636 3.147 7.074 1123 H ALA 53 H ALA 53 -14.017 10.003 1.435 1124 HA ALA 53 HA ALA 53 -12.347 9.881 -0.832 1125 1HB ALA 53 1HB ALA 53 -13.912 11.359 -1.883 1126 2HB ALA 53 2HB ALA 53 -14.812 10.225 -0.876 1127 3HB ALA 53 3HB ALA 53 -14.545 11.878 -0.321 1128 H SER 54 H SER 54 -12.311 11.922 1.911 1129 HA SER 54 HA SER 54 -11.063 14.186 0.678 1130 1HB SER 54 1HB SER 54 -12.397 14.160 2.867 1131 2HB SER 54 2HB SER 54 -10.941 13.501 3.614 1132 HG SER 54 HG SER 54 -9.858 15.401 2.677 1133 H LEU 55 H LEU 55 -9.879 11.600 2.825 1134 HA LEU 55 HA LEU 55 -7.133 12.375 2.411 1135 1HB LEU 55 1HB LEU 55 -6.603 10.923 4.085 1136 2HB LEU 55 2HB LEU 55 -8.286 11.259 4.488 1137 HG LEU 55 HG LEU 55 -8.671 9.091 2.996 1138 1HD1 LEU 55 1HD1 LEU 55 -6.289 8.037 4.305 1139 2HD1 LEU 55 2HD1 LEU 55 -5.932 9.166 2.998 1140 3HD1 LEU 55 3HD1 LEU 55 -6.922 7.740 2.685 1141 1HD2 LEU 55 1HD2 LEU 55 -7.688 8.491 5.722 1142 2HD2 LEU 55 2HD2 LEU 55 -9.211 8.061 4.943 1143 3HD2 LEU 55 3HD2 LEU 55 -8.974 9.690 5.579 1144 H MET 56 H MET 56 -9.387 10.383 0.825 1145 HA MET 56 HA MET 56 -7.848 8.306 -0.176 1146 1HB MET 56 1HB MET 56 -10.381 9.529 -0.782 1147 2HB MET 56 2HB MET 56 -9.541 9.134 -2.276 1148 1HG MET 56 1HG MET 56 -10.116 7.218 -0.028 1149 2HG MET 56 2HG MET 56 -11.006 7.329 -1.545 1150 1HE MET 56 1HE MET 56 -8.540 4.765 -0.066 1151 2HE MET 56 2HE MET 56 -7.014 5.431 -0.650 1152 3HE MET 56 3HE MET 56 -8.060 6.400 0.390 1153 H HIS 57 H HIS 57 -8.669 11.223 -2.058 1154 HA HIS 57 HA HIS 57 -6.810 10.888 -4.069 1155 1HB HIS 57 1HB HIS 57 -8.704 12.622 -3.855 1156 2HB HIS 57 2HB HIS 57 -7.520 13.616 -3.012 1157 HD1 HIS 57 HD1 HIS 57 -5.562 14.575 -4.417 1158 HD2 HIS 57 HD2 HIS 57 -8.344 12.408 -6.613 1159 HE1 HIS 57 HE1 HIS 57 -5.074 15.102 -6.827 1160 H SER 58 H SER 58 -6.429 12.685 -1.028 1161 HA SER 58 HA SER 58 -3.868 13.670 -1.431 1162 1HB SER 58 1HB SER 58 -4.183 12.852 1.316 1163 2HB SER 58 2HB SER 58 -4.199 14.478 0.633 1164 HG SER 58 HG SER 58 -6.192 14.236 1.469 1165 H PHE 59 H PHE 59 -4.899 10.517 -0.217 1166 HA PHE 59 HA PHE 59 -2.389 9.538 0.544 1167 1HB PHE 59 1HB PHE 59 -4.470 8.422 1.172 1168 2HB PHE 59 2HB PHE 59 -4.786 8.026 -0.514 1169 HD1 PHE 59 HD1 PHE 59 -4.647 5.747 -0.765 1170 HD2 PHE 59 HD2 PHE 59 -1.712 7.753 1.576 1171 HE1 PHE 59 HE1 PHE 59 -3.418 3.631 -0.498 1172 HE2 PHE 59 HE2 PHE 59 -0.479 5.641 1.846 1173 HZ PHE 59 HZ PHE 59 -1.331 3.577 0.808 1174 H ILE 60 H ILE 60 -4.168 8.944 -2.491 1175 HA ILE 60 HA ILE 60 -2.132 7.557 -3.805 1176 HB ILE 60 HB ILE 60 -4.272 9.303 -5.030 1177 1HG1 ILE 60 1HG1 ILE 60 -5.229 7.567 -3.621 1178 2HG1 ILE 60 2HG1 ILE 60 -5.492 7.164 -5.314 1179 1HG2 ILE 60 1HG2 ILE 60 -2.124 7.718 -6.183 1180 2HG2 ILE 60 2HG2 ILE 60 -3.714 7.254 -6.783 1181 3HG2 ILE 60 3HG2 ILE 60 -3.169 8.924 -6.933 1182 1HD1 ILE 60 1HD1 ILE 60 -3.072 5.957 -4.626 1183 2HD1 ILE 60 2HD1 ILE 60 -4.160 5.665 -3.269 1184 3HD1 ILE 60 3HD1 ILE 60 -4.629 5.175 -4.896 1185 H LEU 61 H LEU 61 -2.939 11.020 -3.895 1186 HA LEU 61 HA LEU 61 -0.903 11.773 -5.686 1187 1HB LEU 61 1HB LEU 61 -2.944 13.041 -4.199 1188 2HB LEU 61 2HB LEU 61 -1.437 13.876 -3.828 1189 HG LEU 61 HG LEU 61 -1.089 14.293 -6.220 1190 1HD1 LEU 61 1HD1 LEU 61 -3.023 13.881 -7.757 1191 2HD1 LEU 61 2HD1 LEU 61 -3.720 12.858 -6.501 1192 3HD1 LEU 61 3HD1 LEU 61 -2.171 12.430 -7.228 1193 1HD2 LEU 61 1HD2 LEU 61 -3.674 15.189 -4.978 1194 2HD2 LEU 61 2HD2 LEU 61 -3.113 15.805 -6.532 1195 3HD2 LEU 61 3HD2 LEU 61 -2.142 16.058 -5.081 1196 H LYS 62 H LYS 62 -0.885 11.097 -2.287 1197 HA LYS 62 HA LYS 62 1.604 12.416 -1.735 1198 1HB LYS 62 1HB LYS 62 -0.080 12.059 0.020 1199 2HB LYS 62 2HB LYS 62 0.108 10.319 -0.150 1200 1HG LYS 62 1HG LYS 62 1.334 10.998 1.767 1201 2HG LYS 62 2HG LYS 62 2.500 10.589 0.507 1202 1HD LYS 62 1HD LYS 62 3.402 12.569 1.165 1203 2HD LYS 62 2HD LYS 62 2.239 13.194 -0.006 1204 1HE LYS 62 1HE LYS 62 0.914 12.881 2.489 1205 2HE LYS 62 2HE LYS 62 2.427 13.739 2.775 1206 1HZ LYS 62 1HZ LYS 62 0.046 14.725 1.667 1207 2HZ LYS 62 2HZ LYS 62 1.252 14.818 0.486 1208 3HZ LYS 62 3HZ LYS 62 1.481 15.562 1.988 1209 H ALA 63 H ALA 63 0.624 8.999 -1.997 1210 HA ALA 63 HA ALA 63 3.254 7.969 -1.811 1211 1HB ALA 63 1HB ALA 63 2.314 5.902 -2.065 1212 2HB ALA 63 2HB ALA 63 0.894 6.820 -1.562 1213 3HB ALA 63 3HB ALA 63 1.150 6.456 -3.269 1214 H ARG 64 H ARG 64 1.100 8.398 -4.622 1215 HA ARG 64 HA ARG 64 2.845 7.529 -6.593 1216 1HB ARG 64 1HB ARG 64 0.339 8.288 -6.700 1217 2HB ARG 64 2HB ARG 64 1.029 9.853 -7.107 1218 1HG ARG 64 1HG ARG 64 2.382 8.227 -8.805 1219 2HG ARG 64 2HG ARG 64 0.821 7.410 -8.706 1220 1HD ARG 64 1HD ARG 64 0.658 8.935 -10.506 1221 2HD ARG 64 2HD ARG 64 -0.244 9.648 -9.169 1222 HE ARG 64 HE ARG 64 1.259 11.374 -9.122 1223 1HH1 ARG 64 1HH1 ARG 64 2.596 8.746 -10.973 1224 2HH1 ARG 64 2HH1 ARG 64 3.961 9.657 -11.526 1225 1HH2 ARG 64 1HH2 ARG 64 3.053 12.584 -9.843 1226 2HH2 ARG 64 2HH2 ARG 64 4.220 11.840 -10.882 1227 H SER 65 H SER 65 2.812 10.504 -4.810 1228 HA SER 65 HA SER 65 4.458 11.991 -6.609 1229 1HB SER 65 1HB SER 65 3.108 13.268 -5.128 1230 2HB SER 65 2HB SER 65 3.683 12.379 -3.718 1231 HG SER 65 HG SER 65 4.901 14.431 -5.154 1232 H THR 66 H THR 66 5.032 9.883 -3.870 1233 HA THR 66 HA THR 66 7.850 10.518 -3.738 1234 HB THR 66 HB THR 66 6.683 8.110 -2.399 1235 HG1 THR 66 HG1 THR 66 5.494 9.288 -1.076 1236 1HG2 THR 66 1HG2 THR 66 9.084 8.653 -2.183 1237 2HG2 THR 66 2HG2 THR 66 8.239 8.722 -0.636 1238 3HG2 THR 66 3HG2 THR 66 8.650 10.213 -1.485 1239 H VAL 67 H VAL 67 5.801 8.071 -5.159 1240 HA VAL 67 HA VAL 67 7.573 6.014 -5.636 1241 HB VAL 67 HB VAL 67 5.403 7.034 -7.474 1242 1HG1 VAL 67 1HG1 VAL 67 7.336 4.888 -7.775 1243 2HG1 VAL 67 2HG1 VAL 67 5.671 4.313 -7.868 1244 3HG1 VAL 67 3HG1 VAL 67 6.228 5.585 -8.956 1245 1HG2 VAL 67 1HG2 VAL 67 3.898 5.866 -6.261 1246 2HG2 VAL 67 2HG2 VAL 67 5.042 4.580 -5.878 1247 3HG2 VAL 67 3HG2 VAL 67 5.078 6.092 -4.970 1248 H ARG 68 H ARG 68 7.166 9.030 -7.427 1249 HA ARG 68 HA ARG 68 8.708 8.520 -9.657 1250 1HB ARG 68 1HB ARG 68 8.877 10.849 -9.953 1251 2HB ARG 68 2HB ARG 68 7.369 10.618 -9.079 1252 1HG ARG 68 1HG ARG 68 8.640 11.114 -6.967 1253 2HG ARG 68 2HG ARG 68 9.996 11.588 -7.992 1254 1HD ARG 68 1HD ARG 68 8.586 13.495 -7.261 1255 2HD ARG 68 2HD ARG 68 8.690 13.325 -9.013 1256 HE ARG 68 HE ARG 68 6.419 11.960 -8.031 1257 1HH1 ARG 68 1HH1 ARG 68 7.633 15.168 -8.627 1258 2HH1 ARG 68 2HH1 ARG 68 6.062 15.858 -8.871 1259 1HH2 ARG 68 1HH2 ARG 68 4.346 12.857 -8.350 1260 2HH2 ARG 68 2HH2 ARG 68 4.193 14.543 -8.712 1261 H ASP 69 H ASP 69 9.717 9.134 -6.376 1262 HA ASP 69 HA ASP 69 12.468 9.620 -7.001 1263 1HB ASP 69 1HB ASP 69 10.850 9.872 -4.734 1264 2HB ASP 69 2HB ASP 69 12.024 8.628 -4.312 1265 H ILE 70 H ILE 70 10.547 6.808 -6.141 1266 HA ILE 70 HA ILE 70 12.565 4.996 -5.535 1267 HB ILE 70 HB ILE 70 9.986 4.406 -6.993 1268 1HG1 ILE 70 1HG1 ILE 70 10.569 4.306 -4.027 1269 2HG1 ILE 70 2HG1 ILE 70 9.727 5.630 -4.824 1270 1HG2 ILE 70 1HG2 ILE 70 10.229 2.151 -6.128 1271 2HG2 ILE 70 2HG2 ILE 70 11.630 2.587 -7.105 1272 3HG2 ILE 70 3HG2 ILE 70 11.746 2.595 -5.346 1273 1HD1 ILE 70 1HD1 ILE 70 7.900 4.483 -4.228 1274 2HD1 ILE 70 2HD1 ILE 70 8.261 3.526 -5.664 1275 3HD1 ILE 70 3HD1 ILE 70 8.777 2.961 -4.075 1276 H ASP 71 H ASP 71 11.554 6.281 -8.602 1277 HA ASP 71 HA ASP 71 13.878 5.494 -9.943 1278 1HB ASP 71 1HB ASP 71 11.727 3.508 -9.921 1279 2HB ASP 71 2HB ASP 71 12.252 3.945 -11.545 1280 HA PRO 72 HA PRO 72 12.417 8.445 -12.839 1281 1HB PRO 72 1HB PRO 72 13.510 7.576 -15.167 1282 2HB PRO 72 2HB PRO 72 14.465 8.307 -13.872 1283 1HG PRO 72 1HG PRO 72 14.080 5.415 -14.540 1284 2HG PRO 72 2HG PRO 72 15.565 6.270 -14.086 1285 1HD PRO 72 1HD PRO 72 14.154 4.768 -12.330 1286 2HD PRO 72 2HD PRO 72 15.061 6.213 -11.838 1287 H GLN 73 H GLN 73 12.180 5.149 -14.190 1288 HA GLN 73 HA GLN 73 9.604 5.914 -15.391 1289 1HB GLN 73 1HB GLN 73 11.475 3.668 -16.163 1290 2HB GLN 73 2HB GLN 73 9.950 4.045 -16.953 1291 1HG GLN 73 1HG GLN 73 10.961 6.354 -17.386 1292 2HG GLN 73 2HG GLN 73 12.502 5.611 -16.961 1293 1HE2 GLN 73 1HE2 GLN 73 13.620 4.835 -18.590 1294 2HE2 GLN 73 2HE2 GLN 73 12.984 4.304 -20.106 1295 H ASN 74 H ASN 74 8.607 5.548 -13.288 1296 HA ASN 74 HA ASN 74 7.923 2.718 -12.943 1297 1HB ASN 74 1HB ASN 74 9.026 4.573 -10.868 1298 2HB ASN 74 2HB ASN 74 7.863 3.341 -10.386 1299 1HD2 ASN 74 1HD2 ASN 74 9.092 1.936 -9.308 1300 2HD2 ASN 74 2HD2 ASN 74 10.474 1.127 -9.956 1301 H ASP 75 H ASP 75 5.885 2.362 -11.870 1302 HA ASP 75 HA ASP 75 4.151 4.573 -11.294 1303 1HB ASP 75 1HB ASP 75 4.272 3.797 -13.967 1304 2HB ASP 75 2HB ASP 75 2.826 3.003 -13.350 1305 H LEU 76 H LEU 76 3.085 3.886 -9.570 1306 HA LEU 76 HA LEU 76 2.950 1.273 -8.661 1307 1HB LEU 76 1HB LEU 76 1.919 3.819 -7.887 1308 2HB LEU 76 2HB LEU 76 0.642 2.615 -7.727 1309 HG LEU 76 HG LEU 76 1.958 3.030 -5.647 1310 1HD1 LEU 76 1HD1 LEU 76 0.782 0.819 -6.405 1311 2HD1 LEU 76 2HD1 LEU 76 1.788 0.850 -4.957 1312 3HD1 LEU 76 3HD1 LEU 76 2.435 0.205 -6.465 1313 1HD2 LEU 76 1HD2 LEU 76 4.137 3.057 -7.207 1314 2HD2 LEU 76 2HD2 LEU 76 4.181 1.377 -6.672 1315 3HD2 LEU 76 3HD2 LEU 76 4.186 2.682 -5.484 1316 H THR 77 H THR 77 0.976 -0.053 -8.323 1317 HA THR 77 HA THR 77 -0.803 0.061 -10.671 1318 HB THR 77 HB THR 77 -0.936 -2.523 -10.239 1319 HG1 THR 77 HG1 THR 77 0.435 -2.441 -8.370 1320 1HG2 THR 77 1HG2 THR 77 1.081 -0.925 -11.727 1321 2HG2 THR 77 2HG2 THR 77 -0.160 -2.023 -12.330 1322 3HG2 THR 77 3HG2 THR 77 1.324 -2.668 -11.630 1323 H PHE 78 H PHE 78 -0.475 -1.056 -7.319 1324 HA PHE 78 HA PHE 78 -3.222 -0.306 -6.795 1325 1HB PHE 78 1HB PHE 78 -3.894 -2.484 -5.929 1326 2HB PHE 78 2HB PHE 78 -3.429 -2.625 -7.621 1327 HD1 PHE 78 HD1 PHE 78 -2.693 -3.605 -4.214 1328 HD2 PHE 78 HD2 PHE 78 -1.291 -3.684 -8.232 1329 HE1 PHE 78 HE1 PHE 78 -1.106 -5.390 -3.622 1330 HE2 PHE 78 HE2 PHE 78 0.297 -5.470 -7.646 1331 HZ PHE 78 HZ PHE 78 0.390 -6.326 -5.339 1332 H LEU 79 H LEU 79 -3.346 0.593 -4.846 1333 HA LEU 79 HA LEU 79 -1.104 0.229 -3.000 1334 1HB LEU 79 1HB LEU 79 -2.777 2.433 -3.755 1335 2HB LEU 79 2HB LEU 79 -2.877 2.178 -2.014 1336 HG LEU 79 HG LEU 79 -0.521 2.510 -1.763 1337 1HD1 LEU 79 1HD1 LEU 79 0.345 1.410 -3.691 1338 2HD1 LEU 79 2HD1 LEU 79 0.882 3.088 -3.749 1339 3HD1 LEU 79 3HD1 LEU 79 -0.450 2.554 -4.773 1340 1HD2 LEU 79 1HD2 LEU 79 -0.754 4.720 -1.815 1341 2HD2 LEU 79 2HD2 LEU 79 -2.288 4.468 -2.648 1342 3HD2 LEU 79 3HD2 LEU 79 -0.813 4.738 -3.578 1343 H ARG 80 H ARG 80 -1.484 -1.551 -1.791 1344 HA ARG 80 HA ARG 80 -4.118 -1.835 -0.522 1345 1HB ARG 80 1HB ARG 80 -2.025 -3.734 -1.396 1346 2HB ARG 80 2HB ARG 80 -2.832 -4.129 0.116 1347 1HG ARG 80 1HG ARG 80 -4.891 -3.436 -1.617 1348 2HG ARG 80 2HG ARG 80 -3.772 -4.388 -2.596 1349 1HD ARG 80 1HD ARG 80 -4.917 -5.216 0.069 1350 2HD ARG 80 2HD ARG 80 -5.471 -5.786 -1.504 1351 HE ARG 80 HE ARG 80 -2.674 -6.232 -1.069 1352 1HH1 ARG 80 1HH1 ARG 80 -5.873 -7.480 -0.497 1353 2HH1 ARG 80 2HH1 ARG 80 -5.344 -9.121 -0.327 1354 1HH2 ARG 80 1HH2 ARG 80 -1.965 -8.389 -0.847 1355 2HH2 ARG 80 2HH2 ARG 80 -3.121 -9.637 -0.525 1356 H ILE 81 H ILE 81 -4.360 -1.455 1.583 1357 HA ILE 81 HA ILE 81 -1.959 -1.404 3.288 1358 HB ILE 81 HB ILE 81 -3.229 0.422 4.592 1359 1HG1 ILE 81 1HG1 ILE 81 -4.560 0.664 1.885 1360 2HG1 ILE 81 2HG1 ILE 81 -5.356 0.213 3.388 1361 1HG2 ILE 81 1HG2 ILE 81 -2.454 1.840 2.234 1362 2HG2 ILE 81 2HG2 ILE 81 -1.602 1.687 3.770 1363 3HG2 ILE 81 3HG2 ILE 81 -1.349 0.492 2.499 1364 1HD1 ILE 81 1HD1 ILE 81 -4.829 2.814 2.317 1365 2HD1 ILE 81 2HD1 ILE 81 -5.808 2.350 3.710 1366 3HD1 ILE 81 3HD1 ILE 81 -4.080 2.645 3.905 1367 H ARG 82 H ARG 82 -2.384 -3.443 4.136 1368 HA ARG 82 HA ARG 82 -4.904 -4.241 5.152 1369 1HB ARG 82 1HB ARG 82 -2.241 -5.319 6.064 1370 2HB ARG 82 2HB ARG 82 -3.788 -6.152 6.015 1371 1HG ARG 82 1HG ARG 82 -3.294 -5.349 3.386 1372 2HG ARG 82 2HG ARG 82 -1.754 -5.955 4.000 1373 1HD ARG 82 1HD ARG 82 -4.397 -7.388 3.885 1374 2HD ARG 82 2HD ARG 82 -2.902 -7.805 3.049 1375 HE ARG 82 HE ARG 82 -3.602 -8.425 5.773 1376 1HH1 ARG 82 1HH1 ARG 82 -1.009 -8.017 3.486 1377 2HH1 ARG 82 2HH1 ARG 82 0.102 -9.010 4.371 1378 1HH2 ARG 82 1HH2 ARG 82 -2.149 -9.733 6.947 1379 2HH2 ARG 82 2HH2 ARG 82 -0.548 -9.986 6.339 1380 H SER 83 H SER 83 -5.900 -3.297 6.801 1381 HA SER 83 HA SER 83 -4.384 -1.956 8.881 1382 1HB SER 83 1HB SER 83 -7.339 -2.186 9.083 1383 2HB SER 83 2HB SER 83 -6.296 -0.789 9.347 1384 HG SER 83 HG SER 83 -7.679 -1.462 7.153 1385 H LYS 84 H LYS 84 -5.849 -2.246 11.120 1386 HA LYS 84 HA LYS 84 -5.173 -4.945 11.934 1387 1HB LYS 84 1HB LYS 84 -5.780 -2.383 13.303 1388 2HB LYS 84 2HB LYS 84 -6.176 -3.857 14.177 1389 1HG LYS 84 1HG LYS 84 -3.691 -4.470 13.397 1390 2HG LYS 84 2HG LYS 84 -3.549 -2.712 13.472 1391 1HD LYS 84 1HD LYS 84 -4.946 -3.515 15.786 1392 2HD LYS 84 2HD LYS 84 -3.578 -4.617 15.611 1393 1HE LYS 84 1HE LYS 84 -2.171 -2.515 15.236 1394 2HE LYS 84 2HE LYS 84 -3.557 -1.624 15.861 1395 1HZ LYS 84 1HZ LYS 84 -3.183 -3.615 17.678 1396 2HZ LYS 84 2HZ LYS 84 -2.688 -2.008 17.856 1397 3HZ LYS 84 3HZ LYS 84 -1.603 -3.167 17.271 1398 H LYS 85 H LYS 85 -7.979 -3.128 11.100 1399 HA LYS 85 HA LYS 85 -9.755 -5.152 12.261 1400 1HB LYS 85 1HB LYS 85 -10.172 -2.356 11.250 1401 2HB LYS 85 2HB LYS 85 -11.534 -3.461 11.391 1402 1HG LYS 85 1HG LYS 85 -9.724 -3.061 13.727 1403 2HG LYS 85 2HG LYS 85 -10.939 -1.841 13.341 1404 1HD LYS 85 1HD LYS 85 -12.462 -3.077 14.387 1405 2HD LYS 85 2HD LYS 85 -12.225 -4.345 13.182 1406 1HE LYS 85 1HE LYS 85 -10.350 -5.222 14.545 1407 2HE LYS 85 2HE LYS 85 -10.715 -4.010 15.772 1408 1HZ LYS 85 1HZ LYS 85 -11.808 -6.522 15.564 1409 2HZ LYS 85 2HZ LYS 85 -13.040 -5.481 15.055 1410 3HZ LYS 85 3HZ LYS 85 -12.332 -5.273 16.577 1411 H ASN 86 H ASN 86 -9.471 -3.336 9.199 1412 HA ASN 86 HA ASN 86 -9.968 -5.801 7.723 1413 1HB ASN 86 1HB ASN 86 -11.671 -4.585 6.292 1414 2HB ASN 86 2HB ASN 86 -12.204 -5.001 7.918 1415 1HD2 ASN 86 1HD2 ASN 86 -12.169 -3.319 9.530 1416 2HD2 ASN 86 2HD2 ASN 86 -12.398 -1.675 9.051 1417 H GLU 87 H GLU 87 -9.598 -5.523 5.373 1418 HA GLU 87 HA GLU 87 -7.382 -3.662 4.948 1419 1HB GLU 87 1HB GLU 87 -6.736 -5.053 3.106 1420 2HB GLU 87 2HB GLU 87 -7.091 -6.100 4.472 1421 1HG GLU 87 1HG GLU 87 -8.283 -7.265 2.990 1422 2HG GLU 87 2HG GLU 87 -9.503 -6.019 3.243 1423 H ILE 88 H ILE 88 -7.253 -2.339 3.091 1424 HA ILE 88 HA ILE 88 -9.792 -1.898 1.673 1425 HB ILE 88 HB ILE 88 -7.999 0.276 2.758 1426 1HG1 ILE 88 1HG1 ILE 88 -10.449 0.744 3.812 1427 2HG1 ILE 88 2HG1 ILE 88 -10.479 -1.014 3.729 1428 1HG2 ILE 88 1HG2 ILE 88 -10.213 1.561 1.969 1429 2HG2 ILE 88 2HG2 ILE 88 -8.805 1.338 0.932 1430 3HG2 ILE 88 3HG2 ILE 88 -10.191 0.258 0.781 1431 1HD1 ILE 88 1HD1 ILE 88 -8.209 -0.903 4.916 1432 2HD1 ILE 88 2HD1 ILE 88 -8.652 0.763 5.289 1433 3HD1 ILE 88 3HD1 ILE 88 -9.665 -0.566 5.852 1434 H MET 89 H MET 89 -9.470 -2.237 -0.417 1435 HA MET 89 HA MET 89 -6.813 -1.981 -1.560 1436 1HB MET 89 1HB MET 89 -9.434 -2.967 -2.689 1437 2HB MET 89 2HB MET 89 -7.950 -2.872 -3.627 1438 1HG MET 89 1HG MET 89 -6.917 -4.338 -1.815 1439 2HG MET 89 2HG MET 89 -8.572 -4.633 -1.286 1440 1HE MET 89 1HE MET 89 -9.619 -4.436 -4.776 1441 2HE MET 89 2HE MET 89 -10.131 -6.112 -4.576 1442 3HE MET 89 3HE MET 89 -10.389 -4.949 -3.274 1443 H VAL 90 H VAL 90 -6.116 -0.198 -2.523 1444 HA VAL 90 HA VAL 90 -8.062 1.567 -3.841 1445 HB VAL 90 HB VAL 90 -5.832 2.489 -2.022 1446 1HG1 VAL 90 1HG1 VAL 90 -6.645 4.753 -2.495 1447 2HG1 VAL 90 2HG1 VAL 90 -6.061 3.953 -3.955 1448 3HG1 VAL 90 3HG1 VAL 90 -7.795 4.094 -3.658 1449 1HG2 VAL 90 1HG2 VAL 90 -8.086 1.588 -1.087 1450 2HG2 VAL 90 2HG2 VAL 90 -7.431 3.104 -0.469 1451 3HG2 VAL 90 3HG2 VAL 90 -8.731 3.126 -1.661 1452 H ALA 91 H ALA 91 -7.524 1.372 -5.925 1453 HA ALA 91 HA ALA 91 -4.705 1.803 -6.658 1454 1HB ALA 91 1HB ALA 91 -5.004 0.244 -8.541 1455 2HB ALA 91 2HB ALA 91 -5.198 -0.545 -6.975 1456 3HB ALA 91 3HB ALA 91 -6.617 -0.143 -7.942 1457 HA PRO 92 HA PRO 92 -6.120 4.993 -9.323 1458 1HB PRO 92 1HB PRO 92 -4.274 4.865 -11.309 1459 2HB PRO 92 2HB PRO 92 -3.909 5.492 -9.697 1460 1HG PRO 92 1HG PRO 92 -3.357 2.783 -10.845 1461 2HG PRO 92 2HG PRO 92 -2.309 3.811 -9.850 1462 1HD PRO 92 1HD PRO 92 -3.699 1.724 -8.828 1463 2HD PRO 92 2HD PRO 92 -3.352 3.190 -7.890 1464 H ASP 93 H ASP 93 -8.004 4.674 -10.356 1465 HA ASP 93 HA ASP 93 -8.294 2.562 -12.321 1466 1HB ASP 93 1HB ASP 93 -10.299 4.652 -11.450 1467 2HB ASP 93 2HB ASP 93 -10.641 3.196 -12.380 1468 H LYS 94 H LYS 94 -10.012 3.613 -14.154 1469 HA LYS 94 HA LYS 94 -8.384 4.682 -16.096 1470 1HB LYS 94 1HB LYS 94 -11.177 4.142 -15.787 1471 2HB LYS 94 2HB LYS 94 -10.990 5.711 -16.559 1472 1HG LYS 94 1HG LYS 94 -9.655 4.740 -18.314 1473 2HG LYS 94 2HG LYS 94 -9.684 3.169 -17.509 1474 1HD LYS 94 1HD LYS 94 -12.127 3.095 -17.778 1475 2HD LYS 94 2HD LYS 94 -12.073 4.648 -18.615 1476 1HE LYS 94 1HE LYS 94 -10.511 3.564 -20.272 1477 2HE LYS 94 2HE LYS 94 -10.896 2.023 -19.507 1478 1HZ LYS 94 1HZ LYS 94 -12.535 1.972 -21.008 1479 2HZ LYS 94 2HZ LYS 94 -12.482 3.637 -21.302 1480 3HZ LYS 94 3HZ LYS 94 -13.336 3.040 -19.969 1481 H ASP 95 H ASP 95 -10.669 6.473 -14.030 1482 HA ASP 95 HA ASP 95 -8.912 8.779 -14.078 1483 1HB ASP 95 1HB ASP 95 -10.656 10.328 -14.850 1484 2HB ASP 95 2HB ASP 95 -10.274 9.131 -16.084 1485 H TYR 96 H TYR 96 -10.291 6.762 -12.231 1486 HA TYR 96 HA TYR 96 -11.049 8.740 -10.216 1487 1HB TYR 96 1HB TYR 96 -12.941 7.156 -9.524 1488 2HB TYR 96 2HB TYR 96 -13.203 8.140 -10.959 1489 HD1 TYR 96 HD1 TYR 96 -12.743 4.760 -9.674 1490 HD2 TYR 96 HD2 TYR 96 -13.180 7.117 -13.189 1491 HE1 TYR 96 HE1 TYR 96 -13.235 2.727 -10.969 1492 HE2 TYR 96 HE2 TYR 96 -13.675 5.091 -14.493 1493 HH TYR 96 HH TYR 96 -13.262 1.913 -13.178 1494 H PHE 97 H PHE 97 -11.584 7.321 -8.085 1495 HA PHE 97 HA PHE 97 -9.385 5.380 -7.809 1496 1HB PHE 97 1HB PHE 97 -10.213 7.604 -5.949 1497 2HB PHE 97 2HB PHE 97 -9.242 6.240 -5.403 1498 HD1 PHE 97 HD1 PHE 97 -7.406 5.789 -7.590 1499 HD2 PHE 97 HD2 PHE 97 -8.844 9.455 -5.974 1500 HE1 PHE 97 HE1 PHE 97 -5.368 6.927 -8.368 1501 HE2 PHE 97 HE2 PHE 97 -6.809 10.599 -6.750 1502 HZ PHE 97 HZ PHE 97 -5.068 9.335 -7.949 1503 H LEU 98 H LEU 98 -10.142 3.429 -7.367 1504 HA LEU 98 HA LEU 98 -12.788 3.118 -6.193 1505 1HB LEU 98 1HB LEU 98 -11.513 1.769 -8.162 1506 2HB LEU 98 2HB LEU 98 -11.171 0.729 -6.781 1507 HG LEU 98 HG LEU 98 -13.990 1.531 -7.109 1508 1HD1 LEU 98 1HD1 LEU 98 -12.635 -0.332 -9.053 1509 2HD1 LEU 98 2HD1 LEU 98 -13.418 1.201 -9.434 1510 3HD1 LEU 98 3HD1 LEU 98 -14.379 -0.160 -8.856 1511 1HD2 LEU 98 1HD2 LEU 98 -12.890 -1.235 -6.797 1512 2HD2 LEU 98 2HD2 LEU 98 -14.413 -0.564 -6.211 1513 3HD2 LEU 98 3HD2 LEU 98 -12.894 -0.112 -5.437 1514 H ILE 99 H ILE 99 -13.216 2.191 -4.234 1515 HA ILE 99 HA ILE 99 -10.912 1.419 -2.574 1516 HB ILE 99 HB ILE 99 -13.258 3.061 -1.613 1517 1HG1 ILE 99 1HG1 ILE 99 -11.088 4.609 -1.173 1518 2HG1 ILE 99 2HG1 ILE 99 -10.572 3.778 -2.636 1519 1HG2 ILE 99 1HG2 ILE 99 -12.636 2.567 0.460 1520 2HG2 ILE 99 2HG2 ILE 99 -11.524 1.375 -0.211 1521 3HG2 ILE 99 3HG2 ILE 99 -10.965 3.015 0.118 1522 1HD1 ILE 99 1HD1 ILE 99 -12.525 4.568 -3.813 1523 2HD1 ILE 99 2HD1 ILE 99 -13.135 5.325 -2.341 1524 3HD1 ILE 99 3HD1 ILE 99 -11.658 5.925 -3.095 1525 H VAL 100 H VAL 100 -11.169 -0.698 -2.260 1526 HA VAL 100 HA VAL 100 -13.868 -1.749 -1.761 1527 HB VAL 100 HB VAL 100 -11.370 -3.335 -2.356 1528 1HG1 VAL 100 1HG1 VAL 100 -13.194 -5.006 -3.074 1529 2HG1 VAL 100 2HG1 VAL 100 -12.897 -4.778 -1.349 1530 3HG1 VAL 100 3HG1 VAL 100 -14.282 -4.002 -2.117 1531 1HG2 VAL 100 1HG2 VAL 100 -12.786 -3.574 -4.608 1532 2HG2 VAL 100 2HG2 VAL 100 -13.276 -1.945 -4.145 1533 3HG2 VAL 100 3HG2 VAL 100 -11.569 -2.319 -4.376 1534 H ILE 101 H ILE 101 -14.383 -1.906 0.316 1535 HA ILE 101 HA ILE 101 -12.271 -2.568 2.256 1536 HB ILE 101 HB ILE 101 -14.975 -1.360 2.840 1537 1HG1 ILE 101 1HG1 ILE 101 -12.283 0.015 2.700 1538 2HG1 ILE 101 2HG1 ILE 101 -13.533 0.133 1.466 1539 1HG2 ILE 101 1HG2 ILE 101 -14.192 -1.008 5.040 1540 2HG2 ILE 101 2HG2 ILE 101 -13.778 -2.674 4.638 1541 3HG2 ILE 101 3HG2 ILE 101 -12.536 -1.422 4.597 1542 1HD1 ILE 101 1HD1 ILE 101 -14.916 0.861 3.675 1543 2HD1 ILE 101 2HD1 ILE 101 -13.306 1.472 4.057 1544 3HD1 ILE 101 3HD1 ILE 101 -14.114 1.982 2.575 1545 H GLN 102 H GLN 102 -12.344 -4.439 3.330 1546 HA GLN 102 HA GLN 102 -14.747 -5.803 3.987 1547 1HB GLN 102 1HB GLN 102 -14.638 -7.694 2.562 1548 2HB GLN 102 2HB GLN 102 -14.506 -6.289 1.513 1549 1HG GLN 102 1HG GLN 102 -12.070 -6.593 1.443 1550 2HG GLN 102 2HG GLN 102 -12.237 -8.031 2.448 1551 1HE2 GLN 102 1HE2 GLN 102 -12.285 -6.779 -0.693 1552 2HE2 GLN 102 2HE2 GLN 102 -12.779 -8.213 -1.521 1553 H ASN 103 H ASN 103 -14.259 -8.013 4.928 1554 HA ASN 103 HA ASN 103 -12.375 -7.821 6.940 1555 1HB ASN 103 1HB ASN 103 -14.054 -9.964 5.818 1556 2HB ASN 103 2HB ASN 103 -12.613 -10.530 6.658 1557 1HD2 ASN 103 1HD2 ASN 103 -15.617 -8.800 6.962 1558 2HD2 ASN 103 2HD2 ASN 103 -15.704 -8.854 8.687 1559 HA PRO 104 HA PRO 104 -8.449 -8.879 5.293 1560 1HB PRO 104 1HB PRO 104 -7.394 -10.448 7.242 1561 2HB PRO 104 2HB PRO 104 -7.609 -8.703 7.425 1562 1HG PRO 104 1HG PRO 104 -9.329 -10.939 8.427 1563 2HG PRO 104 2HG PRO 104 -8.825 -9.456 9.258 1564 1HD PRO 104 1HD PRO 104 -11.273 -9.738 8.136 1565 2HD PRO 104 2HD PRO 104 -10.433 -8.176 8.215 1566 H THR 105 H THR 105 -7.334 -10.445 4.152 1567 HA THR 105 HA THR 105 -8.014 -13.235 4.358 1568 HB THR 105 HB THR 105 -9.740 -13.111 2.908 1569 HG1 THR 105 HG1 THR 105 -8.948 -13.928 1.122 1570 1HG2 THR 105 1HG2 THR 105 -10.149 -10.834 2.784 1571 2HG2 THR 105 2HG2 THR 105 -9.784 -11.228 1.104 1572 3HG2 THR 105 3HG2 THR 105 -8.554 -10.479 2.121 1573 H GLU 106 H GLU 106 -6.795 -11.097 1.773 1574 HA GLU 106 HA GLU 106 -4.885 -11.178 0.531 1575 1HB GLU 106 1HB GLU 106 -3.873 -10.262 2.490 1576 2HB GLU 106 2HB GLU 106 -3.839 -11.830 3.283 1577 1HG GLU 106 1HG GLU 106 -2.388 -11.703 0.738 1578 2HG GLU 106 2HG GLU 106 -1.734 -10.692 2.025 Start of MODEL 8 1 H MET 11 H MET 11 17.698 -9.315 15.271 2 HA MET 11 HA MET 11 17.722 -8.150 12.581 3 1HB MET 11 1HB MET 11 19.479 -7.350 14.039 4 2HB MET 11 2HB MET 11 19.972 -8.996 14.411 5 1HG MET 11 1HG MET 11 21.210 -9.169 12.565 6 2HG MET 11 2HG MET 11 19.989 -8.393 11.560 7 1HE MET 11 1HE MET 11 20.085 -6.543 10.579 8 2HE MET 11 2HE MET 11 20.028 -5.151 11.660 9 3HE MET 11 3HE MET 11 21.396 -5.363 10.566 10 H ALA 12 H ALA 12 18.753 -11.096 14.294 11 HA ALA 12 HA ALA 12 19.605 -12.600 12.144 12 1HB ALA 12 1HB ALA 12 19.610 -14.388 13.555 13 2HB ALA 12 2HB ALA 12 19.462 -13.092 14.743 14 3HB ALA 12 3HB ALA 12 18.033 -13.995 14.240 15 H GLU 13 H GLU 13 16.311 -12.109 13.328 16 HA GLU 13 HA GLU 13 14.956 -13.994 11.827 17 1HB GLU 13 1HB GLU 13 14.212 -12.021 13.540 18 2HB GLU 13 2HB GLU 13 13.639 -11.359 12.015 19 1HG GLU 13 1HG GLU 13 12.633 -13.773 11.731 20 2HG GLU 13 2HG GLU 13 12.750 -13.779 13.490 21 H VAL 14 H VAL 14 15.687 -10.628 10.921 22 HA VAL 14 HA VAL 14 14.587 -10.772 8.332 23 HB VAL 14 HB VAL 14 16.833 -8.971 9.244 24 1HG1 VAL 14 1HG1 VAL 14 15.436 -7.494 7.516 25 2HG1 VAL 14 2HG1 VAL 14 16.765 -8.541 7.016 26 3HG1 VAL 14 3HG1 VAL 14 15.097 -9.091 6.848 27 1HG2 VAL 14 1HG2 VAL 14 13.874 -8.844 9.664 28 2HG2 VAL 14 2HG2 VAL 14 15.181 -8.531 10.807 29 3HG2 VAL 14 3HG2 VAL 14 14.819 -7.360 9.539 30 H GLU 15 H GLU 15 17.807 -11.461 9.584 31 HA GLU 15 HA GLU 15 19.125 -11.711 7.108 32 1HB GLU 15 1HB GLU 15 19.680 -12.843 9.843 33 2HB GLU 15 2HB GLU 15 20.724 -13.180 8.470 34 1HG GLU 15 1HG GLU 15 21.221 -10.842 8.208 35 2HG GLU 15 2HG GLU 15 20.070 -10.421 9.476 36 H GLU 16 H GLU 16 17.471 -14.084 9.155 37 HA GLU 16 HA GLU 16 18.093 -16.379 7.689 38 1HB GLU 16 1HB GLU 16 16.688 -15.877 9.966 39 2HB GLU 16 2HB GLU 16 15.388 -16.290 8.858 40 1HG GLU 16 1HG GLU 16 16.528 -18.402 8.335 41 2HG GLU 16 2HG GLU 16 17.786 -17.991 9.499 42 H THR 17 H THR 17 15.539 -13.992 7.264 43 HA THR 17 HA THR 17 14.251 -15.459 5.147 44 HB THR 17 HB THR 17 13.876 -12.598 6.054 45 HG1 THR 17 HG1 THR 17 13.295 -14.419 7.509 46 1HG2 THR 17 1HG2 THR 17 12.431 -14.284 4.029 47 2HG2 THR 17 2HG2 THR 17 13.063 -12.647 3.854 48 3HG2 THR 17 3HG2 THR 17 11.636 -12.940 4.848 49 H LEU 18 H LEU 18 16.755 -13.077 5.411 50 HA LEU 18 HA LEU 18 16.630 -12.171 2.700 51 1HB LEU 18 1HB LEU 18 18.078 -11.522 5.063 52 2HB LEU 18 2HB LEU 18 19.233 -11.807 3.763 53 HG LEU 18 HG LEU 18 17.514 -10.168 2.498 54 1HD1 LEU 18 1HD1 LEU 18 17.220 -9.656 5.420 55 2HD1 LEU 18 2HD1 LEU 18 16.015 -9.584 4.136 56 3HD1 LEU 18 3HD1 LEU 18 17.210 -8.297 4.297 57 1HD2 LEU 18 1HD2 LEU 18 20.071 -9.910 3.862 58 2HD2 LEU 18 2HD2 LEU 18 19.201 -8.381 3.743 59 3HD2 LEU 18 3HD2 LEU 18 19.561 -9.307 2.285 60 H LYS 19 H LYS 19 18.375 -14.677 4.431 61 HA LYS 19 HA LYS 19 20.255 -15.313 2.436 62 1HB LYS 19 1HB LYS 19 20.593 -16.143 4.653 63 2HB LYS 19 2HB LYS 19 19.035 -16.958 4.653 64 1HG LYS 19 1HG LYS 19 19.931 -18.795 3.805 65 2HG LYS 19 2HG LYS 19 20.639 -17.892 2.463 66 1HD LYS 19 1HD LYS 19 22.581 -18.567 3.402 67 2HD LYS 19 2HD LYS 19 22.310 -17.169 4.446 68 1HE LYS 19 1HE LYS 19 20.963 -19.611 5.337 69 2HE LYS 19 2HE LYS 19 22.721 -19.731 5.306 70 1HZ LYS 19 1HZ LYS 19 21.085 -17.738 6.773 71 2HZ LYS 19 2HZ LYS 19 22.765 -17.629 6.610 72 3HZ LYS 19 3HZ LYS 19 22.079 -18.937 7.434 73 H ARG 20 H ARG 20 17.093 -16.773 3.182 74 HA ARG 20 HA ARG 20 17.124 -18.601 1.029 75 1HB ARG 20 1HB ARG 20 15.646 -18.651 3.109 76 2HB ARG 20 2HB ARG 20 14.641 -17.457 2.298 77 1HG ARG 20 1HG ARG 20 13.527 -19.207 1.491 78 2HG ARG 20 2HG ARG 20 14.891 -19.394 0.386 79 1HD ARG 20 1HD ARG 20 15.034 -20.627 3.097 80 2HD ARG 20 2HD ARG 20 14.057 -21.405 1.853 81 HE ARG 20 HE ARG 20 16.489 -20.917 0.674 82 1HH1 ARG 20 1HH1 ARG 20 15.353 -22.674 3.457 83 2HH1 ARG 20 2HH1 ARG 20 16.619 -23.855 3.390 84 1HH2 ARG 20 1HH2 ARG 20 18.161 -22.466 0.576 85 2HH2 ARG 20 2HH2 ARG 20 18.216 -23.735 1.752 86 H LEU 21 H LEU 21 16.125 -15.263 1.313 87 HA LEU 21 HA LEU 21 14.657 -15.131 -1.115 88 1HB LEU 21 1HB LEU 21 15.637 -13.265 0.916 89 2HB LEU 21 2HB LEU 21 15.560 -12.583 -0.707 90 HG LEU 21 HG LEU 21 13.198 -13.012 -0.834 91 1HD1 LEU 21 1HD1 LEU 21 12.337 -14.741 0.256 92 2HD1 LEU 21 2HD1 LEU 21 12.466 -13.805 1.745 93 3HD1 LEU 21 3HD1 LEU 21 13.775 -14.886 1.267 94 1HD2 LEU 21 1HD2 LEU 21 13.722 -10.936 0.191 95 2HD2 LEU 21 2HD2 LEU 21 14.074 -11.710 1.736 96 3HD2 LEU 21 3HD2 LEU 21 12.416 -11.655 1.133 97 H GLN 22 H GLN 22 17.951 -14.061 -0.269 98 HA GLN 22 HA GLN 22 18.659 -13.315 -2.901 99 1HB GLN 22 1HB GLN 22 19.831 -13.171 -0.364 100 2HB GLN 22 2HB GLN 22 20.932 -14.158 -1.317 101 1HG GLN 22 1HG GLN 22 21.673 -12.402 -2.452 102 2HG GLN 22 2HG GLN 22 20.040 -11.826 -2.778 103 1HE2 GLN 22 1HE2 GLN 22 18.989 -11.087 -0.532 104 2HE2 GLN 22 2HE2 GLN 22 19.941 -9.913 0.305 105 H SER 23 H SER 23 18.423 -16.355 -1.347 106 HA SER 23 HA SER 23 20.275 -17.719 -3.092 107 1HB SER 23 1HB SER 23 19.851 -18.457 -0.744 108 2HB SER 23 2HB SER 23 18.213 -18.905 -1.219 109 HG SER 23 HG SER 23 18.984 -20.684 -2.005 110 H GLN 24 H GLN 24 16.926 -16.898 -3.084 111 HA GLN 24 HA GLN 24 16.336 -18.809 -5.222 112 1HB GLN 24 1HB GLN 24 14.003 -18.204 -4.893 113 2HB GLN 24 2HB GLN 24 14.737 -18.642 -3.356 114 1HG GLN 24 1HG GLN 24 14.828 -16.398 -2.645 115 2HG GLN 24 2HG GLN 24 14.475 -15.794 -4.263 116 1HE2 GLN 24 1HE2 GLN 24 12.955 -14.732 -2.466 117 2HE2 GLN 24 2HE2 GLN 24 11.373 -15.424 -2.420 118 H LYS 25 H LYS 25 15.273 -18.086 -7.170 119 HA LYS 25 HA LYS 25 16.492 -15.701 -8.222 120 1HB LYS 25 1HB LYS 25 16.321 -17.709 -9.603 121 2HB LYS 25 2HB LYS 25 14.567 -17.666 -9.478 122 1HG LYS 25 1HG LYS 25 14.372 -16.145 -11.100 123 2HG LYS 25 2HG LYS 25 15.731 -15.191 -10.501 124 1HD LYS 25 1HD LYS 25 17.223 -16.229 -11.850 125 2HD LYS 25 2HD LYS 25 16.416 -17.793 -11.715 126 1HE LYS 25 1HE LYS 25 14.592 -16.809 -13.181 127 2HE LYS 25 2HE LYS 25 15.698 -15.471 -13.489 128 1HZ LYS 25 1HZ LYS 25 15.748 -17.287 -15.173 129 2HZ LYS 25 2HZ LYS 25 16.394 -18.310 -13.991 130 3HZ LYS 25 3HZ LYS 25 17.252 -16.937 -14.482 131 H GLY 26 H GLY 26 15.436 -13.871 -9.033 132 1HA GLY 26 1HA GLY 26 13.346 -12.716 -9.542 133 2HA GLY 26 2HA GLY 26 12.626 -13.560 -8.179 134 H VAL 27 H VAL 27 14.424 -13.187 -6.182 135 HA VAL 27 HA VAL 27 13.813 -10.682 -5.182 136 HB VAL 27 HB VAL 27 16.202 -12.396 -4.483 137 1HG1 VAL 27 1HG1 VAL 27 15.598 -11.087 -2.211 138 2HG1 VAL 27 2HG1 VAL 27 16.799 -10.521 -3.374 139 3HG1 VAL 27 3HG1 VAL 27 15.165 -9.857 -3.398 140 1HG2 VAL 27 1HG2 VAL 27 13.410 -12.275 -3.352 141 2HG2 VAL 27 2HG2 VAL 27 14.160 -13.630 -4.194 142 3HG2 VAL 27 3HG2 VAL 27 14.750 -13.144 -2.605 143 H GLN 28 H GLN 28 14.531 -8.692 -5.560 144 HA GLN 28 HA GLN 28 16.855 -8.344 -7.295 145 1HB GLN 28 1HB GLN 28 14.372 -6.901 -6.834 146 2HB GLN 28 2HB GLN 28 15.769 -5.833 -6.806 147 1HG GLN 28 1HG GLN 28 16.361 -6.357 -9.003 148 2HG GLN 28 2HG GLN 28 15.349 -7.799 -9.025 149 1HE2 GLN 28 1HE2 GLN 28 13.374 -7.643 -9.847 150 2HE2 GLN 28 2HE2 GLN 28 12.566 -6.169 -10.244 151 H GLY 29 H GLY 29 15.758 -7.709 -4.045 152 1HA GLY 29 1HA GLY 29 18.150 -7.560 -2.794 153 2HA GLY 29 2HA GLY 29 17.952 -5.932 -3.424 154 H ILE 30 H ILE 30 17.822 -7.398 -0.665 155 HA ILE 30 HA ILE 30 15.256 -6.275 0.225 156 HB ILE 30 HB ILE 30 17.072 -8.085 1.811 157 1HG1 ILE 30 1HG1 ILE 30 15.019 -9.692 1.123 158 2HG1 ILE 30 2HG1 ILE 30 15.102 -8.690 -0.322 159 1HG2 ILE 30 1HG2 ILE 30 15.614 -7.046 3.293 160 2HG2 ILE 30 2HG2 ILE 30 14.278 -7.063 2.142 161 3HG2 ILE 30 3HG2 ILE 30 14.793 -8.561 2.917 162 1HD1 ILE 30 1HD1 ILE 30 16.936 -9.715 -1.043 163 2HD1 ILE 30 2HD1 ILE 30 17.707 -9.640 0.543 164 3HD1 ILE 30 3HD1 ILE 30 16.579 -10.943 0.171 165 H ILE 31 H ILE 31 15.143 -4.733 1.804 166 HA ILE 31 HA ILE 31 17.684 -3.719 2.888 167 HB ILE 31 HB ILE 31 15.423 -2.010 1.842 168 1HG1 ILE 31 1HG1 ILE 31 18.098 -1.636 0.720 169 2HG1 ILE 31 2HG1 ILE 31 17.441 -3.239 0.408 170 1HG2 ILE 31 1HG2 ILE 31 16.969 -0.131 2.326 171 2HG2 ILE 31 2HG2 ILE 31 16.421 -0.981 3.770 172 3HG2 ILE 31 3HG2 ILE 31 18.041 -1.272 3.138 173 1HD1 ILE 31 1HD1 ILE 31 16.980 -1.010 -1.093 174 2HD1 ILE 31 2HD1 ILE 31 15.982 -2.464 -1.085 175 3HD1 ILE 31 3HD1 ILE 31 15.539 -1.085 -0.079 176 H VAL 32 H VAL 32 17.619 -2.895 4.963 177 HA VAL 32 HA VAL 32 15.042 -3.079 6.376 178 HB VAL 32 HB VAL 32 17.622 -3.862 7.701 179 1HG1 VAL 32 1HG1 VAL 32 16.147 -5.024 9.241 180 2HG1 VAL 32 2HG1 VAL 32 15.678 -3.328 9.106 181 3HG1 VAL 32 3HG1 VAL 32 14.746 -4.571 8.271 182 1HG2 VAL 32 1HG2 VAL 32 15.754 -5.657 6.159 183 2HG2 VAL 32 2HG2 VAL 32 17.452 -5.339 5.806 184 3HG2 VAL 32 3HG2 VAL 32 17.005 -6.226 7.263 185 H VAL 33 H VAL 33 14.524 -1.174 7.202 186 HA VAL 33 HA VAL 33 16.687 0.664 7.992 187 HB VAL 33 HB VAL 33 13.856 1.524 7.465 188 1HG1 VAL 33 1HG1 VAL 33 16.220 2.811 8.320 189 2HG1 VAL 33 2HG1 VAL 33 15.874 3.383 6.687 190 3HG1 VAL 33 3HG1 VAL 33 14.655 3.536 7.952 191 1HG2 VAL 33 1HG2 VAL 33 16.021 0.935 5.486 192 2HG2 VAL 33 2HG2 VAL 33 14.301 0.554 5.407 193 3HG2 VAL 33 3HG2 VAL 33 14.847 2.214 5.170 194 H ASN 34 H ASN 34 16.743 1.490 10.019 195 HA ASN 34 HA ASN 34 14.990 0.274 11.987 196 1HB ASN 34 1HB ASN 34 16.510 1.427 13.625 197 2HB ASN 34 2HB ASN 34 17.325 0.301 12.543 198 1HD2 ASN 34 1HD2 ASN 34 19.257 1.456 13.089 199 2HD2 ASN 34 2HD2 ASN 34 19.635 2.935 12.281 200 H THR 35 H THR 35 14.686 2.019 13.957 201 HA THR 35 HA THR 35 12.592 3.695 13.072 202 HB THR 35 HB THR 35 13.448 4.621 15.605 203 HG1 THR 35 HG1 THR 35 13.334 1.794 15.632 204 1HG2 THR 35 1HG2 THR 35 11.334 4.023 16.239 205 2HG2 THR 35 2HG2 THR 35 11.395 2.482 15.383 206 3HG2 THR 35 3HG2 THR 35 11.124 3.977 14.489 207 H GLU 36 H GLU 36 15.991 4.189 13.428 208 HA GLU 36 HA GLU 36 15.867 7.056 13.562 209 1HB GLU 36 1HB GLU 36 18.007 5.004 13.409 210 2HB GLU 36 2HB GLU 36 18.405 6.611 12.819 211 1HG GLU 36 1HG GLU 36 17.234 7.224 15.173 212 2HG GLU 36 2HG GLU 36 17.949 5.659 15.557 213 H GLY 37 H GLY 37 15.869 4.673 11.065 214 1HA GLY 37 1HA GLY 37 15.110 5.267 8.865 215 2HA GLY 37 2HA GLY 37 15.875 6.836 9.068 216 H ILE 38 H ILE 38 18.043 4.762 10.305 217 HA ILE 38 HA ILE 38 19.671 4.851 7.914 218 HB ILE 38 HB ILE 38 20.330 3.717 10.635 219 1HG1 ILE 38 1HG1 ILE 38 21.089 6.395 9.452 220 2HG1 ILE 38 2HG1 ILE 38 19.786 6.160 10.612 221 1HG2 ILE 38 1HG2 ILE 38 22.158 4.485 8.363 222 2HG2 ILE 38 2HG2 ILE 38 22.638 3.813 9.921 223 3HG2 ILE 38 3HG2 ILE 38 21.706 2.834 8.789 224 1HD1 ILE 38 1HD1 ILE 38 21.688 5.054 12.036 225 2HD1 ILE 38 2HD1 ILE 38 22.725 6.043 11.009 226 3HD1 ILE 38 3HD1 ILE 38 21.477 6.804 11.995 227 HA PRO 39 HA PRO 39 18.638 0.761 6.581 228 1HB PRO 39 1HB PRO 39 20.651 0.466 4.782 229 2HB PRO 39 2HB PRO 39 19.231 1.474 4.478 230 1HG PRO 39 1HG PRO 39 21.969 2.280 5.381 231 2HG PRO 39 2HG PRO 39 20.918 3.046 4.176 232 1HD PRO 39 1HD PRO 39 21.164 3.987 6.703 233 2HD PRO 39 2HD PRO 39 19.655 4.122 5.777 234 H ILE 40 H ILE 40 19.216 -0.113 8.718 235 HA ILE 40 HA ILE 40 21.724 -0.785 9.618 236 HB ILE 40 HB ILE 40 20.552 -2.839 10.647 237 1HG1 ILE 40 1HG1 ILE 40 18.046 -1.394 9.833 238 2HG1 ILE 40 2HG1 ILE 40 18.721 -2.660 8.813 239 1HG2 ILE 40 1HG2 ILE 40 20.142 -1.531 12.419 240 2HG2 ILE 40 2HG2 ILE 40 20.756 -0.228 11.402 241 3HG2 ILE 40 3HG2 ILE 40 19.019 -0.507 11.524 242 1HD1 ILE 40 1HD1 ILE 40 18.440 -3.395 11.630 243 2HD1 ILE 40 2HD1 ILE 40 16.923 -3.057 10.797 244 3HD1 ILE 40 3HD1 ILE 40 18.018 -4.289 10.170 245 H LYS 41 H LYS 41 19.767 -2.409 7.192 246 HA LYS 41 HA LYS 41 22.119 -3.919 6.356 247 1HB LYS 41 1HB LYS 41 19.950 -5.096 7.785 248 2HB LYS 41 2HB LYS 41 19.891 -5.682 6.127 249 1HG LYS 41 1HG LYS 41 22.588 -5.795 6.949 250 2HG LYS 41 2HG LYS 41 21.610 -6.479 8.251 251 1HD LYS 41 1HD LYS 41 22.000 -8.323 6.905 252 2HD LYS 41 2HD LYS 41 20.425 -7.769 6.333 253 1HE LYS 41 1HE LYS 41 21.220 -7.339 4.293 254 2HE LYS 41 2HE LYS 41 22.609 -6.467 4.940 255 1HZ LYS 41 1HZ LYS 41 23.430 -8.319 3.747 256 2HZ LYS 41 2HZ LYS 41 22.359 -9.388 4.501 257 3HZ LYS 41 3HZ LYS 41 23.620 -8.691 5.387 258 H SER 42 H SER 42 22.203 -4.324 4.179 259 HA SER 42 HA SER 42 19.944 -4.135 2.456 260 1HB SER 42 1HB SER 42 20.321 -1.719 3.006 261 2HB SER 42 2HB SER 42 21.923 -1.852 2.281 262 HG SER 42 HG SER 42 21.050 -2.011 0.325 263 H THR 43 H THR 43 20.392 -4.850 0.386 264 HA THR 43 HA THR 43 23.160 -5.760 -0.056 265 HB THR 43 HB THR 43 22.348 -7.655 -1.246 266 HG1 THR 43 HG1 THR 43 20.563 -7.374 -2.341 267 1HG2 THR 43 1HG2 THR 43 20.276 -7.951 0.743 268 2HG2 THR 43 2HG2 THR 43 21.716 -7.209 1.440 269 3HG2 THR 43 3HG2 THR 43 21.835 -8.765 0.620 270 H MET 44 H MET 44 20.623 -3.815 -1.229 271 HA MET 44 HA MET 44 21.150 -3.867 -3.997 272 1HB MET 44 1HB MET 44 20.065 -1.573 -2.354 273 2HB MET 44 2HB MET 44 19.909 -1.771 -4.095 274 1HG MET 44 1HG MET 44 18.905 -4.026 -2.522 275 2HG MET 44 2HG MET 44 18.048 -2.508 -2.265 276 1HE MET 44 1HE MET 44 19.770 -2.981 -5.731 277 2HE MET 44 2HE MET 44 19.632 -4.639 -5.147 278 3HE MET 44 3HE MET 44 18.681 -4.111 -6.536 279 H ASP 45 H ASP 45 21.649 -1.366 -4.869 280 HA ASP 45 HA ASP 45 24.470 -1.166 -4.606 281 1HB ASP 45 1HB ASP 45 22.602 -0.305 -6.447 282 2HB ASP 45 2HB ASP 45 23.144 1.198 -5.707 283 H ASN 46 H ASN 46 25.521 1.024 -4.157 284 HA ASN 46 HA ASN 46 25.039 1.709 -1.460 285 1HB ASN 46 1HB ASN 46 27.071 2.156 -3.357 286 2HB ASN 46 2HB ASN 46 26.538 3.752 -2.839 287 1HD2 ASN 46 1HD2 ASN 46 25.844 3.238 -0.224 288 2HD2 ASN 46 2HD2 ASN 46 27.263 2.825 0.670 289 HA PRO 47 HA PRO 47 23.317 5.883 -3.191 290 1HB PRO 47 1HB PRO 47 22.803 6.003 -5.854 291 2HB PRO 47 2HB PRO 47 24.366 6.444 -5.156 292 1HG PRO 47 1HG PRO 47 23.535 3.891 -6.481 293 2HG PRO 47 2HG PRO 47 25.042 4.808 -6.665 294 1HD PRO 47 1HD PRO 47 24.860 2.603 -5.104 295 2HD PRO 47 2HD PRO 47 25.945 3.955 -4.724 296 H THR 48 H THR 48 22.267 2.833 -4.533 297 HA THR 48 HA THR 48 19.538 3.627 -4.925 298 HB THR 48 HB THR 48 20.770 0.867 -4.810 299 HG1 THR 48 HG1 THR 48 21.235 2.555 -6.580 300 1HG2 THR 48 1HG2 THR 48 18.375 0.799 -4.315 301 2HG2 THR 48 2HG2 THR 48 18.707 0.116 -5.907 302 3HG2 THR 48 3HG2 THR 48 18.041 1.743 -5.766 303 H THR 49 H THR 49 21.353 1.940 -2.415 304 HA THR 49 HA THR 49 19.133 1.137 -0.862 305 HB THR 49 HB THR 49 22.002 1.636 -0.053 306 HG1 THR 49 HG1 THR 49 21.457 -0.116 -1.578 307 1HG2 THR 49 1HG2 THR 49 21.467 0.282 1.944 308 2HG2 THR 49 2HG2 THR 49 19.767 0.300 1.477 309 3HG2 THR 49 3HG2 THR 49 20.579 1.804 1.907 310 H THR 50 H THR 50 21.346 3.909 -0.530 311 HA THR 50 HA THR 50 20.192 5.081 1.706 312 HB THR 50 HB THR 50 21.091 7.036 -0.283 313 HG1 THR 50 HG1 THR 50 22.710 5.891 -1.005 314 1HG2 THR 50 1HG2 THR 50 20.906 7.091 2.344 315 2HG2 THR 50 2HG2 THR 50 22.199 7.955 1.512 316 3HG2 THR 50 3HG2 THR 50 22.521 6.388 2.254 317 H GLN 51 H GLN 51 19.419 5.566 -1.725 318 HA GLN 51 HA GLN 51 17.398 7.508 -1.255 319 1HB GLN 51 1HB GLN 51 18.566 7.283 -3.414 320 2HB GLN 51 2HB GLN 51 17.811 5.712 -3.652 321 1HG GLN 51 1HG GLN 51 15.737 7.543 -3.125 322 2HG GLN 51 2HG GLN 51 16.816 8.304 -4.293 323 1HE2 GLN 51 1HE2 GLN 51 14.726 5.587 -3.665 324 2HE2 GLN 51 2HE2 GLN 51 14.556 5.083 -5.308 325 H TYR 52 H TYR 52 17.374 4.005 -1.694 326 HA TYR 52 HA TYR 52 14.588 3.665 -1.839 327 1HB TYR 52 1HB TYR 52 16.924 1.921 -1.289 328 2HB TYR 52 2HB TYR 52 15.357 1.328 -0.748 329 HD1 TYR 52 HD1 TYR 52 14.881 -0.419 -2.224 330 HD2 TYR 52 HD2 TYR 52 16.165 3.326 -3.782 331 HE1 TYR 52 HE1 TYR 52 14.390 -1.205 -4.502 332 HE2 TYR 52 HE2 TYR 52 15.677 2.551 -6.065 333 HH TYR 52 HH TYR 52 15.372 -0.480 -6.950 334 H ALA 53 H ALA 53 16.790 3.319 0.942 335 HA ALA 53 HA ALA 53 14.720 2.902 2.834 336 1HB ALA 53 1HB ALA 53 17.626 3.603 3.061 337 2HB ALA 53 2HB ALA 53 16.585 3.529 4.484 338 3HB ALA 53 3HB ALA 53 16.809 2.096 3.481 339 H SER 54 H SER 54 15.935 5.705 1.302 340 HA SER 54 HA SER 54 15.296 7.587 3.355 341 1HB SER 54 1HB SER 54 16.217 7.699 0.545 342 2HB SER 54 2HB SER 54 15.299 9.096 1.105 343 HG SER 54 HG SER 54 17.711 9.010 1.441 344 H LEU 55 H LEU 55 13.654 6.409 0.452 345 HA LEU 55 HA LEU 55 11.322 8.055 1.025 346 1HB LEU 55 1HB LEU 55 10.628 7.647 -1.111 347 2HB LEU 55 2HB LEU 55 12.373 7.490 -1.304 348 HG LEU 55 HG LEU 55 11.798 4.931 -0.851 349 1HD1 LEU 55 1HD1 LEU 55 9.712 4.229 -1.512 350 2HD1 LEU 55 2HD1 LEU 55 9.382 5.705 -2.420 351 3HD1 LEU 55 3HD1 LEU 55 9.320 5.722 -0.658 352 1HD2 LEU 55 1HD2 LEU 55 12.255 4.599 -3.059 353 2HD2 LEU 55 2HD2 LEU 55 12.742 6.289 -2.919 354 3HD2 LEU 55 3HD2 LEU 55 11.165 5.878 -3.594 355 H MET 56 H MET 56 12.414 4.774 1.336 356 HA MET 56 HA MET 56 9.918 3.494 1.596 357 1HB MET 56 1HB MET 56 12.714 2.842 2.442 358 2HB MET 56 2HB MET 56 11.384 1.857 3.034 359 1HG MET 56 1HG MET 56 11.931 2.385 0.125 360 2HG MET 56 2HG MET 56 12.501 0.969 1.004 361 1HE MET 56 1HE MET 56 9.025 2.567 -0.629 362 2HE MET 56 2HE MET 56 10.505 2.040 -1.429 363 3HE MET 56 3HE MET 56 9.062 1.027 -1.489 364 H HIS 57 H HIS 57 12.221 4.348 4.189 365 HA HIS 57 HA HIS 57 10.522 3.873 6.331 366 1HB HIS 57 1HB HIS 57 12.926 4.234 6.603 367 2HB HIS 57 2HB HIS 57 12.743 5.918 6.121 368 HD1 HIS 57 HD1 HIS 57 12.878 3.817 9.041 369 HD2 HIS 57 HD2 HIS 57 11.017 7.395 8.042 370 HE1 HIS 57 HE1 HIS 57 12.266 4.892 11.231 371 H SER 58 H SER 58 10.766 6.658 4.232 372 HA SER 58 HA SER 58 9.133 8.356 5.871 373 1HB SER 58 1HB SER 58 10.806 8.711 3.643 374 2HB SER 58 2HB SER 58 9.190 9.147 3.089 375 HG SER 58 HG SER 58 10.031 10.970 3.981 376 H PHE 59 H PHE 59 8.579 5.961 3.449 377 HA PHE 59 HA PHE 59 6.080 6.765 2.478 378 1HB PHE 59 1HB PHE 59 7.593 4.875 1.637 379 2HB PHE 59 2HB PHE 59 6.866 3.887 2.899 380 HD1 PHE 59 HD1 PHE 59 4.205 3.990 2.925 381 HD2 PHE 59 HD2 PHE 59 6.670 4.772 -0.455 382 HE1 PHE 59 HE1 PHE 59 2.318 3.469 1.434 383 HE2 PHE 59 HE2 PHE 59 4.787 4.253 -1.952 384 HZ PHE 59 HZ PHE 59 2.608 3.602 -1.008 385 H ILE 60 H ILE 60 6.792 4.390 5.043 386 HA ILE 60 HA ILE 60 4.152 3.983 5.857 387 HB ILE 60 HB ILE 60 6.704 3.765 7.454 388 1HG1 ILE 60 1HG1 ILE 60 5.285 1.318 6.761 389 2HG1 ILE 60 2HG1 ILE 60 5.749 2.239 5.334 390 1HG2 ILE 60 1HG2 ILE 60 5.068 3.936 9.101 391 2HG2 ILE 60 2HG2 ILE 60 3.874 3.064 8.140 392 3HG2 ILE 60 3HG2 ILE 60 5.229 2.196 8.862 393 1HD1 ILE 60 1HD1 ILE 60 7.330 0.469 6.705 394 2HD1 ILE 60 2HD1 ILE 60 7.889 1.686 5.558 395 3HD1 ILE 60 3HD1 ILE 60 7.889 2.037 7.286 396 H LEU 61 H LEU 61 6.541 6.363 6.910 397 HA LEU 61 HA LEU 61 5.135 7.426 9.081 398 1HB LEU 61 1HB LEU 61 7.515 7.969 7.721 399 2HB LEU 61 2HB LEU 61 6.580 9.461 7.638 400 HG LEU 61 HG LEU 61 6.439 9.539 10.061 401 1HD1 LEU 61 1HD1 LEU 61 6.400 7.447 10.950 402 2HD1 LEU 61 2HD1 LEU 61 8.108 7.813 11.189 403 3HD1 LEU 61 3HD1 LEU 61 7.602 6.821 9.822 404 1HD2 LEU 61 1HD2 LEU 61 8.367 10.634 10.044 405 2HD2 LEU 61 2HD2 LEU 61 8.780 9.843 8.522 406 3HD2 LEU 61 3HD2 LEU 61 9.266 9.116 10.055 407 H LYS 62 H LYS 62 4.901 8.059 5.636 408 HA LYS 62 HA LYS 62 3.154 10.318 5.932 409 1HB LYS 62 1HB LYS 62 4.604 9.078 3.819 410 2HB LYS 62 2HB LYS 62 2.912 9.143 3.342 411 1HG LYS 62 1HG LYS 62 4.101 11.108 2.573 412 2HG LYS 62 2HG LYS 62 2.882 11.549 3.771 413 1HD LYS 62 1HD LYS 62 4.418 12.321 5.211 414 2HD LYS 62 2HD LYS 62 5.501 10.956 4.927 415 1HE LYS 62 1HE LYS 62 5.172 13.164 2.918 416 2HE LYS 62 2HE LYS 62 6.315 13.289 4.255 417 1HZ LYS 62 1HZ LYS 62 6.553 10.800 2.883 418 2HZ LYS 62 2HZ LYS 62 7.738 11.961 3.215 419 3HZ LYS 62 3HZ LYS 62 6.775 12.107 1.832 420 H ALA 63 H ALA 63 2.701 6.976 4.779 421 HA ALA 63 HA ALA 63 -0.062 7.085 4.422 422 1HB ALA 63 1HB ALA 63 0.442 4.481 5.221 423 2HB ALA 63 2HB ALA 63 0.502 5.106 3.572 424 3HB ALA 63 3HB ALA 63 1.975 5.028 4.539 425 H ARG 64 H ARG 64 1.844 6.329 7.302 426 HA ARG 64 HA ARG 64 -0.119 5.397 8.995 427 1HB ARG 64 1HB ARG 64 2.341 5.577 9.487 428 2HB ARG 64 2HB ARG 64 2.089 7.287 9.814 429 1HG ARG 64 1HG ARG 64 0.186 6.048 11.378 430 2HG ARG 64 2HG ARG 64 1.583 4.976 11.490 431 1HD ARG 64 1HD ARG 64 1.891 7.936 11.824 432 2HD ARG 64 2HD ARG 64 1.357 6.930 13.170 433 HE ARG 64 HE ARG 64 4.005 7.129 12.119 434 1HH1 ARG 64 1HH1 ARG 64 1.756 4.986 13.691 435 2HH1 ARG 64 2HH1 ARG 64 2.991 4.012 14.419 436 1HH2 ARG 64 1HH2 ARG 64 5.640 5.855 13.072 437 2HH2 ARG 64 2HH2 ARG 64 5.200 4.508 14.067 438 H SER 65 H SER 65 0.883 8.792 8.572 439 HA SER 65 HA SER 65 -0.933 9.970 10.299 440 1HB SER 65 1HB SER 65 1.015 10.960 8.782 441 2HB SER 65 2HB SER 65 -0.339 11.363 7.727 442 HG SER 65 HG SER 65 0.079 13.049 9.189 443 H THR 66 H THR 66 -1.431 8.643 7.128 444 HA THR 66 HA THR 66 -4.020 9.876 6.769 445 HB THR 66 HB THR 66 -3.596 7.605 5.043 446 HG1 THR 66 HG1 THR 66 -1.658 8.282 4.092 447 1HG2 THR 66 1HG2 THR 66 -3.409 10.505 4.278 448 2HG2 THR 66 2HG2 THR 66 -4.948 9.767 4.724 449 3HG2 THR 66 3HG2 THR 66 -4.043 9.153 3.341 450 H VAL 67 H VAL 67 -2.755 6.670 7.580 451 HA VAL 67 HA VAL 67 -5.088 5.192 7.559 452 HB VAL 67 HB VAL 67 -2.789 4.956 9.506 453 1HG1 VAL 67 1HG1 VAL 67 -3.980 3.380 10.522 454 2HG1 VAL 67 2HG1 VAL 67 -5.288 3.549 9.350 455 3HG1 VAL 67 3HG1 VAL 67 -3.948 2.450 9.025 456 1HG2 VAL 67 1HG2 VAL 67 -1.707 4.516 7.573 457 2HG2 VAL 67 2HG2 VAL 67 -2.467 2.935 7.755 458 3HG2 VAL 67 3HG2 VAL 67 -3.193 4.145 6.698 459 H ARG 68 H ARG 68 -3.662 6.786 10.419 460 HA ARG 68 HA ARG 68 -5.771 6.307 12.168 461 1HB ARG 68 1HB ARG 68 -4.809 7.944 13.593 462 2HB ARG 68 2HB ARG 68 -3.471 7.193 12.734 463 1HG ARG 68 1HG ARG 68 -4.089 9.299 11.106 464 2HG ARG 68 2HG ARG 68 -4.401 9.957 12.713 465 1HD ARG 68 1HD ARG 68 -1.848 8.798 11.631 466 2HD ARG 68 2HD ARG 68 -2.135 10.424 12.251 467 HE ARG 68 HE ARG 68 -1.564 8.052 13.785 468 1HH1 ARG 68 1HH1 ARG 68 -2.915 11.261 13.826 469 2HH1 ARG 68 2HH1 ARG 68 -2.700 11.471 15.532 470 1HH2 ARG 68 1HH2 ARG 68 -1.276 8.317 16.033 471 2HH2 ARG 68 2HH2 ARG 68 -1.767 9.796 16.786 472 H ASP 69 H ASP 69 -5.484 8.593 9.593 473 HA ASP 69 HA ASP 69 -7.475 10.425 10.468 474 1HB ASP 69 1HB ASP 69 -5.704 10.177 8.257 475 2HB ASP 69 2HB ASP 69 -7.333 10.368 7.614 476 H ILE 70 H ILE 70 -7.563 7.343 8.902 477 HA ILE 70 HA ILE 70 -10.143 7.554 7.738 478 HB ILE 70 HB ILE 70 -8.655 5.075 8.612 479 1HG1 ILE 70 1HG1 ILE 70 -8.871 6.156 5.810 480 2HG1 ILE 70 2HG1 ILE 70 -7.581 6.667 6.893 481 1HG2 ILE 70 1HG2 ILE 70 -11.309 5.407 7.690 482 2HG2 ILE 70 2HG2 ILE 70 -10.385 4.648 6.394 483 3HG2 ILE 70 3HG2 ILE 70 -10.435 3.906 7.993 484 1HD1 ILE 70 1HD1 ILE 70 -7.921 4.176 5.416 485 2HD1 ILE 70 2HD1 ILE 70 -6.458 4.948 6.030 486 3HD1 ILE 70 3HD1 ILE 70 -7.447 3.955 7.100 487 H ASP 71 H ASP 71 -8.985 6.175 10.801 488 HA ASP 71 HA ASP 71 -11.554 6.714 12.023 489 1HB ASP 71 1HB ASP 71 -10.642 3.978 11.325 490 2HB ASP 71 2HB ASP 71 -11.334 4.190 12.932 491 HA PRO 72 HA PRO 72 -9.153 7.346 15.637 492 1HB PRO 72 1HB PRO 72 -10.814 6.489 17.606 493 2HB PRO 72 2HB PRO 72 -11.088 7.981 16.700 494 1HG PRO 72 1HG PRO 72 -12.332 5.284 16.328 495 2HG PRO 72 2HG PRO 72 -13.097 6.883 16.291 496 1HD PRO 72 1HD PRO 72 -12.456 5.521 14.040 497 2HD PRO 72 2HD PRO 72 -12.421 7.294 14.126 498 H GLN 73 H GLN 73 -10.233 4.167 14.862 499 HA GLN 73 HA GLN 73 -8.104 3.048 16.556 500 1HB GLN 73 1HB GLN 73 -10.766 1.726 16.016 501 2HB GLN 73 2HB GLN 73 -9.472 1.103 17.030 502 1HG GLN 73 1HG GLN 73 -9.768 3.045 18.529 503 2HG GLN 73 2HG GLN 73 -11.136 3.557 17.543 504 1HE2 GLN 73 1HE2 GLN 73 -12.811 3.275 18.874 505 2HE2 GLN 73 2HE2 GLN 73 -13.237 1.782 19.631 506 H ASN 74 H ASN 74 -6.588 2.150 15.342 507 HA ASN 74 HA ASN 74 -7.045 0.171 13.424 508 1HB ASN 74 1HB ASN 74 -7.286 2.871 12.415 509 2HB ASN 74 2HB ASN 74 -5.946 2.035 11.637 510 1HD2 ASN 74 1HD2 ASN 74 -8.542 2.894 10.581 511 2HD2 ASN 74 2HD2 ASN 74 -9.279 1.470 9.936 512 H ASP 75 H ASP 75 -5.045 -0.449 12.258 513 HA ASP 75 HA ASP 75 -2.579 0.710 13.285 514 1HB ASP 75 1HB ASP 75 -3.661 -1.455 14.600 515 2HB ASP 75 2HB ASP 75 -2.539 -2.214 13.473 516 H LEU 76 H LEU 76 -0.642 -0.494 12.296 517 HA LEU 76 HA LEU 76 -1.308 -1.251 9.526 518 1HB LEU 76 1HB LEU 76 0.841 0.512 10.626 519 2HB LEU 76 2HB LEU 76 1.100 -0.348 9.109 520 HG LEU 76 HG LEU 76 0.381 1.931 8.694 521 1HD1 LEU 76 1HD1 LEU 76 -0.944 1.375 6.961 522 2HD1 LEU 76 2HD1 LEU 76 -2.083 0.489 7.975 523 3HD1 LEU 76 3HD1 LEU 76 -0.573 -0.271 7.474 524 1HD2 LEU 76 1HD2 LEU 76 -1.070 1.767 10.943 525 2HD2 LEU 76 2HD2 LEU 76 -2.339 1.481 9.752 526 3HD2 LEU 76 3HD2 LEU 76 -1.376 2.957 9.678 527 H THR 77 H THR 77 -0.608 -3.175 8.865 528 HA THR 77 HA THR 77 1.729 -4.391 10.128 529 HB THR 77 HB THR 77 -0.172 -5.248 11.419 530 HG1 THR 77 HG1 THR 77 1.429 -6.746 11.215 531 1HG2 THR 77 1HG2 THR 77 -1.904 -6.588 10.397 532 2HG2 THR 77 2HG2 THR 77 -1.166 -6.393 8.807 533 3HG2 THR 77 3HG2 THR 77 -1.874 -5.002 9.628 534 H PHE 78 H PHE 78 0.609 -3.341 7.419 535 HA PHE 78 HA PHE 78 2.171 -4.944 5.751 536 1HB PHE 78 1HB PHE 78 -0.438 -6.031 6.274 537 2HB PHE 78 2HB PHE 78 -0.319 -5.581 4.576 538 HD1 PHE 78 HD1 PHE 78 0.070 -8.206 6.744 539 HD2 PHE 78 HD2 PHE 78 2.119 -6.260 3.561 540 HE1 PHE 78 HE1 PHE 78 1.322 -10.275 6.289 541 HE2 PHE 78 HE2 PHE 78 3.373 -8.326 3.100 542 HZ PHE 78 HZ PHE 78 2.975 -10.337 4.465 543 H LEU 79 H LEU 79 2.647 -3.767 4.006 544 HA LEU 79 HA LEU 79 0.696 -2.113 2.692 545 1HB LEU 79 1HB LEU 79 1.230 -0.579 4.423 546 2HB LEU 79 2HB LEU 79 2.955 -0.897 4.261 547 HG LEU 79 HG LEU 79 2.080 0.083 1.767 548 1HD1 LEU 79 1HD1 LEU 79 0.902 2.034 2.173 549 2HD1 LEU 79 2HD1 LEU 79 1.295 2.037 3.892 550 3HD1 LEU 79 3HD1 LEU 79 0.123 0.882 3.257 551 1HD2 LEU 79 1HD2 LEU 79 3.871 1.435 2.014 552 2HD2 LEU 79 2HD2 LEU 79 4.217 0.363 3.371 553 3HD2 LEU 79 3HD2 LEU 79 3.423 1.914 3.652 554 H ARG 80 H ARG 80 1.130 -3.006 0.747 555 HA ARG 80 HA ARG 80 3.898 -2.787 -0.242 556 1HB ARG 80 1HB ARG 80 1.837 -4.776 -1.197 557 2HB ARG 80 2HB ARG 80 3.548 -4.734 -1.599 558 1HG ARG 80 1HG ARG 80 3.992 -6.067 0.106 559 2HG ARG 80 2HG ARG 80 3.311 -4.884 1.224 560 1HD ARG 80 1HD ARG 80 1.735 -6.969 -0.282 561 2HD ARG 80 2HD ARG 80 2.235 -7.095 1.405 562 HE ARG 80 HE ARG 80 0.869 -4.779 1.378 563 1HH1 ARG 80 1HH1 ARG 80 0.121 -7.960 0.177 564 2HH1 ARG 80 2HH1 ARG 80 -1.587 -7.790 0.413 565 1HH2 ARG 80 1HH2 ARG 80 -1.378 -4.543 1.693 566 2HH2 ARG 80 2HH2 ARG 80 -2.438 -5.845 1.274 567 H ILE 81 H ILE 81 4.065 -2.521 -2.619 568 HA ILE 81 HA ILE 81 1.747 -1.349 -3.929 569 HB ILE 81 HB ILE 81 3.238 0.630 -4.641 570 1HG1 ILE 81 1HG1 ILE 81 4.613 -0.180 -2.070 571 2HG1 ILE 81 2HG1 ILE 81 5.327 -0.235 -3.677 572 1HG2 ILE 81 1HG2 ILE 81 2.557 0.968 -1.790 573 2HG2 ILE 81 2HG2 ILE 81 2.074 1.918 -3.194 574 3HG2 ILE 81 3HG2 ILE 81 1.262 0.393 -2.840 575 1HD1 ILE 81 1HD1 ILE 81 5.974 1.868 -3.493 576 2HD1 ILE 81 2HD1 ILE 81 4.320 2.389 -3.174 577 3HD1 ILE 81 3HD1 ILE 81 5.357 1.882 -1.842 578 H ARG 82 H ARG 82 1.885 -3.035 -5.410 579 HA ARG 82 HA ARG 82 4.252 -3.791 -6.754 580 1HB ARG 82 1HB ARG 82 1.371 -4.359 -6.992 581 2HB ARG 82 2HB ARG 82 2.276 -4.502 -8.493 582 1HG ARG 82 1HG ARG 82 2.232 -6.646 -7.491 583 2HG ARG 82 2HG ARG 82 3.866 -6.012 -7.283 584 1HD ARG 82 1HD ARG 82 3.472 -5.499 -5.003 585 2HD ARG 82 2HD ARG 82 1.737 -5.760 -5.174 586 HE ARG 82 HE ARG 82 3.313 -8.091 -5.751 587 1HH1 ARG 82 1HH1 ARG 82 1.772 -6.229 -3.246 588 2HH1 ARG 82 2HH1 ARG 82 1.627 -7.570 -2.158 589 1HH2 ARG 82 1HH2 ARG 82 3.128 -9.864 -4.328 590 2HH2 ARG 82 2HH2 ARG 82 2.400 -9.637 -2.775 591 H SER 83 H SER 83 5.267 -2.964 -8.474 592 HA SER 83 HA SER 83 4.017 -0.665 -9.820 593 1HB SER 83 1HB SER 83 6.856 -0.968 -10.336 594 2HB SER 83 2HB SER 83 5.984 0.406 -9.658 595 HG SER 83 HG SER 83 7.604 -1.178 -8.387 596 H LYS 84 H LYS 84 5.483 -0.437 -12.065 597 HA LYS 84 HA LYS 84 4.440 -2.565 -13.691 598 1HB LYS 84 1HB LYS 84 5.572 0.107 -14.114 599 2HB LYS 84 2HB LYS 84 6.012 -1.052 -15.362 600 1HG LYS 84 1HG LYS 84 3.238 -1.338 -14.841 601 2HG LYS 84 2HG LYS 84 3.588 0.380 -15.048 602 1HD LYS 84 1HD LYS 84 3.149 -0.370 -17.216 603 2HD LYS 84 2HD LYS 84 4.912 -0.347 -17.127 604 1HE LYS 84 1HE LYS 84 4.776 -2.794 -16.496 605 2HE LYS 84 2HE LYS 84 3.072 -2.723 -16.943 606 1HZ LYS 84 1HZ LYS 84 5.447 -2.435 -18.668 607 2HZ LYS 84 2HZ LYS 84 3.959 -1.789 -19.145 608 3HZ LYS 84 3HZ LYS 84 4.108 -3.450 -18.863 609 H LYS 85 H LYS 85 7.485 -1.764 -12.268 610 HA LYS 85 HA LYS 85 8.945 -3.625 -13.973 611 1HB LYS 85 1HB LYS 85 9.725 -1.616 -11.890 612 2HB LYS 85 2HB LYS 85 10.849 -2.895 -12.332 613 1HG LYS 85 1HG LYS 85 9.633 -1.367 -14.551 614 2HG LYS 85 2HG LYS 85 10.800 -0.517 -13.535 615 1HD LYS 85 1HD LYS 85 12.307 -1.422 -14.946 616 2HD LYS 85 2HD LYS 85 12.098 -2.858 -13.941 617 1HE LYS 85 1HE LYS 85 10.897 -3.960 -15.527 618 2HE LYS 85 2HE LYS 85 10.187 -2.481 -16.173 619 1HZ LYS 85 1HZ LYS 85 11.868 -2.201 -17.619 620 2HZ LYS 85 2HZ LYS 85 12.080 -3.867 -17.420 621 3HZ LYS 85 3HZ LYS 85 13.049 -2.781 -16.556 622 H ASN 86 H ASN 86 8.748 -3.125 -10.443 623 HA ASN 86 HA ASN 86 8.392 -6.004 -10.087 624 1HB ASN 86 1HB ASN 86 10.129 -5.723 -8.126 625 2HB ASN 86 2HB ASN 86 10.680 -6.048 -9.767 626 1HD2 ASN 86 1HD2 ASN 86 9.944 -3.367 -7.575 627 2HD2 ASN 86 2HD2 ASN 86 11.209 -2.333 -8.138 628 H GLU 87 H GLU 87 8.117 -6.452 -7.619 629 HA GLU 87 HA GLU 87 6.110 -4.549 -6.676 630 1HB GLU 87 1HB GLU 87 5.296 -6.309 -5.268 631 2HB GLU 87 2HB GLU 87 5.568 -6.983 -6.869 632 1HG GLU 87 1HG GLU 87 6.814 -8.563 -5.964 633 2HG GLU 87 2HG GLU 87 7.962 -7.333 -5.439 634 H ILE 88 H ILE 88 6.082 -3.765 -4.531 635 HA ILE 88 HA ILE 88 8.629 -3.976 -3.075 636 HB ILE 88 HB ILE 88 7.076 -1.405 -3.342 637 1HG1 ILE 88 1HG1 ILE 88 8.015 -2.055 -5.522 638 2HG1 ILE 88 2HG1 ILE 88 8.842 -0.648 -4.863 639 1HG2 ILE 88 1HG2 ILE 88 9.470 -2.277 -1.857 640 2HG2 ILE 88 2HG2 ILE 88 9.569 -0.697 -2.633 641 3HG2 ILE 88 3HG2 ILE 88 8.284 -1.030 -1.471 642 1HD1 ILE 88 1HD1 ILE 88 10.294 -2.842 -3.950 643 2HD1 ILE 88 2HD1 ILE 88 9.902 -3.200 -5.633 644 3HD1 ILE 88 3HD1 ILE 88 10.747 -1.707 -5.222 645 H MET 89 H MET 89 8.053 -5.104 -1.316 646 HA MET 89 HA MET 89 5.517 -4.531 0.011 647 1HB MET 89 1HB MET 89 5.999 -6.526 1.354 648 2HB MET 89 2HB MET 89 6.090 -6.877 -0.367 649 1HG MET 89 1HG MET 89 8.081 -7.764 -0.014 650 2HG MET 89 2HG MET 89 8.677 -6.151 0.370 651 1HE MET 89 1HE MET 89 6.921 -9.297 1.732 652 2HE MET 89 2HE MET 89 8.640 -9.691 1.676 653 3HE MET 89 3HE MET 89 7.809 -9.589 3.229 654 H VAL 90 H VAL 90 5.335 -3.530 1.939 655 HA VAL 90 HA VAL 90 7.732 -3.048 3.544 656 HB VAL 90 HB VAL 90 5.880 -0.764 2.902 657 1HG1 VAL 90 1HG1 VAL 90 8.724 -0.733 3.889 658 2HG1 VAL 90 2HG1 VAL 90 7.576 0.606 3.847 659 3HG1 VAL 90 3HG1 VAL 90 7.325 -0.738 4.961 660 1HG2 VAL 90 1HG2 VAL 90 6.872 -1.483 0.802 661 2HG2 VAL 90 2HG2 VAL 90 7.578 0.047 1.322 662 3HG2 VAL 90 3HG2 VAL 90 8.478 -1.455 1.531 663 H ALA 91 H ALA 91 7.242 -3.753 5.507 664 HA ALA 91 HA ALA 91 4.585 -3.121 6.608 665 1HB ALA 91 1HB ALA 91 4.436 -5.419 6.138 666 2HB ALA 91 2HB ALA 91 6.070 -5.730 6.728 667 3HB ALA 91 3HB ALA 91 4.785 -5.321 7.865 668 HA PRO 92 HA PRO 92 6.895 -1.299 9.899 669 1HB PRO 92 1HB PRO 92 4.889 -1.125 11.721 670 2HB PRO 92 2HB PRO 92 5.009 -0.055 10.319 671 1HG PRO 92 1HG PRO 92 3.322 -2.498 10.697 672 2HG PRO 92 2HG PRO 92 2.887 -0.939 9.973 673 1HD PRO 92 1HD PRO 92 3.504 -3.116 8.485 674 2HD PRO 92 2HD PRO 92 3.869 -1.461 7.954 675 H ASP 93 H ASP 93 8.345 -2.860 10.566 676 HA ASP 93 HA ASP 93 7.534 -5.190 12.022 677 1HB ASP 93 1HB ASP 93 9.858 -4.345 10.698 678 2HB ASP 93 2HB ASP 93 10.320 -4.506 12.390 679 H LYS 94 H LYS 94 9.316 -5.408 14.081 680 HA LYS 94 HA LYS 94 8.028 -4.254 16.223 681 1HB LYS 94 1HB LYS 94 10.381 -5.824 15.809 682 2HB LYS 94 2HB LYS 94 10.756 -4.549 16.961 683 1HG LYS 94 1HG LYS 94 8.507 -5.324 18.068 684 2HG LYS 94 2HG LYS 94 8.850 -6.820 17.196 685 1HD LYS 94 1HD LYS 94 10.376 -7.403 18.707 686 2HD LYS 94 2HD LYS 94 11.231 -5.874 18.492 687 1HE LYS 94 1HE LYS 94 8.742 -6.033 20.155 688 2HE LYS 94 2HE LYS 94 10.311 -6.472 20.830 689 1HZ LYS 94 1HZ LYS 94 10.902 -4.346 20.986 690 2HZ LYS 94 2HZ LYS 94 9.274 -3.965 20.731 691 3HZ LYS 94 3HZ LYS 94 10.355 -3.970 19.430 692 H ASP 95 H ASP 95 11.072 -3.151 14.734 693 HA ASP 95 HA ASP 95 10.394 -0.407 15.422 694 1HB ASP 95 1HB ASP 95 12.414 0.058 16.616 695 2HB ASP 95 2HB ASP 95 11.683 -1.359 17.367 696 H TYR 96 H TYR 96 11.009 -2.316 13.074 697 HA TYR 96 HA TYR 96 12.604 -0.363 11.596 698 1HB TYR 96 1HB TYR 96 13.889 -2.227 10.515 699 2HB TYR 96 2HB TYR 96 14.264 -1.981 12.217 700 HD1 TYR 96 HD1 TYR 96 13.057 -4.297 9.734 701 HD2 TYR 96 HD2 TYR 96 13.288 -3.556 13.918 702 HE1 TYR 96 HE1 TYR 96 12.574 -6.668 10.175 703 HE2 TYR 96 HE2 TYR 96 12.807 -5.926 14.370 704 HH TYR 96 HH TYR 96 12.901 -8.059 13.308 705 H PHE 97 H PHE 97 12.659 -1.124 9.170 706 HA PHE 97 HA PHE 97 9.950 -2.051 8.471 707 1HB PHE 97 1HB PHE 97 11.627 0.042 7.072 708 2HB PHE 97 2HB PHE 97 10.075 -0.557 6.497 709 HD1 PHE 97 HD1 PHE 97 8.597 -0.693 9.074 710 HD2 PHE 97 HD2 PHE 97 11.185 2.291 7.489 711 HE1 PHE 97 HE1 PHE 97 7.441 1.017 10.415 712 HE2 PHE 97 HE2 PHE 97 10.034 4.005 8.828 713 HZ PHE 97 HZ PHE 97 8.160 3.369 10.293 714 H LEU 98 H LEU 98 9.855 -3.797 7.223 715 HA LEU 98 HA LEU 98 12.322 -4.834 6.065 716 1HB LEU 98 1HB LEU 98 10.204 -6.020 7.372 717 2HB LEU 98 2HB LEU 98 9.913 -6.425 5.682 718 HG LEU 98 HG LEU 98 11.130 -8.207 6.769 719 1HD1 LEU 98 1HD1 LEU 98 13.354 -7.113 5.217 720 2HD1 LEU 98 2HD1 LEU 98 11.797 -7.051 4.392 721 3HD1 LEU 98 3HD1 LEU 98 12.421 -8.591 4.983 722 1HD2 LEU 98 1HD2 LEU 98 12.322 -6.230 8.242 723 2HD2 LEU 98 2HD2 LEU 98 13.622 -6.735 7.161 724 3HD2 LEU 98 3HD2 LEU 98 12.826 -7.920 8.198 725 H ILE 99 H ILE 99 12.792 -4.160 4.079 726 HA ILE 99 HA ILE 99 10.595 -3.849 2.142 727 HB ILE 99 HB ILE 99 13.344 -2.633 1.915 728 1HG1 ILE 99 1HG1 ILE 99 11.754 -0.518 2.431 729 2HG1 ILE 99 2HG1 ILE 99 10.935 -1.740 3.396 730 1HG2 ILE 99 1HG2 ILE 99 10.773 -1.884 0.538 731 2HG2 ILE 99 2HG2 ILE 99 12.392 -1.277 0.195 732 3HG2 ILE 99 3HG2 ILE 99 11.988 -2.957 -0.157 733 1HD1 ILE 99 1HD1 ILE 99 13.059 -2.211 4.544 734 2HD1 ILE 99 2HD1 ILE 99 13.818 -0.915 3.619 735 3HD1 ILE 99 3HD1 ILE 99 12.518 -0.545 4.752 736 H VAL 100 H VAL 100 10.441 -5.750 1.096 737 HA VAL 100 HA VAL 100 12.914 -6.973 0.067 738 HB VAL 100 HB VAL 100 10.194 -8.230 0.459 739 1HG1 VAL 100 1HG1 VAL 100 12.789 -9.346 -0.584 740 2HG1 VAL 100 2HG1 VAL 100 11.448 -10.351 -0.031 741 3HG1 VAL 100 3HG1 VAL 100 11.233 -9.272 -1.410 742 1HG2 VAL 100 1HG2 VAL 100 11.468 -7.729 2.542 743 2HG2 VAL 100 2HG2 VAL 100 11.174 -9.448 2.278 744 3HG2 VAL 100 3HG2 VAL 100 12.764 -8.764 1.941 745 H ILE 101 H ILE 101 13.317 -6.444 -1.974 746 HA ILE 101 HA ILE 101 11.082 -5.895 -3.789 747 HB ILE 101 HB ILE 101 14.030 -5.380 -4.198 748 1HG1 ILE 101 1HG1 ILE 101 12.362 -3.030 -4.014 749 2HG1 ILE 101 2HG1 ILE 101 12.189 -4.016 -2.566 750 1HG2 ILE 101 1HG2 ILE 101 11.643 -4.437 -5.781 751 2HG2 ILE 101 2HG2 ILE 101 13.330 -4.034 -6.096 752 3HG2 ILE 101 3HG2 ILE 101 12.771 -5.696 -6.280 753 1HD1 ILE 101 1HD1 ILE 101 14.390 -3.749 -1.962 754 2HD1 ILE 101 2HD1 ILE 101 14.908 -3.385 -3.608 755 3HD1 ILE 101 3HD1 ILE 101 14.014 -2.183 -2.679 756 H GLN 102 H GLN 102 10.670 -7.094 -5.573 757 HA GLN 102 HA GLN 102 12.522 -8.897 -6.745 758 1HB GLN 102 1HB GLN 102 11.525 -11.005 -6.148 759 2HB GLN 102 2HB GLN 102 11.956 -10.153 -4.671 760 1HG GLN 102 1HG GLN 102 9.621 -9.447 -4.414 761 2HG GLN 102 2HG GLN 102 9.203 -10.348 -5.870 762 1HE2 GLN 102 1HE2 GLN 102 8.987 -10.471 -2.671 763 2HE2 GLN 102 2HE2 GLN 102 9.053 -12.176 -2.404 764 H ASN 103 H ASN 103 11.304 -10.425 -8.323 765 HA ASN 103 HA ASN 103 9.924 -8.904 -10.166 766 1HB ASN 103 1HB ASN 103 10.451 -11.767 -9.766 767 2HB ASN 103 2HB ASN 103 8.998 -11.430 -10.701 768 1HD2 ASN 103 1HD2 ASN 103 11.962 -12.323 -11.161 769 2HD2 ASN 103 2HD2 ASN 103 12.386 -11.454 -12.593 770 HA PRO 104 HA PRO 104 5.736 -8.594 -8.898 771 1HB PRO 104 1HB PRO 104 4.387 -8.951 -11.227 772 2HB PRO 104 2HB PRO 104 5.317 -7.491 -10.869 773 1HG PRO 104 1HG PRO 104 6.084 -9.870 -12.516 774 2HG PRO 104 2HG PRO 104 6.339 -8.148 -12.852 775 1HD PRO 104 1HD PRO 104 8.296 -9.748 -11.883 776 2HD PRO 104 2HD PRO 104 8.184 -8.023 -11.477 777 H THR 105 H THR 105 3.929 -9.779 -8.303 778 HA THR 105 HA THR 105 4.080 -12.667 -8.861 779 HB THR 105 HB THR 105 2.741 -12.926 -6.744 780 HG1 THR 105 HG1 THR 105 2.243 -11.198 -5.593 781 1HG2 THR 105 1HG2 THR 105 5.434 -11.587 -6.454 782 2HG2 THR 105 2HG2 THR 105 5.170 -13.296 -6.805 783 3HG2 THR 105 3HG2 THR 105 4.654 -12.622 -5.259 784 H GLU 106 H GLU 106 1.958 -9.874 -8.697 785 HA GLU 106 HA GLU 106 -0.520 -11.067 -8.983 786 1HB GLU 106 1HB GLU 106 0.289 -8.523 -8.846 787 2HB GLU 106 2HB GLU 106 0.007 -8.614 -10.579 788 1HG GLU 106 1HG GLU 106 -2.212 -9.787 -9.246 789 2HG GLU 106 2HG GLU 106 -1.871 -8.222 -8.508 790 H MET 11 H MET 11 -18.776 4.743 -15.363 791 HA MET 11 HA MET 11 -19.180 4.192 -12.773 792 1HB MET 11 1HB MET 11 -21.307 4.742 -14.844 793 2HB MET 11 2HB MET 11 -21.608 4.776 -13.112 794 1HG MET 11 1HG MET 11 -19.451 6.418 -13.323 795 2HG MET 11 2HG MET 11 -20.294 6.736 -14.837 796 1HE MET 11 1HE MET 11 -21.832 7.564 -10.591 797 2HE MET 11 2HE MET 11 -21.035 6.069 -11.080 798 3HE MET 11 3HE MET 11 -20.133 7.585 -11.063 799 H ALA 12 H ALA 12 -20.918 2.479 -15.375 800 HA ALA 12 HA ALA 12 -22.335 0.679 -13.837 801 1HB ALA 12 1HB ALA 12 -22.891 -0.292 -15.789 802 2HB ALA 12 2HB ALA 12 -22.058 1.094 -16.494 803 3HB ALA 12 3HB ALA 12 -21.214 -0.444 -16.313 804 H GLU 13 H GLU 13 -18.986 0.478 -14.948 805 HA GLU 13 HA GLU 13 -18.392 -2.135 -14.271 806 1HB GLU 13 1HB GLU 13 -16.929 -0.294 -15.381 807 2HB GLU 13 2HB GLU 13 -16.434 0.076 -13.735 808 1HG GLU 13 1HG GLU 13 -16.241 -2.733 -14.120 809 2HG GLU 13 2HG GLU 13 -15.444 -1.924 -15.467 810 H VAL 14 H VAL 14 -18.135 0.757 -12.213 811 HA VAL 14 HA VAL 14 -17.280 -0.606 -9.896 812 HB VAL 14 HB VAL 14 -18.827 1.985 -9.979 813 1HG1 VAL 14 1HG1 VAL 14 -16.856 2.022 -7.994 814 2HG1 VAL 14 2HG1 VAL 14 -18.603 1.906 -7.769 815 3HG1 VAL 14 3HG1 VAL 14 -17.626 0.441 -7.871 816 1HG2 VAL 14 1HG2 VAL 14 -15.939 1.387 -10.518 817 2HG2 VAL 14 2HG2 VAL 14 -17.057 2.391 -11.442 818 3HG2 VAL 14 3HG2 VAL 14 -16.442 2.956 -9.889 819 H GLU 15 H GLU 15 -20.457 0.099 -11.205 820 HA GLU 15 HA GLU 15 -21.944 -0.557 -8.884 821 1HB GLU 15 1HB GLU 15 -22.633 -0.376 -11.807 822 2HB GLU 15 2HB GLU 15 -23.817 -0.908 -10.622 823 1HG GLU 15 1HG GLU 15 -23.534 1.208 -9.411 824 2HG GLU 15 2HG GLU 15 -22.391 1.742 -10.642 825 H GLU 16 H GLU 16 -20.840 -2.429 -11.665 826 HA GLU 16 HA GLU 16 -22.252 -4.795 -11.108 827 1HB GLU 16 1HB GLU 16 -20.612 -3.956 -13.122 828 2HB GLU 16 2HB GLU 16 -19.584 -5.127 -12.308 829 1HG GLU 16 1HG GLU 16 -22.109 -6.329 -12.537 830 2HG GLU 16 2HG GLU 16 -21.776 -5.566 -14.091 831 H THR 17 H THR 17 -19.148 -3.580 -9.983 832 HA THR 17 HA THR 17 -18.478 -6.018 -8.599 833 HB THR 17 HB THR 17 -17.210 -3.275 -8.456 834 HG1 THR 17 HG1 THR 17 -17.121 -4.559 -10.489 835 1HG2 THR 17 1HG2 THR 17 -16.531 -5.896 -7.178 836 2HG2 THR 17 2HG2 THR 17 -16.510 -4.275 -6.484 837 3HG2 THR 17 3HG2 THR 17 -15.248 -4.767 -7.613 838 H LEU 18 H LEU 18 -20.146 -3.070 -7.878 839 HA LEU 18 HA LEU 18 -19.907 -3.233 -5.034 840 1HB LEU 18 1HB LEU 18 -21.110 -1.474 -6.977 841 2HB LEU 18 2HB LEU 18 -22.216 -1.780 -5.639 842 HG LEU 18 HG LEU 18 -20.004 -1.187 -4.247 843 1HD1 LEU 18 1HD1 LEU 18 -18.884 0.720 -5.325 844 2HD1 LEU 18 2HD1 LEU 18 -19.770 0.381 -6.811 845 3HD1 LEU 18 3HD1 LEU 18 -18.614 -0.795 -6.186 846 1HD2 LEU 18 1HD2 LEU 18 -20.903 1.138 -4.126 847 2HD2 LEU 18 2HD2 LEU 18 -22.113 -0.122 -3.884 848 3HD2 LEU 18 3HD2 LEU 18 -22.014 0.721 -5.431 849 H LYS 19 H LYS 19 -22.354 -4.202 -7.396 850 HA LYS 19 HA LYS 19 -24.366 -4.986 -5.630 851 1HB LYS 19 1HB LYS 19 -23.790 -5.268 -8.431 852 2HB LYS 19 2HB LYS 19 -24.399 -6.793 -7.802 853 1HG LYS 19 1HG LYS 19 -26.390 -5.867 -8.280 854 2HG LYS 19 2HG LYS 19 -26.175 -5.112 -6.699 855 1HD LYS 19 1HD LYS 19 -25.887 -3.061 -7.582 856 2HD LYS 19 2HD LYS 19 -24.927 -3.670 -8.932 857 1HE LYS 19 1HE LYS 19 -26.725 -3.888 -10.284 858 2HE LYS 19 2HE LYS 19 -27.787 -4.383 -8.966 859 1HZ LYS 19 1HZ LYS 19 -27.706 -1.919 -10.185 860 2HZ LYS 19 2HZ LYS 19 -26.990 -1.672 -8.673 861 3HZ LYS 19 3HZ LYS 19 -28.548 -2.324 -8.774 862 H ARG 20 H ARG 20 -21.701 -6.890 -7.013 863 HA ARG 20 HA ARG 20 -22.389 -9.298 -5.681 864 1HB ARG 20 1HB ARG 20 -20.893 -9.003 -7.736 865 2HB ARG 20 2HB ARG 20 -19.619 -8.558 -6.608 866 1HG ARG 20 1HG ARG 20 -19.131 -10.727 -6.562 867 2HG ARG 20 2HG ARG 20 -20.561 -10.899 -5.544 868 1HD ARG 20 1HD ARG 20 -21.835 -11.756 -7.238 869 2HD ARG 20 2HD ARG 20 -20.936 -10.898 -8.490 870 HE ARG 20 HE ARG 20 -19.174 -12.732 -7.457 871 1HH1 ARG 20 1HH1 ARG 20 -22.307 -12.841 -8.971 872 2HH1 ARG 20 2HH1 ARG 20 -22.059 -14.407 -9.671 873 1HH2 ARG 20 1HH2 ARG 20 -18.835 -14.793 -8.373 874 2HH2 ARG 20 2HH2 ARG 20 -20.084 -15.516 -9.330 875 H LEU 21 H LEU 21 -20.377 -6.551 -4.845 876 HA LEU 21 HA LEU 21 -19.072 -7.732 -2.625 877 1HB LEU 21 1HB LEU 21 -19.327 -5.076 -3.810 878 2HB LEU 21 2HB LEU 21 -19.168 -5.048 -2.055 879 HG LEU 21 HG LEU 21 -17.048 -6.176 -2.175 880 1HD1 LEU 21 1HD1 LEU 21 -16.400 -6.213 -4.894 881 2HD1 LEU 21 2HD1 LEU 21 -17.997 -6.952 -4.774 882 3HD1 LEU 21 3HD1 LEU 21 -16.654 -7.597 -3.831 883 1HD2 LEU 21 1HD2 LEU 21 -17.467 -3.774 -3.891 884 2HD2 LEU 21 2HD2 LEU 21 -15.869 -4.515 -3.824 885 3HD2 LEU 21 3HD2 LEU 21 -16.630 -3.924 -2.346 886 H GLN 22 H GLN 22 -21.822 -5.467 -2.793 887 HA GLN 22 HA GLN 22 -22.399 -5.529 -0.038 888 1HB GLN 22 1HB GLN 22 -23.374 -4.183 -2.283 889 2HB GLN 22 2HB GLN 22 -24.753 -5.084 -1.669 890 1HG GLN 22 1HG GLN 22 -25.028 -3.666 0.007 891 2HG GLN 22 2HG GLN 22 -23.336 -3.806 0.482 892 1HE2 GLN 22 1HE2 GLN 22 -21.789 -2.528 -0.832 893 2HE2 GLN 22 2HE2 GLN 22 -22.285 -0.959 -1.358 894 H SER 23 H SER 23 -23.117 -7.719 -2.605 895 HA SER 23 HA SER 23 -25.313 -9.022 -1.285 896 1HB SER 23 1HB SER 23 -25.044 -8.989 -3.766 897 2HB SER 23 2HB SER 23 -23.628 -10.026 -3.591 898 HG SER 23 HG SER 23 -25.420 -11.305 -4.005 899 H GLN 24 H GLN 24 -21.890 -9.219 -1.164 900 HA GLN 24 HA GLN 24 -22.004 -11.830 0.175 901 1HB GLN 24 1HB GLN 24 -19.617 -11.983 -0.194 902 2HB GLN 24 2HB GLN 24 -20.418 -11.598 -1.712 903 1HG GLN 24 1HG GLN 24 -19.684 -9.364 -1.653 904 2HG GLN 24 2HG GLN 24 -19.193 -9.490 0.035 905 1HE2 GLN 24 1HE2 GLN 24 -17.297 -8.489 -1.306 906 2HE2 GLN 24 2HE2 GLN 24 -16.076 -9.620 -1.769 907 H LYS 25 H LYS 25 -20.874 -12.139 2.165 908 HA LYS 25 HA LYS 25 -21.193 -9.931 3.970 909 1HB LYS 25 1HB LYS 25 -21.517 -12.512 4.363 910 2HB LYS 25 2HB LYS 25 -19.801 -12.464 4.743 911 1HG LYS 25 1HG LYS 25 -21.141 -10.342 6.115 912 2HG LYS 25 2HG LYS 25 -21.962 -11.872 6.431 913 1HD LYS 25 1HD LYS 25 -19.543 -12.766 6.820 914 2HD LYS 25 2HD LYS 25 -19.152 -11.061 7.050 915 1HE LYS 25 1HE LYS 25 -20.498 -10.877 8.931 916 2HE LYS 25 2HE LYS 25 -21.464 -12.287 8.500 917 1HZ LYS 25 1HZ LYS 25 -19.335 -13.594 8.877 918 2HZ LYS 25 2HZ LYS 25 -20.121 -12.994 10.250 919 3HZ LYS 25 3HZ LYS 25 -18.744 -12.212 9.654 920 H GLY 26 H GLY 26 -19.510 -9.157 5.421 921 1HA GLY 26 1HA GLY 26 -17.189 -8.911 5.981 922 2HA GLY 26 2HA GLY 26 -16.781 -9.438 4.355 923 H VAL 27 H VAL 27 -18.310 -7.839 2.777 924 HA VAL 27 HA VAL 27 -16.846 -5.513 2.545 925 HB VAL 27 HB VAL 27 -19.697 -5.968 1.653 926 1HG1 VAL 27 1HG1 VAL 27 -19.012 -4.237 -0.100 927 2HG1 VAL 27 2HG1 VAL 27 -19.373 -3.652 1.525 928 3HG1 VAL 27 3HG1 VAL 27 -17.698 -3.826 1.001 929 1HG2 VAL 27 1HG2 VAL 27 -18.218 -7.640 0.746 930 2HG2 VAL 27 2HG2 VAL 27 -18.641 -6.495 -0.527 931 3HG2 VAL 27 3HG2 VAL 27 -17.061 -6.403 0.253 932 H GLN 28 H GLN 28 -16.682 -3.803 3.823 933 HA GLN 28 HA GLN 28 -18.784 -3.218 5.750 934 1HB GLN 28 1HB GLN 28 -15.922 -2.450 5.428 935 2HB GLN 28 2HB GLN 28 -16.972 -1.364 6.328 936 1HG GLN 28 1HG GLN 28 -17.158 -2.767 8.078 937 2HG GLN 28 2HG GLN 28 -17.132 -4.210 7.064 938 1HE2 GLN 28 1HE2 GLN 28 -15.534 -5.436 7.769 939 2HE2 GLN 28 2HE2 GLN 28 -13.918 -4.913 8.082 940 H GLY 29 H GLY 29 -17.428 -1.944 2.809 941 1HA GLY 29 1HA GLY 29 -19.545 -0.425 2.022 942 2HA GLY 29 2HA GLY 29 -18.638 0.656 3.069 943 H ILE 30 H ILE 30 -19.197 0.511 0.072 944 HA ILE 30 HA ILE 30 -16.409 0.559 -0.867 945 HB ILE 30 HB ILE 30 -18.878 0.473 -2.595 946 1HG1 ILE 30 1HG1 ILE 30 -17.681 -2.003 -2.790 947 2HG1 ILE 30 2HG1 ILE 30 -17.542 -1.645 -1.072 948 1HG2 ILE 30 1HG2 ILE 30 -15.974 -0.102 -3.169 949 2HG2 ILE 30 2HG2 ILE 30 -17.300 -0.287 -4.316 950 3HG2 ILE 30 3HG2 ILE 30 -16.885 1.312 -3.699 951 1HD1 ILE 30 1HD1 ILE 30 -19.721 -1.955 -0.721 952 2HD1 ILE 30 2HD1 ILE 30 -20.181 -1.086 -2.186 953 3HD1 ILE 30 3HD1 ILE 30 -19.699 -2.779 -2.280 954 H ILE 31 H ILE 31 -15.578 2.345 -1.878 955 HA ILE 31 HA ILE 31 -17.310 4.725 -2.003 956 HB ILE 31 HB ILE 31 -14.421 4.646 -1.123 957 1HG1 ILE 31 1HG1 ILE 31 -16.575 5.755 0.592 958 2HG1 ILE 31 2HG1 ILE 31 -16.543 4.005 0.403 959 1HG2 ILE 31 1HG2 ILE 31 -14.760 7.071 -0.684 960 2HG2 ILE 31 2HG2 ILE 31 -14.814 6.642 -2.393 961 3HG2 ILE 31 3HG2 ILE 31 -16.311 6.960 -1.516 962 1HD1 ILE 31 1HD1 ILE 31 -14.516 3.797 1.468 963 2HD1 ILE 31 2HD1 ILE 31 -14.049 5.465 1.133 964 3HD1 ILE 31 3HD1 ILE 31 -15.268 5.120 2.359 965 H VAL 32 H VAL 32 -17.010 6.115 -3.718 966 HA VAL 32 HA VAL 32 -14.966 5.395 -5.702 967 HB VAL 32 HB VAL 32 -17.785 6.093 -6.503 968 1HG1 VAL 32 1HG1 VAL 32 -15.760 6.393 -8.052 969 2HG1 VAL 32 2HG1 VAL 32 -15.724 4.629 -8.118 970 3HG1 VAL 32 3HG1 VAL 32 -17.152 5.505 -8.671 971 1HG2 VAL 32 1HG2 VAL 32 -16.564 3.348 -6.228 972 2HG2 VAL 32 2HG2 VAL 32 -17.866 4.013 -5.241 973 3HG2 VAL 32 3HG2 VAL 32 -18.130 3.705 -6.957 974 H VAL 33 H VAL 33 -13.816 7.103 -6.302 975 HA VAL 33 HA VAL 33 -15.082 9.755 -6.293 976 HB VAL 33 HB VAL 33 -12.254 9.366 -5.340 977 1HG1 VAL 33 1HG1 VAL 33 -13.307 11.600 -6.187 978 2HG1 VAL 33 2HG1 VAL 33 -14.071 11.615 -4.596 979 3HG1 VAL 33 3HG1 VAL 33 -12.312 11.586 -4.731 980 1HG2 VAL 33 1HG2 VAL 33 -14.753 9.491 -3.654 981 2HG2 VAL 33 2HG2 VAL 33 -13.670 8.109 -3.821 982 3HG2 VAL 33 3HG2 VAL 33 -13.102 9.584 -3.039 983 H ASN 34 H ASN 34 -14.490 11.096 -7.937 984 HA ASN 34 HA ASN 34 -13.268 9.939 -10.225 985 1HB ASN 34 1HB ASN 34 -13.648 12.899 -9.896 986 2HB ASN 34 2HB ASN 34 -13.820 11.914 -11.346 987 1HD2 ASN 34 1HD2 ASN 34 -15.493 13.652 -9.191 988 2HD2 ASN 34 2HD2 ASN 34 -17.023 12.852 -9.265 989 H THR 35 H THR 35 -11.682 11.841 -11.342 990 HA THR 35 HA THR 35 -9.205 11.424 -9.950 991 HB THR 35 HB THR 35 -8.962 13.303 -12.124 992 HG1 THR 35 HG1 THR 35 -9.881 12.066 -13.755 993 1HG2 THR 35 1HG2 THR 35 -7.230 11.732 -11.253 994 2HG2 THR 35 2HG2 THR 35 -7.454 11.645 -13.000 995 3HG2 THR 35 3HG2 THR 35 -8.147 10.402 -11.958 996 H GLU 36 H GLU 36 -11.508 13.992 -10.237 997 HA GLU 36 HA GLU 36 -9.769 16.121 -9.481 998 1HB GLU 36 1HB GLU 36 -12.698 15.763 -9.829 999 2HB GLU 36 2HB GLU 36 -12.171 17.094 -8.807 1000 1HG GLU 36 1HG GLU 36 -10.567 17.505 -10.903 1001 2HG GLU 36 2HG GLU 36 -11.916 16.721 -11.723 1002 H GLY 37 H GLY 37 -11.866 13.893 -7.741 1003 1HA GLY 37 1HA GLY 37 -11.001 13.315 -5.475 1004 2HA GLY 37 2HA GLY 37 -10.859 15.047 -5.213 1005 H ILE 38 H ILE 38 -13.591 14.230 -7.028 1006 HA ILE 38 HA ILE 38 -15.289 14.663 -4.673 1007 HB ILE 38 HB ILE 38 -16.087 14.848 -7.578 1008 1HG1 ILE 38 1HG1 ILE 38 -15.284 17.048 -5.662 1009 2HG1 ILE 38 2HG1 ILE 38 -14.357 16.509 -7.057 1010 1HG2 ILE 38 1HG2 ILE 38 -17.894 14.431 -5.929 1011 2HG2 ILE 38 2HG2 ILE 38 -17.443 15.927 -5.113 1012 3HG2 ILE 38 3HG2 ILE 38 -18.050 15.974 -6.768 1013 1HD1 ILE 38 1HD1 ILE 38 -16.292 17.190 -8.487 1014 2HD1 ILE 38 2HD1 ILE 38 -17.008 17.919 -7.048 1015 3HD1 ILE 38 3HD1 ILE 38 -15.465 18.511 -7.662 1016 HA PRO 39 HA PRO 39 -16.540 10.421 -4.813 1017 1HB PRO 39 1HB PRO 39 -18.658 10.635 -3.129 1018 2HB PRO 39 2HB PRO 39 -16.982 10.647 -2.570 1019 1HG PRO 39 1HG PRO 39 -18.840 12.948 -3.035 1020 2HG PRO 39 2HG PRO 39 -17.717 12.671 -1.691 1021 1HD PRO 39 1HD PRO 39 -17.143 14.333 -3.750 1022 2HD PRO 39 2HD PRO 39 -15.894 13.402 -2.898 1023 H ILE 40 H ILE 40 -17.955 9.211 -5.976 1024 HA ILE 40 HA ILE 40 -20.241 10.618 -7.196 1025 HB ILE 40 HB ILE 40 -19.924 8.811 -9.040 1026 1HG1 ILE 40 1HG1 ILE 40 -17.125 8.953 -7.900 1027 2HG1 ILE 40 2HG1 ILE 40 -18.186 7.552 -7.802 1028 1HG2 ILE 40 1HG2 ILE 40 -17.904 11.038 -8.881 1029 2HG2 ILE 40 2HG2 ILE 40 -18.618 10.330 -10.329 1030 3HG2 ILE 40 3HG2 ILE 40 -19.613 11.290 -9.235 1031 1HD1 ILE 40 1HD1 ILE 40 -16.418 7.501 -9.593 1032 2HD1 ILE 40 2HD1 ILE 40 -18.070 7.183 -10.123 1033 3HD1 ILE 40 3HD1 ILE 40 -17.339 8.761 -10.414 1034 H LYS 41 H LYS 41 -19.038 7.633 -5.801 1035 HA LYS 41 HA LYS 41 -21.794 6.811 -5.286 1036 1HB LYS 41 1HB LYS 41 -19.743 5.204 -6.785 1037 2HB LYS 41 2HB LYS 41 -21.017 4.408 -5.870 1038 1HG LYS 41 1HG LYS 41 -22.393 6.272 -7.348 1039 2HG LYS 41 2HG LYS 41 -21.123 5.739 -8.451 1040 1HD LYS 41 1HD LYS 41 -22.926 4.272 -8.825 1041 2HD LYS 41 2HD LYS 41 -21.790 3.364 -7.825 1042 1HE LYS 41 1HE LYS 41 -23.300 3.128 -6.207 1043 2HE LYS 41 2HE LYS 41 -23.634 4.859 -6.189 1044 1HZ LYS 41 1HZ LYS 41 -25.523 3.256 -6.778 1045 2HZ LYS 41 2HZ LYS 41 -24.774 3.128 -8.288 1046 3HZ LYS 41 3HZ LYS 41 -25.320 4.632 -7.740 1047 H SER 42 H SER 42 -22.040 6.195 -3.240 1048 HA SER 42 HA SER 42 -20.062 4.695 -1.819 1049 1HB SER 42 1HB SER 42 -19.528 7.350 -1.783 1050 2HB SER 42 2HB SER 42 -20.598 7.230 -0.386 1051 HG SER 42 HG SER 42 -19.193 5.881 0.592 1052 H THR 43 H THR 43 -21.262 3.297 -0.736 1053 HA THR 43 HA THR 43 -24.003 3.867 -0.059 1054 HB THR 43 HB THR 43 -24.193 1.599 0.603 1055 HG1 THR 43 HG1 THR 43 -22.293 0.298 0.904 1056 1HG2 THR 43 1HG2 THR 43 -22.175 0.988 -1.420 1057 2HG2 THR 43 2HG2 THR 43 -23.268 2.290 -1.891 1058 3HG2 THR 43 3HG2 THR 43 -23.917 0.714 -1.440 1059 H MET 44 H MET 44 -20.981 4.171 1.495 1060 HA MET 44 HA MET 44 -21.683 3.732 4.176 1061 1HB MET 44 1HB MET 44 -19.415 4.617 2.767 1062 2HB MET 44 2HB MET 44 -19.784 5.887 3.925 1063 1HG MET 44 1HG MET 44 -19.581 4.414 5.755 1064 2HG MET 44 2HG MET 44 -19.577 2.998 4.706 1065 1HE MET 44 1HE MET 44 -16.106 3.179 2.993 1066 2HE MET 44 2HE MET 44 -17.717 2.461 3.009 1067 3HE MET 44 3HE MET 44 -17.480 4.080 2.349 1068 H ASP 45 H ASP 45 -21.140 5.992 5.601 1069 HA ASP 45 HA ASP 45 -23.633 7.396 5.421 1070 1HB ASP 45 1HB ASP 45 -21.602 6.986 7.396 1071 2HB ASP 45 2HB ASP 45 -21.887 8.716 7.229 1072 H ASN 46 H ASN 46 -23.567 9.875 5.699 1073 HA ASN 46 HA ASN 46 -22.512 10.977 3.319 1074 1HB ASN 46 1HB ASN 46 -24.371 11.751 5.289 1075 2HB ASN 46 2HB ASN 46 -23.142 13.013 5.263 1076 1HD2 ASN 46 1HD2 ASN 46 -22.423 12.982 2.609 1077 2HD2 ASN 46 2HD2 ASN 46 -23.761 13.506 1.649 1078 HA PRO 47 HA PRO 47 -19.390 13.285 6.200 1079 1HB PRO 47 1HB PRO 47 -19.207 12.429 8.769 1080 2HB PRO 47 2HB PRO 47 -20.329 13.695 8.256 1081 1HG PRO 47 1HG PRO 47 -20.850 10.788 8.744 1082 2HG PRO 47 2HG PRO 47 -21.824 12.194 9.213 1083 1HD PRO 47 1HD PRO 47 -22.418 10.662 7.061 1084 2HD PRO 47 2HD PRO 47 -22.759 12.403 7.117 1085 H THR 48 H THR 48 -19.931 9.852 6.563 1086 HA THR 48 HA THR 48 -17.208 9.187 7.152 1087 HB THR 48 HB THR 48 -19.290 7.311 6.035 1088 HG1 THR 48 HG1 THR 48 -19.724 8.678 8.108 1089 1HG2 THR 48 1HG2 THR 48 -18.041 5.604 7.187 1090 2HG2 THR 48 2HG2 THR 48 -16.984 6.812 7.919 1091 3HG2 THR 48 3HG2 THR 48 -16.929 6.529 6.179 1092 H THR 49 H THR 49 -19.145 9.499 4.255 1093 HA THR 49 HA THR 49 -17.265 8.219 2.518 1094 HB THR 49 HB THR 49 -19.592 10.050 1.909 1095 HG1 THR 49 HG1 THR 49 -20.112 7.971 2.788 1096 1HG2 THR 49 1HG2 THR 49 -17.841 8.436 0.052 1097 2HG2 THR 49 2HG2 THR 49 -18.023 10.191 0.084 1098 3HG2 THR 49 3HG2 THR 49 -19.375 9.172 -0.409 1099 H THR 50 H THR 50 -18.054 11.584 3.304 1100 HA THR 50 HA THR 50 -16.366 12.838 1.468 1101 HB THR 50 HB THR 50 -16.512 14.203 4.057 1102 HG1 THR 50 HG1 THR 50 -18.683 14.237 4.250 1103 1HG2 THR 50 1HG2 THR 50 -17.320 14.797 1.218 1104 2HG2 THR 50 2HG2 THR 50 -15.997 15.497 2.150 1105 3HG2 THR 50 3HG2 THR 50 -17.666 15.902 2.548 1106 H GLN 51 H GLN 51 -15.736 11.970 4.866 1107 HA GLN 51 HA GLN 51 -13.117 12.891 5.020 1108 1HB GLN 51 1HB GLN 51 -14.255 12.242 7.020 1109 2HB GLN 51 2HB GLN 51 -14.489 10.602 6.427 1110 1HG GLN 51 1HG GLN 51 -11.689 11.385 6.528 1111 2HG GLN 51 2HG GLN 51 -12.487 11.451 8.098 1112 1HE2 GLN 51 1HE2 GLN 51 -11.191 9.456 5.657 1113 2HE2 GLN 51 2HE2 GLN 51 -11.534 7.932 6.396 1114 H TYR 52 H TYR 52 -14.247 9.598 4.260 1115 HA TYR 52 HA TYR 52 -11.755 8.449 3.796 1116 1HB TYR 52 1HB TYR 52 -14.534 7.831 2.879 1117 2HB TYR 52 2HB TYR 52 -13.186 6.956 2.162 1118 HD1 TYR 52 HD1 TYR 52 -14.139 8.035 5.619 1119 HD2 TYR 52 HD2 TYR 52 -12.861 4.872 3.077 1120 HE1 TYR 52 HE1 TYR 52 -14.118 6.505 7.544 1121 HE2 TYR 52 HE2 TYR 52 -12.838 3.332 4.995 1122 HH TYR 52 HH TYR 52 -13.563 3.064 7.149 1123 H ALA 53 H ALA 53 -14.015 9.848 1.421 1124 HA ALA 53 HA ALA 53 -12.333 9.542 -0.812 1125 1HB ALA 53 1HB ALA 53 -14.636 9.900 -1.206 1126 2HB ALA 53 2HB ALA 53 -14.638 11.398 -0.274 1127 3HB ALA 53 3HB ALA 53 -13.803 11.326 -1.826 1128 H SER 54 H SER 54 -12.269 11.771 1.791 1129 HA SER 54 HA SER 54 -10.936 13.908 0.446 1130 1HB SER 54 1HB SER 54 -11.937 13.377 3.094 1131 2HB SER 54 2HB SER 54 -10.299 14.024 3.193 1132 HG SER 54 HG SER 54 -11.065 15.896 2.657 1133 H LEU 55 H LEU 55 -9.823 11.373 2.687 1134 HA LEU 55 HA LEU 55 -7.057 12.051 2.266 1135 1HB LEU 55 1HB LEU 55 -6.585 10.625 3.972 1136 2HB LEU 55 2HB LEU 55 -8.270 10.983 4.344 1137 HG LEU 55 HG LEU 55 -8.646 8.801 2.863 1138 1HD1 LEU 55 1HD1 LEU 55 -6.246 7.833 4.260 1139 2HD1 LEU 55 2HD1 LEU 55 -5.948 8.824 2.832 1140 3HD1 LEU 55 3HD1 LEU 55 -6.926 7.362 2.702 1141 1HD2 LEU 55 1HD2 LEU 55 -9.277 7.834 4.804 1142 2HD2 LEU 55 2HD2 LEU 55 -8.970 9.446 5.450 1143 3HD2 LEU 55 3HD2 LEU 55 -7.745 8.185 5.605 1144 H MET 56 H MET 56 -9.366 10.010 0.770 1145 HA MET 56 HA MET 56 -7.822 7.934 -0.226 1146 1HB MET 56 1HB MET 56 -10.408 9.016 -0.707 1147 2HB MET 56 2HB MET 56 -9.634 8.770 -2.266 1148 1HG MET 56 1HG MET 56 -10.924 6.825 -1.617 1149 2HG MET 56 2HG MET 56 -9.205 6.443 -1.701 1150 1HE MET 56 1HE MET 56 -7.872 5.904 1.456 1151 2HE MET 56 2HE MET 56 -8.628 4.456 0.790 1152 3HE MET 56 3HE MET 56 -7.904 5.650 -0.289 1153 H HIS 57 H HIS 57 -8.509 11.069 -1.779 1154 HA HIS 57 HA HIS 57 -6.797 10.639 -3.987 1155 1HB HIS 57 1HB HIS 57 -8.693 12.352 -3.750 1156 2HB HIS 57 2HB HIS 57 -7.523 13.352 -2.895 1157 HD1 HIS 57 HD1 HIS 57 -5.712 14.503 -4.284 1158 HD2 HIS 57 HD2 HIS 57 -8.206 12.043 -6.518 1159 HE1 HIS 57 HE1 HIS 57 -5.204 15.037 -6.688 1160 H SER 58 H SER 58 -6.361 12.556 -1.016 1161 HA SER 58 HA SER 58 -3.781 13.460 -1.504 1162 1HB SER 58 1HB SER 58 -4.019 12.893 1.284 1163 2HB SER 58 2HB SER 58 -4.165 14.450 0.467 1164 HG SER 58 HG SER 58 -6.092 14.117 1.466 1165 H PHE 59 H PHE 59 -4.900 10.319 -0.571 1166 HA PHE 59 HA PHE 59 -2.419 9.342 0.439 1167 1HB PHE 59 1HB PHE 59 -4.456 8.240 1.102 1168 2HB PHE 59 2HB PHE 59 -4.885 7.920 -0.575 1169 HD1 PHE 59 HD1 PHE 59 -4.859 5.653 -0.937 1170 HD2 PHE 59 HD2 PHE 59 -1.733 7.416 1.353 1171 HE1 PHE 59 HE1 PHE 59 -3.727 3.473 -0.810 1172 HE2 PHE 59 HE2 PHE 59 -0.596 5.238 1.482 1173 HZ PHE 59 HZ PHE 59 -1.592 3.263 0.399 1174 H ILE 60 H ILE 60 -4.154 8.706 -2.613 1175 HA ILE 60 HA ILE 60 -2.113 7.253 -3.850 1176 HB ILE 60 HB ILE 60 -4.214 8.981 -5.162 1177 1HG1 ILE 60 1HG1 ILE 60 -5.197 7.290 -3.703 1178 2HG1 ILE 60 2HG1 ILE 60 -5.466 6.864 -5.389 1179 1HG2 ILE 60 1HG2 ILE 60 -2.134 7.180 -6.218 1180 2HG2 ILE 60 2HG2 ILE 60 -3.742 7.000 -6.918 1181 3HG2 ILE 60 3HG2 ILE 60 -2.929 8.564 -6.969 1182 1HD1 ILE 60 1HD1 ILE 60 -4.103 5.404 -3.311 1183 2HD1 ILE 60 2HD1 ILE 60 -4.673 4.859 -4.889 1184 3HD1 ILE 60 3HD1 ILE 60 -3.085 5.610 -4.736 1185 H LEU 61 H LEU 61 -2.789 10.724 -3.842 1186 HA LEU 61 HA LEU 61 -0.801 11.448 -5.714 1187 1HB LEU 61 1HB LEU 61 -2.720 12.759 -4.058 1188 2HB LEU 61 2HB LEU 61 -1.161 13.560 -3.867 1189 HG LEU 61 HG LEU 61 -1.056 14.006 -6.240 1190 1HD1 LEU 61 1HD1 LEU 61 -3.386 13.484 -7.428 1191 2HD1 LEU 61 2HD1 LEU 61 -3.336 12.123 -6.308 1192 3HD1 LEU 61 3HD1 LEU 61 -2.024 12.364 -7.462 1193 1HD2 LEU 61 1HD2 LEU 61 -3.628 14.766 -4.882 1194 2HD2 LEU 61 2HD2 LEU 61 -3.153 15.414 -6.452 1195 3HD2 LEU 61 3HD2 LEU 61 -2.148 15.712 -5.034 1196 H LYS 62 H LYS 62 -0.696 10.679 -2.341 1197 HA LYS 62 HA LYS 62 1.840 11.917 -1.824 1198 1HB LYS 62 1HB LYS 62 0.116 11.471 -0.068 1199 2HB LYS 62 2HB LYS 62 0.445 9.752 -0.242 1200 1HG LYS 62 1HG LYS 62 1.647 10.505 1.651 1201 2HG LYS 62 2HG LYS 62 2.827 10.240 0.364 1202 1HD LYS 62 1HD LYS 62 3.532 12.288 1.066 1203 2HD LYS 62 2HD LYS 62 2.310 12.811 -0.096 1204 1HE LYS 62 1HE LYS 62 0.952 12.370 2.320 1205 2HE LYS 62 2HE LYS 62 2.430 13.233 2.745 1206 1HZ LYS 62 1HZ LYS 62 0.114 14.311 1.708 1207 2HZ LYS 62 2HZ LYS 62 1.232 14.369 0.440 1208 3HZ LYS 62 3HZ LYS 62 1.596 15.099 1.922 1209 H ALA 63 H ALA 63 0.770 8.535 -2.178 1210 HA ALA 63 HA ALA 63 3.370 7.430 -2.098 1211 1HB ALA 63 1HB ALA 63 1.821 5.823 -1.650 1212 2HB ALA 63 2HB ALA 63 0.668 6.445 -2.831 1213 3HB ALA 63 3HB ALA 63 2.061 5.508 -3.368 1214 H ARG 64 H ARG 64 1.212 8.229 -4.809 1215 HA ARG 64 HA ARG 64 2.774 7.313 -6.902 1216 1HB ARG 64 1HB ARG 64 0.416 8.275 -6.985 1217 2HB ARG 64 2HB ARG 64 1.171 9.863 -7.020 1218 1HG ARG 64 1HG ARG 64 2.460 8.374 -9.005 1219 2HG ARG 64 2HG ARG 64 0.742 7.999 -9.157 1220 1HD ARG 64 1HD ARG 64 1.751 10.818 -8.908 1221 2HD ARG 64 2HD ARG 64 1.624 10.002 -10.466 1222 HE ARG 64 HE ARG 64 -0.528 11.046 -8.876 1223 1HH1 ARG 64 1HH1 ARG 64 0.360 8.725 -11.314 1224 2HH1 ARG 64 2HH1 ARG 64 -1.237 8.613 -11.975 1225 1HH2 ARG 64 1HH2 ARG 64 -2.635 10.908 -9.738 1226 2HH2 ARG 64 2HH2 ARG 64 -2.940 9.856 -11.079 1227 H SER 65 H SER 65 3.081 10.233 -4.998 1228 HA SER 65 HA SER 65 5.031 11.440 -6.735 1229 1HB SER 65 1HB SER 65 3.407 12.621 -5.093 1230 2HB SER 65 2HB SER 65 4.603 12.219 -3.861 1231 HG SER 65 HG SER 65 5.390 14.078 -4.533 1232 H THR 66 H THR 66 5.058 9.281 -4.024 1233 HA THR 66 HA THR 66 7.842 9.671 -3.396 1234 HB THR 66 HB THR 66 6.207 7.292 -2.545 1235 HG1 THR 66 HG1 THR 66 5.649 8.688 -0.702 1236 1HG2 THR 66 1HG2 THR 66 8.756 7.684 -2.092 1237 2HG2 THR 66 2HG2 THR 66 7.709 7.093 -0.801 1238 3HG2 THR 66 3HG2 THR 66 8.164 8.796 -0.859 1239 H VAL 67 H VAL 67 5.915 7.190 -5.047 1240 HA VAL 67 HA VAL 67 7.887 5.315 -5.546 1241 HB VAL 67 HB VAL 67 5.643 6.087 -7.418 1242 1HG1 VAL 67 1HG1 VAL 67 7.679 3.986 -7.466 1243 2HG1 VAL 67 2HG1 VAL 67 6.028 3.396 -7.671 1244 3HG1 VAL 67 3HG1 VAL 67 6.671 4.621 -8.766 1245 1HG2 VAL 67 1HG2 VAL 67 4.201 5.156 -6.004 1246 2HG2 VAL 67 2HG2 VAL 67 5.199 3.711 -5.851 1247 3HG2 VAL 67 3HG2 VAL 67 5.494 5.101 -4.806 1248 H ARG 68 H ARG 68 7.290 8.382 -7.115 1249 HA ARG 68 HA ARG 68 8.698 8.082 -9.478 1250 1HB ARG 68 1HB ARG 68 8.587 10.539 -7.719 1251 2HB ARG 68 2HB ARG 68 9.027 10.514 -9.421 1252 1HG ARG 68 1HG ARG 68 6.455 9.267 -8.941 1253 2HG ARG 68 2HG ARG 68 6.510 10.939 -8.379 1254 1HD ARG 68 1HD ARG 68 6.990 11.764 -10.503 1255 2HD ARG 68 2HD ARG 68 7.543 10.196 -11.090 1256 HE ARG 68 HE ARG 68 4.845 9.957 -10.431 1257 1HH1 ARG 68 1HH1 ARG 68 6.850 11.642 -12.725 1258 2HH1 ARG 68 2HH1 ARG 68 5.626 11.698 -13.950 1259 1HH2 ARG 68 1HH2 ARG 68 3.226 10.024 -12.036 1260 2HH2 ARG 68 2HH2 ARG 68 3.565 10.778 -13.557 1261 H ASP 69 H ASP 69 9.879 8.406 -6.224 1262 HA ASP 69 HA ASP 69 12.582 9.025 -6.975 1263 1HB ASP 69 1HB ASP 69 11.207 9.354 -4.678 1264 2HB ASP 69 2HB ASP 69 12.040 7.846 -4.310 1265 H ILE 70 H ILE 70 10.735 6.137 -6.284 1266 HA ILE 70 HA ILE 70 12.854 4.337 -5.901 1267 HB ILE 70 HB ILE 70 10.166 3.737 -7.140 1268 1HG1 ILE 70 1HG1 ILE 70 10.983 3.600 -4.231 1269 2HG1 ILE 70 2HG1 ILE 70 10.044 4.913 -4.935 1270 1HG2 ILE 70 1HG2 ILE 70 11.546 1.872 -7.491 1271 2HG2 ILE 70 2HG2 ILE 70 12.297 2.023 -5.904 1272 3HG2 ILE 70 3HG2 ILE 70 10.623 1.485 -6.039 1273 1HD1 ILE 70 1HD1 ILE 70 9.252 2.070 -4.469 1274 2HD1 ILE 70 2HD1 ILE 70 8.445 3.554 -3.961 1275 3HD1 ILE 70 3HD1 ILE 70 8.410 3.066 -5.655 1276 H ASP 71 H ASP 71 11.569 5.805 -8.761 1277 HA ASP 71 HA ASP 71 13.742 5.051 -10.366 1278 1HB ASP 71 1HB ASP 71 11.504 3.162 -10.300 1279 2HB ASP 71 2HB ASP 71 11.915 3.702 -11.925 1280 HA PRO 72 HA PRO 72 12.168 8.282 -12.878 1281 1HB PRO 72 1HB PRO 72 13.003 7.559 -15.359 1282 2HB PRO 72 2HB PRO 72 14.105 8.144 -14.107 1283 1HG PRO 72 1HG PRO 72 13.522 5.333 -14.955 1284 2HG PRO 72 2HG PRO 72 15.082 6.088 -14.579 1285 1HD PRO 72 1HD PRO 72 13.766 4.508 -12.817 1286 2HD PRO 72 2HD PRO 72 14.781 5.871 -12.304 1287 H GLN 73 H GLN 73 11.641 5.108 -14.422 1288 HA GLN 73 HA GLN 73 8.967 6.049 -15.227 1289 1HB GLN 73 1HB GLN 73 10.777 4.050 -16.590 1290 2HB GLN 73 2HB GLN 73 9.117 4.376 -17.071 1291 1HG GLN 73 1HG GLN 73 9.892 6.819 -17.294 1292 2HG GLN 73 2HG GLN 73 11.519 6.143 -17.282 1293 1HE2 GLN 73 1HE2 GLN 73 12.009 6.666 -19.370 1294 2HE2 GLN 73 2HE2 GLN 73 11.244 5.937 -20.737 1295 H ASN 74 H ASN 74 7.285 5.015 -14.379 1296 HA ASN 74 HA ASN 74 7.245 2.219 -13.870 1297 1HB ASN 74 1HB ASN 74 8.373 3.769 -11.816 1298 2HB ASN 74 2HB ASN 74 6.741 3.387 -11.276 1299 1HD2 ASN 74 1HD2 ASN 74 9.134 2.447 -10.102 1300 2HD2 ASN 74 2HD2 ASN 74 9.161 0.727 -10.265 1301 H ASP 75 H ASP 75 5.246 1.982 -12.050 1302 HA ASP 75 HA ASP 75 3.140 3.819 -12.232 1303 1HB ASP 75 1HB ASP 75 3.501 2.549 -14.654 1304 2HB ASP 75 2HB ASP 75 2.241 1.582 -13.892 1305 H LEU 76 H LEU 76 2.104 3.391 -10.409 1306 HA LEU 76 HA LEU 76 2.311 0.973 -8.995 1307 1HB LEU 76 1HB LEU 76 1.247 3.540 -8.559 1308 2HB LEU 76 2HB LEU 76 -0.067 2.402 -8.267 1309 HG LEU 76 HG LEU 76 0.981 2.840 -6.180 1310 1HD1 LEU 76 1HD1 LEU 76 1.413 0.683 -5.453 1311 2HD1 LEU 76 2HD1 LEU 76 2.206 0.224 -6.959 1312 3HD1 LEU 76 3HD1 LEU 76 0.454 0.421 -6.910 1313 1HD2 LEU 76 1HD2 LEU 76 3.142 3.623 -7.309 1314 2HD2 LEU 76 2HD2 LEU 76 3.633 1.930 -7.252 1315 3HD2 LEU 76 3HD2 LEU 76 3.280 2.797 -5.756 1316 H THR 77 H THR 77 0.748 -0.629 -8.541 1317 HA THR 77 HA THR 77 -1.197 -1.005 -10.717 1318 HB THR 77 HB THR 77 -1.087 -3.377 -10.306 1319 HG1 THR 77 HG1 THR 77 0.056 -4.232 -8.603 1320 1HG2 THR 77 1HG2 THR 77 1.619 -2.053 -10.432 1321 2HG2 THR 77 2HG2 THR 77 0.629 -2.626 -11.775 1322 3HG2 THR 77 3HG2 THR 77 1.376 -3.783 -10.674 1323 H PHE 78 H PHE 78 -0.776 -1.341 -7.212 1324 HA PHE 78 HA PHE 78 -3.469 -0.545 -6.708 1325 1HB PHE 78 1HB PHE 78 -4.194 -2.642 -5.599 1326 2HB PHE 78 2HB PHE 78 -3.957 -2.840 -7.332 1327 HD1 PHE 78 HD1 PHE 78 -2.497 -4.461 -8.164 1328 HD2 PHE 78 HD2 PHE 78 -2.363 -3.422 -4.038 1329 HE1 PHE 78 HE1 PHE 78 -0.978 -6.350 -7.741 1330 HE2 PHE 78 HE2 PHE 78 -0.843 -5.308 -3.609 1331 HZ PHE 78 HZ PHE 78 -0.148 -6.775 -5.461 1332 H LEU 79 H LEU 79 -3.811 0.012 -4.565 1333 HA LEU 79 HA LEU 79 -1.444 -0.208 -2.824 1334 1HB LEU 79 1HB LEU 79 -3.197 2.030 -3.520 1335 2HB LEU 79 2HB LEU 79 -2.904 1.859 -1.791 1336 HG LEU 79 HG LEU 79 -0.545 2.129 -2.097 1337 1HD1 LEU 79 1HD1 LEU 79 0.465 2.459 -4.286 1338 2HD1 LEU 79 2HD1 LEU 79 -1.098 2.202 -5.060 1339 3HD1 LEU 79 3HD1 LEU 79 -0.319 0.882 -4.187 1340 1HD2 LEU 79 1HD2 LEU 79 -0.961 4.308 -2.031 1341 2HD2 LEU 79 2HD2 LEU 79 -2.466 4.095 -2.927 1342 3HD2 LEU 79 3HD2 LEU 79 -0.946 4.322 -3.795 1343 H ARG 80 H ARG 80 -1.901 -1.918 -1.543 1344 HA ARG 80 HA ARG 80 -4.522 -1.986 -0.212 1345 1HB ARG 80 1HB ARG 80 -2.468 -4.151 -0.676 1346 2HB ARG 80 2HB ARG 80 -3.886 -4.360 0.343 1347 1HG ARG 80 1HG ARG 80 -5.355 -4.098 -1.508 1348 2HG ARG 80 2HG ARG 80 -4.033 -3.584 -2.558 1349 1HD ARG 80 1HD ARG 80 -3.955 -5.726 -3.202 1350 2HD ARG 80 2HD ARG 80 -3.150 -6.011 -1.660 1351 HE ARG 80 HE ARG 80 -5.957 -6.123 -1.339 1352 1HH1 ARG 80 1HH1 ARG 80 -3.278 -7.924 -2.644 1353 2HH1 ARG 80 2HH1 ARG 80 -4.041 -9.464 -2.432 1354 1HH2 ARG 80 1HH2 ARG 80 -6.972 -8.146 -1.054 1355 2HH2 ARG 80 2HH2 ARG 80 -6.142 -9.590 -1.528 1356 H ILE 81 H ILE 81 -4.597 -1.297 1.813 1357 HA ILE 81 HA ILE 81 -2.131 -1.379 3.423 1358 HB ILE 81 HB ILE 81 -4.512 0.412 3.892 1359 1HG1 ILE 81 1HG1 ILE 81 -1.904 1.043 2.492 1360 2HG1 ILE 81 2HG1 ILE 81 -3.484 0.937 1.723 1361 1HG2 ILE 81 1HG2 ILE 81 -2.485 -0.285 5.585 1362 2HG2 ILE 81 2HG2 ILE 81 -1.874 1.204 4.866 1363 3HG2 ILE 81 3HG2 ILE 81 -3.433 1.198 5.689 1364 1HD1 ILE 81 1HD1 ILE 81 -3.781 3.088 2.110 1365 2HD1 ILE 81 2HD1 ILE 81 -3.721 2.774 3.845 1366 3HD1 ILE 81 3HD1 ILE 81 -2.243 3.169 2.968 1367 H ARG 82 H ARG 82 -2.394 -3.430 4.289 1368 HA ARG 82 HA ARG 82 -4.777 -4.431 5.396 1369 1HB ARG 82 1HB ARG 82 -2.289 -5.455 4.891 1370 2HB ARG 82 2HB ARG 82 -2.290 -5.374 6.647 1371 1HG ARG 82 1HG ARG 82 -3.042 -7.544 5.911 1372 2HG ARG 82 2HG ARG 82 -4.368 -6.680 6.692 1373 1HD ARG 82 1HD ARG 82 -5.608 -6.738 4.842 1374 2HD ARG 82 2HD ARG 82 -4.274 -6.157 3.847 1375 HE ARG 82 HE ARG 82 -5.162 -8.855 4.117 1376 1HH1 ARG 82 1HH1 ARG 82 -2.364 -6.863 3.546 1377 2HH1 ARG 82 2HH1 ARG 82 -1.506 -8.091 2.676 1378 1HH2 ARG 82 1HH2 ARG 82 -4.042 -10.480 2.973 1379 2HH2 ARG 82 2HH2 ARG 82 -2.462 -10.147 2.349 1380 H SER 83 H SER 83 -5.828 -3.857 7.171 1381 HA SER 83 HA SER 83 -4.327 -2.505 9.318 1382 1HB SER 83 1HB SER 83 -7.220 -2.063 9.316 1383 2HB SER 83 2HB SER 83 -5.903 -0.896 9.436 1384 HG SER 83 HG SER 83 -7.303 -1.776 7.216 1385 H LYS 84 H LYS 84 -6.168 -2.523 11.312 1386 HA LYS 84 HA LYS 84 -6.303 -5.374 11.969 1387 1HB LYS 84 1HB LYS 84 -6.449 -2.898 13.695 1388 2HB LYS 84 2HB LYS 84 -6.671 -4.531 14.310 1389 1HG LYS 84 1HG LYS 84 -4.376 -5.049 13.378 1390 2HG LYS 84 2HG LYS 84 -4.189 -3.310 13.143 1391 1HD LYS 84 1HD LYS 84 -3.266 -3.541 15.228 1392 2HD LYS 84 2HD LYS 84 -4.947 -3.227 15.665 1393 1HE LYS 84 1HE LYS 84 -5.302 -5.694 15.764 1394 2HE LYS 84 2HE LYS 84 -3.570 -5.905 15.512 1395 1HZ LYS 84 1HZ LYS 84 -3.380 -4.355 17.547 1396 2HZ LYS 84 2HZ LYS 84 -3.765 -5.983 17.792 1397 3HZ LYS 84 3HZ LYS 84 -4.981 -4.809 17.853 1398 H LYS 85 H LYS 85 -8.295 -2.582 11.422 1399 HA LYS 85 HA LYS 85 -10.684 -3.908 12.431 1400 1HB LYS 85 1HB LYS 85 -10.041 -1.153 11.456 1401 2HB LYS 85 2HB LYS 85 -11.715 -1.692 11.453 1402 1HG LYS 85 1HG LYS 85 -10.066 -1.967 13.926 1403 2HG LYS 85 2HG LYS 85 -10.776 -0.409 13.499 1404 1HD LYS 85 1HD LYS 85 -12.461 -2.884 13.530 1405 2HD LYS 85 2HD LYS 85 -12.096 -2.034 15.034 1406 1HE LYS 85 1HE LYS 85 -12.864 0.054 13.579 1407 2HE LYS 85 2HE LYS 85 -13.764 -1.197 12.724 1408 1HZ LYS 85 1HZ LYS 85 -15.272 -0.719 14.315 1409 2HZ LYS 85 2HZ LYS 85 -14.121 -0.172 15.427 1410 3HZ LYS 85 3HZ LYS 85 -14.369 -1.832 15.214 1411 H ASN 86 H ASN 86 -9.071 -3.247 9.435 1412 HA ASN 86 HA ASN 86 -10.552 -5.109 7.971 1413 1HB ASN 86 1HB ASN 86 -11.731 -3.489 6.416 1414 2HB ASN 86 2HB ASN 86 -12.434 -3.649 8.023 1415 1HD2 ASN 86 1HD2 ASN 86 -10.734 -1.587 5.827 1416 2HD2 ASN 86 2HD2 ASN 86 -10.888 -0.132 6.747 1417 H GLU 87 H GLU 87 -10.329 -4.415 5.430 1418 HA GLU 87 HA GLU 87 -7.517 -3.583 5.126 1419 1HB GLU 87 1HB GLU 87 -7.518 -5.046 3.081 1420 2HB GLU 87 2HB GLU 87 -7.663 -5.906 4.607 1421 1HG GLU 87 1HG GLU 87 -9.650 -6.750 4.070 1422 2HG GLU 87 2HG GLU 87 -10.239 -5.206 3.455 1423 H ILE 88 H ILE 88 -7.237 -1.757 4.048 1424 HA ILE 88 HA ILE 88 -9.405 -0.767 2.339 1425 HB ILE 88 HB ILE 88 -7.015 0.703 3.457 1426 1HG1 ILE 88 1HG1 ILE 88 -9.702 1.521 4.287 1427 2HG1 ILE 88 2HG1 ILE 88 -9.287 -0.114 4.789 1428 1HG2 ILE 88 1HG2 ILE 88 -8.924 1.366 1.383 1429 2HG2 ILE 88 2HG2 ILE 88 -8.945 2.539 2.699 1430 3HG2 ILE 88 3HG2 ILE 88 -7.438 2.190 1.853 1431 1HD1 ILE 88 1HD1 ILE 88 -7.870 0.611 6.345 1432 2HD1 ILE 88 2HD1 ILE 88 -7.169 1.826 5.275 1433 3HD1 ILE 88 3HD1 ILE 88 -8.667 2.170 6.139 1434 H MET 89 H MET 89 -9.126 -1.633 0.349 1435 HA MET 89 HA MET 89 -6.466 -1.418 -0.888 1436 1HB MET 89 1HB MET 89 -7.338 -3.052 -2.550 1437 2HB MET 89 2HB MET 89 -7.310 -3.676 -0.906 1438 1HG MET 89 1HG MET 89 -9.723 -3.151 -0.718 1439 2HG MET 89 2HG MET 89 -9.711 -2.674 -2.414 1440 1HE MET 89 1HE MET 89 -10.222 -4.088 -4.229 1441 2HE MET 89 2HE MET 89 -8.555 -4.659 -4.300 1442 3HE MET 89 3HE MET 89 -9.887 -5.813 -4.379 1443 H VAL 90 H VAL 90 -6.143 0.103 -2.365 1444 HA VAL 90 HA VAL 90 -8.375 1.005 -4.029 1445 HB VAL 90 HB VAL 90 -6.561 2.936 -2.578 1446 1HG1 VAL 90 1HG1 VAL 90 -8.811 4.250 -3.564 1447 2HG1 VAL 90 2HG1 VAL 90 -7.163 4.350 -4.187 1448 3HG1 VAL 90 3HG1 VAL 90 -8.296 3.183 -4.871 1449 1HG2 VAL 90 1HG2 VAL 90 -9.476 2.316 -2.110 1450 2HG2 VAL 90 2HG2 VAL 90 -8.142 1.881 -1.041 1451 3HG2 VAL 90 3HG2 VAL 90 -8.544 3.578 -1.302 1452 H ALA 91 H ALA 91 -7.812 1.387 -6.095 1453 HA ALA 91 HA ALA 91 -4.973 1.743 -6.749 1454 1HB ALA 91 1HB ALA 91 -4.812 -0.064 -8.101 1455 2HB ALA 91 2HB ALA 91 -6.056 -0.690 -7.018 1456 3HB ALA 91 3HB ALA 91 -6.510 0.001 -8.576 1457 HA PRO 92 HA PRO 92 -6.334 4.812 -9.575 1458 1HB PRO 92 1HB PRO 92 -4.518 4.563 -11.579 1459 2HB PRO 92 2HB PRO 92 -4.118 5.248 -9.999 1460 1HG PRO 92 1HG PRO 92 -3.638 2.483 -11.041 1461 2HG PRO 92 2HG PRO 92 -2.555 3.529 -10.103 1462 1HD PRO 92 1HD PRO 92 -3.973 1.516 -8.977 1463 2HD PRO 92 2HD PRO 92 -3.582 3.012 -8.106 1464 H ASP 93 H ASP 93 -8.330 4.178 -10.336 1465 HA ASP 93 HA ASP 93 -8.654 2.097 -12.274 1466 1HB ASP 93 1HB ASP 93 -10.338 3.481 -10.540 1467 2HB ASP 93 2HB ASP 93 -10.862 3.985 -12.144 1468 H LYS 94 H LYS 94 -10.420 3.091 -14.110 1469 HA LYS 94 HA LYS 94 -8.827 4.018 -16.154 1470 1HB LYS 94 1HB LYS 94 -11.618 3.549 -15.739 1471 2HB LYS 94 2HB LYS 94 -11.427 5.073 -16.597 1472 1HG LYS 94 1HG LYS 94 -10.201 4.005 -18.353 1473 2HG LYS 94 2HG LYS 94 -10.154 2.485 -17.457 1474 1HD LYS 94 1HD LYS 94 -12.393 2.040 -17.839 1475 2HD LYS 94 2HD LYS 94 -12.786 3.738 -18.122 1476 1HE LYS 94 1HE LYS 94 -12.323 3.595 -20.309 1477 2HE LYS 94 2HE LYS 94 -10.862 2.650 -20.030 1478 1HZ LYS 94 1HZ LYS 94 -13.140 1.087 -19.451 1479 2HZ LYS 94 2HZ LYS 94 -11.936 0.819 -20.608 1480 3HZ LYS 94 3HZ LYS 94 -13.295 1.747 -21.002 1481 H ASP 95 H ASP 95 -11.017 5.963 -14.125 1482 HA ASP 95 HA ASP 95 -9.223 8.232 -14.377 1483 1HB ASP 95 1HB ASP 95 -10.976 9.765 -15.139 1484 2HB ASP 95 2HB ASP 95 -10.708 8.484 -16.318 1485 H TYR 96 H TYR 96 -10.548 6.328 -12.360 1486 HA TYR 96 HA TYR 96 -11.100 8.408 -10.388 1487 1HB TYR 96 1HB TYR 96 -13.044 6.937 -9.549 1488 2HB TYR 96 2HB TYR 96 -13.325 7.945 -10.964 1489 HD1 TYR 96 HD1 TYR 96 -13.099 4.550 -9.695 1490 HD2 TYR 96 HD2 TYR 96 -13.421 6.919 -13.215 1491 HE1 TYR 96 HE1 TYR 96 -13.802 2.562 -10.961 1492 HE2 TYR 96 HE2 TYR 96 -14.126 4.938 -14.490 1493 HH TYR 96 HH TYR 96 -15.237 2.199 -13.170 1494 H PHE 97 H PHE 97 -11.453 7.258 -8.155 1495 HA PHE 97 HA PHE 97 -9.394 5.162 -7.928 1496 1HB PHE 97 1HB PHE 97 -10.100 7.429 -6.066 1497 2HB PHE 97 2HB PHE 97 -9.110 6.063 -5.565 1498 HD1 PHE 97 HD1 PHE 97 -8.712 9.265 -6.158 1499 HD2 PHE 97 HD2 PHE 97 -7.413 5.591 -7.869 1500 HE1 PHE 97 HE1 PHE 97 -6.715 10.391 -7.053 1501 HE2 PHE 97 HE2 PHE 97 -5.414 6.711 -8.766 1502 HZ PHE 97 HZ PHE 97 -5.063 9.114 -8.358 1503 H LEU 98 H LEU 98 -10.396 3.270 -7.668 1504 HA LEU 98 HA LEU 98 -12.939 3.065 -6.325 1505 1HB LEU 98 1HB LEU 98 -11.904 1.670 -8.323 1506 2HB LEU 98 2HB LEU 98 -11.315 0.668 -6.999 1507 HG LEU 98 HG LEU 98 -14.219 1.358 -7.148 1508 1HD1 LEU 98 1HD1 LEU 98 -14.619 -0.617 -8.522 1509 2HD1 LEU 98 2HD1 LEU 98 -12.881 -0.852 -8.703 1510 3HD1 LEU 98 3HD1 LEU 98 -13.653 0.577 -9.389 1511 1HD2 LEU 98 1HD2 LEU 98 -13.433 -1.338 -6.431 1512 2HD2 LEU 98 2HD2 LEU 98 -14.400 -0.167 -5.534 1513 3HD2 LEU 98 3HD2 LEU 98 -12.639 -0.127 -5.424 1514 H ILE 99 H ILE 99 -13.357 2.219 -4.334 1515 HA ILE 99 HA ILE 99 -11.078 1.295 -2.727 1516 HB ILE 99 HB ILE 99 -13.179 3.171 -1.649 1517 1HG1 ILE 99 1HG1 ILE 99 -10.823 4.565 -1.584 1518 2HG1 ILE 99 2HG1 ILE 99 -10.683 3.704 -3.113 1519 1HG2 ILE 99 1HG2 ILE 99 -12.362 2.061 0.184 1520 2HG2 ILE 99 2HG2 ILE 99 -10.771 1.818 -0.536 1521 3HG2 ILE 99 3HG2 ILE 99 -11.224 3.405 0.085 1522 1HD1 ILE 99 1HD1 ILE 99 -12.764 4.657 -3.877 1523 2HD1 ILE 99 2HD1 ILE 99 -12.998 5.453 -2.320 1524 3HD1 ILE 99 3HD1 ILE 99 -11.662 5.935 -3.365 1525 H VAL 100 H VAL 100 -11.567 -0.760 -2.303 1526 HA VAL 100 HA VAL 100 -14.344 -1.451 -1.628 1527 HB VAL 100 HB VAL 100 -12.070 -3.258 -2.460 1528 1HG1 VAL 100 1HG1 VAL 100 -14.180 -4.819 -2.747 1529 2HG1 VAL 100 2HG1 VAL 100 -13.338 -4.686 -1.201 1530 3HG1 VAL 100 3HG1 VAL 100 -14.828 -3.782 -1.477 1531 1HG2 VAL 100 1HG2 VAL 100 -14.241 -1.889 -3.929 1532 2HG2 VAL 100 2HG2 VAL 100 -12.628 -2.360 -4.466 1533 3HG2 VAL 100 3HG2 VAL 100 -13.914 -3.563 -4.375 1534 H ILE 101 H ILE 101 -14.739 -1.499 0.481 1535 HA ILE 101 HA ILE 101 -12.589 -2.278 2.322 1536 HB ILE 101 HB ILE 101 -15.231 -1.015 3.044 1537 1HG1 ILE 101 1HG1 ILE 101 -12.554 0.332 2.622 1538 2HG1 ILE 101 2HG1 ILE 101 -13.931 0.450 1.531 1539 1HG2 ILE 101 1HG2 ILE 101 -14.310 -0.635 5.170 1540 2HG2 ILE 101 2HG2 ILE 101 -13.861 -2.291 4.768 1541 3HG2 ILE 101 3HG2 ILE 101 -12.674 -0.995 4.618 1542 1HD1 ILE 101 1HD1 ILE 101 -15.219 1.425 3.463 1543 2HD1 ILE 101 2HD1 ILE 101 -13.680 1.531 4.318 1544 3HD1 ILE 101 3HD1 ILE 101 -13.916 2.421 2.815 1545 H GLN 102 H GLN 102 -12.642 -4.177 3.331 1546 HA GLN 102 HA GLN 102 -15.044 -5.450 4.168 1547 1HB GLN 102 1HB GLN 102 -15.105 -7.336 2.735 1548 2HB GLN 102 2HB GLN 102 -14.995 -5.932 1.682 1549 1HG GLN 102 1HG GLN 102 -12.578 -6.325 1.450 1550 2HG GLN 102 2HG GLN 102 -12.738 -7.769 2.448 1551 1HE2 GLN 102 1HE2 GLN 102 -12.698 -6.595 -0.656 1552 2HE2 GLN 102 2HE2 GLN 102 -13.399 -7.948 -1.470 1553 H ASN 103 H ASN 103 -14.515 -7.785 4.926 1554 HA ASN 103 HA ASN 103 -12.591 -7.681 6.900 1555 1HB ASN 103 1HB ASN 103 -14.237 -9.786 5.670 1556 2HB ASN 103 2HB ASN 103 -12.755 -10.372 6.419 1557 1HD2 ASN 103 1HD2 ASN 103 -15.841 -10.153 7.014 1558 2HD2 ASN 103 2HD2 ASN 103 -15.851 -9.800 8.705 1559 HA PRO 104 HA PRO 104 -8.670 -8.494 5.107 1560 1HB PRO 104 1HB PRO 104 -7.525 -10.158 6.921 1561 2HB PRO 104 2HB PRO 104 -7.791 -8.438 7.229 1562 1HG PRO 104 1HG PRO 104 -9.418 -10.792 8.107 1563 2HG PRO 104 2HG PRO 104 -8.943 -9.354 9.029 1564 1HD PRO 104 1HD PRO 104 -11.405 -9.637 7.938 1565 2HD PRO 104 2HD PRO 104 -10.612 -8.058 8.109 1566 H THR 105 H THR 105 -7.529 -9.943 3.841 1567 HA THR 105 HA THR 105 -8.857 -12.529 3.389 1568 HB THR 105 HB THR 105 -7.689 -12.492 1.168 1569 HG1 THR 105 HG1 THR 105 -6.645 -10.650 0.534 1570 1HG2 THR 105 1HG2 THR 105 -9.281 -9.984 1.295 1571 2HG2 THR 105 2HG2 THR 105 -10.060 -11.481 1.807 1572 3HG2 THR 105 3HG2 THR 105 -9.400 -11.342 0.177 1573 H GLU 106 H GLU 106 -5.747 -10.988 3.947 1574 HA GLU 106 HA GLU 106 -4.661 -13.478 4.920 1575 1HB GLU 106 1HB GLU 106 -4.239 -12.877 2.241 1576 2HB GLU 106 2HB GLU 106 -2.764 -12.334 3.031 1577 1HG GLU 106 1HG GLU 106 -2.108 -14.450 2.760 1578 2HG GLU 106 2HG GLU 106 -3.098 -14.758 4.186 Start of MODEL 9 1 H MET 11 H MET 11 16.076 -8.794 14.145 2 HA MET 11 HA MET 11 17.324 -7.743 12.398 3 1HB MET 11 1HB MET 11 18.863 -6.564 13.811 4 2HB MET 11 2HB MET 11 19.589 -8.066 14.367 5 1HG MET 11 1HG MET 11 20.970 -8.172 12.625 6 2HG MET 11 2HG MET 11 19.698 -7.755 11.479 7 1HE MET 11 1HE MET 11 22.021 -5.104 10.288 8 2HE MET 11 2HE MET 11 21.461 -6.770 10.138 9 3HE MET 11 3HE MET 11 20.320 -5.435 9.958 10 H ALA 12 H ALA 12 18.778 -10.392 14.279 11 HA ALA 12 HA ALA 12 19.961 -11.804 12.217 12 1HB ALA 12 1HB ALA 12 18.643 -12.881 14.706 13 2HB ALA 12 2HB ALA 12 19.729 -13.795 13.658 14 3HB ALA 12 3HB ALA 12 20.327 -12.385 14.533 15 H GLU 13 H GLU 13 16.604 -11.878 13.323 16 HA GLU 13 HA GLU 13 15.655 -14.037 11.881 17 1HB GLU 13 1HB GLU 13 14.532 -11.793 13.267 18 2HB GLU 13 2HB GLU 13 13.659 -12.032 11.760 19 1HG GLU 13 1HG GLU 13 13.527 -14.497 12.466 20 2HG GLU 13 2HG GLU 13 13.971 -13.909 14.068 21 H VAL 14 H VAL 14 15.768 -10.631 10.846 22 HA VAL 14 HA VAL 14 14.775 -11.072 8.249 23 HB VAL 14 HB VAL 14 16.666 -8.864 9.061 24 1HG1 VAL 14 1HG1 VAL 14 16.439 -8.572 6.814 25 2HG1 VAL 14 2HG1 VAL 14 14.864 -9.366 6.756 26 3HG1 VAL 14 3HG1 VAL 14 14.997 -7.710 7.351 27 1HG2 VAL 14 1HG2 VAL 14 14.545 -7.581 9.516 28 2HG2 VAL 14 2HG2 VAL 14 13.693 -9.124 9.468 29 3HG2 VAL 14 3HG2 VAL 14 14.935 -8.840 10.687 30 H GLU 15 H GLU 15 18.029 -11.161 9.584 31 HA GLU 15 HA GLU 15 19.429 -11.255 7.136 32 1HB GLU 15 1HB GLU 15 20.109 -12.145 9.929 33 2HB GLU 15 2HB GLU 15 21.225 -12.379 8.591 34 1HG GLU 15 1HG GLU 15 21.288 -9.989 8.192 35 2HG GLU 15 2HG GLU 15 20.115 -9.727 9.481 36 H GLU 16 H GLU 16 18.008 -13.755 9.173 37 HA GLU 16 HA GLU 16 19.104 -15.970 7.792 38 1HB GLU 16 1HB GLU 16 17.657 -15.648 10.091 39 2HB GLU 16 2HB GLU 16 16.464 -16.372 9.021 40 1HG GLU 16 1HG GLU 16 18.658 -17.938 8.580 41 2HG GLU 16 2HG GLU 16 18.809 -17.550 10.293 42 H THR 17 H THR 17 16.199 -14.048 7.350 43 HA THR 17 HA THR 17 15.079 -15.791 5.356 44 HB THR 17 HB THR 17 14.345 -12.955 6.109 45 HG1 THR 17 HG1 THR 17 14.048 -14.751 7.680 46 1HG2 THR 17 1HG2 THR 17 13.450 -13.189 3.977 47 2HG2 THR 17 2HG2 THR 17 12.128 -13.742 5.005 48 3HG2 THR 17 3HG2 THR 17 13.155 -14.915 4.181 49 H LEU 18 H LEU 18 17.269 -13.112 5.400 50 HA LEU 18 HA LEU 18 16.951 -12.243 2.729 51 1HB LEU 18 1HB LEU 18 18.675 -11.687 4.955 52 2HB LEU 18 2HB LEU 18 19.629 -11.834 3.480 53 HG LEU 18 HG LEU 18 17.710 -10.184 2.594 54 1HD1 LEU 18 1HD1 LEU 18 16.464 -9.985 4.599 55 2HD1 LEU 18 2HD1 LEU 18 17.363 -8.480 4.410 56 3HD1 LEU 18 3HD1 LEU 18 17.918 -9.700 5.556 57 1HD2 LEU 18 1HD2 LEU 18 20.095 -9.254 4.186 58 2HD2 LEU 18 2HD2 LEU 18 19.285 -8.393 2.877 59 3HD2 LEU 18 3HD2 LEU 18 20.175 -9.878 2.538 60 H LYS 19 H LYS 19 18.992 -14.694 4.233 61 HA LYS 19 HA LYS 19 20.621 -15.281 2.030 62 1HB LYS 19 1HB LYS 19 20.016 -16.465 4.610 63 2HB LYS 19 2HB LYS 19 20.251 -17.699 3.378 64 1HG LYS 19 1HG LYS 19 22.394 -17.454 4.093 65 2HG LYS 19 2HG LYS 19 22.373 -16.238 2.814 66 1HD LYS 19 1HD LYS 19 22.508 -14.513 4.273 67 2HD LYS 19 2HD LYS 19 21.507 -15.321 5.482 68 1HE LYS 19 1HE LYS 19 23.316 -16.546 6.323 69 2HE LYS 19 2HE LYS 19 24.300 -16.247 4.891 70 1HZ LYS 19 1HZ LYS 19 24.845 -14.944 6.988 71 2HZ LYS 19 2HZ LYS 19 23.450 -14.043 6.667 72 3HZ LYS 19 3HZ LYS 19 24.718 -14.065 5.548 73 H ARG 20 H ARG 20 17.599 -16.833 3.102 74 HA ARG 20 HA ARG 20 17.434 -18.637 0.937 75 1HB ARG 20 1HB ARG 20 16.193 -18.744 3.161 76 2HB ARG 20 2HB ARG 20 15.083 -17.560 2.486 77 1HG ARG 20 1HG ARG 20 13.921 -19.342 1.811 78 2HG ARG 20 2HG ARG 20 15.124 -19.442 0.524 79 1HD ARG 20 1HD ARG 20 16.424 -20.780 2.445 80 2HD ARG 20 2HD ARG 20 14.765 -21.122 2.933 81 HE ARG 20 HE ARG 20 15.036 -21.592 0.175 82 1HH1 ARG 20 1HH1 ARG 20 16.029 -22.911 3.240 83 2HH1 ARG 20 2HH1 ARG 20 16.148 -24.535 2.650 84 1HH2 ARG 20 1HH2 ARG 20 15.190 -23.727 -0.614 85 2HH2 ARG 20 2HH2 ARG 20 15.672 -24.998 0.457 86 H LEU 21 H LEU 21 16.173 -15.382 1.440 87 HA LEU 21 HA LEU 21 14.527 -15.255 -0.836 88 1HB LEU 21 1HB LEU 21 15.639 -13.390 1.115 89 2HB LEU 21 2HB LEU 21 15.409 -12.680 -0.481 90 HG LEU 21 HG LEU 21 13.053 -13.172 -0.416 91 1HD1 LEU 21 1HD1 LEU 21 12.467 -14.006 2.142 92 2HD1 LEU 21 2HD1 LEU 21 13.864 -14.988 1.703 93 3HD1 LEU 21 3HD1 LEU 21 12.422 -15.001 0.687 94 1HD2 LEU 21 1HD2 LEU 21 13.427 -11.100 0.550 95 2HD2 LEU 21 2HD2 LEU 21 14.232 -11.788 1.961 96 3HD2 LEU 21 3HD2 LEU 21 12.483 -11.934 1.785 97 H GLN 22 H GLN 22 17.856 -14.079 -0.349 98 HA GLN 22 HA GLN 22 18.232 -13.289 -3.040 99 1HB GLN 22 1HB GLN 22 19.680 -13.120 -0.640 100 2HB GLN 22 2HB GLN 22 20.709 -14.016 -1.748 101 1HG GLN 22 1HG GLN 22 21.184 -12.202 -2.939 102 2HG GLN 22 2HG GLN 22 19.498 -11.692 -2.993 103 1HE2 GLN 22 1HE2 GLN 22 18.842 -11.209 -0.466 104 2HE2 GLN 22 2HE2 GLN 22 19.834 -9.971 0.219 105 H SER 23 H SER 23 18.132 -16.337 -1.580 106 HA SER 23 HA SER 23 19.894 -17.621 -3.497 107 1HB SER 23 1HB SER 23 18.582 -18.375 -0.978 108 2HB SER 23 2HB SER 23 18.613 -19.662 -2.183 109 HG SER 23 HG SER 23 20.717 -19.802 -1.992 110 H GLN 24 H GLN 24 16.530 -16.959 -3.072 111 HA GLN 24 HA GLN 24 15.752 -18.893 -5.115 112 1HB GLN 24 1HB GLN 24 13.450 -18.249 -4.564 113 2HB GLN 24 2HB GLN 24 14.343 -18.733 -3.128 114 1HG GLN 24 1HG GLN 24 14.565 -16.493 -2.400 115 2HG GLN 24 2HG GLN 24 13.998 -15.864 -3.946 116 1HE2 GLN 24 1HE2 GLN 24 12.736 -14.823 -1.954 117 2HE2 GLN 24 2HE2 GLN 24 11.174 -15.515 -1.700 118 H LYS 25 H LYS 25 14.565 -18.264 -6.991 119 HA LYS 25 HA LYS 25 15.587 -15.858 -8.191 120 1HB LYS 25 1HB LYS 25 14.744 -18.325 -9.141 121 2HB LYS 25 2HB LYS 25 13.486 -17.222 -9.683 122 1HG LYS 25 1HG LYS 25 15.440 -15.768 -10.530 123 2HG LYS 25 2HG LYS 25 16.397 -17.242 -10.365 124 1HD LYS 25 1HD LYS 25 14.207 -18.172 -11.680 125 2HD LYS 25 2HD LYS 25 14.328 -16.536 -12.330 126 1HE LYS 25 1HE LYS 25 16.866 -17.175 -12.578 127 2HE LYS 25 2HE LYS 25 16.233 -18.820 -12.547 128 1HZ LYS 25 1HZ LYS 25 15.212 -16.737 -14.390 129 2HZ LYS 25 2HZ LYS 25 14.929 -18.403 -14.452 130 3HZ LYS 25 3HZ LYS 25 16.468 -17.793 -14.802 131 H GLY 26 H GLY 26 14.562 -13.965 -8.530 132 1HA GLY 26 1HA GLY 26 12.330 -12.935 -9.037 133 2HA GLY 26 2HA GLY 26 11.759 -13.789 -7.611 134 H VAL 27 H VAL 27 13.870 -13.330 -5.864 135 HA VAL 27 HA VAL 27 13.219 -10.814 -4.825 136 HB VAL 27 HB VAL 27 15.661 -12.502 -4.261 137 1HG1 VAL 27 1HG1 VAL 27 14.492 -10.125 -2.834 138 2HG1 VAL 27 2HG1 VAL 27 15.613 -11.253 -2.067 139 3HG1 VAL 27 3HG1 VAL 27 16.124 -10.318 -3.473 140 1HG2 VAL 27 1HG2 VAL 27 13.612 -13.711 -3.824 141 2HG2 VAL 27 2HG2 VAL 27 14.370 -13.259 -2.297 142 3HG2 VAL 27 3HG2 VAL 27 12.977 -12.355 -2.891 143 H GLN 28 H GLN 28 14.250 -8.843 -4.825 144 HA GLN 28 HA GLN 28 16.353 -8.510 -6.861 145 1HB GLN 28 1HB GLN 28 13.867 -7.116 -6.406 146 2HB GLN 28 2HB GLN 28 15.222 -5.999 -6.311 147 1HG GLN 28 1HG GLN 28 15.914 -6.486 -8.506 148 2HG GLN 28 2HG GLN 28 14.875 -7.908 -8.598 149 1HE2 GLN 28 1HE2 GLN 28 13.216 -7.607 -9.882 150 2HE2 GLN 28 2HE2 GLN 28 12.332 -6.138 -10.089 151 H GLY 29 H GLY 29 15.362 -7.815 -3.588 152 1HA GLY 29 1HA GLY 29 17.863 -7.595 -2.494 153 2HA GLY 29 2HA GLY 29 17.486 -5.967 -3.037 154 H ILE 30 H ILE 30 17.800 -7.269 -0.319 155 HA ILE 30 HA ILE 30 15.214 -6.393 0.795 156 HB ILE 30 HB ILE 30 17.112 -8.328 2.117 157 1HG1 ILE 30 1HG1 ILE 30 15.035 -9.888 1.456 158 2HG1 ILE 30 2HG1 ILE 30 14.964 -8.761 0.106 159 1HG2 ILE 30 1HG2 ILE 30 14.377 -7.284 2.723 160 2HG2 ILE 30 2HG2 ILE 30 14.871 -8.872 3.307 161 3HG2 ILE 30 3HG2 ILE 30 15.778 -7.437 3.783 162 1HD1 ILE 30 1HD1 ILE 30 16.544 -11.019 0.303 163 2HD1 ILE 30 2HD1 ILE 30 16.691 -9.727 -0.889 164 3HD1 ILE 30 3HD1 ILE 30 17.659 -9.682 0.584 165 H ILE 31 H ILE 31 15.282 -4.631 2.015 166 HA ILE 31 HA ILE 31 17.833 -3.909 3.303 167 HB ILE 31 HB ILE 31 15.803 -2.017 2.109 168 1HG1 ILE 31 1HG1 ILE 31 18.646 -2.103 1.236 169 2HG1 ILE 31 2HG1 ILE 31 17.601 -3.416 0.704 170 1HG2 ILE 31 1HG2 ILE 31 17.467 -0.270 2.684 171 2HG2 ILE 31 2HG2 ILE 31 16.754 -1.052 4.094 172 3HG2 ILE 31 3HG2 ILE 31 18.382 -1.486 3.574 173 1HD1 ILE 31 1HD1 ILE 31 17.890 -1.297 -0.763 174 2HD1 ILE 31 2HD1 ILE 31 16.296 -2.031 -0.582 175 3HD1 ILE 31 3HD1 ILE 31 16.716 -0.593 0.349 176 H VAL 32 H VAL 32 17.750 -3.073 5.368 177 HA VAL 32 HA VAL 32 15.100 -3.011 6.656 178 HB VAL 32 HB VAL 32 17.582 -3.971 8.065 179 1HG1 VAL 32 1HG1 VAL 32 16.008 -4.885 9.663 180 2HG1 VAL 32 2HG1 VAL 32 15.697 -3.163 9.434 181 3HG1 VAL 32 3HG1 VAL 32 14.651 -4.358 8.667 182 1HG2 VAL 32 1HG2 VAL 32 16.712 -6.270 7.730 183 2HG2 VAL 32 2HG2 VAL 32 15.521 -5.619 6.603 184 3HG2 VAL 32 3HG2 VAL 32 17.242 -5.499 6.235 185 H VAL 33 H VAL 33 14.665 -1.141 7.610 186 HA VAL 33 HA VAL 33 16.916 0.610 8.361 187 HB VAL 33 HB VAL 33 14.149 1.637 7.822 188 1HG1 VAL 33 1HG1 VAL 33 15.099 3.700 7.822 189 2HG1 VAL 33 2HG1 VAL 33 16.265 2.880 8.863 190 3HG1 VAL 33 3HG1 VAL 33 16.624 3.120 7.152 191 1HG2 VAL 33 1HG2 VAL 33 16.307 1.142 5.774 192 2HG2 VAL 33 2HG2 VAL 33 14.713 0.390 5.833 193 3HG2 VAL 33 3HG2 VAL 33 14.862 2.115 5.500 194 H ASN 34 H ASN 34 17.029 1.371 10.398 195 HA ASN 34 HA ASN 34 15.162 0.301 12.340 196 1HB ASN 34 1HB ASN 34 16.743 1.309 14.002 197 2HB ASN 34 2HB ASN 34 17.498 0.157 12.904 198 1HD2 ASN 34 1HD2 ASN 34 19.515 1.107 13.371 199 2HD2 ASN 34 2HD2 ASN 34 19.985 2.604 12.646 200 H THR 35 H THR 35 14.978 2.065 14.313 201 HA THR 35 HA THR 35 12.973 3.834 13.499 202 HB THR 35 HB THR 35 13.886 4.935 15.859 203 HG1 THR 35 HG1 THR 35 15.185 3.525 16.737 204 1HG2 THR 35 1HG2 THR 35 11.873 2.879 15.110 205 2HG2 THR 35 2HG2 THR 35 11.647 4.467 15.842 206 3HG2 THR 35 3HG2 THR 35 12.210 3.115 16.824 207 H GLU 36 H GLU 36 16.408 4.391 14.157 208 HA GLU 36 HA GLU 36 16.389 7.185 13.913 209 1HB GLU 36 1HB GLU 36 18.456 5.054 13.744 210 2HB GLU 36 2HB GLU 36 18.872 6.631 13.088 211 1HG GLU 36 1HG GLU 36 17.797 7.309 15.492 212 2HG GLU 36 2HG GLU 36 18.563 5.765 15.863 213 H GLY 37 H GLY 37 16.461 4.638 11.517 214 1HA GLY 37 1HA GLY 37 15.573 5.099 9.317 215 2HA GLY 37 2HA GLY 37 16.271 6.708 9.426 216 H ILE 38 H ILE 38 18.316 4.282 10.619 217 HA ILE 38 HA ILE 38 20.033 4.567 8.276 218 HB ILE 38 HB ILE 38 20.640 3.272 10.937 219 1HG1 ILE 38 1HG1 ILE 38 21.333 6.028 9.894 220 2HG1 ILE 38 2HG1 ILE 38 20.174 5.671 11.170 221 1HG2 ILE 38 1HG2 ILE 38 22.961 3.379 10.247 222 2HG2 ILE 38 2HG2 ILE 38 22.021 2.465 9.068 223 3HG2 ILE 38 3HG2 ILE 38 22.495 4.127 8.719 224 1HD1 ILE 38 1HD1 ILE 38 22.432 4.455 12.095 225 2HD1 ILE 38 2HD1 ILE 38 23.078 5.876 11.275 226 3HD1 ILE 38 3HD1 ILE 38 21.875 6.065 12.550 227 HA PRO 39 HA PRO 39 18.901 0.578 6.733 228 1HB PRO 39 1HB PRO 39 20.914 0.323 4.929 229 2HB PRO 39 2HB PRO 39 19.522 1.381 4.671 230 1HG PRO 39 1HG PRO 39 22.275 2.071 5.624 231 2HG PRO 39 2HG PRO 39 21.249 2.923 4.455 232 1HD PRO 39 1HD PRO 39 21.505 3.729 7.027 233 2HD PRO 39 2HD PRO 39 20.005 3.948 6.103 234 H ILE 40 H ILE 40 19.505 -0.319 8.898 235 HA ILE 40 HA ILE 40 22.009 -1.141 9.683 236 HB ILE 40 HB ILE 40 20.769 -3.127 10.758 237 1HG1 ILE 40 1HG1 ILE 40 18.298 -1.559 10.108 238 2HG1 ILE 40 2HG1 ILE 40 18.871 -2.787 8.984 239 1HG2 ILE 40 1HG2 ILE 40 20.690 -1.770 12.515 240 2HG2 ILE 40 2HG2 ILE 40 21.011 -0.424 11.424 241 3HG2 ILE 40 3HG2 ILE 40 19.349 -0.862 11.819 242 1HD1 ILE 40 1HD1 ILE 40 17.233 -3.163 11.189 243 2HD1 ILE 40 2HD1 ILE 40 18.021 -4.411 10.223 244 3HD1 ILE 40 3HD1 ILE 40 18.803 -3.799 11.680 245 H LYS 41 H LYS 41 19.862 -2.614 7.327 246 HA LYS 41 HA LYS 41 22.075 -4.309 6.440 247 1HB LYS 41 1HB LYS 41 19.863 -5.307 7.872 248 2HB LYS 41 2HB LYS 41 19.600 -5.763 6.194 249 1HG LYS 41 1HG LYS 41 22.299 -6.310 6.744 250 2HG LYS 41 2HG LYS 41 21.371 -6.906 8.122 251 1HD LYS 41 1HD LYS 41 20.320 -8.500 6.895 252 2HD LYS 41 2HD LYS 41 20.286 -7.507 5.437 253 1HE LYS 41 1HE LYS 41 21.752 -9.517 5.275 254 2HE LYS 41 2HE LYS 41 22.581 -7.991 4.973 255 1HZ LYS 41 1HZ LYS 41 22.677 -8.695 7.728 256 2HZ LYS 41 2HZ LYS 41 23.948 -8.366 6.662 257 3HZ LYS 41 3HZ LYS 41 23.318 -9.932 6.768 258 H SER 42 H SER 42 22.136 -4.678 4.254 259 HA SER 42 HA SER 42 19.931 -4.195 2.518 260 1HB SER 42 1HB SER 42 20.369 -1.867 2.942 261 2HB SER 42 2HB SER 42 22.098 -2.091 2.676 262 HG SER 42 HG SER 42 21.707 -2.432 0.515 263 H THR 43 H THR 43 20.324 -4.885 0.422 264 HA THR 43 HA THR 43 23.023 -5.949 -0.098 265 HB THR 43 HB THR 43 22.154 -7.932 -1.054 266 HG1 THR 43 HG1 THR 43 19.792 -8.187 -1.180 267 1HG2 THR 43 1HG2 THR 43 21.771 -7.355 1.594 268 2HG2 THR 43 2HG2 THR 43 21.580 -8.950 0.866 269 3HG2 THR 43 3HG2 THR 43 20.173 -7.913 1.103 270 H MET 44 H MET 44 20.731 -3.792 -1.062 271 HA MET 44 HA MET 44 20.937 -4.118 -3.911 272 1HB MET 44 1HB MET 44 19.886 -1.819 -2.253 273 2HB MET 44 2HB MET 44 19.736 -1.952 -4.000 274 1HG MET 44 1HG MET 44 18.738 -4.270 -2.517 275 2HG MET 44 2HG MET 44 17.873 -2.767 -2.205 276 1HE MET 44 1HE MET 44 19.382 -4.943 -5.078 277 2HE MET 44 2HE MET 44 18.484 -4.372 -6.484 278 3HE MET 44 3HE MET 44 19.636 -3.305 -5.680 279 H ASP 45 H ASP 45 21.396 -1.727 -4.991 280 HA ASP 45 HA ASP 45 24.226 -1.462 -4.807 281 1HB ASP 45 1HB ASP 45 22.484 -0.990 -6.787 282 2HB ASP 45 2HB ASP 45 22.632 0.650 -6.162 283 H ASN 46 H ASN 46 25.189 0.840 -4.687 284 HA ASN 46 HA ASN 46 24.836 1.792 -2.067 285 1HB ASN 46 1HB ASN 46 26.656 2.213 -4.179 286 2HB ASN 46 2HB ASN 46 26.023 3.802 -3.759 287 1HD2 ASN 46 1HD2 ASN 46 25.600 3.485 -1.055 288 2HD2 ASN 46 2HD2 ASN 46 27.122 3.283 -0.262 289 HA PRO 47 HA PRO 47 22.598 5.598 -4.038 290 1HB PRO 47 1HB PRO 47 21.865 5.393 -6.644 291 2HB PRO 47 2HB PRO 47 23.431 6.037 -6.134 292 1HG PRO 47 1HG PRO 47 22.741 3.297 -7.125 293 2HG PRO 47 2HG PRO 47 24.135 4.315 -7.530 294 1HD PRO 47 1HD PRO 47 24.285 2.278 -5.751 295 2HD PRO 47 2HD PRO 47 25.266 3.751 -5.602 296 H THR 48 H THR 48 21.735 2.347 -4.986 297 HA THR 48 HA THR 48 18.916 2.873 -5.183 298 HB THR 48 HB THR 48 20.419 0.255 -5.009 299 HG1 THR 48 HG1 THR 48 20.733 0.608 -7.064 300 1HG2 THR 48 1HG2 THR 48 18.240 -0.632 -6.003 301 2HG2 THR 48 2HG2 THR 48 17.508 0.874 -5.449 302 3HG2 THR 48 3HG2 THR 48 18.231 -0.235 -4.285 303 H THR 49 H THR 49 21.135 1.822 -2.701 304 HA THR 49 HA THR 49 19.082 0.939 -0.889 305 HB THR 49 HB THR 49 22.015 1.506 -0.417 306 HG1 THR 49 HG1 THR 49 22.276 -0.644 -0.735 307 1HG2 THR 49 1HG2 THR 49 20.912 1.719 1.686 308 2HG2 THR 49 2HG2 THR 49 21.638 0.112 1.648 309 3HG2 THR 49 3HG2 THR 49 19.907 0.304 1.373 310 H THR 50 H THR 50 21.281 3.736 -1.029 311 HA THR 50 HA THR 50 20.421 5.058 1.253 312 HB THR 50 HB THR 50 21.112 6.635 -1.199 313 HG1 THR 50 HG1 THR 50 22.922 5.573 -1.398 314 1HG2 THR 50 1HG2 THR 50 22.282 8.035 0.369 315 2HG2 THR 50 2HG2 THR 50 22.051 6.857 1.661 316 3HG2 THR 50 3HG2 THR 50 20.666 7.726 1.001 317 H GLN 51 H GLN 51 18.988 4.932 -1.945 318 HA GLN 51 HA GLN 51 17.116 7.041 -1.505 319 1HB GLN 51 1HB GLN 51 17.705 6.501 -3.765 320 2HB GLN 51 2HB GLN 51 17.237 4.820 -3.545 321 1HG GLN 51 1HG GLN 51 15.012 6.504 -2.941 322 2HG GLN 51 2HG GLN 51 15.678 6.949 -4.511 323 1HE2 GLN 51 1HE2 GLN 51 13.688 4.828 -2.849 324 2HE2 GLN 51 2HE2 GLN 51 13.462 3.653 -4.095 325 H TYR 52 H TYR 52 16.785 3.494 -1.609 326 HA TYR 52 HA TYR 52 14.087 3.379 -0.899 327 1HB TYR 52 1HB TYR 52 16.373 1.454 -0.711 328 2HB TYR 52 2HB TYR 52 14.835 1.045 0.042 329 HD1 TYR 52 HD1 TYR 52 12.830 1.959 -1.789 330 HD2 TYR 52 HD2 TYR 52 16.619 0.225 -2.648 331 HE1 TYR 52 HE1 TYR 52 11.973 1.175 -3.957 332 HE2 TYR 52 HE2 TYR 52 15.773 -0.563 -4.819 333 HH TYR 52 HH TYR 52 13.023 -1.081 -5.643 334 H ALA 53 H ALA 53 16.970 3.695 1.063 335 HA ALA 53 HA ALA 53 15.996 3.034 3.571 336 1HB ALA 53 1HB ALA 53 17.977 5.190 2.847 337 2HB ALA 53 2HB ALA 53 17.729 4.538 4.467 338 3HB ALA 53 3HB ALA 53 18.340 3.497 3.181 339 H SER 54 H SER 54 16.092 6.291 2.113 340 HA SER 54 HA SER 54 14.425 7.387 4.182 341 1HB SER 54 1HB SER 54 15.849 8.419 1.795 342 2HB SER 54 2HB SER 54 14.415 9.317 2.293 343 HG SER 54 HG SER 54 16.847 8.959 3.610 344 H LEU 55 H LEU 55 14.013 6.598 0.747 345 HA LEU 55 HA LEU 55 11.447 7.522 0.341 346 1HB LEU 55 1HB LEU 55 13.100 6.402 -1.284 347 2HB LEU 55 2HB LEU 55 12.362 4.889 -0.764 348 HG LEU 55 HG LEU 55 11.458 5.744 -2.900 349 1HD1 LEU 55 1HD1 LEU 55 9.439 4.874 -2.448 350 2HD1 LEU 55 2HD1 LEU 55 9.136 5.995 -1.121 351 3HD1 LEU 55 3HD1 LEU 55 10.132 4.564 -0.855 352 1HD2 LEU 55 1HD2 LEU 55 10.291 7.967 -1.232 353 2HD2 LEU 55 2HD2 LEU 55 10.089 7.711 -2.965 354 3HD2 LEU 55 3HD2 LEU 55 11.669 8.153 -2.317 355 H MET 56 H MET 56 12.343 4.205 1.310 356 HA MET 56 HA MET 56 9.752 3.272 1.746 357 1HB MET 56 1HB MET 56 12.344 2.453 3.065 358 2HB MET 56 2HB MET 56 10.838 1.557 3.204 359 1HG MET 56 1HG MET 56 12.271 2.122 0.620 360 2HG MET 56 2HG MET 56 12.385 0.620 1.535 361 1HE MET 56 1HE MET 56 10.297 1.345 -1.874 362 2HE MET 56 2HE MET 56 9.270 2.458 -0.970 363 3HE MET 56 3HE MET 56 11.025 2.635 -0.916 364 H HIS 57 H HIS 57 12.092 4.424 4.184 365 HA HIS 57 HA HIS 57 10.467 4.317 6.408 366 1HB HIS 57 1HB HIS 57 12.803 4.805 6.656 367 2HB HIS 57 2HB HIS 57 12.653 6.281 5.708 368 HD1 HIS 57 HD1 HIS 57 13.347 7.948 7.461 369 HD2 HIS 57 HD2 HIS 57 10.316 5.419 8.758 370 HE1 HIS 57 HE1 HIS 57 12.579 8.892 9.661 371 H SER 58 H SER 58 10.498 6.659 3.821 372 HA SER 58 HA SER 58 8.867 8.588 5.176 373 1HB SER 58 1HB SER 58 10.477 9.051 3.248 374 2HB SER 58 2HB SER 58 9.245 8.367 2.188 375 HG SER 58 HG SER 58 8.979 10.597 2.309 376 H PHE 59 H PHE 59 8.306 6.027 2.804 377 HA PHE 59 HA PHE 59 5.664 6.521 2.160 378 1HB PHE 59 1HB PHE 59 7.219 4.735 1.211 379 2HB PHE 59 2HB PHE 59 6.762 3.745 2.593 380 HD1 PHE 59 HD1 PHE 59 4.144 3.550 2.958 381 HD2 PHE 59 HD2 PHE 59 6.041 4.481 -0.737 382 HE1 PHE 59 HE1 PHE 59 2.150 2.776 1.743 383 HE2 PHE 59 HE2 PHE 59 4.049 3.708 -1.958 384 HZ PHE 59 HZ PHE 59 2.100 2.855 -0.718 385 H ILE 60 H ILE 60 6.835 4.329 4.720 386 HA ILE 60 HA ILE 60 4.365 3.691 5.819 387 HB ILE 60 HB ILE 60 7.000 3.957 7.271 388 1HG1 ILE 60 1HG1 ILE 60 7.169 2.422 5.395 389 2HG1 ILE 60 2HG1 ILE 60 7.155 1.509 6.900 390 1HG2 ILE 60 1HG2 ILE 60 5.459 1.942 8.429 391 2HG2 ILE 60 2HG2 ILE 60 5.835 3.522 9.113 392 3HG2 ILE 60 3HG2 ILE 60 4.351 3.292 8.188 393 1HD1 ILE 60 1HD1 ILE 60 4.482 1.713 6.086 394 2HD1 ILE 60 2HD1 ILE 60 5.416 1.310 4.645 395 3HD1 ILE 60 3HD1 ILE 60 5.515 0.284 6.075 396 H LEU 61 H LEU 61 6.571 6.342 6.666 397 HA LEU 61 HA LEU 61 5.032 7.384 8.780 398 1HB LEU 61 1HB LEU 61 7.367 8.155 7.249 399 2HB LEU 61 2HB LEU 61 6.360 9.546 7.646 400 HG LEU 61 HG LEU 61 6.538 9.013 10.019 401 1HD1 LEU 61 1HD1 LEU 61 8.475 7.246 10.449 402 2HD1 LEU 61 2HD1 LEU 61 7.829 6.567 8.955 403 3HD1 LEU 61 3HD1 LEU 61 6.776 6.780 10.354 404 1HD2 LEU 61 1HD2 LEU 61 9.254 9.034 8.710 405 2HD2 LEU 61 2HD2 LEU 61 8.849 9.606 10.328 406 3HD2 LEU 61 3HD2 LEU 61 8.227 10.453 8.911 407 H LYS 62 H LYS 62 4.771 7.679 5.336 408 HA LYS 62 HA LYS 62 3.082 10.001 5.367 409 1HB LYS 62 1HB LYS 62 4.575 9.156 3.443 410 2HB LYS 62 2HB LYS 62 3.272 8.024 3.107 411 1HG LYS 62 1HG LYS 62 2.642 9.693 1.717 412 2HG LYS 62 2HG LYS 62 1.836 10.257 3.183 413 1HD LYS 62 1HD LYS 62 2.914 12.183 2.703 414 2HD LYS 62 2HD LYS 62 4.261 11.383 3.515 415 1HE LYS 62 1HE LYS 62 5.126 10.624 1.375 416 2HE LYS 62 2HE LYS 62 3.749 11.345 0.542 417 1HZ LYS 62 1HZ LYS 62 6.076 12.577 0.843 418 2HZ LYS 62 2HZ LYS 62 5.297 13.126 2.240 419 3HZ LYS 62 3HZ LYS 62 4.606 13.406 0.721 420 H ALA 63 H ALA 63 2.520 6.545 4.697 421 HA ALA 63 HA ALA 63 -0.291 6.767 4.515 422 1HB ALA 63 1HB ALA 63 0.283 4.157 5.334 423 2HB ALA 63 2HB ALA 63 0.058 4.738 3.684 424 3HB ALA 63 3HB ALA 63 1.676 4.673 4.383 425 H ARG 64 H ARG 64 1.851 5.799 7.179 426 HA ARG 64 HA ARG 64 -0.053 5.092 9.058 427 1HB ARG 64 1HB ARG 64 2.477 4.912 9.237 428 2HB ARG 64 2HB ARG 64 2.472 6.602 9.722 429 1HG ARG 64 1HG ARG 64 0.576 5.369 11.355 430 2HG ARG 64 2HG ARG 64 1.936 4.247 11.280 431 1HD ARG 64 1HD ARG 64 2.543 7.122 11.690 432 2HD ARG 64 2HD ARG 64 1.825 6.241 13.037 433 HE ARG 64 HE ARG 64 4.502 6.054 12.130 434 1HH1 ARG 64 1HH1 ARG 64 1.896 4.145 13.428 435 2HH1 ARG 64 2HH1 ARG 64 2.943 2.970 14.152 436 1HH2 ARG 64 1HH2 ARG 64 5.892 4.514 13.079 437 2HH2 ARG 64 2HH2 ARG 64 5.216 3.182 13.954 438 H SER 65 H SER 65 1.102 8.289 8.139 439 HA SER 65 HA SER 65 -0.239 9.685 10.230 440 1HB SER 65 1HB SER 65 1.743 10.444 8.689 441 2HB SER 65 2HB SER 65 0.452 10.980 7.614 442 HG SER 65 HG SER 65 1.401 12.195 9.775 443 H THR 66 H THR 66 -1.168 8.492 7.116 444 HA THR 66 HA THR 66 -3.534 10.140 6.921 445 HB THR 66 HB THR 66 -3.618 7.828 5.200 446 HG1 THR 66 HG1 THR 66 -1.631 8.569 4.028 447 1HG2 THR 66 1HG2 THR 66 -4.295 10.490 5.101 448 2HG2 THR 66 2HG2 THR 66 -4.321 9.376 3.734 449 3HG2 THR 66 3HG2 THR 66 -2.913 10.402 4.009 450 H VAL 67 H VAL 67 -2.767 6.771 7.690 451 HA VAL 67 HA VAL 67 -5.298 5.689 7.842 452 HB VAL 67 HB VAL 67 -2.975 5.112 9.686 453 1HG1 VAL 67 1HG1 VAL 67 -4.852 4.147 10.704 454 2HG1 VAL 67 2HG1 VAL 67 -5.553 3.665 9.158 455 3HG1 VAL 67 3HG1 VAL 67 -4.127 2.833 9.778 456 1HG2 VAL 67 1HG2 VAL 67 -3.367 4.632 6.893 457 2HG2 VAL 67 2HG2 VAL 67 -1.980 4.230 7.906 458 3HG2 VAL 67 3HG2 VAL 67 -3.319 3.093 7.753 459 H ARG 68 H ARG 68 -3.668 7.802 10.111 460 HA ARG 68 HA ARG 68 -5.190 7.470 12.388 461 1HB ARG 68 1HB ARG 68 -4.061 10.038 11.260 462 2HB ARG 68 2HB ARG 68 -4.640 9.833 12.908 463 1HG ARG 68 1HG ARG 68 -2.835 7.776 12.617 464 2HG ARG 68 2HG ARG 68 -2.094 9.105 11.722 465 1HD ARG 68 1HD ARG 68 -1.300 9.614 13.786 466 2HD ARG 68 2HD ARG 68 -2.850 10.449 13.894 467 HE ARG 68 HE ARG 68 -3.331 7.904 14.802 468 1HH1 ARG 68 1HH1 ARG 68 -1.200 10.515 15.676 469 2HH1 ARG 68 2HH1 ARG 68 -1.153 10.088 17.354 470 1HH2 ARG 68 1HH2 ARG 68 -3.277 7.332 17.010 471 2HH2 ARG 68 2HH2 ARG 68 -2.334 8.278 18.112 472 H ASP 69 H ASP 69 -5.970 9.201 9.438 473 HA ASP 69 HA ASP 69 -8.282 10.520 10.429 474 1HB ASP 69 1HB ASP 69 -6.831 10.806 8.190 475 2HB ASP 69 2HB ASP 69 -8.136 9.813 7.548 476 H ILE 70 H ILE 70 -7.725 7.416 8.860 477 HA ILE 70 HA ILE 70 -10.302 6.657 8.236 478 HB ILE 70 HB ILE 70 -8.166 4.854 9.380 479 1HG1 ILE 70 1HG1 ILE 70 -7.309 6.108 7.475 480 2HG1 ILE 70 2HG1 ILE 70 -7.576 4.430 7.013 481 1HG2 ILE 70 1HG2 ILE 70 -9.550 3.381 7.565 482 2HG2 ILE 70 2HG2 ILE 70 -9.848 3.371 9.302 483 3HG2 ILE 70 3HG2 ILE 70 -10.829 4.387 8.245 484 1HD1 ILE 70 1HD1 ILE 70 -8.376 5.667 5.215 485 2HD1 ILE 70 2HD1 ILE 70 -9.829 5.235 6.117 486 3HD1 ILE 70 3HD1 ILE 70 -9.152 6.858 6.258 487 H ASP 71 H ASP 71 -8.615 6.279 11.340 488 HA ASP 71 HA ASP 71 -10.883 6.702 12.914 489 1HB ASP 71 1HB ASP 71 -10.690 4.031 11.847 490 2HB ASP 71 2HB ASP 71 -10.545 3.993 13.602 491 HA PRO 72 HA PRO 72 -7.834 6.951 16.056 492 1HB PRO 72 1HB PRO 72 -9.233 6.271 18.281 493 2HB PRO 72 2HB PRO 72 -9.461 7.806 17.434 494 1HG PRO 72 1HG PRO 72 -11.090 5.298 17.283 495 2HG PRO 72 2HG PRO 72 -11.636 6.983 17.376 496 1HD PRO 72 1HD PRO 72 -11.569 5.600 15.049 497 2HD PRO 72 2HD PRO 72 -11.290 7.351 15.127 498 H GLN 73 H GLN 73 -9.839 4.027 16.465 499 HA GLN 73 HA GLN 73 -7.576 2.594 17.594 500 1HB GLN 73 1HB GLN 73 -10.433 1.741 17.096 501 2HB GLN 73 2HB GLN 73 -9.213 0.744 17.878 502 1HG GLN 73 1HG GLN 73 -9.132 2.116 19.765 503 2HG GLN 73 2HG GLN 73 -9.935 3.450 18.938 504 1HE2 GLN 73 1HE2 GLN 73 -12.191 3.168 18.384 505 2HE2 GLN 73 2HE2 GLN 73 -13.193 2.183 19.388 506 H ASN 74 H ASN 74 -6.140 1.724 16.260 507 HA ASN 74 HA ASN 74 -6.769 -0.232 14.366 508 1HB ASN 74 1HB ASN 74 -7.350 2.233 13.324 509 2HB ASN 74 2HB ASN 74 -5.695 1.994 12.771 510 1HD2 ASN 74 1HD2 ASN 74 -7.725 2.166 10.974 511 2HD2 ASN 74 2HD2 ASN 74 -7.996 0.627 10.237 512 H ASP 75 H ASP 75 -4.743 -0.381 12.709 513 HA ASP 75 HA ASP 75 -2.238 0.538 13.612 514 1HB ASP 75 1HB ASP 75 -3.228 -1.461 15.250 515 2HB ASP 75 2HB ASP 75 -2.173 -2.334 14.142 516 H LEU 76 H LEU 76 -0.645 0.092 12.147 517 HA LEU 76 HA LEU 76 -1.498 -1.194 9.693 518 1HB LEU 76 1HB LEU 76 0.224 0.914 10.350 519 2HB LEU 76 2HB LEU 76 1.257 -0.357 9.699 520 HG LEU 76 HG LEU 76 0.649 1.157 7.935 521 1HD1 LEU 76 1HD1 LEU 76 -0.325 -0.387 6.354 522 2HD1 LEU 76 2HD1 LEU 76 -0.943 -1.388 7.667 523 3HD1 LEU 76 3HD1 LEU 76 0.796 -1.246 7.411 524 1HD2 LEU 76 1HD2 LEU 76 -2.248 0.486 8.292 525 2HD2 LEU 76 2HD2 LEU 76 -1.513 1.818 7.399 526 3HD2 LEU 76 3HD2 LEU 76 -1.518 1.834 9.163 527 H THR 77 H THR 77 -0.659 -3.036 8.813 528 HA THR 77 HA THR 77 1.537 -4.403 10.157 529 HB THR 77 HB THR 77 -0.463 -5.229 11.323 530 HG1 THR 77 HG1 THR 77 0.879 -6.889 11.299 531 1HG2 THR 77 1HG2 THR 77 -2.190 -4.961 9.714 532 2HG2 THR 77 2HG2 THR 77 -2.036 -6.696 9.989 533 3HG2 THR 77 3HG2 THR 77 -1.346 -5.968 8.538 534 H PHE 78 H PHE 78 0.658 -3.193 7.455 535 HA PHE 78 HA PHE 78 2.198 -4.836 5.804 536 1HB PHE 78 1HB PHE 78 -0.358 -5.907 6.196 537 2HB PHE 78 2HB PHE 78 -0.422 -5.148 4.609 538 HD1 PHE 78 HD1 PHE 78 2.262 -5.572 3.575 539 HD2 PHE 78 HD2 PHE 78 -0.235 -8.181 5.827 540 HE1 PHE 78 HE1 PHE 78 3.415 -7.514 2.598 541 HE2 PHE 78 HE2 PHE 78 0.914 -10.127 4.855 542 HZ PHE 78 HZ PHE 78 2.743 -9.795 3.239 543 H LEU 79 H LEU 79 2.766 -3.737 4.006 544 HA LEU 79 HA LEU 79 1.038 -1.783 2.796 545 1HB LEU 79 1HB LEU 79 2.346 -0.797 4.887 546 2HB LEU 79 2HB LEU 79 3.630 -0.643 3.689 547 HG LEU 79 HG LEU 79 2.154 0.752 2.306 548 1HD1 LEU 79 1HD1 LEU 79 -0.003 -0.079 2.896 549 2HD1 LEU 79 2HD1 LEU 79 0.063 1.622 3.356 550 3HD1 LEU 79 3HD1 LEU 79 0.225 0.369 4.587 551 1HD2 LEU 79 1HD2 LEU 79 3.654 1.838 3.861 552 2HD2 LEU 79 2HD2 LEU 79 2.475 1.667 5.163 553 3HD2 LEU 79 3HD2 LEU 79 2.129 2.721 3.791 554 H ARG 80 H ARG 80 1.301 -2.664 0.814 555 HA ARG 80 HA ARG 80 4.036 -2.671 -0.280 556 1HB ARG 80 1HB ARG 80 1.892 -4.607 -1.141 557 2HB ARG 80 2HB ARG 80 3.613 -4.663 -1.498 558 1HG ARG 80 1HG ARG 80 4.076 -5.106 0.873 559 2HG ARG 80 2HG ARG 80 2.341 -5.099 1.195 560 1HD ARG 80 1HD ARG 80 3.229 -6.875 -0.980 561 2HD ARG 80 2HD ARG 80 3.772 -7.321 0.637 562 HE ARG 80 HE ARG 80 1.074 -6.801 0.857 563 1HH1 ARG 80 1HH1 ARG 80 3.100 -9.003 -0.921 564 2HH1 ARG 80 2HH1 ARG 80 1.906 -10.257 -0.984 565 1HH2 ARG 80 1HH2 ARG 80 -0.507 -8.444 0.782 566 2HH2 ARG 80 2HH2 ARG 80 -0.146 -9.938 -0.016 567 H ILE 81 H ILE 81 4.097 -2.481 -2.668 568 HA ILE 81 HA ILE 81 1.754 -1.283 -3.908 569 HB ILE 81 HB ILE 81 3.264 0.629 -4.751 570 1HG1 ILE 81 1HG1 ILE 81 4.736 -0.140 -2.221 571 2HG1 ILE 81 2HG1 ILE 81 5.372 -0.269 -3.857 572 1HG2 ILE 81 1HG2 ILE 81 2.231 2.004 -3.276 573 2HG2 ILE 81 2HG2 ILE 81 1.361 0.522 -2.880 574 3HG2 ILE 81 3HG2 ILE 81 2.713 1.046 -1.876 575 1HD1 ILE 81 1HD1 ILE 81 5.536 1.910 -2.096 576 2HD1 ILE 81 2HD1 ILE 81 6.092 1.816 -3.768 577 3HD1 ILE 81 3HD1 ILE 81 4.466 2.398 -3.410 578 H ARG 82 H ARG 82 1.776 -3.018 -5.338 579 HA ARG 82 HA ARG 82 4.053 -3.889 -6.762 580 1HB ARG 82 1HB ARG 82 1.988 -5.232 -6.470 581 2HB ARG 82 2HB ARG 82 1.146 -4.132 -7.554 582 1HG ARG 82 1HG ARG 82 3.627 -5.354 -8.586 583 2HG ARG 82 2HG ARG 82 2.246 -6.428 -8.356 584 1HD ARG 82 1HD ARG 82 0.869 -5.011 -9.753 585 2HD ARG 82 2HD ARG 82 2.184 -3.847 -9.914 586 HE ARG 82 HE ARG 82 3.149 -5.199 -11.498 587 1HH1 ARG 82 1HH1 ARG 82 0.648 -6.961 -9.836 588 2HH1 ARG 82 2HH1 ARG 82 0.692 -8.307 -10.926 589 1HH2 ARG 82 1HH2 ARG 82 3.217 -6.966 -12.939 590 2HH2 ARG 82 2HH2 ARG 82 2.154 -8.309 -12.689 591 H SER 83 H SER 83 5.147 -2.854 -8.283 592 HA SER 83 HA SER 83 3.791 -0.746 -9.819 593 1HB SER 83 1HB SER 83 6.718 -0.944 -10.049 594 2HB SER 83 2HB SER 83 5.702 0.464 -9.739 595 HG SER 83 HG SER 83 7.083 -1.074 -7.993 596 H LYS 84 H LYS 84 5.422 -0.491 -11.970 597 HA LYS 84 HA LYS 84 4.630 -2.750 -13.573 598 1HB LYS 84 1HB LYS 84 5.834 -0.068 -14.105 599 2HB LYS 84 2HB LYS 84 5.969 -1.312 -15.340 600 1HG LYS 84 1HG LYS 84 3.336 -1.478 -14.740 601 2HG LYS 84 2HG LYS 84 3.638 0.239 -14.466 602 1HD LYS 84 1HD LYS 84 3.336 0.456 -16.676 603 2HD LYS 84 2HD LYS 84 4.959 -0.221 -16.822 604 1HE LYS 84 1HE LYS 84 3.658 -2.504 -16.691 605 2HE LYS 84 2HE LYS 84 2.308 -1.516 -17.246 606 1HZ LYS 84 1HZ LYS 84 4.905 -1.425 -18.639 607 2HZ LYS 84 2HZ LYS 84 3.370 -1.031 -19.228 608 3HZ LYS 84 3HZ LYS 84 3.790 -2.651 -18.980 609 H LYS 85 H LYS 85 7.523 -1.620 -12.039 610 HA LYS 85 HA LYS 85 9.243 -3.385 -13.581 611 1HB LYS 85 1HB LYS 85 9.638 -1.221 -11.588 612 2HB LYS 85 2HB LYS 85 10.865 -2.480 -11.639 613 1HG LYS 85 1HG LYS 85 10.099 -1.407 -14.259 614 2HG LYS 85 2HG LYS 85 10.875 -0.250 -13.175 615 1HD LYS 85 1HD LYS 85 12.615 -1.269 -14.418 616 2HD LYS 85 2HD LYS 85 12.671 -1.990 -12.808 617 1HE LYS 85 1HE LYS 85 11.341 -3.900 -13.688 618 2HE LYS 85 2HE LYS 85 11.471 -3.195 -15.298 619 1HZ LYS 85 1HZ LYS 85 13.548 -3.932 -15.525 620 2HZ LYS 85 2HZ LYS 85 13.219 -4.949 -14.214 621 3HZ LYS 85 3HZ LYS 85 14.000 -3.470 -13.961 622 H ASN 86 H ASN 86 8.447 -2.958 -10.127 623 HA ASN 86 HA ASN 86 8.146 -5.763 -9.712 624 1HB ASN 86 1HB ASN 86 10.080 -5.708 -7.928 625 2HB ASN 86 2HB ASN 86 10.436 -6.063 -9.615 626 1HD2 ASN 86 1HD2 ASN 86 10.472 -3.565 -7.156 627 2HD2 ASN 86 2HD2 ASN 86 11.685 -2.586 -7.901 628 H GLU 87 H GLU 87 7.770 -6.268 -7.378 629 HA GLU 87 HA GLU 87 6.280 -4.071 -6.171 630 1HB GLU 87 1HB GLU 87 5.201 -5.742 -4.819 631 2HB GLU 87 2HB GLU 87 5.217 -6.301 -6.485 632 1HG GLU 87 1HG GLU 87 7.003 -7.820 -6.033 633 2HG GLU 87 2HG GLU 87 7.217 -7.161 -4.412 634 H ILE 88 H ILE 88 6.516 -3.467 -3.982 635 HA ILE 88 HA ILE 88 9.066 -4.263 -2.742 636 HB ILE 88 HB ILE 88 7.908 -1.476 -2.671 637 1HG1 ILE 88 1HG1 ILE 88 10.265 -1.219 -3.978 638 2HG1 ILE 88 2HG1 ILE 88 9.771 -2.811 -4.545 639 1HG2 ILE 88 1HG2 ILE 88 10.118 -2.834 -1.294 640 2HG2 ILE 88 2HG2 ILE 88 10.520 -1.261 -1.982 641 3HG2 ILE 88 3HG2 ILE 88 9.194 -1.406 -0.829 642 1HD1 ILE 88 1HD1 ILE 88 8.819 -1.511 -6.142 643 2HD1 ILE 88 2HD1 ILE 88 7.494 -1.554 -4.979 644 3HD1 ILE 88 3HD1 ILE 88 8.563 -0.153 -5.046 645 H MET 89 H MET 89 8.418 -5.504 -1.083 646 HA MET 89 HA MET 89 6.012 -5.038 0.381 647 1HB MET 89 1HB MET 89 8.359 -6.881 0.778 648 2HB MET 89 2HB MET 89 7.048 -6.787 1.946 649 1HG MET 89 1HG MET 89 5.580 -7.172 -0.217 650 2HG MET 89 2HG MET 89 7.074 -7.903 -0.799 651 1HE MET 89 1HE MET 89 8.477 -9.467 1.007 652 2HE MET 89 2HE MET 89 7.898 -8.765 2.518 653 3HE MET 89 3HE MET 89 7.672 -10.485 2.201 654 H VAL 90 H VAL 90 5.680 -3.845 2.153 655 HA VAL 90 HA VAL 90 7.938 -3.043 3.820 656 HB VAL 90 HB VAL 90 6.009 -0.989 2.739 657 1HG1 VAL 90 1HG1 VAL 90 7.098 -0.675 5.015 658 2HG1 VAL 90 2HG1 VAL 90 8.625 -0.525 4.144 659 3HG1 VAL 90 3HG1 VAL 90 7.320 0.623 3.843 660 1HG2 VAL 90 1HG2 VAL 90 7.469 -1.853 0.956 661 2HG2 VAL 90 2HG2 VAL 90 7.826 -0.172 1.352 662 3HG2 VAL 90 3HG2 VAL 90 8.880 -1.459 1.938 663 H ALA 91 H ALA 91 7.310 -3.799 5.738 664 HA ALA 91 HA ALA 91 4.654 -3.017 6.726 665 1HB ALA 91 1HB ALA 91 4.493 -5.217 7.879 666 2HB ALA 91 2HB ALA 91 4.429 -5.323 6.119 667 3HB ALA 91 3HB ALA 91 5.913 -5.743 6.974 668 HA PRO 92 HA PRO 92 6.774 -1.578 10.295 669 1HB PRO 92 1HB PRO 92 4.836 -1.868 12.173 670 2HB PRO 92 2HB PRO 92 4.786 -0.616 10.927 671 1HG PRO 92 1HG PRO 92 3.383 -3.259 11.013 672 2HG PRO 92 2HG PRO 92 2.757 -1.676 10.518 673 1HD PRO 92 1HD PRO 92 3.542 -3.555 8.733 674 2HD PRO 92 2HD PRO 92 3.707 -1.815 8.422 675 H ASP 93 H ASP 93 8.205 -2.457 11.655 676 HA ASP 93 HA ASP 93 7.724 -5.210 12.591 677 1HB ASP 93 1HB ASP 93 9.891 -4.159 11.143 678 2HB ASP 93 2HB ASP 93 10.489 -4.395 12.783 679 H LYS 94 H LYS 94 9.646 -5.440 14.500 680 HA LYS 94 HA LYS 94 8.473 -4.426 16.781 681 1HB LYS 94 1HB LYS 94 10.829 -5.911 16.133 682 2HB LYS 94 2HB LYS 94 11.254 -4.678 17.313 683 1HG LYS 94 1HG LYS 94 9.801 -5.538 18.916 684 2HG LYS 94 2HG LYS 94 8.879 -6.455 17.723 685 1HD LYS 94 1HD LYS 94 10.229 -7.990 18.978 686 2HD LYS 94 2HD LYS 94 10.897 -7.869 17.348 687 1HE LYS 94 1HE LYS 94 12.856 -7.522 18.373 688 2HE LYS 94 2HE LYS 94 12.247 -5.896 18.677 689 1HZ LYS 94 1HZ LYS 94 12.600 -6.394 20.809 690 2HZ LYS 94 2HZ LYS 94 12.701 -8.057 20.520 691 3HZ LYS 94 3HZ LYS 94 11.189 -7.323 20.712 692 H ASP 95 H ASP 95 11.375 -3.171 15.137 693 HA ASP 95 HA ASP 95 10.673 -0.477 15.950 694 1HB ASP 95 1HB ASP 95 12.438 -1.937 17.542 695 2HB ASP 95 2HB ASP 95 13.481 -0.923 16.548 696 H TYR 96 H TYR 96 11.227 -2.265 13.521 697 HA TYR 96 HA TYR 96 12.774 -0.252 12.075 698 1HB TYR 96 1HB TYR 96 14.030 -2.069 10.883 699 2HB TYR 96 2HB TYR 96 14.460 -1.883 12.580 700 HD1 TYR 96 HD1 TYR 96 13.529 -3.521 14.254 701 HD2 TYR 96 HD2 TYR 96 13.202 -4.118 10.054 702 HE1 TYR 96 HE1 TYR 96 13.072 -5.907 14.635 703 HE2 TYR 96 HE2 TYR 96 12.742 -6.506 10.423 704 HH TYR 96 HH TYR 96 13.262 -8.040 13.385 705 H PHE 97 H PHE 97 12.782 -0.991 9.614 706 HA PHE 97 HA PHE 97 10.038 -1.851 8.967 707 1HB PHE 97 1HB PHE 97 11.708 0.358 7.784 708 2HB PHE 97 2HB PHE 97 10.355 -0.347 6.904 709 HD1 PHE 97 HD1 PHE 97 8.223 -0.651 8.670 710 HD2 PHE 97 HD2 PHE 97 11.202 2.389 8.697 711 HE1 PHE 97 HE1 PHE 97 6.673 0.853 9.848 712 HE2 PHE 97 HE2 PHE 97 9.657 3.897 9.876 713 HZ PHE 97 HZ PHE 97 7.389 3.130 10.453 714 H LEU 98 H LEU 98 9.929 -3.632 7.782 715 HA LEU 98 HA LEU 98 12.323 -4.725 6.579 716 1HB LEU 98 1HB LEU 98 10.221 -5.870 7.817 717 2HB LEU 98 2HB LEU 98 9.719 -6.042 6.136 718 HG LEU 98 HG LEU 98 10.792 -8.061 6.730 719 1HD1 LEU 98 1HD1 LEU 98 12.425 -8.231 5.091 720 2HD1 LEU 98 2HD1 LEU 98 13.019 -6.595 5.369 721 3HD1 LEU 98 3HD1 LEU 98 11.472 -6.845 4.560 722 1HD2 LEU 98 1HD2 LEU 98 11.917 -7.200 8.753 723 2HD2 LEU 98 2HD2 LEU 98 13.132 -6.439 7.725 724 3HD2 LEU 98 3HD2 LEU 98 12.975 -8.196 7.752 725 H ILE 99 H ILE 99 12.924 -4.197 4.594 726 HA ILE 99 HA ILE 99 10.841 -3.526 2.620 727 HB ILE 99 HB ILE 99 13.722 -2.621 2.691 728 1HG1 ILE 99 1HG1 ILE 99 11.486 -0.683 2.753 729 2HG1 ILE 99 2HG1 ILE 99 11.699 -1.652 4.207 730 1HG2 ILE 99 1HG2 ILE 99 13.009 -1.155 0.795 731 2HG2 ILE 99 2HG2 ILE 99 13.057 -2.876 0.414 732 3HG2 ILE 99 3HG2 ILE 99 11.512 -2.083 0.718 733 1HD1 ILE 99 1HD1 ILE 99 13.861 -0.007 2.918 734 2HD1 ILE 99 2HD1 ILE 99 12.874 0.510 4.285 735 3HD1 ILE 99 3HD1 ILE 99 13.957 -0.872 4.451 736 H VAL 100 H VAL 100 10.467 -5.368 1.523 737 HA VAL 100 HA VAL 100 12.798 -6.794 0.415 738 HB VAL 100 HB VAL 100 10.057 -7.905 1.034 739 1HG1 VAL 100 1HG1 VAL 100 10.852 -9.032 -0.888 740 2HG1 VAL 100 2HG1 VAL 100 12.489 -9.142 -0.236 741 3HG1 VAL 100 3HG1 VAL 100 11.187 -10.095 0.479 742 1HG2 VAL 100 1HG2 VAL 100 10.844 -8.295 3.073 743 2HG2 VAL 100 2HG2 VAL 100 12.107 -9.307 2.371 744 3HG2 VAL 100 3HG2 VAL 100 12.401 -7.589 2.640 745 H ILE 101 H ILE 101 13.071 -6.311 -1.657 746 HA ILE 101 HA ILE 101 10.720 -5.712 -3.310 747 HB ILE 101 HB ILE 101 13.631 -5.206 -3.931 748 1HG1 ILE 101 1HG1 ILE 101 12.029 -2.838 -3.602 749 2HG1 ILE 101 2HG1 ILE 101 11.910 -3.838 -2.160 750 1HG2 ILE 101 1HG2 ILE 101 11.099 -4.807 -5.417 751 2HG2 ILE 101 2HG2 ILE 101 12.324 -3.546 -5.547 752 3HG2 ILE 101 3HG2 ILE 101 12.712 -5.203 -6.010 753 1HD1 ILE 101 1HD1 ILE 101 13.699 -2.278 -1.886 754 2HD1 ILE 101 2HD1 ILE 101 14.384 -3.894 -2.063 755 3HD1 ILE 101 3HD1 ILE 101 14.421 -2.767 -3.419 756 H GLN 102 H GLN 102 10.222 -6.875 -5.109 757 HA GLN 102 HA GLN 102 11.993 -8.709 -6.358 758 1HB GLN 102 1HB GLN 102 10.952 -10.798 -5.741 759 2HB GLN 102 2HB GLN 102 11.487 -9.973 -4.284 760 1HG GLN 102 1HG GLN 102 9.191 -9.190 -3.904 761 2HG GLN 102 2HG GLN 102 8.670 -10.077 -5.336 762 1HE2 GLN 102 1HE2 GLN 102 8.488 -10.209 -2.176 763 2HE2 GLN 102 2HE2 GLN 102 8.567 -11.912 -1.895 764 H ASN 103 H ASN 103 10.647 -10.235 -7.865 765 HA ASN 103 HA ASN 103 9.227 -8.647 -9.647 766 1HB ASN 103 1HB ASN 103 9.785 -11.513 -9.336 767 2HB ASN 103 2HB ASN 103 8.285 -11.169 -10.193 768 1HD2 ASN 103 1HD2 ASN 103 11.171 -12.082 -10.864 769 2HD2 ASN 103 2HD2 ASN 103 11.541 -11.158 -12.276 770 HA PRO 104 HA PRO 104 5.091 -8.375 -8.210 771 1HB PRO 104 1HB PRO 104 3.654 -8.676 -10.493 772 2HB PRO 104 2HB PRO 104 4.596 -7.224 -10.135 773 1HG PRO 104 1HG PRO 104 5.301 -9.560 -11.869 774 2HG PRO 104 2HG PRO 104 5.542 -7.829 -12.172 775 1HD PRO 104 1HD PRO 104 7.536 -9.450 -11.319 776 2HD PRO 104 2HD PRO 104 7.439 -7.736 -10.866 777 H THR 105 H THR 105 3.300 -9.574 -7.587 778 HA THR 105 HA THR 105 3.451 -12.452 -8.194 779 HB THR 105 HB THR 105 2.138 -12.741 -6.062 780 HG1 THR 105 HG1 THR 105 2.939 -10.067 -5.522 781 1HG2 THR 105 1HG2 THR 105 4.231 -11.866 -4.642 782 2HG2 THR 105 2HG2 THR 105 4.933 -11.775 -6.258 783 3HG2 THR 105 3HG2 THR 105 4.303 -13.308 -5.654 784 H GLU 106 H GLU 106 1.313 -9.675 -7.971 785 HA GLU 106 HA GLU 106 -1.149 -10.943 -8.286 786 1HB GLU 106 1HB GLU 106 -0.125 -8.257 -8.435 787 2HB GLU 106 2HB GLU 106 -1.280 -8.527 -9.733 788 1HG GLU 106 1HG GLU 106 -2.399 -9.630 -7.393 789 2HG GLU 106 2HG GLU 106 -1.763 -8.041 -6.969 790 H MET 11 H MET 11 -19.487 4.922 -15.418 791 HA MET 11 HA MET 11 -19.547 4.229 -12.830 792 1HB MET 11 1HB MET 11 -21.434 5.496 -14.638 793 2HB MET 11 2HB MET 11 -22.256 4.644 -13.339 794 1HG MET 11 1HG MET 11 -20.027 6.176 -12.338 795 2HG MET 11 2HG MET 11 -21.149 7.186 -13.246 796 1HE MET 11 1HE MET 11 -20.844 4.336 -10.954 797 2HE MET 11 2HE MET 11 -21.404 5.010 -9.424 798 3HE MET 11 3HE MET 11 -22.516 4.097 -10.445 799 H ALA 12 H ALA 12 -21.572 2.685 -15.315 800 HA ALA 12 HA ALA 12 -22.965 0.902 -13.738 801 1HB ALA 12 1HB ALA 12 -23.671 0.948 -15.931 802 2HB ALA 12 2HB ALA 12 -22.034 0.814 -16.574 803 3HB ALA 12 3HB ALA 12 -22.820 -0.596 -15.865 804 H GLU 13 H GLU 13 -19.700 0.593 -15.060 805 HA GLU 13 HA GLU 13 -19.172 -2.054 -14.464 806 1HB GLU 13 1HB GLU 13 -17.703 0.119 -15.366 807 2HB GLU 13 2HB GLU 13 -16.907 -0.322 -13.862 808 1HG GLU 13 1HG GLU 13 -15.762 -1.723 -15.182 809 2HG GLU 13 2HG GLU 13 -17.178 -2.753 -14.978 810 H VAL 14 H VAL 14 -18.608 0.784 -12.385 811 HA VAL 14 HA VAL 14 -17.691 -0.664 -10.149 812 HB VAL 14 HB VAL 14 -19.110 1.997 -10.059 813 1HG1 VAL 14 1HG1 VAL 14 -17.627 0.371 -8.145 814 2HG1 VAL 14 2HG1 VAL 14 -17.044 2.033 -8.255 815 3HG1 VAL 14 3HG1 VAL 14 -18.737 1.713 -7.872 816 1HG2 VAL 14 1HG2 VAL 14 -16.572 2.745 -10.114 817 2HG2 VAL 14 2HG2 VAL 14 -16.407 1.259 -11.049 818 3HG2 VAL 14 3HG2 VAL 14 -17.505 2.526 -11.595 819 H GLU 15 H GLU 15 -20.911 0.317 -11.181 820 HA GLU 15 HA GLU 15 -22.272 -0.325 -8.795 821 1HB GLU 15 1HB GLU 15 -23.165 -0.108 -11.664 822 2HB GLU 15 2HB GLU 15 -24.281 -0.521 -10.371 823 1HG GLU 15 1HG GLU 15 -23.856 1.576 -9.269 824 2HG GLU 15 2HG GLU 15 -22.618 1.985 -10.455 825 H GLU 16 H GLU 16 -21.385 -2.226 -11.622 826 HA GLU 16 HA GLU 16 -22.908 -4.523 -10.977 827 1HB GLU 16 1HB GLU 16 -21.405 -3.734 -13.126 828 2HB GLU 16 2HB GLU 16 -20.396 -4.993 -12.426 829 1HG GLU 16 1HG GLU 16 -22.023 -6.635 -12.732 830 2HG GLU 16 2HG GLU 16 -23.307 -5.449 -12.957 831 H THR 17 H THR 17 -19.686 -3.441 -10.101 832 HA THR 17 HA THR 17 -18.975 -5.933 -8.837 833 HB THR 17 HB THR 17 -17.620 -3.231 -8.745 834 HG1 THR 17 HG1 THR 17 -17.664 -4.334 -10.810 835 1HG2 THR 17 1HG2 THR 17 -17.038 -5.817 -7.426 836 2HG2 THR 17 2HG2 THR 17 -16.643 -4.174 -6.923 837 3HG2 THR 17 3HG2 THR 17 -15.670 -4.977 -8.155 838 H LEU 18 H LEU 18 -20.343 -2.867 -7.878 839 HA LEU 18 HA LEU 18 -19.926 -3.167 -5.080 840 1HB LEU 18 1HB LEU 18 -21.194 -1.284 -6.864 841 2HB LEU 18 2HB LEU 18 -22.184 -1.569 -5.434 842 HG LEU 18 HG LEU 18 -19.878 -1.125 -4.203 843 1HD1 LEU 18 1HD1 LEU 18 -19.587 0.175 -6.891 844 2HD1 LEU 18 2HD1 LEU 18 -18.427 -0.819 -6.010 845 3HD1 LEU 18 3HD1 LEU 18 -18.788 0.815 -5.455 846 1HD2 LEU 18 1HD2 LEU 18 -21.506 1.146 -5.327 847 2HD2 LEU 18 2HD2 LEU 18 -20.603 1.112 -3.812 848 3HD2 LEU 18 3HD2 LEU 18 -22.045 0.113 -4.003 849 H LYS 19 H LYS 19 -22.593 -3.943 -7.264 850 HA LYS 19 HA LYS 19 -24.504 -4.667 -5.361 851 1HB LYS 19 1HB LYS 19 -24.232 -4.787 -8.180 852 2HB LYS 19 2HB LYS 19 -24.703 -6.393 -7.639 853 1HG LYS 19 1HG LYS 19 -26.774 -5.544 -7.833 854 2HG LYS 19 2HG LYS 19 -26.434 -4.911 -6.220 855 1HD LYS 19 1HD LYS 19 -26.788 -2.864 -7.016 856 2HD LYS 19 2HD LYS 19 -25.348 -3.054 -8.019 857 1HE LYS 19 1HE LYS 19 -26.671 -3.949 -9.825 858 2HE LYS 19 2HE LYS 19 -28.118 -3.940 -8.817 859 1HZ LYS 19 1HZ LYS 19 -28.495 -1.833 -9.336 860 2HZ LYS 19 2HZ LYS 19 -27.243 -1.922 -10.470 861 3HZ LYS 19 3HZ LYS 19 -26.927 -1.365 -8.904 862 H ARG 20 H ARG 20 -22.144 -6.717 -7.068 863 HA ARG 20 HA ARG 20 -22.832 -9.100 -5.714 864 1HB ARG 20 1HB ARG 20 -21.515 -8.830 -7.896 865 2HB ARG 20 2HB ARG 20 -20.117 -8.512 -6.877 866 1HG ARG 20 1HG ARG 20 -19.799 -10.721 -7.025 867 2HG ARG 20 2HG ARG 20 -21.042 -10.806 -5.775 868 1HD ARG 20 1HD ARG 20 -21.753 -10.801 -8.689 869 2HD ARG 20 2HD ARG 20 -21.300 -12.289 -7.860 870 HE ARG 20 HE ARG 20 -23.235 -11.227 -6.276 871 1HH1 ARG 20 1HH1 ARG 20 -23.032 -12.026 -9.659 872 2HH1 ARG 20 2HH1 ARG 20 -24.721 -12.380 -9.810 873 1HH2 ARG 20 1HH2 ARG 20 -25.460 -11.691 -6.463 874 2HH2 ARG 20 2HH2 ARG 20 -26.102 -12.188 -7.992 875 H LEU 21 H LEU 21 -20.586 -6.505 -5.007 876 HA LEU 21 HA LEU 21 -19.148 -7.825 -2.955 877 1HB LEU 21 1HB LEU 21 -19.361 -5.125 -4.041 878 2HB LEU 21 2HB LEU 21 -19.046 -5.156 -2.307 879 HG LEU 21 HG LEU 21 -17.011 -6.396 -2.646 880 1HD1 LEU 21 1HD1 LEU 21 -16.612 -6.370 -5.414 881 2HD1 LEU 21 2HD1 LEU 21 -18.226 -7.034 -5.168 882 3HD1 LEU 21 3HD1 LEU 21 -16.838 -7.775 -4.373 883 1HD2 LEU 21 1HD2 LEU 21 -15.734 -4.764 -3.986 884 2HD2 LEU 21 2HD2 LEU 21 -16.827 -3.995 -2.835 885 3HD2 LEU 21 3HD2 LEU 21 -17.254 -4.066 -4.545 886 H GLN 22 H GLN 22 -21.802 -5.449 -2.813 887 HA GLN 22 HA GLN 22 -22.108 -5.567 -0.009 888 1HB GLN 22 1HB GLN 22 -23.212 -4.089 -2.112 889 2HB GLN 22 2HB GLN 22 -24.575 -4.926 -1.382 890 1HG GLN 22 1HG GLN 22 -24.532 -3.650 0.445 891 2HG GLN 22 2HG GLN 22 -22.774 -3.716 0.565 892 1HE2 GLN 22 1HE2 GLN 22 -21.732 -2.489 -1.408 893 2HE2 GLN 22 2HE2 GLN 22 -22.334 -0.886 -1.634 894 H SER 23 H SER 23 -23.130 -7.647 -2.545 895 HA SER 23 HA SER 23 -25.293 -8.864 -1.085 896 1HB SER 23 1HB SER 23 -25.209 -8.756 -3.588 897 2HB SER 23 2HB SER 23 -23.871 -9.905 -3.546 898 HG SER 23 HG SER 23 -25.209 -11.473 -2.921 899 H GLN 24 H GLN 24 -21.880 -9.314 -1.378 900 HA GLN 24 HA GLN 24 -22.010 -11.956 -0.126 901 1HB GLN 24 1HB GLN 24 -19.646 -12.137 -0.627 902 2HB GLN 24 2HB GLN 24 -20.517 -11.642 -2.072 903 1HG GLN 24 1HG GLN 24 -19.719 -9.438 -1.927 904 2HG GLN 24 2HG GLN 24 -19.159 -9.666 -0.271 905 1HE2 GLN 24 1HE2 GLN 24 -17.408 -8.607 -1.942 906 2HE2 GLN 24 2HE2 GLN 24 -16.193 -9.746 -2.401 907 H LYS 25 H LYS 25 -20.884 -12.430 1.805 908 HA LYS 25 HA LYS 25 -20.972 -10.304 3.734 909 1HB LYS 25 1HB LYS 25 -21.498 -12.873 3.997 910 2HB LYS 25 2HB LYS 25 -19.775 -12.978 4.337 911 1HG LYS 25 1HG LYS 25 -20.378 -10.985 5.987 912 2HG LYS 25 2HG LYS 25 -21.959 -11.768 5.928 913 1HD LYS 25 1HD LYS 25 -20.919 -12.831 7.713 914 2HD LYS 25 2HD LYS 25 -20.633 -13.945 6.374 915 1HE LYS 25 1HE LYS 25 -18.395 -13.156 6.105 916 2HE LYS 25 2HE LYS 25 -18.668 -11.829 7.234 917 1HZ LYS 25 1HZ LYS 25 -18.453 -13.179 9.018 918 2HZ LYS 25 2HZ LYS 25 -17.501 -14.078 7.947 919 3HZ LYS 25 3HZ LYS 25 -19.104 -14.532 8.238 920 H GLY 26 H GLY 26 -19.292 -9.315 4.789 921 1HA GLY 26 1HA GLY 26 -16.902 -9.405 5.419 922 2HA GLY 26 2HA GLY 26 -16.585 -9.933 3.773 923 H VAL 27 H VAL 27 -18.305 -8.121 2.438 924 HA VAL 27 HA VAL 27 -16.597 -5.894 2.188 925 HB VAL 27 HB VAL 27 -19.449 -6.210 1.240 926 1HG1 VAL 27 1HG1 VAL 27 -19.235 -3.995 0.880 927 2HG1 VAL 27 2HG1 VAL 27 -17.473 -4.042 0.969 928 3HG1 VAL 27 3HG1 VAL 27 -18.295 -4.518 -0.518 929 1HG2 VAL 27 1HG2 VAL 27 -18.395 -6.767 -0.925 930 2HG2 VAL 27 2HG2 VAL 27 -16.817 -6.737 -0.138 931 3HG2 VAL 27 3HG2 VAL 27 -18.017 -7.938 0.339 932 H GLN 28 H GLN 28 -16.383 -4.241 3.532 933 HA GLN 28 HA GLN 28 -18.432 -3.641 5.484 934 1HB GLN 28 1HB GLN 28 -15.590 -3.105 5.157 935 2HB GLN 28 2HB GLN 28 -16.474 -1.684 5.696 936 1HG GLN 28 1HG GLN 28 -16.464 -2.470 7.757 937 2HG GLN 28 2HG GLN 28 -17.398 -3.867 7.224 938 1HE2 GLN 28 1HE2 GLN 28 -15.725 -5.304 5.753 939 2HE2 GLN 28 2HE2 GLN 28 -14.344 -5.801 6.664 940 H GLY 29 H GLY 29 -17.197 -2.305 2.505 941 1HA GLY 29 1HA GLY 29 -19.410 -0.843 1.824 942 2HA GLY 29 2HA GLY 29 -18.452 0.257 2.804 943 H ILE 30 H ILE 30 -19.111 0.636 0.064 944 HA ILE 30 HA ILE 30 -16.401 0.626 -1.080 945 HB ILE 30 HB ILE 30 -18.889 0.216 -2.733 946 1HG1 ILE 30 1HG1 ILE 30 -17.660 -2.151 -2.936 947 2HG1 ILE 30 2HG1 ILE 30 -17.148 -1.731 -1.305 948 1HG2 ILE 30 1HG2 ILE 30 -17.155 -0.581 -4.393 949 2HG2 ILE 30 2HG2 ILE 30 -17.157 1.146 -4.041 950 3HG2 ILE 30 3HG2 ILE 30 -15.941 0.098 -3.311 951 1HD1 ILE 30 1HD1 ILE 30 -19.992 -1.314 -1.758 952 2HD1 ILE 30 2HD1 ILE 30 -19.478 -2.987 -1.978 953 3HD1 ILE 30 3HD1 ILE 30 -19.158 -2.159 -0.455 954 H ILE 31 H ILE 31 -15.778 2.466 -2.118 955 HA ILE 31 HA ILE 31 -17.775 4.605 -2.416 956 HB ILE 31 HB ILE 31 -14.996 4.948 -1.283 957 1HG1 ILE 31 1HG1 ILE 31 -17.386 5.814 0.226 958 2HG1 ILE 31 2HG1 ILE 31 -17.189 4.073 0.056 959 1HG2 ILE 31 1HG2 ILE 31 -17.118 6.920 -2.072 960 2HG2 ILE 31 2HG2 ILE 31 -15.860 7.316 -0.902 961 3HG2 ILE 31 3HG2 ILE 31 -15.421 6.874 -2.552 962 1HD1 ILE 31 1HD1 ILE 31 -15.184 4.067 1.230 963 2HD1 ILE 31 2HD1 ILE 31 -14.942 5.801 1.012 964 3HD1 ILE 31 3HD1 ILE 31 -16.191 5.216 2.111 965 H VAL 32 H VAL 32 -17.488 5.991 -4.142 966 HA VAL 32 HA VAL 32 -15.226 5.425 -5.938 967 HB VAL 32 HB VAL 32 -17.897 6.078 -7.104 968 1HG1 VAL 32 1HG1 VAL 32 -15.769 6.030 -8.431 969 2HG1 VAL 32 2HG1 VAL 32 -15.689 4.296 -8.114 970 3HG1 VAL 32 3HG1 VAL 32 -17.041 4.965 -9.027 971 1HG2 VAL 32 1HG2 VAL 32 -18.429 4.244 -5.637 972 2HG2 VAL 32 2HG2 VAL 32 -18.377 3.651 -7.297 973 3HG2 VAL 32 3HG2 VAL 32 -17.030 3.333 -6.204 974 H VAL 33 H VAL 33 -14.094 7.208 -6.288 975 HA VAL 33 HA VAL 33 -15.493 9.803 -6.231 976 HB VAL 33 HB VAL 33 -12.566 9.395 -5.637 977 1HG1 VAL 33 1HG1 VAL 33 -12.661 11.618 -5.990 978 2HG1 VAL 33 2HG1 VAL 33 -14.407 11.688 -5.748 979 3HG1 VAL 33 3HG1 VAL 33 -13.324 11.650 -4.356 980 1HG2 VAL 33 1HG2 VAL 33 -14.936 9.066 -3.902 981 2HG2 VAL 33 2HG2 VAL 33 -13.338 8.328 -3.793 982 3HG2 VAL 33 3HG2 VAL 33 -13.586 9.980 -3.230 983 H ASN 34 H ASN 34 -15.123 11.256 -7.855 984 HA ASN 34 HA ASN 34 -13.939 10.190 -10.276 985 1HB ASN 34 1HB ASN 34 -14.822 12.274 -11.317 986 2HB ASN 34 2HB ASN 34 -16.060 11.337 -10.486 987 1HD2 ASN 34 1HD2 ASN 34 -17.303 13.273 -10.430 988 2HD2 ASN 34 2HD2 ASN 34 -16.992 14.476 -9.230 989 H THR 35 H THR 35 -12.903 12.254 -11.603 990 HA THR 35 HA THR 35 -10.334 12.563 -10.447 991 HB THR 35 HB THR 35 -10.640 14.510 -12.478 992 HG1 THR 35 HG1 THR 35 -11.536 13.140 -14.138 993 1HG2 THR 35 1HG2 THR 35 -9.396 12.613 -13.788 994 2HG2 THR 35 2HG2 THR 35 -9.361 11.822 -12.211 995 3HG2 THR 35 3HG2 THR 35 -8.613 13.405 -12.421 996 H GLU 36 H GLU 36 -13.191 14.578 -10.548 997 HA GLU 36 HA GLU 36 -11.955 17.004 -9.763 998 1HB GLU 36 1HB GLU 36 -14.741 15.972 -9.903 999 2HB GLU 36 2HB GLU 36 -14.451 17.374 -8.884 1000 1HG GLU 36 1HG GLU 36 -13.151 18.125 -11.122 1001 2HG GLU 36 2HG GLU 36 -14.427 17.122 -11.810 1002 H GLY 37 H GLY 37 -12.898 14.164 -8.044 1003 1HA GLY 37 1HA GLY 37 -11.924 13.763 -5.871 1004 2HA GLY 37 2HA GLY 37 -12.096 15.478 -5.530 1005 H ILE 38 H ILE 38 -14.862 14.765 -7.044 1006 HA ILE 38 HA ILE 38 -16.318 14.562 -4.542 1007 HB ILE 38 HB ILE 38 -17.396 14.808 -7.352 1008 1HG1 ILE 38 1HG1 ILE 38 -17.025 16.968 -5.268 1009 2HG1 ILE 38 2HG1 ILE 38 -15.939 16.711 -6.629 1010 1HG2 ILE 38 1HG2 ILE 38 -18.980 13.884 -5.709 1011 2HG2 ILE 38 2HG2 ILE 38 -18.737 15.309 -4.699 1012 3HG2 ILE 38 3HG2 ILE 38 -19.470 15.474 -6.295 1013 1HD1 ILE 38 1HD1 ILE 38 -18.609 17.937 -6.538 1014 2HD1 ILE 38 2HD1 ILE 38 -17.230 18.280 -7.582 1015 3HD1 ILE 38 3HD1 ILE 38 -18.279 16.907 -7.930 1016 HA PRO 39 HA PRO 39 -16.888 10.186 -4.852 1017 1HB PRO 39 1HB PRO 39 -18.838 9.959 -2.977 1018 2HB PRO 39 2HB PRO 39 -17.138 10.221 -2.569 1019 1HG PRO 39 1HG PRO 39 -19.379 12.201 -2.714 1020 2HG PRO 39 2HG PRO 39 -18.099 12.047 -1.496 1021 1HD PRO 39 1HD PRO 39 -18.005 13.884 -3.483 1022 2HD PRO 39 2HD PRO 39 -16.546 13.131 -2.808 1023 H ILE 40 H ILE 40 -17.768 10.194 -6.994 1024 HA ILE 40 HA ILE 40 -20.294 10.922 -7.795 1025 HB ILE 40 HB ILE 40 -20.096 8.938 -9.432 1026 1HG1 ILE 40 1HG1 ILE 40 -17.218 8.899 -8.616 1027 2HG1 ILE 40 2HG1 ILE 40 -18.362 7.887 -7.743 1028 1HG2 ILE 40 1HG2 ILE 40 -19.588 11.183 -10.099 1029 2HG2 ILE 40 2HG2 ILE 40 -18.025 11.121 -9.287 1030 3HG2 ILE 40 3HG2 ILE 40 -18.319 10.123 -10.711 1031 1HD1 ILE 40 1HD1 ILE 40 -18.466 6.407 -9.398 1032 2HD1 ILE 40 2HD1 ILE 40 -18.619 7.661 -10.629 1033 3HD1 ILE 40 3HD1 ILE 40 -17.025 7.203 -10.030 1034 H LYS 41 H LYS 41 -19.304 8.034 -6.060 1035 HA LYS 41 HA LYS 41 -22.059 7.531 -5.317 1036 1HB LYS 41 1HB LYS 41 -20.802 6.044 -7.418 1037 2HB LYS 41 2HB LYS 41 -21.055 4.978 -6.042 1038 1HG LYS 41 1HG LYS 41 -23.333 6.693 -6.800 1039 2HG LYS 41 2HG LYS 41 -22.896 5.412 -7.934 1040 1HD LYS 41 1HD LYS 41 -22.867 3.907 -5.815 1041 2HD LYS 41 2HD LYS 41 -23.835 5.198 -5.099 1042 1HE LYS 41 1HE LYS 41 -24.712 4.342 -7.765 1043 2HE LYS 41 2HE LYS 41 -24.834 3.100 -6.520 1044 1HZ LYS 41 1HZ LYS 41 -26.076 5.793 -6.495 1045 2HZ LYS 41 2HZ LYS 41 -26.048 4.765 -5.152 1046 3HZ LYS 41 3HZ LYS 41 -26.866 4.298 -6.557 1047 H SER 42 H SER 42 -22.271 6.282 -3.446 1048 HA SER 42 HA SER 42 -20.075 4.935 -2.230 1049 1HB SER 42 1HB SER 42 -19.362 7.258 -1.809 1050 2HB SER 42 2HB SER 42 -20.899 7.582 -1.008 1051 HG SER 42 HG SER 42 -19.386 5.417 -0.104 1052 H THR 43 H THR 43 -20.682 3.761 -0.400 1053 HA THR 43 HA THR 43 -23.555 3.866 0.254 1054 HB THR 43 HB THR 43 -23.519 1.827 -0.770 1055 HG1 THR 43 HG1 THR 43 -22.367 0.724 1.527 1056 1HG2 THR 43 1HG2 THR 43 -21.395 0.295 -0.408 1057 2HG2 THR 43 2HG2 THR 43 -20.617 1.847 -0.096 1058 3HG2 THR 43 3HG2 THR 43 -21.415 1.554 -1.641 1059 H MET 44 H MET 44 -20.401 4.109 1.414 1060 HA MET 44 HA MET 44 -20.719 3.046 4.023 1061 1HB MET 44 1HB MET 44 -18.822 5.196 3.063 1062 2HB MET 44 2HB MET 44 -18.680 4.294 4.566 1063 1HG MET 44 1HG MET 44 -18.872 2.403 2.486 1064 2HG MET 44 2HG MET 44 -17.718 3.630 1.970 1065 1HE MET 44 1HE MET 44 -17.551 0.973 5.655 1066 2HE MET 44 2HE MET 44 -17.910 2.655 6.044 1067 3HE MET 44 3HE MET 44 -18.961 1.760 4.946 1068 H ASP 45 H ASP 45 -20.011 4.923 5.819 1069 HA ASP 45 HA ASP 45 -22.447 6.237 6.369 1070 1HB ASP 45 1HB ASP 45 -19.867 5.889 7.666 1071 2HB ASP 45 2HB ASP 45 -20.520 7.504 7.928 1072 H ASN 46 H ASN 46 -22.655 8.597 6.786 1073 HA ASN 46 HA ASN 46 -22.128 10.065 4.441 1074 1HB ASN 46 1HB ASN 46 -23.690 10.395 6.763 1075 2HB ASN 46 2HB ASN 46 -22.634 11.802 6.686 1076 1HD2 ASN 46 1HD2 ASN 46 -22.390 12.124 3.967 1077 2HD2 ASN 46 2HD2 ASN 46 -23.925 12.559 3.303 1078 HA PRO 47 HA PRO 47 -18.830 12.458 7.043 1079 1HB PRO 47 1HB PRO 47 -18.117 11.385 9.432 1080 2HB PRO 47 2HB PRO 47 -19.442 12.542 9.256 1081 1HG PRO 47 1HG PRO 47 -19.549 9.558 9.474 1082 2HG PRO 47 2HG PRO 47 -20.577 10.775 10.254 1083 1HD PRO 47 1HD PRO 47 -21.359 9.398 8.058 1084 2HD PRO 47 2HD PRO 47 -21.874 11.067 8.371 1085 H THR 48 H THR 48 -18.918 8.963 7.093 1086 HA THR 48 HA THR 48 -16.071 8.615 7.138 1087 HB THR 48 HB THR 48 -18.208 6.632 6.333 1088 HG1 THR 48 HG1 THR 48 -17.659 5.900 8.592 1089 1HG2 THR 48 1HG2 THR 48 -16.559 4.933 6.720 1090 2HG2 THR 48 2HG2 THR 48 -15.395 6.125 7.300 1091 3HG2 THR 48 3HG2 THR 48 -15.873 6.111 5.602 1092 H THR 49 H THR 49 -18.565 8.758 4.661 1093 HA THR 49 HA THR 49 -16.941 7.894 2.503 1094 HB THR 49 HB THR 49 -19.463 9.561 2.512 1095 HG1 THR 49 HG1 THR 49 -19.349 7.199 3.203 1096 1HG2 THR 49 1HG2 THR 49 -18.035 8.235 0.203 1097 2HG2 THR 49 2HG2 THR 49 -18.219 9.970 0.460 1098 3HG2 THR 49 3HG2 THR 49 -19.634 8.973 0.125 1099 H THR 50 H THR 50 -17.963 11.140 3.558 1100 HA THR 50 HA THR 50 -16.633 12.631 1.631 1101 HB THR 50 HB THR 50 -16.559 13.860 4.290 1102 HG1 THR 50 HG1 THR 50 -18.912 13.910 4.383 1103 1HG2 THR 50 1HG2 THR 50 -17.001 15.679 3.069 1104 2HG2 THR 50 2HG2 THR 50 -18.434 14.937 2.356 1105 3HG2 THR 50 3HG2 THR 50 -16.846 14.654 1.643 1106 H GLN 51 H GLN 51 -15.459 11.488 4.779 1107 HA GLN 51 HA GLN 51 -12.903 12.703 4.562 1108 1HB GLN 51 1HB GLN 51 -13.859 12.042 6.721 1109 2HB GLN 51 2HB GLN 51 -13.792 10.352 6.241 1110 1HG GLN 51 1HG GLN 51 -11.237 10.911 5.904 1111 2HG GLN 51 2HG GLN 51 -11.608 12.180 7.069 1112 1HE2 GLN 51 1HE2 GLN 51 -11.207 8.800 6.549 1113 2HE2 GLN 51 2HE2 GLN 51 -11.327 8.310 8.202 1114 H TYR 52 H TYR 52 -14.094 9.428 3.911 1115 HA TYR 52 HA TYR 52 -11.629 8.270 3.246 1116 1HB TYR 52 1HB TYR 52 -14.486 7.612 2.728 1117 2HB TYR 52 2HB TYR 52 -13.271 6.787 1.758 1118 HD1 TYR 52 HD1 TYR 52 -13.267 4.597 2.557 1119 HD2 TYR 52 HD2 TYR 52 -13.126 7.816 5.335 1120 HE1 TYR 52 HE1 TYR 52 -12.891 2.995 4.385 1121 HE2 TYR 52 HE2 TYR 52 -12.748 6.223 7.170 1122 HH TYR 52 HH TYR 52 -13.303 2.980 6.933 1123 H ALA 53 H ALA 53 -13.991 10.018 1.292 1124 HA ALA 53 HA ALA 53 -13.042 9.537 -1.250 1125 1HB ALA 53 1HB ALA 53 -13.746 12.169 -1.410 1126 2HB ALA 53 2HB ALA 53 -14.869 10.810 -1.492 1127 3HB ALA 53 3HB ALA 53 -14.606 11.646 0.039 1128 H SER 54 H SER 54 -12.015 12.132 0.965 1129 HA SER 54 HA SER 54 -9.912 12.987 -0.796 1130 1HB SER 54 1HB SER 54 -10.994 13.832 1.831 1131 2HB SER 54 2HB SER 54 -9.292 14.193 1.540 1132 HG SER 54 HG SER 54 -10.469 15.902 0.761 1133 H LEU 55 H LEU 55 -10.073 11.253 2.298 1134 HA LEU 55 HA LEU 55 -7.388 10.956 2.833 1135 1HB LEU 55 1HB LEU 55 -9.437 10.195 4.175 1136 2HB LEU 55 2HB LEU 55 -9.342 8.712 3.228 1137 HG LEU 55 HG LEU 55 -8.307 8.546 5.479 1138 1HD1 LEU 55 1HD1 LEU 55 -5.982 8.214 3.734 1139 2HD1 LEU 55 2HD1 LEU 55 -7.466 7.494 3.113 1140 3HD1 LEU 55 3HD1 LEU 55 -6.859 7.028 4.701 1141 1HD2 LEU 55 1HD2 LEU 55 -7.446 10.877 5.534 1142 2HD2 LEU 55 2HD2 LEU 55 -6.219 10.410 4.357 1143 3HD2 LEU 55 3HD2 LEU 55 -6.238 9.664 5.956 1144 H MET 56 H MET 56 -9.411 9.078 0.633 1145 HA MET 56 HA MET 56 -7.243 7.293 -0.058 1146 1HB MET 56 1HB MET 56 -10.007 7.607 -1.241 1147 2HB MET 56 2HB MET 56 -8.866 6.339 -1.668 1148 1HG MET 56 1HG MET 56 -10.045 6.778 1.066 1149 2HG MET 56 2HG MET 56 -10.573 5.567 -0.100 1150 1HE MET 56 1HE MET 56 -7.744 5.187 3.147 1151 2HE MET 56 2HE MET 56 -9.200 6.138 2.853 1152 3HE MET 56 3HE MET 56 -9.313 4.388 3.048 1153 H HIS 57 H HIS 57 -8.546 10.279 -1.174 1154 HA HIS 57 HA HIS 57 -7.554 10.122 -3.852 1155 1HB HIS 57 1HB HIS 57 -9.422 11.594 -3.302 1156 2HB HIS 57 2HB HIS 57 -8.401 12.511 -2.198 1157 HD1 HIS 57 HD1 HIS 57 -9.424 12.296 -5.707 1158 HD2 HIS 57 HD2 HIS 57 -6.336 14.038 -3.541 1159 HE1 HIS 57 HE1 HIS 57 -8.394 13.993 -7.251 1160 H SER 58 H SER 58 -6.493 11.918 -0.961 1161 HA SER 58 HA SER 58 -4.102 12.869 -2.163 1162 1HB SER 58 1HB SER 58 -4.818 14.166 -0.355 1163 2HB SER 58 2HB SER 58 -5.140 12.756 0.654 1164 HG SER 58 HG SER 58 -3.135 12.769 1.295 1165 H PHE 59 H PHE 59 -4.963 9.966 -0.457 1166 HA PHE 59 HA PHE 59 -2.489 9.063 0.408 1167 1HB PHE 59 1HB PHE 59 -4.487 7.883 1.035 1168 2HB PHE 59 2HB PHE 59 -4.861 7.518 -0.647 1169 HD1 PHE 59 HD1 PHE 59 -1.631 7.218 1.164 1170 HD2 PHE 59 HD2 PHE 59 -4.846 5.203 -0.765 1171 HE1 PHE 59 HE1 PHE 59 -0.410 5.090 1.360 1172 HE2 PHE 59 HE2 PHE 59 -3.631 3.072 -0.572 1173 HZ PHE 59 HZ PHE 59 -1.411 3.014 0.492 1174 H ILE 60 H ILE 60 -4.067 8.432 -2.722 1175 HA ILE 60 HA ILE 60 -1.848 7.043 -3.821 1176 HB ILE 60 HB ILE 60 -4.201 8.372 -5.166 1177 1HG1 ILE 60 1HG1 ILE 60 -4.028 5.485 -5.326 1178 2HG1 ILE 60 2HG1 ILE 60 -4.002 6.024 -3.651 1179 1HG2 ILE 60 1HG2 ILE 60 -2.943 8.235 -7.019 1180 2HG2 ILE 60 2HG2 ILE 60 -1.789 7.130 -6.273 1181 3HG2 ILE 60 3HG2 ILE 60 -3.302 6.510 -6.933 1182 1HD1 ILE 60 1HD1 ILE 60 -6.022 7.487 -4.963 1183 2HD1 ILE 60 2HD1 ILE 60 -6.210 5.794 -5.421 1184 3HD1 ILE 60 3HD1 ILE 60 -6.194 6.251 -3.718 1185 H LEU 61 H LEU 61 -2.915 10.402 -3.923 1186 HA LEU 61 HA LEU 61 -1.099 11.310 -5.874 1187 1HB LEU 61 1HB LEU 61 -3.093 12.418 -4.223 1188 2HB LEU 61 2HB LEU 61 -1.620 13.336 -3.916 1189 HG LEU 61 HG LEU 61 -1.449 13.885 -6.281 1190 1HD1 LEU 61 1HD1 LEU 61 -3.540 11.840 -6.494 1191 2HD1 LEU 61 2HD1 LEU 61 -2.330 12.360 -7.668 1192 3HD1 LEU 61 3HD1 LEU 61 -3.816 13.288 -7.463 1193 1HD2 LEU 61 1HD2 LEU 61 -2.613 15.527 -5.124 1194 2HD2 LEU 61 2HD2 LEU 61 -4.008 14.484 -4.845 1195 3HD2 LEU 61 3HD2 LEU 61 -3.701 15.135 -6.456 1196 H LYS 62 H LYS 62 -0.777 10.707 -2.456 1197 HA LYS 62 HA LYS 62 1.702 12.123 -2.164 1198 1HB LYS 62 1HB LYS 62 -0.187 10.887 -0.443 1199 2HB LYS 62 2HB LYS 62 1.369 10.125 -0.142 1200 1HG LYS 62 1HG LYS 62 1.386 11.877 1.349 1201 2HG LYS 62 2HG LYS 62 2.257 12.557 -0.027 1202 1HD LYS 62 1HD LYS 62 0.626 14.051 -0.482 1203 2HD LYS 62 2HD LYS 62 -0.666 12.918 -0.076 1204 1HE LYS 62 1HE LYS 62 -0.941 14.209 1.738 1205 2HE LYS 62 2HE LYS 62 0.468 13.353 2.361 1206 1HZ LYS 62 1HZ LYS 62 0.617 15.805 2.527 1207 2HZ LYS 62 2HZ LYS 62 0.614 15.896 0.839 1208 3HZ LYS 62 3HZ LYS 62 1.882 15.114 1.641 1209 H ALA 63 H ALA 63 0.819 8.670 -2.220 1210 HA ALA 63 HA ALA 63 3.445 7.676 -2.156 1211 1HB ALA 63 1HB ALA 63 2.419 5.585 -3.081 1212 2HB ALA 63 2HB ALA 63 1.644 6.213 -1.625 1213 3HB ALA 63 3HB ALA 63 0.895 6.465 -3.202 1214 H ARG 64 H ARG 64 1.271 8.303 -4.900 1215 HA ARG 64 HA ARG 64 2.854 7.381 -6.964 1216 1HB ARG 64 1HB ARG 64 0.486 8.297 -7.086 1217 2HB ARG 64 2HB ARG 64 1.206 9.901 -7.133 1218 1HG ARG 64 1HG ARG 64 2.543 8.419 -9.092 1219 2HG ARG 64 2HG ARG 64 0.834 8.006 -9.253 1220 1HD ARG 64 1HD ARG 64 1.620 10.866 -8.935 1221 2HD ARG 64 2HD ARG 64 1.840 10.084 -10.500 1222 HE ARG 64 HE ARG 64 -0.637 10.881 -9.300 1223 1HH1 ARG 64 1HH1 ARG 64 0.858 8.650 -11.515 1224 2HH1 ARG 64 2HH1 ARG 64 -0.593 8.376 -12.422 1225 1HH2 ARG 64 1HH2 ARG 64 -2.553 10.529 -10.486 1226 2HH2 ARG 64 2HH2 ARG 64 -2.532 9.446 -11.837 1227 H SER 65 H SER 65 2.994 10.480 -5.283 1228 HA SER 65 HA SER 65 4.934 11.654 -6.995 1229 1HB SER 65 1HB SER 65 3.322 12.731 -5.203 1230 2HB SER 65 2HB SER 65 4.691 12.465 -4.124 1231 HG SER 65 HG SER 65 4.514 14.542 -5.397 1232 H THR 66 H THR 66 5.095 9.558 -4.219 1233 HA THR 66 HA THR 66 7.901 9.981 -3.739 1234 HB THR 66 HB THR 66 6.789 7.485 -2.695 1235 HG1 THR 66 HG1 THR 66 5.334 8.587 -1.266 1236 1HG2 THR 66 1HG2 THR 66 7.476 9.578 -0.798 1237 2HG2 THR 66 2HG2 THR 66 8.738 9.327 -2.004 1238 3HG2 THR 66 3HG2 THR 66 8.182 7.977 -1.015 1239 H VAL 67 H VAL 67 5.918 7.569 -5.384 1240 HA VAL 67 HA VAL 67 7.780 5.589 -5.859 1241 HB VAL 67 HB VAL 67 5.631 6.550 -7.753 1242 1HG1 VAL 67 1HG1 VAL 67 5.740 4.223 -8.631 1243 2HG1 VAL 67 2HG1 VAL 67 7.191 5.176 -8.951 1244 3HG1 VAL 67 3HG1 VAL 67 7.191 3.972 -7.661 1245 1HG2 VAL 67 1HG2 VAL 67 5.206 4.100 -6.206 1246 2HG2 VAL 67 2HG2 VAL 67 5.294 5.567 -5.230 1247 3HG2 VAL 67 3HG2 VAL 67 4.109 5.442 -6.531 1248 H ARG 68 H ARG 68 7.392 8.688 -7.457 1249 HA ARG 68 HA ARG 68 8.935 8.294 -9.728 1250 1HB ARG 68 1HB ARG 68 8.728 10.793 -8.038 1251 2HB ARG 68 2HB ARG 68 9.320 10.729 -9.692 1252 1HG ARG 68 1HG ARG 68 6.820 9.503 -9.774 1253 2HG ARG 68 2HG ARG 68 6.620 10.901 -8.715 1254 1HD ARG 68 1HD ARG 68 6.158 11.577 -10.970 1255 2HD ARG 68 2HD ARG 68 7.681 12.306 -10.466 1256 HE ARG 68 HE ARG 68 8.352 9.948 -11.723 1257 1HH1 ARG 68 1HH1 ARG 68 6.682 12.885 -12.564 1258 2HH1 ARG 68 2HH1 ARG 68 7.136 12.819 -14.235 1259 1HH2 ARG 68 1HH2 ARG 68 8.957 9.850 -13.920 1260 2HH2 ARG 68 2HH2 ARG 68 8.429 11.092 -15.005 1261 H ASP 69 H ASP 69 9.900 8.639 -6.414 1262 HA ASP 69 HA ASP 69 12.634 9.288 -6.921 1263 1HB ASP 69 1HB ASP 69 11.042 9.325 -4.699 1264 2HB ASP 69 2HB ASP 69 12.029 7.897 -4.400 1265 H ILE 70 H ILE 70 10.852 6.298 -6.346 1266 HA ILE 70 HA ILE 70 13.027 4.558 -6.080 1267 HB ILE 70 HB ILE 70 10.341 3.933 -7.313 1268 1HG1 ILE 70 1HG1 ILE 70 11.213 3.632 -4.434 1269 2HG1 ILE 70 2HG1 ILE 70 10.256 4.983 -5.032 1270 1HG2 ILE 70 1HG2 ILE 70 10.985 1.653 -6.190 1271 2HG2 ILE 70 2HG2 ILE 70 11.589 2.069 -7.793 1272 3HG2 ILE 70 3HG2 ILE 70 12.627 2.266 -6.380 1273 1HD1 ILE 70 1HD1 ILE 70 8.588 3.237 -5.822 1274 2HD1 ILE 70 2HD1 ILE 70 9.482 2.099 -4.814 1275 3HD1 ILE 70 3HD1 ILE 70 8.716 3.509 -4.084 1276 H ASP 71 H ASP 71 11.245 5.581 -8.973 1277 HA ASP 71 HA ASP 71 13.580 5.006 -10.600 1278 1HB ASP 71 1HB ASP 71 11.086 3.407 -10.682 1279 2HB ASP 71 2HB ASP 71 11.756 3.883 -12.240 1280 HA PRO 72 HA PRO 72 12.268 8.500 -12.901 1281 1HB PRO 72 1HB PRO 72 12.995 7.845 -15.434 1282 2HB PRO 72 2HB PRO 72 14.165 8.257 -14.175 1283 1HG PRO 72 1HG PRO 72 13.315 5.562 -15.161 1284 2HG PRO 72 2HG PRO 72 14.943 6.150 -14.778 1285 1HD PRO 72 1HD PRO 72 13.516 4.600 -13.077 1286 2HD PRO 72 2HD PRO 72 14.659 5.835 -12.512 1287 H GLN 73 H GLN 73 11.428 5.477 -14.600 1288 HA GLN 73 HA GLN 73 8.810 6.672 -15.231 1289 1HB GLN 73 1HB GLN 73 10.333 4.664 -16.898 1290 2HB GLN 73 2HB GLN 73 8.774 5.374 -17.294 1291 1HG GLN 73 1HG GLN 73 9.905 7.611 -17.304 1292 2HG GLN 73 2HG GLN 73 11.439 6.754 -17.166 1293 1HE2 GLN 73 1HE2 GLN 73 12.440 6.465 -19.012 1294 2HE2 GLN 73 2HE2 GLN 73 11.700 6.286 -20.562 1295 H ASN 74 H ASN 74 7.200 5.709 -14.202 1296 HA ASN 74 HA ASN 74 6.926 2.865 -14.131 1297 1HB ASN 74 1HB ASN 74 8.128 4.228 -11.848 1298 2HB ASN 74 2HB ASN 74 6.679 3.329 -11.408 1299 1HD2 ASN 74 1HD2 ASN 74 6.662 1.104 -11.585 1300 2HD2 ASN 74 2HD2 ASN 74 8.104 0.180 -11.813 1301 H ASP 75 H ASP 75 5.009 2.362 -12.458 1302 HA ASP 75 HA ASP 75 3.082 4.419 -12.082 1303 1HB ASP 75 1HB ASP 75 3.155 3.406 -14.676 1304 2HB ASP 75 2HB ASP 75 1.821 2.546 -13.912 1305 H LEU 76 H LEU 76 2.162 3.810 -10.249 1306 HA LEU 76 HA LEU 76 2.300 1.253 -9.144 1307 1HB LEU 76 1HB LEU 76 1.294 3.784 -8.403 1308 2HB LEU 76 2HB LEU 76 -0.008 2.622 -8.154 1309 HG LEU 76 HG LEU 76 1.224 2.926 -6.103 1310 1HD1 LEU 76 1HD1 LEU 76 0.447 0.598 -6.993 1311 2HD1 LEU 76 2HD1 LEU 76 1.429 0.710 -5.532 1312 3HD1 LEU 76 3HD1 LEU 76 2.179 0.270 -7.067 1313 1HD2 LEU 76 1HD2 LEU 76 3.499 2.821 -5.873 1314 2HD2 LEU 76 2HD2 LEU 76 3.379 3.492 -7.500 1315 3HD2 LEU 76 3HD2 LEU 76 3.706 1.772 -7.276 1316 H THR 77 H THR 77 0.637 -0.301 -8.725 1317 HA THR 77 HA THR 77 -1.380 -0.406 -10.870 1318 HB THR 77 HB THR 77 -1.329 -2.824 -10.701 1319 HG1 THR 77 HG1 THR 77 0.487 -2.333 -8.566 1320 1HG2 THR 77 1HG2 THR 77 0.757 -3.223 -11.700 1321 2HG2 THR 77 2HG2 THR 77 1.552 -1.973 -10.743 1322 3HG2 THR 77 3HG2 THR 77 0.436 -1.521 -12.031 1323 H PHE 78 H PHE 78 -0.810 -1.230 -7.462 1324 HA PHE 78 HA PHE 78 -3.500 -0.467 -6.780 1325 1HB PHE 78 1HB PHE 78 -4.141 -2.631 -5.807 1326 2HB PHE 78 2HB PHE 78 -3.880 -2.765 -7.543 1327 HD1 PHE 78 HD1 PHE 78 -2.248 -4.215 -8.425 1328 HD2 PHE 78 HD2 PHE 78 -2.398 -3.472 -4.237 1329 HE1 PHE 78 HE1 PHE 78 -0.659 -6.055 -8.046 1330 HE2 PHE 78 HE2 PHE 78 -0.809 -5.310 -3.851 1331 HZ PHE 78 HZ PHE 78 0.063 -6.604 -5.756 1332 H LEU 79 H LEU 79 -3.725 0.039 -4.630 1333 HA LEU 79 HA LEU 79 -1.289 -0.232 -2.996 1334 1HB LEU 79 1HB LEU 79 -3.084 1.999 -3.537 1335 2HB LEU 79 2HB LEU 79 -2.804 1.743 -1.816 1336 HG LEU 79 HG LEU 79 -0.436 2.049 -2.100 1337 1HD1 LEU 79 1HD1 LEU 79 0.569 2.544 -4.251 1338 2HD1 LEU 79 2HD1 LEU 79 -0.994 2.363 -5.046 1339 3HD1 LEU 79 3HD1 LEU 79 -0.222 0.968 -4.292 1340 1HD2 LEU 79 1HD2 LEU 79 -0.963 4.350 -3.668 1341 2HD2 LEU 79 2HD2 LEU 79 -0.806 4.227 -1.916 1342 3HD2 LEU 79 3HD2 LEU 79 -2.386 4.035 -2.675 1343 H ARG 80 H ARG 80 -1.598 -1.947 -1.704 1344 HA ARG 80 HA ARG 80 -4.196 -2.256 -0.369 1345 1HB ARG 80 1HB ARG 80 -2.235 -4.110 -1.429 1346 2HB ARG 80 2HB ARG 80 -2.606 -4.468 0.252 1347 1HG ARG 80 1HG ARG 80 -4.336 -5.617 -0.544 1348 2HG ARG 80 2HG ARG 80 -5.088 -4.047 -0.832 1349 1HD ARG 80 1HD ARG 80 -4.712 -4.125 -3.077 1350 2HD ARG 80 2HD ARG 80 -3.234 -5.071 -2.905 1351 HE ARG 80 HE ARG 80 -5.917 -6.074 -3.214 1352 1HH1 ARG 80 1HH1 ARG 80 -2.688 -6.773 -2.115 1353 2HH1 ARG 80 2HH1 ARG 80 -2.866 -8.489 -2.270 1354 1HH2 ARG 80 1HH2 ARG 80 -6.164 -8.332 -3.422 1355 2HH2 ARG 80 2HH2 ARG 80 -4.843 -9.375 -3.014 1356 H ILE 81 H ILE 81 -4.397 -2.180 1.814 1357 HA ILE 81 HA ILE 81 -1.962 -1.898 3.429 1358 HB ILE 81 HB ILE 81 -4.347 -0.114 3.867 1359 1HG1 ILE 81 1HG1 ILE 81 -1.819 0.506 2.324 1360 2HG1 ILE 81 2HG1 ILE 81 -3.439 0.381 1.647 1361 1HG2 ILE 81 1HG2 ILE 81 -2.022 -0.698 5.353 1362 2HG2 ILE 81 2HG2 ILE 81 -1.843 0.943 4.735 1363 3HG2 ILE 81 3HG2 ILE 81 -3.258 0.512 5.696 1364 1HD1 ILE 81 1HD1 ILE 81 -3.585 2.261 3.729 1365 2HD1 ILE 81 2HD1 ILE 81 -2.137 2.639 2.795 1366 3HD1 ILE 81 3HD1 ILE 81 -3.704 2.543 1.992 1367 H ARG 82 H ARG 82 -2.259 -3.931 4.321 1368 HA ARG 82 HA ARG 82 -4.720 -4.849 5.385 1369 1HB ARG 82 1HB ARG 82 -2.273 -5.987 4.846 1370 2HB ARG 82 2HB ARG 82 -2.307 -5.976 6.604 1371 1HG ARG 82 1HG ARG 82 -3.745 -7.665 6.674 1372 2HG ARG 82 2HG ARG 82 -4.813 -6.900 5.495 1373 1HD ARG 82 1HD ARG 82 -2.264 -8.269 4.688 1374 2HD ARG 82 2HD ARG 82 -3.781 -9.150 4.867 1375 HE ARG 82 HE ARG 82 -4.310 -6.991 3.219 1376 1HH1 ARG 82 1HH1 ARG 82 -2.276 -9.816 3.177 1377 2HH1 ARG 82 2HH1 ARG 82 -2.296 -9.965 1.451 1378 1HH2 ARG 82 1HH2 ARG 82 -4.345 -7.177 0.946 1379 2HH2 ARG 82 2HH2 ARG 82 -3.473 -8.463 0.183 1380 H SER 83 H SER 83 -5.709 -3.777 6.977 1381 HA SER 83 HA SER 83 -4.091 -2.828 9.246 1382 1HB SER 83 1HB SER 83 -6.798 -1.833 9.277 1383 2HB SER 83 2HB SER 83 -5.285 -0.932 9.190 1384 HG SER 83 HG SER 83 -7.079 -1.417 7.248 1385 H LYS 84 H LYS 84 -5.539 -2.708 11.325 1386 HA LYS 84 HA LYS 84 -6.257 -5.423 11.937 1387 1HB LYS 84 1HB LYS 84 -6.244 -2.880 13.559 1388 2HB LYS 84 2HB LYS 84 -6.776 -4.423 14.215 1389 1HG LYS 84 1HG LYS 84 -4.377 -5.125 13.197 1390 2HG LYS 84 2HG LYS 84 -4.068 -3.444 13.636 1391 1HD LYS 84 1HD LYS 84 -5.323 -4.237 15.859 1392 2HD LYS 84 2HD LYS 84 -4.648 -5.788 15.355 1393 1HE LYS 84 1HE LYS 84 -2.464 -4.340 15.046 1394 2HE LYS 84 2HE LYS 84 -3.266 -3.296 16.218 1395 1HZ LYS 84 1HZ LYS 84 -3.465 -5.214 17.701 1396 2HZ LYS 84 2HZ LYS 84 -1.850 -4.874 17.334 1397 3HZ LYS 84 3HZ LYS 84 -2.631 -6.174 16.584 1398 H LYS 85 H LYS 85 -7.934 -2.474 11.179 1399 HA LYS 85 HA LYS 85 -10.493 -3.344 12.142 1400 1HB LYS 85 1HB LYS 85 -9.569 -1.048 10.431 1401 2HB LYS 85 2HB LYS 85 -11.280 -1.368 10.684 1402 1HG LYS 85 1HG LYS 85 -9.374 -1.024 12.974 1403 2HG LYS 85 2HG LYS 85 -10.172 0.346 12.198 1404 1HD LYS 85 1HD LYS 85 -12.247 -1.402 12.633 1405 2HD LYS 85 2HD LYS 85 -11.233 -1.639 14.059 1406 1HE LYS 85 1HE LYS 85 -11.363 0.650 14.644 1407 2HE LYS 85 2HE LYS 85 -12.046 1.086 13.078 1408 1HZ LYS 85 1HZ LYS 85 -13.663 -0.846 14.383 1409 2HZ LYS 85 2HZ LYS 85 -14.079 0.699 13.833 1410 3HZ LYS 85 3HZ LYS 85 -13.432 0.499 15.384 1411 H ASN 86 H ASN 86 -9.100 -2.898 8.891 1412 HA ASN 86 HA ASN 86 -10.154 -5.254 7.822 1413 1HB ASN 86 1HB ASN 86 -11.880 -4.097 6.283 1414 2HB ASN 86 2HB ASN 86 -12.355 -4.458 7.940 1415 1HD2 ASN 86 1HD2 ASN 86 -12.816 -2.821 9.323 1416 2HD2 ASN 86 2HD2 ASN 86 -12.852 -1.156 8.862 1417 H GLU 87 H GLU 87 -9.942 -5.349 5.435 1418 HA GLU 87 HA GLU 87 -7.594 -3.874 4.620 1419 1HB GLU 87 1HB GLU 87 -8.103 -6.374 4.193 1420 2HB GLU 87 2HB GLU 87 -9.118 -5.792 2.880 1421 1HG GLU 87 1HG GLU 87 -6.816 -4.441 2.402 1422 2HG GLU 87 2HG GLU 87 -6.202 -5.944 3.086 1423 H ILE 88 H ILE 88 -7.454 -2.349 3.039 1424 HA ILE 88 HA ILE 88 -9.953 -1.549 1.704 1425 HB ILE 88 HB ILE 88 -7.896 0.392 2.756 1426 1HG1 ILE 88 1HG1 ILE 88 -10.612 -0.323 3.883 1427 2HG1 ILE 88 2HG1 ILE 88 -9.059 -0.717 4.613 1428 1HG2 ILE 88 1HG2 ILE 88 -10.639 0.795 1.572 1429 2HG2 ILE 88 2HG2 ILE 88 -9.631 2.067 2.260 1430 3HG2 ILE 88 3HG2 ILE 88 -9.098 1.204 0.818 1431 1HD1 ILE 88 1HD1 ILE 88 -9.781 1.137 5.800 1432 2HD1 ILE 88 2HD1 ILE 88 -8.659 1.818 4.621 1433 3HD1 ILE 88 3HD1 ILE 88 -10.399 1.942 4.357 1434 H MET 89 H MET 89 -9.562 -2.179 -0.341 1435 HA MET 89 HA MET 89 -6.945 -1.787 -1.536 1436 1HB MET 89 1HB MET 89 -9.491 -3.094 -2.469 1437 2HB MET 89 2HB MET 89 -8.146 -2.809 -3.566 1438 1HG MET 89 1HG MET 89 -6.793 -4.346 -2.528 1439 2HG MET 89 2HG MET 89 -7.655 -4.228 -0.995 1440 1HE MET 89 1HE MET 89 -8.322 -4.980 -4.724 1441 2HE MET 89 2HE MET 89 -9.560 -6.235 -4.673 1442 3HE MET 89 3HE MET 89 -9.956 -4.584 -4.192 1443 H VAL 90 H VAL 90 -6.398 0.014 -2.558 1444 HA VAL 90 HA VAL 90 -8.444 1.505 -4.037 1445 HB VAL 90 HB VAL 90 -6.509 2.763 -2.087 1446 1HG1 VAL 90 1HG1 VAL 90 -7.561 4.889 -2.726 1447 2HG1 VAL 90 2HG1 VAL 90 -6.732 4.127 -4.085 1448 3HG1 VAL 90 3HG1 VAL 90 -8.490 4.046 -3.965 1449 1HG2 VAL 90 1HG2 VAL 90 -9.293 1.923 -1.904 1450 2HG2 VAL 90 2HG2 VAL 90 -8.154 2.353 -0.628 1451 3HG2 VAL 90 3HG2 VAL 90 -9.050 3.616 -1.473 1452 H ALA 91 H ALA 91 -7.773 2.189 -5.981 1453 HA ALA 91 HA ALA 91 -4.969 2.670 -6.521 1454 1HB ALA 91 1HB ALA 91 -6.145 0.794 -8.467 1455 2HB ALA 91 2HB ALA 91 -4.498 0.906 -7.844 1456 3HB ALA 91 3HB ALA 91 -5.752 0.120 -6.885 1457 HA PRO 92 HA PRO 92 -6.567 5.582 -9.389 1458 1HB PRO 92 1HB PRO 92 -4.643 5.591 -11.305 1459 2HB PRO 92 2HB PRO 92 -4.407 6.299 -9.702 1460 1HG PRO 92 1HG PRO 92 -3.534 3.631 -10.742 1461 2HG PRO 92 2HG PRO 92 -2.637 4.790 -9.744 1462 1HD PRO 92 1HD PRO 92 -3.842 2.599 -8.705 1463 2HD PRO 92 2HD PRO 92 -3.684 4.120 -7.803 1464 H ASP 93 H ASP 93 -8.282 5.245 -10.647 1465 HA ASP 93 HA ASP 93 -8.267 3.015 -12.544 1466 1HB ASP 93 1HB ASP 93 -10.208 3.960 -10.799 1467 2HB ASP 93 2HB ASP 93 -10.747 4.535 -12.374 1468 H LYS 94 H LYS 94 -10.109 3.863 -14.386 1469 HA LYS 94 HA LYS 94 -8.615 5.163 -16.293 1470 1HB LYS 94 1HB LYS 94 -11.314 4.262 -16.026 1471 2HB LYS 94 2HB LYS 94 -11.332 5.861 -16.756 1472 1HG LYS 94 1HG LYS 94 -10.061 5.162 -18.593 1473 2HG LYS 94 2HG LYS 94 -9.548 3.680 -17.783 1474 1HD LYS 94 1HD LYS 94 -11.780 2.780 -17.917 1475 2HD LYS 94 2HD LYS 94 -12.393 4.298 -18.576 1476 1HE LYS 94 1HE LYS 94 -11.631 3.852 -20.651 1477 2HE LYS 94 2HE LYS 94 -10.151 3.100 -20.056 1478 1HZ LYS 94 1HZ LYS 94 -11.942 1.290 -19.313 1479 2HZ LYS 94 2HZ LYS 94 -11.159 1.251 -20.811 1480 3HZ LYS 94 3HZ LYS 94 -12.718 1.895 -20.689 1481 H ASP 95 H ASP 95 -11.122 6.616 -14.220 1482 HA ASP 95 HA ASP 95 -9.669 9.124 -14.207 1483 1HB ASP 95 1HB ASP 95 -12.188 8.715 -15.722 1484 2HB ASP 95 2HB ASP 95 -12.076 10.190 -14.765 1485 H TYR 96 H TYR 96 -10.807 6.921 -12.414 1486 HA TYR 96 HA TYR 96 -11.812 8.748 -10.370 1487 1HB TYR 96 1HB TYR 96 -13.561 7.007 -9.749 1488 2HB TYR 96 2HB TYR 96 -13.876 7.939 -11.208 1489 HD1 TYR 96 HD1 TYR 96 -13.545 6.886 -13.437 1490 HD2 TYR 96 HD2 TYR 96 -13.262 4.646 -9.832 1491 HE1 TYR 96 HE1 TYR 96 -13.794 4.802 -14.720 1492 HE2 TYR 96 HE2 TYR 96 -13.508 2.555 -11.104 1493 HH TYR 96 HH TYR 96 -14.432 1.811 -13.258 1494 H PHE 97 H PHE 97 -11.995 7.547 -8.211 1495 HA PHE 97 HA PHE 97 -9.724 5.684 -7.981 1496 1HB PHE 97 1HB PHE 97 -10.623 7.960 -6.253 1497 2HB PHE 97 2HB PHE 97 -9.758 6.611 -5.524 1498 HD1 PHE 97 HD1 PHE 97 -7.705 5.895 -7.324 1499 HD2 PHE 97 HD2 PHE 97 -9.250 9.773 -6.497 1500 HE1 PHE 97 HE1 PHE 97 -5.565 6.891 -8.017 1501 HE2 PHE 97 HE2 PHE 97 -7.113 10.776 -7.189 1502 HZ PHE 97 HZ PHE 97 -5.267 9.335 -7.952 1503 H LEU 98 H LEU 98 -10.445 3.685 -7.669 1504 HA LEU 98 HA LEU 98 -13.008 3.156 -6.472 1505 1HB LEU 98 1HB LEU 98 -11.511 1.851 -8.300 1506 2HB LEU 98 2HB LEU 98 -11.102 0.938 -6.849 1507 HG LEU 98 HG LEU 98 -13.983 1.383 -7.344 1508 1HD1 LEU 98 1HD1 LEU 98 -13.991 0.623 -9.429 1509 2HD1 LEU 98 2HD1 LEU 98 -13.400 -0.916 -8.803 1510 3HD1 LEU 98 3HD1 LEU 98 -12.258 0.296 -9.382 1511 1HD2 LEU 98 1HD2 LEU 98 -12.788 0.018 -5.492 1512 2HD2 LEU 98 2HD2 LEU 98 -12.603 -1.204 -6.750 1513 3HD2 LEU 98 3HD2 LEU 98 -14.214 -0.659 -6.280 1514 H ILE 99 H ILE 99 -13.442 2.314 -4.480 1515 HA ILE 99 HA ILE 99 -11.171 1.827 -2.679 1516 HB ILE 99 HB ILE 99 -13.625 3.446 -1.985 1517 1HG1 ILE 99 1HG1 ILE 99 -10.831 4.469 -1.751 1518 2HG1 ILE 99 2HG1 ILE 99 -11.559 4.399 -3.352 1519 1HG2 ILE 99 1HG2 ILE 99 -12.535 3.753 0.202 1520 2HG2 ILE 99 2HG2 ILE 99 -12.946 2.069 -0.115 1521 3HG2 ILE 99 3HG2 ILE 99 -11.278 2.615 -0.285 1522 1HD1 ILE 99 1HD1 ILE 99 -11.752 6.575 -2.039 1523 2HD1 ILE 99 2HD1 ILE 99 -13.215 5.938 -2.791 1524 3HD1 ILE 99 3HD1 ILE 99 -12.950 5.729 -1.060 1525 H VAL 100 H VAL 100 -11.357 -0.319 -2.390 1526 HA VAL 100 HA VAL 100 -14.006 -1.430 -1.766 1527 HB VAL 100 HB VAL 100 -11.470 -2.855 -2.583 1528 1HG1 VAL 100 1HG1 VAL 100 -12.650 -4.350 -1.202 1529 2HG1 VAL 100 2HG1 VAL 100 -14.210 -3.863 -1.869 1530 3HG1 VAL 100 3HG1 VAL 100 -13.083 -4.801 -2.850 1531 1HG2 VAL 100 1HG2 VAL 100 -13.459 -3.355 -4.447 1532 2HG2 VAL 100 2HG2 VAL 100 -13.630 -1.637 -4.085 1533 3HG2 VAL 100 3HG2 VAL 100 -12.082 -2.270 -4.646 1534 H ILE 101 H ILE 101 -14.424 -1.571 0.333 1535 HA ILE 101 HA ILE 101 -12.214 -2.219 2.171 1536 HB ILE 101 HB ILE 101 -14.808 -0.800 2.790 1537 1HG1 ILE 101 1HG1 ILE 101 -12.279 0.596 3.272 1538 2HG1 ILE 101 2HG1 ILE 101 -12.556 0.227 1.573 1539 1HG2 ILE 101 1HG2 ILE 101 -12.920 -0.456 4.845 1540 2HG2 ILE 101 2HG2 ILE 101 -14.439 -1.347 4.908 1541 3HG2 ILE 101 3HG2 ILE 101 -12.947 -2.179 4.469 1542 1HD1 ILE 101 1HD1 ILE 101 -13.447 2.365 1.919 1543 2HD1 ILE 101 2HD1 ILE 101 -14.839 1.282 1.872 1544 3HD1 ILE 101 3HD1 ILE 101 -14.241 1.883 3.418 1545 H GLN 102 H GLN 102 -12.293 -4.077 3.259 1546 HA GLN 102 HA GLN 102 -14.732 -5.314 4.074 1547 1HB GLN 102 1HB GLN 102 -14.678 -7.289 2.733 1548 2HB GLN 102 2HB GLN 102 -14.626 -5.914 1.639 1549 1HG GLN 102 1HG GLN 102 -12.181 -6.195 1.458 1550 2HG GLN 102 2HG GLN 102 -12.301 -7.632 2.472 1551 1HE2 GLN 102 1HE2 GLN 102 -11.978 -6.665 -0.596 1552 2HE2 GLN 102 2HE2 GLN 102 -12.718 -7.989 -1.423 1553 H ASN 103 H ASN 103 -14.263 -7.553 5.026 1554 HA ASN 103 HA ASN 103 -12.372 -7.354 7.024 1555 1HB ASN 103 1HB ASN 103 -13.986 -9.557 5.877 1556 2HB ASN 103 2HB ASN 103 -12.589 -10.041 6.833 1557 1HD2 ASN 103 1HD2 ASN 103 -15.765 -9.562 7.020 1558 2HD2 ASN 103 2HD2 ASN 103 -15.921 -9.091 8.675 1559 HA PRO 104 HA PRO 104 -8.444 -8.401 5.375 1560 1HB PRO 104 1HB PRO 104 -7.379 -9.956 7.329 1561 2HB PRO 104 2HB PRO 104 -7.602 -8.211 7.504 1562 1HG PRO 104 1HG PRO 104 -9.309 -10.451 8.520 1563 2HG PRO 104 2HG PRO 104 -8.811 -8.962 9.344 1564 1HD PRO 104 1HD PRO 104 -11.260 -9.259 8.227 1565 2HD PRO 104 2HD PRO 104 -10.426 -7.693 8.297 1566 H THR 105 H THR 105 -7.308 -9.976 4.257 1567 HA THR 105 HA THR 105 -8.696 -12.556 3.976 1568 HB THR 105 HB THR 105 -7.490 -12.704 1.770 1569 HG1 THR 105 HG1 THR 105 -6.794 -10.541 1.004 1570 1HG2 THR 105 1HG2 THR 105 -9.867 -11.598 2.342 1571 2HG2 THR 105 2HG2 THR 105 -9.227 -11.700 0.702 1572 3HG2 THR 105 3HG2 THR 105 -9.066 -10.203 1.620 1573 H GLU 106 H GLU 106 -5.569 -11.034 4.465 1574 HA GLU 106 HA GLU 106 -4.525 -13.575 5.444 1575 1HB GLU 106 1HB GLU 106 -3.933 -12.981 2.912 1576 2HB GLU 106 2HB GLU 106 -2.692 -12.014 3.696 1577 1HG GLU 106 1HG GLU 106 -2.530 -14.447 4.987 1578 2HG GLU 106 2HG GLU 106 -2.850 -14.881 3.309 Start of MODEL 10 1 H MET 11 H MET 11 17.660 -9.295 15.894 2 HA MET 11 HA MET 11 18.101 -8.462 13.178 3 1HB MET 11 1HB MET 11 20.004 -9.957 14.984 4 2HB MET 11 2HB MET 11 20.413 -8.998 13.568 5 1HG MET 11 1HG MET 11 19.229 -7.921 16.116 6 2HG MET 11 2HG MET 11 20.931 -7.849 15.666 7 1HE MET 11 1HE MET 11 21.466 -7.283 13.256 8 2HE MET 11 2HE MET 11 20.260 -6.649 12.136 9 3HE MET 11 3HE MET 11 21.356 -5.546 12.971 10 H ALA 12 H ALA 12 18.253 -11.568 14.910 11 HA ALA 12 HA ALA 12 18.946 -13.223 12.810 12 1HB ALA 12 1HB ALA 12 18.853 -14.638 14.518 13 2HB ALA 12 2HB ALA 12 17.822 -13.542 15.439 14 3HB ALA 12 3HB ALA 12 17.103 -14.690 14.311 15 H GLU 13 H GLU 13 15.749 -12.010 13.710 16 HA GLU 13 HA GLU 13 14.154 -13.529 12.041 17 1HB GLU 13 1HB GLU 13 13.772 -11.357 13.701 18 2HB GLU 13 2HB GLU 13 13.359 -10.717 12.116 19 1HG GLU 13 1HG GLU 13 12.054 -13.113 12.117 20 2HG GLU 13 2HG GLU 13 11.933 -12.621 13.806 21 H VAL 14 H VAL 14 15.690 -10.401 11.303 22 HA VAL 14 HA VAL 14 14.834 -10.286 8.619 23 HB VAL 14 HB VAL 14 17.321 -9.010 9.759 24 1HG1 VAL 14 1HG1 VAL 14 16.403 -9.074 7.170 25 2HG1 VAL 14 2HG1 VAL 14 15.758 -7.549 7.781 26 3HG1 VAL 14 3HG1 VAL 14 17.492 -7.864 7.848 27 1HG2 VAL 14 1HG2 VAL 14 15.843 -7.045 10.174 28 2HG2 VAL 14 2HG2 VAL 14 14.455 -8.075 9.824 29 3HG2 VAL 14 3HG2 VAL 14 15.495 -8.435 11.202 30 H GLU 15 H GLU 15 17.711 -11.633 10.146 31 HA GLU 15 HA GLU 15 19.177 -12.143 7.797 32 1HB GLU 15 1HB GLU 15 19.223 -13.430 10.524 33 2HB GLU 15 2HB GLU 15 20.336 -13.884 9.242 34 1HG GLU 15 1HG GLU 15 21.328 -11.737 9.215 35 2HG GLU 15 2HG GLU 15 20.060 -11.065 10.239 36 H GLU 16 H GLU 16 16.718 -13.990 9.504 37 HA GLU 16 HA GLU 16 17.044 -16.373 7.973 38 1HB GLU 16 1HB GLU 16 15.696 -15.706 10.278 39 2HB GLU 16 2HB GLU 16 14.387 -15.928 9.125 40 1HG GLU 16 1HG GLU 16 16.103 -18.088 8.712 41 2HG GLU 16 2HG GLU 16 16.004 -17.891 10.461 42 H THR 17 H THR 17 15.109 -13.473 7.654 43 HA THR 17 HA THR 17 13.461 -14.516 5.542 44 HB THR 17 HB THR 17 13.867 -11.702 6.564 45 HG1 THR 17 HG1 THR 17 12.613 -13.581 7.679 46 1HG2 THR 17 1HG2 THR 17 13.160 -11.235 4.426 47 2HG2 THR 17 2HG2 THR 17 11.607 -11.445 5.235 48 3HG2 THR 17 3HG2 THR 17 12.282 -12.756 4.268 49 H LEU 18 H LEU 18 16.516 -12.900 5.775 50 HA LEU 18 HA LEU 18 16.595 -11.965 3.071 51 1HB LEU 18 1HB LEU 18 18.111 -11.596 5.385 52 2HB LEU 18 2HB LEU 18 19.196 -12.392 4.247 53 HG LEU 18 HG LEU 18 18.496 -10.550 2.599 54 1HD1 LEU 18 1HD1 LEU 18 17.743 -9.166 5.166 55 2HD1 LEU 18 2HD1 LEU 18 16.581 -9.778 3.989 56 3HD1 LEU 18 3HD1 LEU 18 17.703 -8.496 3.535 57 1HD2 LEU 18 1HD2 LEU 18 20.290 -10.307 4.962 58 2HD2 LEU 18 2HD2 LEU 18 20.055 -8.899 3.926 59 3HD2 LEU 18 3HD2 LEU 18 20.687 -10.399 3.246 60 H LYS 19 H LYS 19 18.205 -14.639 4.790 61 HA LYS 19 HA LYS 19 19.463 -15.751 2.542 62 1HB LYS 19 1HB LYS 19 18.643 -16.879 5.206 63 2HB LYS 19 2HB LYS 19 19.402 -17.891 3.984 64 1HG LYS 19 1HG LYS 19 20.953 -15.534 4.241 65 2HG LYS 19 2HG LYS 19 20.623 -16.151 5.861 66 1HD LYS 19 1HD LYS 19 21.617 -17.910 3.631 67 2HD LYS 19 2HD LYS 19 22.709 -17.032 4.705 68 1HE LYS 19 1HE LYS 19 21.817 -18.179 6.626 69 2HE LYS 19 2HE LYS 19 20.584 -18.958 5.636 70 1HZ LYS 19 1HZ LYS 19 22.350 -20.497 6.042 71 2HZ LYS 19 2HZ LYS 19 23.515 -19.402 5.490 72 3HZ LYS 19 3HZ LYS 19 22.397 -20.064 4.407 73 H ARG 20 H ARG 20 16.199 -15.956 3.696 74 HA ARG 20 HA ARG 20 15.518 -18.267 2.113 75 1HB ARG 20 1HB ARG 20 14.392 -17.681 4.275 76 2HB ARG 20 2HB ARG 20 13.663 -16.302 3.463 77 1HG ARG 20 1HG ARG 20 11.971 -17.633 2.939 78 2HG ARG 20 2HG ARG 20 13.063 -18.464 1.830 79 1HD ARG 20 1HD ARG 20 13.777 -19.754 3.998 80 2HD ARG 20 2HD ARG 20 12.198 -19.228 4.580 81 HE ARG 20 HE ARG 20 11.896 -20.376 2.038 82 1HH1 ARG 20 1HH1 ARG 20 12.678 -21.280 5.307 83 2HH1 ARG 20 2HH1 ARG 20 12.056 -22.889 5.150 84 1HH2 ARG 20 1HH2 ARG 20 11.074 -22.492 1.818 85 2HH2 ARG 20 2HH2 ARG 20 11.145 -23.578 3.164 86 H LEU 21 H LEU 21 14.926 -14.773 1.946 87 HA LEU 21 HA LEU 21 13.407 -14.872 -0.448 88 1HB LEU 21 1HB LEU 21 14.628 -12.796 1.245 89 2HB LEU 21 2HB LEU 21 14.413 -12.361 -0.449 90 HG LEU 21 HG LEU 21 12.038 -12.685 -0.289 91 1HD1 LEU 21 1HD1 LEU 21 11.354 -14.304 1.089 92 2HD1 LEU 21 2HD1 LEU 21 11.393 -13.064 2.342 93 3HD1 LEU 21 3HD1 LEU 21 12.770 -14.145 2.130 94 1HD2 LEU 21 1HD2 LEU 21 13.017 -11.133 2.105 95 2HD2 LEU 21 2HD2 LEU 21 11.463 -10.940 1.292 96 3HD2 LEU 21 3HD2 LEU 21 12.957 -10.526 0.449 97 H GLN 22 H GLN 22 16.823 -14.190 0.222 98 HA GLN 22 HA GLN 22 17.688 -13.497 -2.300 99 1HB GLN 22 1HB GLN 22 18.913 -14.570 0.126 100 2HB GLN 22 2HB GLN 22 19.766 -15.041 -1.338 101 1HG GLN 22 1HG GLN 22 20.829 -13.088 -0.823 102 2HG GLN 22 2HG GLN 22 19.576 -12.505 -1.918 103 1HE2 GLN 22 1HE2 GLN 22 18.440 -10.837 -1.248 104 2HE2 GLN 22 2HE2 GLN 22 18.240 -10.332 0.392 105 H SER 23 H SER 23 16.916 -16.668 -1.033 106 HA SER 23 HA SER 23 18.049 -18.135 -3.204 107 1HB SER 23 1HB SER 23 17.018 -18.775 -0.703 108 2HB SER 23 2HB SER 23 15.863 -19.487 -1.829 109 HG SER 23 HG SER 23 17.287 -20.946 -2.309 110 H GLN 24 H GLN 24 14.893 -16.772 -2.501 111 HA GLN 24 HA GLN 24 13.354 -18.070 -4.418 112 1HB GLN 24 1HB GLN 24 13.145 -15.225 -3.418 113 2HB GLN 24 2HB GLN 24 11.901 -16.050 -4.347 114 1HG GLN 24 1HG GLN 24 11.684 -17.715 -2.563 115 2HG GLN 24 2HG GLN 24 12.910 -16.858 -1.629 116 1HE2 GLN 24 1HE2 GLN 24 12.197 -14.256 -2.018 117 2HE2 GLN 24 2HE2 GLN 24 10.647 -13.959 -1.315 118 H LYS 25 H LYS 25 12.657 -17.430 -6.516 119 HA LYS 25 HA LYS 25 14.779 -16.114 -8.042 120 1HB LYS 25 1HB LYS 25 13.125 -18.367 -8.506 121 2HB LYS 25 2HB LYS 25 12.682 -17.153 -9.700 122 1HG LYS 25 1HG LYS 25 15.475 -17.157 -9.646 123 2HG LYS 25 2HG LYS 25 14.993 -18.854 -9.593 124 1HD LYS 25 1HD LYS 25 15.215 -18.215 -11.890 125 2HD LYS 25 2HD LYS 25 13.496 -18.414 -11.542 126 1HE LYS 25 1HE LYS 25 13.070 -16.163 -11.680 127 2HE LYS 25 2HE LYS 25 14.715 -15.714 -11.233 128 1HZ LYS 25 1HZ LYS 25 13.905 -16.879 -13.842 129 2HZ LYS 25 2HZ LYS 25 15.470 -16.403 -13.412 130 3HZ LYS 25 3HZ LYS 25 14.246 -15.245 -13.564 131 H GLY 26 H GLY 26 14.556 -14.024 -8.474 132 1HA GLY 26 1HA GLY 26 13.131 -12.507 -9.889 133 2HA GLY 26 2HA GLY 26 11.821 -12.955 -8.807 134 H VAL 27 H VAL 27 13.796 -12.937 -6.519 135 HA VAL 27 HA VAL 27 13.222 -10.452 -5.459 136 HB VAL 27 HB VAL 27 15.639 -12.152 -4.825 137 1HG1 VAL 27 1HG1 VAL 27 16.057 -10.109 -3.800 138 2HG1 VAL 27 2HG1 VAL 27 14.351 -9.824 -3.449 139 3HG1 VAL 27 3HG1 VAL 27 15.251 -11.033 -2.533 140 1HG2 VAL 27 1HG2 VAL 27 13.876 -12.623 -2.834 141 2HG2 VAL 27 2HG2 VAL 27 12.773 -12.407 -4.193 142 3HG2 VAL 27 3HG2 VAL 27 14.034 -13.637 -4.268 143 H GLN 28 H GLN 28 13.983 -8.455 -5.734 144 HA GLN 28 HA GLN 28 16.229 -8.064 -7.557 145 1HB GLN 28 1HB GLN 28 13.823 -6.576 -6.859 146 2HB GLN 28 2HB GLN 28 15.257 -5.558 -6.881 147 1HG GLN 28 1HG GLN 28 15.191 -5.471 -9.085 148 2HG GLN 28 2HG GLN 28 15.305 -7.228 -9.179 149 1HE2 GLN 28 1HE2 GLN 28 13.210 -8.391 -8.794 150 2HE2 GLN 28 2HE2 GLN 28 11.793 -7.710 -9.510 151 H GLY 29 H GLY 29 15.323 -7.590 -4.221 152 1HA GLY 29 1HA GLY 29 17.782 -7.580 -3.096 153 2HA GLY 29 2HA GLY 29 17.597 -5.912 -3.618 154 H ILE 30 H ILE 30 17.749 -7.216 -0.913 155 HA ILE 30 HA ILE 30 15.179 -6.280 0.174 156 HB ILE 30 HB ILE 30 17.175 -7.953 1.677 157 1HG1 ILE 30 1HG1 ILE 30 14.873 -8.924 -0.031 158 2HG1 ILE 30 2HG1 ILE 30 16.583 -9.165 -0.373 159 1HG2 ILE 30 1HG2 ILE 30 14.192 -7.724 2.011 160 2HG2 ILE 30 2HG2 ILE 30 15.351 -8.459 3.117 161 3HG2 ILE 30 3HG2 ILE 30 15.350 -6.712 2.874 162 1HD1 ILE 30 1HD1 ILE 30 15.904 -11.186 0.531 163 2HD1 ILE 30 2HD1 ILE 30 16.651 -10.358 1.898 164 3HD1 ILE 30 3HD1 ILE 30 14.895 -10.414 1.753 165 H ILE 31 H ILE 31 15.117 -4.611 1.567 166 HA ILE 31 HA ILE 31 17.689 -3.502 2.485 167 HB ILE 31 HB ILE 31 15.223 -1.962 1.669 168 1HG1 ILE 31 1HG1 ILE 31 17.884 -1.583 0.388 169 2HG1 ILE 31 2HG1 ILE 31 16.980 -3.033 -0.034 170 1HG2 ILE 31 1HG2 ILE 31 17.809 -1.120 2.932 171 2HG2 ILE 31 2HG2 ILE 31 16.845 -0.000 1.971 172 3HG2 ILE 31 3HG2 ILE 31 16.160 -0.734 3.422 173 1HD1 ILE 31 1HD1 ILE 31 16.652 -0.365 -0.978 174 2HD1 ILE 31 2HD1 ILE 31 15.842 -1.841 -1.502 175 3HD1 ILE 31 3HD1 ILE 31 15.171 -0.889 -0.179 176 H VAL 32 H VAL 32 17.805 -2.720 4.565 177 HA VAL 32 HA VAL 32 15.398 -2.971 6.236 178 HB VAL 32 HB VAL 32 18.078 -3.825 7.282 179 1HG1 VAL 32 1HG1 VAL 32 16.742 -5.037 8.901 180 2HG1 VAL 32 2HG1 VAL 32 16.252 -3.342 8.863 181 3HG1 VAL 32 3HG1 VAL 32 15.262 -4.566 8.067 182 1HG2 VAL 32 1HG2 VAL 32 17.719 -5.212 5.337 183 2HG2 VAL 32 2HG2 VAL 32 17.439 -6.164 6.796 184 3HG2 VAL 32 3HG2 VAL 32 16.071 -5.567 5.855 185 H VAL 33 H VAL 33 15.019 -1.181 7.353 186 HA VAL 33 HA VAL 33 17.289 0.589 7.992 187 HB VAL 33 HB VAL 33 14.475 1.549 7.497 188 1HG1 VAL 33 1HG1 VAL 33 15.826 3.694 7.053 189 2HG1 VAL 33 2HG1 VAL 33 15.618 3.167 8.724 190 3HG1 VAL 33 3HG1 VAL 33 17.140 2.864 7.886 191 1HG2 VAL 33 1HG2 VAL 33 15.997 2.404 5.361 192 2HG2 VAL 33 2HG2 VAL 33 16.504 0.729 5.581 193 3HG2 VAL 33 3HG2 VAL 33 14.800 1.108 5.331 194 H ASN 34 H ASN 34 17.389 1.456 10.021 195 HA ASN 34 HA ASN 34 15.675 0.224 12.020 196 1HB ASN 34 1HB ASN 34 17.266 1.299 13.637 197 2HB ASN 34 2HB ASN 34 18.030 0.188 12.503 198 1HD2 ASN 34 1HD2 ASN 34 20.003 1.276 12.993 199 2HD2 ASN 34 2HD2 ASN 34 20.384 2.776 12.225 200 H THR 35 H THR 35 15.472 1.942 14.029 201 HA THR 35 HA THR 35 13.388 3.674 13.243 202 HB THR 35 HB THR 35 14.362 4.558 15.748 203 HG1 THR 35 HG1 THR 35 15.010 2.782 16.762 204 1HG2 THR 35 1HG2 THR 35 12.231 2.475 15.413 205 2HG2 THR 35 2HG2 THR 35 11.987 4.119 14.823 206 3HG2 THR 35 3HG2 THR 35 12.292 3.833 16.536 207 H GLU 36 H GLU 36 16.818 4.131 13.639 208 HA GLU 36 HA GLU 36 16.759 6.980 13.760 209 1HB GLU 36 1HB GLU 36 18.846 4.888 13.452 210 2HB GLU 36 2HB GLU 36 19.250 6.506 12.897 211 1HG GLU 36 1HG GLU 36 18.195 7.061 15.321 212 2HG GLU 36 2HG GLU 36 18.900 5.473 15.621 213 H GLY 37 H GLY 37 16.651 4.645 11.206 214 1HA GLY 37 1HA GLY 37 15.789 5.307 9.056 215 2HA GLY 37 2HA GLY 37 16.590 6.858 9.262 216 H ILE 38 H ILE 38 18.744 4.662 10.352 217 HA ILE 38 HA ILE 38 20.288 4.805 7.905 218 HB ILE 38 HB ILE 38 21.020 3.564 10.559 219 1HG1 ILE 38 1HG1 ILE 38 21.781 6.265 9.431 220 2HG1 ILE 38 2HG1 ILE 38 20.547 6.010 10.660 221 1HG2 ILE 38 1HG2 ILE 38 23.302 3.626 9.759 222 2HG2 ILE 38 2HG2 ILE 38 22.300 2.706 8.637 223 3HG2 ILE 38 3HG2 ILE 38 22.778 4.357 8.242 224 1HD1 ILE 38 1HD1 ILE 38 22.618 4.764 11.822 225 2HD1 ILE 38 2HD1 ILE 38 23.478 5.984 10.881 226 3HD1 ILE 38 3HD1 ILE 38 22.249 6.474 12.047 227 HA PRO 39 HA PRO 39 19.097 0.791 6.479 228 1HB PRO 39 1HB PRO 39 21.028 0.507 4.593 229 2HB PRO 39 2HB PRO 39 19.625 1.560 4.379 230 1HG PRO 39 1HG PRO 39 22.416 2.267 5.198 231 2HG PRO 39 2HG PRO 39 21.338 3.100 4.062 232 1HD PRO 39 1HD PRO 39 21.708 3.947 6.607 233 2HD PRO 39 2HD PRO 39 20.168 4.150 5.747 234 H ILE 40 H ILE 40 19.717 -0.200 8.540 235 HA ILE 40 HA ILE 40 22.237 -0.952 9.339 236 HB ILE 40 HB ILE 40 21.056 -3.032 10.305 237 1HG1 ILE 40 1HG1 ILE 40 18.599 -1.481 9.484 238 2HG1 ILE 40 2HG1 ILE 40 19.190 -2.879 8.593 239 1HG2 ILE 40 1HG2 ILE 40 21.458 -1.353 11.830 240 2HG2 ILE 40 2HG2 ILE 40 20.487 -0.175 10.948 241 3HG2 ILE 40 3HG2 ILE 40 19.698 -1.452 11.874 242 1HD1 ILE 40 1HD1 ILE 40 17.426 -2.877 10.729 243 2HD1 ILE 40 2HD1 ILE 40 18.230 -4.276 10.016 244 3HD1 ILE 40 3HD1 ILE 40 18.947 -3.460 11.405 245 H LYS 41 H LYS 41 20.158 -2.484 6.943 246 HA LYS 41 HA LYS 41 22.462 -3.906 5.881 247 1HB LYS 41 1HB LYS 41 20.822 -5.255 7.608 248 2HB LYS 41 2HB LYS 41 20.087 -5.631 6.056 249 1HG LYS 41 1HG LYS 41 22.426 -6.288 5.293 250 2HG LYS 41 2HG LYS 41 22.866 -6.241 7.001 251 1HD LYS 41 1HD LYS 41 20.511 -7.711 6.935 252 2HD LYS 41 2HD LYS 41 21.408 -8.258 5.517 253 1HE LYS 41 1HE LYS 41 22.276 -9.668 7.089 254 2HE LYS 41 2HE LYS 41 23.406 -8.323 7.240 255 1HZ LYS 41 1HZ LYS 41 22.818 -8.788 9.414 256 2HZ LYS 41 2HZ LYS 41 21.196 -9.086 9.037 257 3HZ LYS 41 3HZ LYS 41 21.788 -7.501 9.031 258 H SER 42 H SER 42 22.236 -4.523 3.707 259 HA SER 42 HA SER 42 19.797 -4.224 2.268 260 1HB SER 42 1HB SER 42 20.472 -1.819 2.697 261 2HB SER 42 2HB SER 42 21.885 -2.117 1.685 262 HG SER 42 HG SER 42 20.060 -2.948 0.178 263 H THR 43 H THR 43 19.926 -5.062 0.207 264 HA THR 43 HA THR 43 22.522 -6.259 -0.494 265 HB THR 43 HB THR 43 21.351 -7.993 -1.660 266 HG1 THR 43 HG1 THR 43 19.627 -6.839 -2.540 267 1HG2 THR 43 1HG2 THR 43 20.938 -9.085 0.240 268 2HG2 THR 43 2HG2 THR 43 19.500 -8.111 0.544 269 3HG2 THR 43 3HG2 THR 43 21.078 -7.548 1.094 270 H MET 44 H MET 44 20.104 -4.048 -1.514 271 HA MET 44 HA MET 44 20.505 -4.126 -4.303 272 1HB MET 44 1HB MET 44 19.702 -1.728 -2.651 273 2HB MET 44 2HB MET 44 19.389 -1.984 -4.362 274 1HG MET 44 1HG MET 44 18.332 -4.170 -2.846 275 2HG MET 44 2HG MET 44 17.750 -2.642 -2.189 276 1HE MET 44 1HE MET 44 17.278 -3.934 -6.575 277 2HE MET 44 2HE MET 44 18.574 -2.817 -6.146 278 3HE MET 44 3HE MET 44 18.544 -4.441 -5.456 279 H ASP 45 H ASP 45 21.141 -1.620 -5.144 280 HA ASP 45 HA ASP 45 24.004 -1.636 -4.889 281 1HB ASP 45 1HB ASP 45 22.142 -0.734 -6.803 282 2HB ASP 45 2HB ASP 45 23.008 0.697 -6.252 283 H ASN 46 H ASN 46 25.071 0.658 -4.733 284 HA ASN 46 HA ASN 46 24.706 1.549 -2.086 285 1HB ASN 46 1HB ASN 46 26.603 1.923 -4.136 286 2HB ASN 46 2HB ASN 46 26.042 3.533 -3.694 287 1HD2 ASN 46 1HD2 ASN 46 25.534 3.194 -1.015 288 2HD2 ASN 46 2HD2 ASN 46 27.018 2.886 -0.185 289 HA PRO 47 HA PRO 47 22.726 5.514 -4.017 290 1HB PRO 47 1HB PRO 47 22.060 5.414 -6.647 291 2HB PRO 47 2HB PRO 47 23.641 5.961 -6.077 292 1HG PRO 47 1HG PRO 47 22.839 3.288 -7.159 293 2HG PRO 47 2HG PRO 47 24.296 4.241 -7.497 294 1HD PRO 47 1HD PRO 47 24.288 2.155 -5.770 295 2HD PRO 47 2HD PRO 47 25.338 3.570 -5.554 296 H THR 48 H THR 48 21.723 2.340 -5.080 297 HA THR 48 HA THR 48 18.942 3.016 -5.342 298 HB THR 48 HB THR 48 20.187 0.271 -5.098 299 HG1 THR 48 HG1 THR 48 19.982 0.359 -7.449 300 1HG2 THR 48 1HG2 THR 48 17.938 -0.123 -4.820 301 2HG2 THR 48 2HG2 THR 48 18.054 -0.170 -6.579 302 3HG2 THR 48 3HG2 THR 48 17.463 1.283 -5.773 303 H THR 49 H THR 49 21.027 1.793 -2.823 304 HA THR 49 HA THR 49 18.876 0.979 -1.094 305 HB THR 49 HB THR 49 21.823 1.368 -0.542 306 HG1 THR 49 HG1 THR 49 21.992 -0.670 -1.129 307 1HG2 THR 49 1HG2 THR 49 21.403 0.108 1.534 308 2HG2 THR 49 2HG2 THR 49 19.673 0.153 1.198 309 3HG2 THR 49 3HG2 THR 49 20.550 1.650 1.514 310 H THR 50 H THR 50 21.208 3.668 -1.122 311 HA THR 50 HA THR 50 20.368 4.980 1.172 312 HB THR 50 HB THR 50 21.165 6.587 -1.226 313 HG1 THR 50 HG1 THR 50 23.173 5.778 -1.210 314 1HG2 THR 50 1HG2 THR 50 21.856 6.657 1.712 315 2HG2 THR 50 2HG2 THR 50 20.825 7.787 0.833 316 3HG2 THR 50 3HG2 THR 50 22.555 7.729 0.499 317 H GLN 51 H GLN 51 18.993 4.997 -2.056 318 HA GLN 51 HA GLN 51 17.204 7.173 -1.592 319 1HB GLN 51 1HB GLN 51 17.806 6.683 -3.854 320 2HB GLN 51 2HB GLN 51 17.288 5.010 -3.694 321 1HG GLN 51 1HG GLN 51 15.107 6.760 -3.084 322 2HG GLN 51 2HG GLN 51 15.809 7.192 -4.642 323 1HE2 GLN 51 1HE2 GLN 51 13.811 5.045 -2.963 324 2HE2 GLN 51 2HE2 GLN 51 13.525 3.922 -4.244 325 H TYR 52 H TYR 52 16.725 3.648 -1.803 326 HA TYR 52 HA TYR 52 14.009 3.631 -1.150 327 1HB TYR 52 1HB TYR 52 16.206 1.602 -0.967 328 2HB TYR 52 2HB TYR 52 14.632 1.240 -0.267 329 HD1 TYR 52 HD1 TYR 52 12.719 2.296 -2.121 330 HD2 TYR 52 HD2 TYR 52 16.451 0.421 -2.935 331 HE1 TYR 52 HE1 TYR 52 11.888 1.616 -4.334 332 HE2 TYR 52 HE2 TYR 52 15.631 -0.263 -5.150 333 HH TYR 52 HH TYR 52 13.992 0.122 -6.707 334 H ALA 53 H ALA 53 16.864 3.758 0.877 335 HA ALA 53 HA ALA 53 15.805 3.073 3.344 336 1HB ALA 53 1HB ALA 53 18.188 3.455 2.956 337 2HB ALA 53 2HB ALA 53 17.884 5.183 2.774 338 3HB ALA 53 3HB ALA 53 17.601 4.397 4.327 339 H SER 54 H SER 54 16.092 6.361 1.981 340 HA SER 54 HA SER 54 14.441 7.482 4.049 341 1HB SER 54 1HB SER 54 15.956 8.505 1.714 342 2HB SER 54 2HB SER 54 14.560 9.460 2.216 343 HG SER 54 HG SER 54 16.767 9.816 3.235 344 H LEU 55 H LEU 55 14.056 6.828 0.581 345 HA LEU 55 HA LEU 55 11.548 7.880 0.158 346 1HB LEU 55 1HB LEU 55 13.169 6.724 -1.469 347 2HB LEU 55 2HB LEU 55 12.355 5.233 -0.999 348 HG LEU 55 HG LEU 55 11.528 6.186 -3.127 349 1HD1 LEU 55 1HD1 LEU 55 10.125 4.980 -1.174 350 2HD1 LEU 55 2HD1 LEU 55 9.444 5.427 -2.739 351 3HD1 LEU 55 3HD1 LEU 55 9.204 6.475 -1.341 352 1HD2 LEU 55 1HD2 LEU 55 10.430 8.409 -1.413 353 2HD2 LEU 55 2HD2 LEU 55 10.241 8.211 -3.156 354 3HD2 LEU 55 3HD2 LEU 55 11.830 8.567 -2.475 355 H MET 56 H MET 56 12.370 4.654 1.392 356 HA MET 56 HA MET 56 9.635 3.872 1.712 357 1HB MET 56 1HB MET 56 12.189 2.682 2.806 358 2HB MET 56 2HB MET 56 10.603 1.939 2.955 359 1HG MET 56 1HG MET 56 11.987 2.560 0.356 360 2HG MET 56 2HG MET 56 11.946 0.982 1.137 361 1HE MET 56 1HE MET 56 10.913 2.942 -1.429 362 2HE MET 56 2HE MET 56 10.547 1.350 -2.092 363 3HE MET 56 3HE MET 56 9.263 2.545 -1.907 364 H HIS 57 H HIS 57 12.201 4.951 3.914 365 HA HIS 57 HA HIS 57 10.894 4.680 6.332 366 1HB HIS 57 1HB HIS 57 13.257 5.329 6.126 367 2HB HIS 57 2HB HIS 57 12.772 6.905 5.507 368 HD1 HIS 57 HD1 HIS 57 11.315 5.117 8.515 369 HD2 HIS 57 HD2 HIS 57 13.526 8.508 7.580 370 HE1 HIS 57 HE1 HIS 57 11.506 6.409 10.664 371 H SER 58 H SER 58 10.929 7.554 4.224 372 HA SER 58 HA SER 58 9.061 9.002 5.799 373 1HB SER 58 1HB SER 58 10.490 10.289 4.407 374 2HB SER 58 2HB SER 58 10.078 9.341 2.978 375 HG SER 58 HG SER 58 8.669 10.866 2.656 376 H PHE 59 H PHE 59 8.779 6.853 3.036 377 HA PHE 59 HA PHE 59 6.192 7.375 2.214 378 1HB PHE 59 1HB PHE 59 7.548 5.861 0.948 379 2HB PHE 59 2HB PHE 59 7.714 4.769 2.319 380 HD1 PHE 59 HD1 PHE 59 4.884 6.377 0.485 381 HD2 PHE 59 HD2 PHE 59 6.563 2.809 2.087 382 HE1 PHE 59 HE1 PHE 59 2.926 5.109 -0.297 383 HE2 PHE 59 HE2 PHE 59 4.609 1.535 1.307 384 HZ PHE 59 HZ PHE 59 2.787 2.684 0.112 385 H ILE 60 H ILE 60 7.207 4.928 4.603 386 HA ILE 60 HA ILE 60 4.692 4.054 5.367 387 HB ILE 60 HB ILE 60 7.137 4.319 7.120 388 1HG1 ILE 60 1HG1 ILE 60 7.520 3.001 5.067 389 2HG1 ILE 60 2HG1 ILE 60 7.581 1.996 6.511 390 1HG2 ILE 60 1HG2 ILE 60 4.466 3.461 7.700 391 2HG2 ILE 60 2HG2 ILE 60 5.579 2.104 7.864 392 3HG2 ILE 60 3HG2 ILE 60 5.856 3.586 8.778 393 1HD1 ILE 60 1HD1 ILE 60 4.912 2.033 5.509 394 2HD1 ILE 60 2HD1 ILE 60 6.028 1.626 4.205 395 3HD1 ILE 60 3HD1 ILE 60 6.020 0.673 5.688 396 H LEU 61 H LEU 61 6.596 6.750 6.666 397 HA LEU 61 HA LEU 61 4.916 7.483 8.759 398 1HB LEU 61 1HB LEU 61 7.170 8.568 7.400 399 2HB LEU 61 2HB LEU 61 5.969 9.844 7.595 400 HG LEU 61 HG LEU 61 5.983 9.543 9.994 401 1HD1 LEU 61 1HD1 LEU 61 7.867 7.271 9.408 402 2HD1 LEU 61 2HD1 LEU 61 6.305 7.202 10.224 403 3HD1 LEU 61 3HD1 LEU 61 7.674 7.992 11.006 404 1HD2 LEU 61 1HD2 LEU 61 7.938 10.651 10.378 405 2HD2 LEU 61 2HD2 LEU 61 7.870 10.790 8.621 406 3HD2 LEU 61 3HD2 LEU 61 8.887 9.559 9.370 407 H LYS 62 H LYS 62 4.842 8.436 5.351 408 HA LYS 62 HA LYS 62 2.828 10.355 5.482 409 1HB LYS 62 1HB LYS 62 4.301 9.104 3.470 410 2HB LYS 62 2HB LYS 62 2.627 8.724 3.088 411 1HG LYS 62 1HG LYS 62 3.178 10.716 1.933 412 2HG LYS 62 2HG LYS 62 2.124 11.171 3.275 413 1HD LYS 62 1HD LYS 62 3.673 12.634 3.915 414 2HD LYS 62 2HD LYS 62 4.739 11.275 4.284 415 1HE LYS 62 1HE LYS 62 5.481 11.311 1.901 416 2HE LYS 62 2HE LYS 62 4.534 12.782 1.680 417 1HZ LYS 62 1HZ LYS 62 5.880 13.787 3.486 418 2HZ LYS 62 2HZ LYS 62 6.779 13.394 2.108 419 3HZ LYS 62 3HZ LYS 62 6.863 12.409 3.481 420 H ALA 63 H ALA 63 2.519 6.877 4.766 421 HA ALA 63 HA ALA 63 -0.319 6.905 4.719 422 1HB ALA 63 1HB ALA 63 1.241 5.187 3.672 423 2HB ALA 63 2HB ALA 63 1.359 4.478 5.283 424 3HB ALA 63 3HB ALA 63 -0.205 4.573 4.473 425 H ARG 64 H ARG 64 2.024 6.682 7.254 426 HA ARG 64 HA ARG 64 0.487 5.391 9.222 427 1HB ARG 64 1HB ARG 64 3.017 6.056 9.179 428 2HB ARG 64 2HB ARG 64 2.448 7.549 9.914 429 1HG ARG 64 1HG ARG 64 1.209 5.701 11.464 430 2HG ARG 64 2HG ARG 64 2.708 4.864 11.054 431 1HD ARG 64 1HD ARG 64 2.937 6.151 13.120 432 2HD ARG 64 2HD ARG 64 4.004 6.762 11.857 433 HE ARG 64 HE ARG 64 1.838 8.331 11.591 434 1HH1 ARG 64 1HH1 ARG 64 3.752 7.421 14.352 435 2HH1 ARG 64 2HH1 ARG 64 3.465 8.902 15.204 436 1HH2 ARG 64 1HH2 ARG 64 1.452 10.286 12.702 437 2HH2 ARG 64 2HH2 ARG 64 2.156 10.531 14.264 438 H SER 65 H SER 65 0.664 8.747 8.194 439 HA SER 65 HA SER 65 -0.979 9.713 10.349 440 1HB SER 65 1HB SER 65 0.808 10.961 8.814 441 2HB SER 65 2HB SER 65 -0.629 11.302 7.851 442 HG SER 65 HG SER 65 -0.442 11.811 10.634 443 H THR 66 H THR 66 -1.439 8.832 6.971 444 HA THR 66 HA THR 66 -4.120 9.754 6.774 445 HB THR 66 HB THR 66 -3.613 7.535 5.004 446 HG1 THR 66 HG1 THR 66 -1.622 9.578 5.042 447 1HG2 THR 66 1HG2 THR 66 -5.100 9.584 4.715 448 2HG2 THR 66 2HG2 THR 66 -4.126 9.112 3.321 449 3HG2 THR 66 3HG2 THR 66 -3.624 10.469 4.330 450 H VAL 67 H VAL 67 -2.680 6.582 7.443 451 HA VAL 67 HA VAL 67 -4.957 5.016 7.480 452 HB VAL 67 HB VAL 67 -2.434 4.843 9.113 453 1HG1 VAL 67 1HG1 VAL 67 -3.628 3.591 10.554 454 2HG1 VAL 67 2HG1 VAL 67 -4.941 3.329 9.403 455 3HG1 VAL 67 3HG1 VAL 67 -3.472 2.356 9.305 456 1HG2 VAL 67 1HG2 VAL 67 -1.624 3.595 7.438 457 2HG2 VAL 67 2HG2 VAL 67 -3.136 2.710 7.239 458 3HG2 VAL 67 3HG2 VAL 67 -2.932 4.289 6.481 459 H ARG 68 H ARG 68 -3.413 6.397 10.389 460 HA ARG 68 HA ARG 68 -5.513 5.842 12.139 461 1HB ARG 68 1HB ARG 68 -4.446 7.311 13.686 462 2HB ARG 68 2HB ARG 68 -3.173 6.524 12.762 463 1HG ARG 68 1HG ARG 68 -2.349 8.499 12.217 464 2HG ARG 68 2HG ARG 68 -3.864 8.916 11.414 465 1HD ARG 68 1HD ARG 68 -3.120 9.381 14.295 466 2HD ARG 68 2HD ARG 68 -3.406 10.597 13.051 467 HE ARG 68 HE ARG 68 -5.657 8.873 13.582 468 1HH1 ARG 68 1HH1 ARG 68 -4.014 11.824 14.423 469 2HH1 ARG 68 2HH1 ARG 68 -5.427 12.575 15.088 470 1HH2 ARG 68 1HH2 ARG 68 -7.524 9.850 14.454 471 2HH2 ARG 68 2HH2 ARG 68 -7.423 11.450 15.106 472 H ASP 69 H ASP 69 -5.232 8.243 9.712 473 HA ASP 69 HA ASP 69 -7.011 10.173 10.803 474 1HB ASP 69 1HB ASP 69 -5.432 9.892 8.454 475 2HB ASP 69 2HB ASP 69 -7.085 10.226 7.946 476 H ILE 70 H ILE 70 -7.445 7.170 9.149 477 HA ILE 70 HA ILE 70 -10.071 7.604 8.174 478 HB ILE 70 HB ILE 70 -8.729 4.999 8.905 479 1HG1 ILE 70 1HG1 ILE 70 -9.065 6.034 6.114 480 2HG1 ILE 70 2HG1 ILE 70 -7.732 6.625 7.100 481 1HG2 ILE 70 1HG2 ILE 70 -11.118 4.714 8.781 482 2HG2 ILE 70 2HG2 ILE 70 -11.176 5.572 7.242 483 3HG2 ILE 70 3HG2 ILE 70 -10.376 4.004 7.347 484 1HD1 ILE 70 1HD1 ILE 70 -6.777 4.874 5.952 485 2HD1 ILE 70 2HD1 ILE 70 -7.233 4.114 7.477 486 3HD1 ILE 70 3HD1 ILE 70 -8.232 3.882 6.043 487 H ASP 71 H ASP 71 -8.833 6.070 11.130 488 HA ASP 71 HA ASP 71 -11.317 6.733 12.489 489 1HB ASP 71 1HB ASP 71 -10.456 3.961 11.837 490 2HB ASP 71 2HB ASP 71 -11.130 4.241 13.441 491 HA PRO 72 HA PRO 72 -8.728 7.395 15.965 492 1HB PRO 72 1HB PRO 72 -10.296 6.595 18.031 493 2HB PRO 72 2HB PRO 72 -10.598 8.075 17.113 494 1HG PRO 72 1HG PRO 72 -11.893 5.388 16.855 495 2HG PRO 72 2HG PRO 72 -12.639 6.996 16.827 496 1HD PRO 72 1HD PRO 72 -12.131 5.586 14.572 497 2HD PRO 72 2HD PRO 72 -12.070 7.360 14.623 498 H GLN 73 H GLN 73 -9.724 4.249 15.144 499 HA GLN 73 HA GLN 73 -7.583 3.124 16.807 500 1HB GLN 73 1HB GLN 73 -10.344 1.944 16.459 501 2HB GLN 73 2HB GLN 73 -8.991 1.119 17.222 502 1HG GLN 73 1HG GLN 73 -8.918 3.113 18.821 503 2HG GLN 73 2HG GLN 73 -10.518 3.504 18.192 504 1HE2 GLN 73 1HE2 GLN 73 -11.428 3.167 20.237 505 2HE2 GLN 73 2HE2 GLN 73 -11.677 1.578 20.867 506 H ASN 74 H ASN 74 -6.118 2.307 15.476 507 HA ASN 74 HA ASN 74 -6.646 0.269 13.631 508 1HB ASN 74 1HB ASN 74 -7.470 2.593 12.534 509 2HB ASN 74 2HB ASN 74 -5.780 2.615 12.039 510 1HD2 ASN 74 1HD2 ASN 74 -8.200 0.043 12.383 511 2HD2 ASN 74 2HD2 ASN 74 -8.031 -0.564 10.774 512 H ASP 75 H ASP 75 -4.719 -0.388 12.424 513 HA ASP 75 HA ASP 75 -2.218 0.884 13.208 514 1HB ASP 75 1HB ASP 75 -3.190 -1.313 14.636 515 2HB ASP 75 2HB ASP 75 -1.985 -1.988 13.544 516 H LEU 76 H LEU 76 -0.322 -0.334 12.155 517 HA LEU 76 HA LEU 76 -1.153 -1.199 9.463 518 1HB LEU 76 1HB LEU 76 1.146 0.489 10.384 519 2HB LEU 76 2HB LEU 76 1.206 -0.365 8.844 520 HG LEU 76 HG LEU 76 0.565 1.919 8.462 521 1HD1 LEU 76 1HD1 LEU 76 -2.091 0.702 8.148 522 2HD1 LEU 76 2HD1 LEU 76 -0.751 -0.228 7.478 523 3HD1 LEU 76 3HD1 LEU 76 -1.022 1.433 6.949 524 1HD2 LEU 76 1HD2 LEU 76 -0.376 2.186 10.818 525 2HD2 LEU 76 2HD2 LEU 76 -1.873 1.514 10.171 526 3HD2 LEU 76 3HD2 LEU 76 -1.222 3.016 9.513 527 H THR 77 H THR 77 -0.523 -3.152 8.811 528 HA THR 77 HA THR 77 1.625 -4.499 10.318 529 HB THR 77 HB THR 77 -0.323 -5.648 10.964 530 HG1 THR 77 HG1 THR 77 0.688 -7.434 10.473 531 1HG2 THR 77 1HG2 THR 77 -2.076 -4.958 9.647 532 2HG2 THR 77 2HG2 THR 77 -1.825 -6.582 9.008 533 3HG2 THR 77 3HG2 THR 77 -1.180 -5.186 8.146 534 H PHE 78 H PHE 78 0.104 -3.932 7.218 535 HA PHE 78 HA PHE 78 2.544 -4.855 5.898 536 1HB PHE 78 1HB PHE 78 0.517 -6.581 5.954 537 2HB PHE 78 2HB PHE 78 -0.033 -5.601 4.599 538 HD1 PHE 78 HD1 PHE 78 2.960 -7.441 5.826 539 HD2 PHE 78 HD2 PHE 78 0.730 -6.068 2.471 540 HE1 PHE 78 HE1 PHE 78 4.458 -8.688 4.325 541 HE2 PHE 78 HE2 PHE 78 2.224 -7.314 0.964 542 HZ PHE 78 HZ PHE 78 4.090 -8.627 1.890 543 H LEU 79 H LEU 79 2.913 -3.921 3.846 544 HA LEU 79 HA LEU 79 1.050 -2.028 2.743 545 1HB LEU 79 1HB LEU 79 2.512 -1.007 4.738 546 2HB LEU 79 2HB LEU 79 3.649 -0.777 3.410 547 HG LEU 79 HG LEU 79 1.651 0.381 2.228 548 1HD1 LEU 79 1HD1 LEU 79 0.122 1.493 3.810 549 2HD1 LEU 79 2HD1 LEU 79 0.787 0.510 5.113 550 3HD1 LEU 79 3HD1 LEU 79 -0.080 -0.259 3.784 551 1HD2 LEU 79 1HD2 LEU 79 3.818 1.328 3.375 552 2HD2 LEU 79 2HD2 LEU 79 2.659 1.954 4.547 553 3HD2 LEU 79 3HD2 LEU 79 2.525 2.405 2.847 554 H ARG 80 H ARG 80 1.198 -2.823 0.728 555 HA ARG 80 HA ARG 80 3.871 -2.869 -0.512 556 1HB ARG 80 1HB ARG 80 3.091 -4.730 -1.935 557 2HB ARG 80 2HB ARG 80 3.095 -5.152 -0.228 558 1HG ARG 80 1HG ARG 80 0.759 -5.064 -0.085 559 2HG ARG 80 2HG ARG 80 0.615 -4.193 -1.613 560 1HD ARG 80 1HD ARG 80 1.953 -6.534 -2.274 561 2HD ARG 80 2HD ARG 80 0.736 -7.043 -1.104 562 HE ARG 80 HE ARG 80 -0.843 -6.719 -2.711 563 1HH1 ARG 80 1HH1 ARG 80 1.958 -4.816 -3.520 564 2HH1 ARG 80 2HH1 ARG 80 1.316 -4.278 -5.037 565 1HH2 ARG 80 1HH2 ARG 80 -1.699 -6.017 -4.705 566 2HH2 ARG 80 2HH2 ARG 80 -0.765 -4.960 -5.709 567 H ILE 81 H ILE 81 3.955 -2.344 -2.759 568 HA ILE 81 HA ILE 81 1.561 -1.091 -3.888 569 HB ILE 81 HB ILE 81 4.227 0.320 -3.871 570 1HG1 ILE 81 1HG1 ILE 81 2.699 1.933 -2.388 571 2HG1 ILE 81 2HG1 ILE 81 1.935 0.403 -1.972 572 1HG2 ILE 81 1HG2 ILE 81 1.642 0.762 -5.175 573 2HG2 ILE 81 2HG2 ILE 81 2.305 2.182 -4.368 574 3HG2 ILE 81 3HG2 ILE 81 3.247 1.351 -5.606 575 1HD1 ILE 81 1HD1 ILE 81 4.474 -0.296 -1.601 576 2HD1 ILE 81 2HD1 ILE 81 4.615 1.435 -1.293 577 3HD1 ILE 81 3HD1 ILE 81 3.494 0.459 -0.343 578 H ARG 82 H ARG 82 1.302 -2.353 -5.633 579 HA ARG 82 HA ARG 82 3.444 -3.508 -7.098 580 1HB ARG 82 1HB ARG 82 0.731 -3.935 -6.938 581 2HB ARG 82 2HB ARG 82 0.908 -3.228 -8.539 582 1HG ARG 82 1HG ARG 82 1.513 -5.210 -9.308 583 2HG ARG 82 2HG ARG 82 2.949 -5.144 -8.284 584 1HD ARG 82 1HD ARG 82 0.414 -5.929 -6.978 585 2HD ARG 82 2HD ARG 82 1.111 -7.085 -8.113 586 HE ARG 82 HE ARG 82 3.165 -6.276 -6.443 587 1HH1 ARG 82 1HH1 ARG 82 0.102 -7.906 -6.150 588 2HH1 ARG 82 2HH1 ARG 82 0.585 -8.844 -4.776 589 1HH2 ARG 82 1HH2 ARG 82 3.812 -7.505 -4.633 590 2HH2 ARG 82 2HH2 ARG 82 2.695 -8.614 -3.913 591 H SER 83 H SER 83 4.764 -2.500 -8.447 592 HA SER 83 HA SER 83 3.735 -0.190 -9.962 593 1HB SER 83 1HB SER 83 6.550 -0.009 -9.846 594 2HB SER 83 2HB SER 83 5.373 1.035 -9.049 595 HG SER 83 HG SER 83 7.085 -0.583 -7.904 596 H LYS 84 H LYS 84 4.579 0.120 -12.083 597 HA LYS 84 HA LYS 84 4.655 -2.130 -13.685 598 1HB LYS 84 1HB LYS 84 5.637 0.680 -14.103 599 2HB LYS 84 2HB LYS 84 5.834 -0.539 -15.355 600 1HG LYS 84 1HG LYS 84 3.252 -0.892 -14.914 601 2HG LYS 84 2HG LYS 84 3.372 0.777 -14.353 602 1HD LYS 84 1HD LYS 84 4.739 0.992 -16.645 603 2HD LYS 84 2HD LYS 84 3.669 -0.344 -17.078 604 1HE LYS 84 1HE LYS 84 1.831 1.219 -16.041 605 2HE LYS 84 2HE LYS 84 3.009 2.483 -16.392 606 1HZ LYS 84 1HZ LYS 84 2.354 0.559 -18.504 607 2HZ LYS 84 2HZ LYS 84 2.803 2.185 -18.630 608 3HZ LYS 84 3HZ LYS 84 1.232 1.776 -18.153 609 H LYS 85 H LYS 85 7.238 -0.572 -11.946 610 HA LYS 85 HA LYS 85 9.361 -1.911 -13.333 611 1HB LYS 85 1HB LYS 85 9.145 0.192 -11.462 612 2HB LYS 85 2HB LYS 85 10.122 -1.053 -10.695 613 1HG LYS 85 1HG LYS 85 10.879 -0.535 -13.462 614 2HG LYS 85 2HG LYS 85 11.037 0.874 -12.409 615 1HD LYS 85 1HD LYS 85 13.050 -0.025 -11.936 616 2HD LYS 85 2HD LYS 85 12.116 -1.044 -10.838 617 1HE LYS 85 1HE LYS 85 12.791 -2.840 -11.955 618 2HE LYS 85 2HE LYS 85 11.992 -2.229 -13.402 619 1HZ LYS 85 1HZ LYS 85 14.315 -2.654 -13.831 620 2HZ LYS 85 2HZ LYS 85 14.778 -1.633 -12.565 621 3HZ LYS 85 3HZ LYS 85 14.014 -0.992 -13.932 622 H ASN 86 H ASN 86 8.040 -2.219 -10.032 623 HA ASN 86 HA ASN 86 7.945 -5.010 -10.027 624 1HB ASN 86 1HB ASN 86 9.921 -5.242 -8.304 625 2HB ASN 86 2HB ASN 86 10.239 -5.302 -10.035 626 1HD2 ASN 86 1HD2 ASN 86 10.258 -3.201 -7.217 627 2HD2 ASN 86 2HD2 ASN 86 11.473 -2.122 -7.802 628 H GLU 87 H GLU 87 7.566 -5.907 -7.837 629 HA GLU 87 HA GLU 87 6.018 -4.027 -6.280 630 1HB GLU 87 1HB GLU 87 5.193 -5.943 -5.088 631 2HB GLU 87 2HB GLU 87 5.204 -6.325 -6.804 632 1HG GLU 87 1HG GLU 87 6.326 -8.165 -6.321 633 2HG GLU 87 2HG GLU 87 7.691 -7.153 -5.852 634 H ILE 88 H ILE 88 6.296 -3.610 -4.059 635 HA ILE 88 HA ILE 88 8.862 -4.394 -2.880 636 HB ILE 88 HB ILE 88 7.878 -1.543 -2.811 637 1HG1 ILE 88 1HG1 ILE 88 10.077 -2.755 -4.501 638 2HG1 ILE 88 2HG1 ILE 88 8.535 -2.154 -5.100 639 1HG2 ILE 88 1HG2 ILE 88 10.667 -1.871 -2.311 640 2HG2 ILE 88 2HG2 ILE 88 9.415 -1.239 -1.242 641 3HG2 ILE 88 3HG2 ILE 88 9.762 -2.968 -1.268 642 1HD1 ILE 88 1HD1 ILE 88 9.498 0.008 -3.751 643 2HD1 ILE 88 2HD1 ILE 88 10.971 -0.714 -4.402 644 3HD1 ILE 88 3HD1 ILE 88 9.654 -0.268 -5.486 645 H MET 89 H MET 89 8.013 -5.635 -1.284 646 HA MET 89 HA MET 89 5.715 -4.824 0.235 647 1HB MET 89 1HB MET 89 7.634 -7.127 0.367 648 2HB MET 89 2HB MET 89 6.513 -6.833 1.690 649 1HG MET 89 1HG MET 89 4.655 -7.296 0.393 650 2HG MET 89 2HG MET 89 5.515 -7.008 -1.118 651 1HE MET 89 1HE MET 89 6.091 -8.824 2.071 652 2HE MET 89 2HE MET 89 6.064 -10.544 1.683 653 3HE MET 89 3HE MET 89 7.535 -9.605 1.428 654 H VAL 90 H VAL 90 5.670 -3.602 2.004 655 HA VAL 90 HA VAL 90 8.004 -3.443 3.743 656 HB VAL 90 HB VAL 90 6.749 -0.968 2.547 657 1HG1 VAL 90 1HG1 VAL 90 9.047 -1.253 4.481 658 2HG1 VAL 90 2HG1 VAL 90 8.446 0.257 3.792 659 3HG1 VAL 90 3HG1 VAL 90 7.428 -0.682 4.884 660 1HG2 VAL 90 1HG2 VAL 90 9.189 -0.681 1.740 661 2HG2 VAL 90 2HG2 VAL 90 9.310 -2.421 2.000 662 3HG2 VAL 90 3HG2 VAL 90 8.126 -1.780 0.861 663 H ALA 91 H ALA 91 7.488 -3.150 5.850 664 HA ALA 91 HA ALA 91 4.947 -2.040 6.649 665 1HB ALA 91 1HB ALA 91 5.192 -4.642 7.905 666 2HB ALA 91 2HB ALA 91 3.804 -3.895 7.114 667 3HB ALA 91 3HB ALA 91 5.005 -4.761 6.155 668 HA PRO 92 HA PRO 92 7.173 -0.966 10.275 669 1HB PRO 92 1HB PRO 92 5.234 -1.037 12.174 670 2HB PRO 92 2HB PRO 92 5.321 0.222 10.936 671 1HG PRO 92 1HG PRO 92 3.613 -2.235 11.023 672 2HG PRO 92 2HG PRO 92 3.175 -0.585 10.545 673 1HD PRO 92 1HD PRO 92 3.710 -2.531 8.740 674 2HD PRO 92 2HD PRO 92 4.078 -0.821 8.438 675 H ASP 93 H ASP 93 8.573 -2.116 11.433 676 HA ASP 93 HA ASP 93 7.760 -4.771 12.405 677 1HB ASP 93 1HB ASP 93 9.977 -4.006 10.913 678 2HB ASP 93 2HB ASP 93 10.612 -4.199 12.545 679 H LYS 94 H LYS 94 9.692 -5.236 14.281 680 HA LYS 94 HA LYS 94 8.653 -4.182 16.603 681 1HB LYS 94 1HB LYS 94 10.875 -5.831 15.876 682 2HB LYS 94 2HB LYS 94 11.410 -4.668 17.082 683 1HG LYS 94 1HG LYS 94 10.537 -5.959 18.650 684 2HG LYS 94 2HG LYS 94 8.935 -5.640 17.980 685 1HD LYS 94 1HD LYS 94 8.924 -7.602 16.741 686 2HD LYS 94 2HD LYS 94 10.683 -7.746 16.767 687 1HE LYS 94 1HE LYS 94 9.839 -9.418 18.222 688 2HE LYS 94 2HE LYS 94 10.503 -8.145 19.245 689 1HZ LYS 94 1HZ LYS 94 8.520 -7.757 20.142 690 2HZ LYS 94 2HZ LYS 94 8.011 -9.212 19.446 691 3HZ LYS 94 3HZ LYS 94 7.731 -7.748 18.645 692 H ASP 95 H ASP 95 11.614 -3.121 14.929 693 HA ASP 95 HA ASP 95 11.147 -0.400 15.813 694 1HB ASP 95 1HB ASP 95 13.574 -0.277 16.653 695 2HB ASP 95 2HB ASP 95 12.385 -1.036 17.707 696 H TYR 96 H TYR 96 11.517 -2.166 13.339 697 HA TYR 96 HA TYR 96 13.192 -0.250 11.908 698 1HB TYR 96 1HB TYR 96 14.244 -2.203 10.650 699 2HB TYR 96 2HB TYR 96 14.810 -1.932 12.294 700 HD1 TYR 96 HD1 TYR 96 14.060 -3.441 14.121 701 HD2 TYR 96 HD2 TYR 96 13.130 -4.221 10.043 702 HE1 TYR 96 HE1 TYR 96 13.519 -5.770 14.696 703 HE2 TYR 96 HE2 TYR 96 12.585 -6.552 10.607 704 HH TYR 96 HH TYR 96 12.280 -8.024 12.258 705 H PHE 97 H PHE 97 13.081 -0.788 9.457 706 HA PHE 97 HA PHE 97 10.313 -1.566 8.814 707 1HB PHE 97 1HB PHE 97 11.987 0.723 7.850 708 2HB PHE 97 2HB PHE 97 10.758 0.045 6.787 709 HD1 PHE 97 HD1 PHE 97 8.427 -0.375 8.116 710 HD2 PHE 97 HD2 PHE 97 11.360 2.568 9.040 711 HE1 PHE 97 HE1 PHE 97 6.707 0.981 9.238 712 HE2 PHE 97 HE2 PHE 97 9.646 3.928 10.165 713 HZ PHE 97 HZ PHE 97 7.316 3.135 10.266 714 H LEU 98 H LEU 98 10.385 -3.505 7.880 715 HA LEU 98 HA LEU 98 12.660 -4.420 6.393 716 1HB LEU 98 1HB LEU 98 10.777 -5.694 7.798 717 2HB LEU 98 2HB LEU 98 10.065 -5.835 6.192 718 HG LEU 98 HG LEU 98 12.904 -6.628 6.451 719 1HD1 LEU 98 1HD1 LEU 98 11.555 -8.948 7.103 720 2HD1 LEU 98 2HD1 LEU 98 10.831 -7.731 8.152 721 3HD1 LEU 98 3HD1 LEU 98 12.575 -7.991 8.178 722 1HD2 LEU 98 1HD2 LEU 98 10.515 -7.873 5.094 723 2HD2 LEU 98 2HD2 LEU 98 12.200 -8.354 4.895 724 3HD2 LEU 98 3HD2 LEU 98 11.663 -6.769 4.336 725 H ILE 99 H ILE 99 12.868 -4.720 4.205 726 HA ILE 99 HA ILE 99 10.675 -3.798 2.485 727 HB ILE 99 HB ILE 99 13.552 -2.924 2.201 728 1HG1 ILE 99 1HG1 ILE 99 11.689 -0.764 2.325 729 2HG1 ILE 99 2HG1 ILE 99 11.385 -1.831 3.691 730 1HG2 ILE 99 1HG2 ILE 99 12.652 -1.526 0.342 731 2HG2 ILE 99 2HG2 ILE 99 12.612 -3.260 0.029 732 3HG2 ILE 99 3HG2 ILE 99 11.133 -2.411 0.481 733 1HD1 ILE 99 1HD1 ILE 99 14.143 -1.574 3.617 734 2HD1 ILE 99 2HD1 ILE 99 13.530 0.040 3.255 735 3HD1 ILE 99 3HD1 ILE 99 13.030 -0.782 4.733 736 H VAL 100 H VAL 100 10.260 -5.182 0.896 737 HA VAL 100 HA VAL 100 12.418 -6.961 -0.029 738 HB VAL 100 HB VAL 100 9.536 -7.744 0.433 739 1HG1 VAL 100 1HG1 VAL 100 11.856 -9.251 -0.753 740 2HG1 VAL 100 2HG1 VAL 100 10.389 -10.034 -0.162 741 3HG1 VAL 100 3HG1 VAL 100 10.302 -8.890 -1.502 742 1HG2 VAL 100 1HG2 VAL 100 10.450 -9.265 2.119 743 2HG2 VAL 100 2HG2 VAL 100 12.067 -8.628 1.820 744 3HG2 VAL 100 3HG2 VAL 100 10.820 -7.584 2.502 745 H ILE 101 H ILE 101 12.846 -6.455 -2.070 746 HA ILE 101 HA ILE 101 10.629 -5.628 -3.820 747 HB ILE 101 HB ILE 101 13.586 -5.156 -4.216 748 1HG1 ILE 101 1HG1 ILE 101 11.999 -2.776 -3.868 749 2HG1 ILE 101 2HG1 ILE 101 11.780 -3.848 -2.489 750 1HG2 ILE 101 1HG2 ILE 101 12.956 -4.852 -6.338 751 2HG2 ILE 101 2HG2 ILE 101 11.244 -4.827 -5.918 752 3HG2 ILE 101 3HG2 ILE 101 12.210 -3.359 -5.768 753 1HD1 ILE 101 1HD1 ILE 101 14.554 -3.708 -3.161 754 2HD1 ILE 101 2HD1 ILE 101 13.894 -2.082 -2.980 755 3HD1 ILE 101 3HD1 ILE 101 13.738 -3.248 -1.667 756 H GLN 102 H GLN 102 10.218 -6.694 -5.695 757 HA GLN 102 HA GLN 102 12.034 -8.486 -6.940 758 1HB GLN 102 1HB GLN 102 10.959 -10.591 -6.484 759 2HB GLN 102 2HB GLN 102 11.387 -9.840 -4.953 760 1HG GLN 102 1HG GLN 102 9.075 -9.080 -4.686 761 2HG GLN 102 2HG GLN 102 8.652 -9.863 -6.208 762 1HE2 GLN 102 1HE2 GLN 102 8.380 -10.198 -3.026 763 2HE2 GLN 102 2HE2 GLN 102 8.377 -11.919 -2.879 764 H ASN 103 H ASN 103 10.805 -9.871 -8.631 765 HA ASN 103 HA ASN 103 9.505 -8.201 -10.400 766 1HB ASN 103 1HB ASN 103 9.820 -11.139 -10.140 767 2HB ASN 103 2HB ASN 103 8.535 -10.581 -11.208 768 1HD2 ASN 103 1HD2 ASN 103 11.585 -11.596 -11.211 769 2HD2 ASN 103 2HD2 ASN 103 12.210 -10.734 -12.571 770 HA PRO 104 HA PRO 104 5.304 -7.842 -9.188 771 1HB PRO 104 1HB PRO 104 3.991 -8.011 -11.558 772 2HB PRO 104 2HB PRO 104 4.957 -6.605 -11.093 773 1HG PRO 104 1HG PRO 104 5.686 -8.900 -12.873 774 2HG PRO 104 2HG PRO 104 5.998 -7.168 -13.095 775 1HD PRO 104 1HD PRO 104 7.888 -8.885 -12.194 776 2HD PRO 104 2HD PRO 104 7.819 -7.187 -11.682 777 H THR 105 H THR 105 3.452 -9.005 -8.701 778 HA THR 105 HA THR 105 3.555 -11.865 -9.389 779 HB THR 105 HB THR 105 2.075 -12.167 -7.373 780 HG1 THR 105 HG1 THR 105 1.271 -10.152 -6.988 781 1HG2 THR 105 1HG2 THR 105 4.195 -12.801 -6.827 782 2HG2 THR 105 2HG2 THR 105 4.068 -11.396 -5.770 783 3HG2 THR 105 3HG2 THR 105 4.900 -11.262 -7.319 784 H GLU 106 H GLU 106 1.483 -9.033 -9.260 785 HA GLU 106 HA GLU 106 -0.997 -10.145 -9.737 786 1HB GLU 106 1HB GLU 106 -0.367 -7.688 -9.364 787 2HB GLU 106 2HB GLU 106 -0.075 -7.622 -11.096 788 1HG GLU 106 1HG GLU 106 -2.313 -6.811 -10.410 789 2HG GLU 106 2HG GLU 106 -2.353 -8.133 -11.576 790 H MET 11 H MET 11 -18.607 4.667 -16.216 791 HA MET 11 HA MET 11 -18.898 4.330 -13.577 792 1HB MET 11 1HB MET 11 -21.073 4.925 -15.581 793 2HB MET 11 2HB MET 11 -21.311 5.058 -13.844 794 1HG MET 11 1HG MET 11 -18.988 6.484 -14.981 795 2HG MET 11 2HG MET 11 -20.586 7.108 -15.384 796 1HE MET 11 1HE MET 11 -17.880 6.514 -13.190 797 2HE MET 11 2HE MET 11 -17.975 7.987 -12.224 798 3HE MET 11 3HE MET 11 -18.510 6.449 -11.543 799 H ALA 12 H ALA 12 -20.882 2.565 -15.956 800 HA ALA 12 HA ALA 12 -22.361 1.006 -14.227 801 1HB ALA 12 1HB ALA 12 -22.311 -0.698 -16.156 802 2HB ALA 12 2HB ALA 12 -22.992 0.900 -16.464 803 3HB ALA 12 3HB ALA 12 -21.358 0.518 -17.007 804 H GLU 13 H GLU 13 -19.076 0.484 -15.411 805 HA GLU 13 HA GLU 13 -18.638 -2.111 -14.568 806 1HB GLU 13 1HB GLU 13 -17.083 -0.493 -15.848 807 2HB GLU 13 2HB GLU 13 -16.541 0.022 -14.257 808 1HG GLU 13 1HG GLU 13 -15.451 -1.925 -13.840 809 2HG GLU 13 2HG GLU 13 -16.558 -2.886 -14.819 810 H VAL 14 H VAL 14 -18.093 0.885 -12.721 811 HA VAL 14 HA VAL 14 -17.286 -0.381 -10.336 812 HB VAL 14 HB VAL 14 -18.566 2.333 -10.695 813 1HG1 VAL 14 1HG1 VAL 14 -16.926 2.495 -8.514 814 2HG1 VAL 14 2HG1 VAL 14 -18.678 2.285 -8.458 815 3HG1 VAL 14 3HG1 VAL 14 -17.616 0.881 -8.341 816 1HG2 VAL 14 1HG2 VAL 14 -15.658 1.544 -10.539 817 2HG2 VAL 14 2HG2 VAL 14 -16.510 2.048 -11.998 818 3HG2 VAL 14 3HG2 VAL 14 -16.282 3.189 -10.673 819 H GLU 15 H GLU 15 -20.444 0.579 -11.565 820 HA GLU 15 HA GLU 15 -21.900 0.160 -9.184 821 1HB GLU 15 1HB GLU 15 -22.689 0.179 -12.091 822 2HB GLU 15 2HB GLU 15 -23.860 -0.111 -10.811 823 1HG GLU 15 1HG GLU 15 -23.418 2.054 -9.854 824 2HG GLU 15 2HG GLU 15 -22.133 2.344 -11.025 825 H GLU 16 H GLU 16 -21.033 -1.969 -11.860 826 HA GLU 16 HA GLU 16 -22.616 -4.171 -11.077 827 1HB GLU 16 1HB GLU 16 -20.991 -3.580 -13.222 828 2HB GLU 16 2HB GLU 16 -20.100 -4.857 -12.406 829 1HG GLU 16 1HG GLU 16 -22.893 -5.522 -12.592 830 2HG GLU 16 2HG GLU 16 -22.228 -5.140 -14.179 831 H THR 17 H THR 17 -19.443 -3.058 -10.123 832 HA THR 17 HA THR 17 -18.723 -5.473 -8.748 833 HB THR 17 HB THR 17 -17.528 -2.699 -8.580 834 HG1 THR 17 HG1 THR 17 -17.336 -3.760 -10.634 835 1HG2 THR 17 1HG2 THR 17 -15.538 -3.965 -7.674 836 2HG2 THR 17 2HG2 THR 17 -16.614 -5.347 -7.466 837 3HG2 THR 17 3HG2 THR 17 -16.921 -3.849 -6.587 838 H LEU 18 H LEU 18 -20.343 -2.495 -7.930 839 HA LEU 18 HA LEU 18 -20.086 -2.599 -5.133 840 1HB LEU 18 1HB LEU 18 -21.452 -1.022 -7.052 841 2HB LEU 18 2HB LEU 18 -22.628 -1.524 -5.839 842 HG LEU 18 HG LEU 18 -21.810 0.588 -5.160 843 1HD1 LEU 18 1HD1 LEU 18 -20.017 -0.793 -3.357 844 2HD1 LEU 18 2HD1 LEU 18 -21.523 -1.680 -3.593 845 3HD1 LEU 18 3HD1 LEU 18 -21.564 -0.008 -3.033 846 1HD2 LEU 18 1HD2 LEU 18 -19.006 -0.490 -5.433 847 2HD2 LEU 18 2HD2 LEU 18 -19.472 1.142 -4.954 848 3HD2 LEU 18 3HD2 LEU 18 -19.794 0.578 -6.595 849 H LYS 19 H LYS 19 -22.582 -3.890 -7.300 850 HA LYS 19 HA LYS 19 -24.268 -4.925 -5.303 851 1HB LYS 19 1HB LYS 19 -23.858 -5.862 -8.148 852 2HB LYS 19 2HB LYS 19 -25.194 -6.344 -7.111 853 1HG LYS 19 1HG LYS 19 -25.109 -3.518 -7.120 854 2HG LYS 19 2HG LYS 19 -24.972 -4.066 -8.793 855 1HD LYS 19 1HD LYS 19 -27.059 -5.144 -6.915 856 2HD LYS 19 2HD LYS 19 -27.324 -3.693 -7.884 857 1HE LYS 19 1HE LYS 19 -26.818 -5.017 -9.917 858 2HE LYS 19 2HE LYS 19 -26.684 -6.457 -8.909 859 1HZ LYS 19 1HZ LYS 19 -29.050 -5.759 -8.154 860 2HZ LYS 19 2HZ LYS 19 -28.845 -6.578 -9.620 861 3HZ LYS 19 3HZ LYS 19 -29.075 -4.902 -9.612 862 H ARG 20 H ARG 20 -21.713 -6.495 -7.219 863 HA ARG 20 HA ARG 20 -21.930 -9.048 -6.122 864 1HB ARG 20 1HB ARG 20 -20.501 -8.169 -8.111 865 2HB ARG 20 2HB ARG 20 -19.271 -7.886 -6.887 866 1HG ARG 20 1HG ARG 20 -18.650 -9.974 -7.446 867 2HG ARG 20 2HG ARG 20 -19.911 -10.420 -6.294 868 1HD ARG 20 1HD ARG 20 -21.002 -11.487 -7.904 869 2HD ARG 20 2HD ARG 20 -21.151 -9.977 -8.801 870 HE ARG 20 HE ARG 20 -19.482 -10.683 -10.203 871 1HH1 ARG 20 1HH1 ARG 20 -19.506 -12.679 -7.351 872 2HH1 ARG 20 2HH1 ARG 20 -18.358 -13.815 -7.978 873 1HH2 ARG 20 1HH2 ARG 20 -17.970 -12.172 -11.040 874 2HH2 ARG 20 2HH2 ARG 20 -17.485 -13.525 -10.076 875 H LEU 21 H LEU 21 -19.881 -6.325 -5.110 876 HA LEU 21 HA LEU 21 -18.606 -7.629 -2.979 877 1HB LEU 21 1HB LEU 21 -19.012 -4.841 -3.847 878 2HB LEU 21 2HB LEU 21 -18.648 -5.064 -2.137 879 HG LEU 21 HG LEU 21 -16.546 -6.101 -2.660 880 1HD1 LEU 21 1HD1 LEU 21 -16.513 -7.340 -4.522 881 2HD1 LEU 21 2HD1 LEU 21 -16.074 -5.837 -5.333 882 3HD1 LEU 21 3HD1 LEU 21 -17.756 -6.367 -5.309 883 1HD2 LEU 21 1HD2 LEU 21 -15.490 -4.228 -4.021 884 2HD2 LEU 21 2HD2 LEU 21 -16.347 -3.763 -2.551 885 3HD2 LEU 21 3HD2 LEU 21 -17.111 -3.540 -4.126 886 H GLN 22 H GLN 22 -21.371 -5.374 -2.891 887 HA GLN 22 HA GLN 22 -21.926 -5.647 -0.167 888 1HB GLN 22 1HB GLN 22 -22.975 -4.195 -2.270 889 2HB GLN 22 2HB GLN 22 -24.304 -5.254 -1.817 890 1HG GLN 22 1HG GLN 22 -24.760 -4.027 -0.035 891 2HG GLN 22 2HG GLN 22 -23.091 -4.119 0.524 892 1HE2 GLN 22 1HE2 GLN 22 -21.662 -2.475 0.008 893 2HE2 GLN 22 2HE2 GLN 22 -22.189 -0.946 -0.599 894 H SER 23 H SER 23 -22.512 -7.779 -2.795 895 HA SER 23 HA SER 23 -24.646 -9.245 -1.544 896 1HB SER 23 1HB SER 23 -23.147 -9.375 -4.078 897 2HB SER 23 2HB SER 23 -23.675 -10.937 -3.454 898 HG SER 23 HG SER 23 -25.118 -9.154 -4.743 899 H GLN 24 H GLN 24 -21.183 -9.347 -1.546 900 HA GLN 24 HA GLN 24 -21.172 -11.970 -0.242 901 1HB GLN 24 1HB GLN 24 -18.777 -11.972 -0.597 902 2HB GLN 24 2HB GLN 24 -19.593 -11.583 -2.106 903 1HG GLN 24 1HG GLN 24 -18.979 -9.322 -1.983 904 2HG GLN 24 2HG GLN 24 -18.516 -9.457 -0.287 905 1HE2 GLN 24 1HE2 GLN 24 -16.837 -8.347 -2.164 906 2HE2 GLN 24 2HE2 GLN 24 -15.471 -9.379 -2.393 907 H LYS 25 H LYS 25 -20.144 -12.299 1.769 908 HA LYS 25 HA LYS 25 -20.514 -10.133 3.618 909 1HB LYS 25 1HB LYS 25 -20.685 -12.843 3.833 910 2HB LYS 25 2HB LYS 25 -19.111 -12.549 4.560 911 1HG LYS 25 1HG LYS 25 -20.769 -10.624 5.683 912 2HG LYS 25 2HG LYS 25 -21.751 -12.090 5.627 913 1HD LYS 25 1HD LYS 25 -20.026 -13.323 6.804 914 2HD LYS 25 2HD LYS 25 -18.970 -11.909 6.788 915 1HE LYS 25 1HE LYS 25 -20.295 -10.755 8.321 916 2HE LYS 25 2HE LYS 25 -21.697 -11.783 8.026 917 1HZ LYS 25 1HZ LYS 25 -19.939 -12.036 10.086 918 2HZ LYS 25 2HZ LYS 25 -19.441 -13.246 9.013 919 3HZ LYS 25 3HZ LYS 25 -21.037 -13.217 9.574 920 H GLY 26 H GLY 26 -18.785 -9.694 5.305 921 1HA GLY 26 1HA GLY 26 -16.527 -9.362 5.888 922 2HA GLY 26 2HA GLY 26 -16.057 -9.891 4.279 923 H VAL 27 H VAL 27 -17.683 -8.200 2.746 924 HA VAL 27 HA VAL 27 -16.101 -5.939 2.488 925 HB VAL 27 HB VAL 27 -18.991 -6.257 1.664 926 1HG1 VAL 27 1HG1 VAL 27 -18.598 -3.973 1.497 927 2HG1 VAL 27 2HG1 VAL 27 -16.912 -4.197 1.026 928 3HG1 VAL 27 3HG1 VAL 27 -18.205 -4.562 -0.117 929 1HG2 VAL 27 1HG2 VAL 27 -17.573 -7.997 0.735 930 2HG2 VAL 27 2HG2 VAL 27 -18.054 -6.863 -0.528 931 3HG2 VAL 27 3HG2 VAL 27 -16.430 -6.785 0.157 932 H GLN 28 H GLN 28 -15.769 -4.469 4.029 933 HA GLN 28 HA GLN 28 -17.758 -3.794 5.979 934 1HB GLN 28 1HB GLN 28 -14.932 -3.100 5.457 935 2HB GLN 28 2HB GLN 28 -15.876 -1.876 6.298 936 1HG GLN 28 1HG GLN 28 -14.614 -3.510 7.741 937 2HG GLN 28 2HG GLN 28 -16.328 -3.309 8.101 938 1HE2 GLN 28 1HE2 GLN 28 -13.866 -5.489 7.398 939 2HE2 GLN 28 2HE2 GLN 28 -14.834 -6.902 7.174 940 H GLY 29 H GLY 29 -16.635 -2.445 2.962 941 1HA GLY 29 1HA GLY 29 -18.902 -0.896 2.514 942 2HA GLY 29 2HA GLY 29 -17.717 0.155 3.274 943 H ILE 30 H ILE 30 -18.582 0.797 0.797 944 HA ILE 30 HA ILE 30 -16.184 0.307 -0.822 945 HB ILE 30 HB ILE 30 -18.982 0.273 -1.955 946 1HG1 ILE 30 1HG1 ILE 30 -17.703 -2.167 -2.466 947 2HG1 ILE 30 2HG1 ILE 30 -17.369 -1.822 -0.773 948 1HG2 ILE 30 1HG2 ILE 30 -17.736 1.016 -3.715 949 2HG2 ILE 30 2HG2 ILE 30 -16.258 0.251 -3.135 950 3HG2 ILE 30 3HG2 ILE 30 -17.507 -0.721 -3.913 951 1HD1 ILE 30 1HD1 ILE 30 -20.117 -1.287 -1.309 952 2HD1 ILE 30 2HD1 ILE 30 -19.705 -2.897 -1.900 953 3HD1 ILE 30 3HD1 ILE 30 -19.402 -2.472 -0.215 954 H ILE 31 H ILE 31 -15.389 2.075 -1.816 955 HA ILE 31 HA ILE 31 -17.068 4.487 -1.922 956 HB ILE 31 HB ILE 31 -14.192 4.398 -1.003 957 1HG1 ILE 31 1HG1 ILE 31 -16.297 5.587 0.693 958 2HG1 ILE 31 2HG1 ILE 31 -16.397 3.842 0.487 959 1HG2 ILE 31 1HG2 ILE 31 -14.451 6.816 -0.649 960 2HG2 ILE 31 2HG2 ILE 31 -14.621 6.371 -2.346 961 3HG2 ILE 31 3HG2 ILE 31 -16.052 6.740 -1.384 962 1HD1 ILE 31 1HD1 ILE 31 -14.424 3.466 1.586 963 2HD1 ILE 31 2HD1 ILE 31 -13.790 5.072 1.225 964 3HD1 ILE 31 3HD1 ILE 31 -15.039 4.872 2.454 965 H VAL 32 H VAL 32 -16.711 5.860 -3.647 966 HA VAL 32 HA VAL 32 -14.655 5.078 -5.593 967 HB VAL 32 HB VAL 32 -17.383 5.870 -6.551 968 1HG1 VAL 32 1HG1 VAL 32 -15.252 5.768 -7.985 969 2HG1 VAL 32 2HG1 VAL 32 -15.423 4.016 -7.861 970 3HG1 VAL 32 3HG1 VAL 32 -16.705 4.979 -8.597 971 1HG2 VAL 32 1HG2 VAL 32 -17.935 3.473 -6.784 972 2HG2 VAL 32 2HG2 VAL 32 -16.490 3.073 -5.854 973 3HG2 VAL 32 3HG2 VAL 32 -17.801 3.982 -5.100 974 H VAL 33 H VAL 33 -13.450 6.769 -6.120 975 HA VAL 33 HA VAL 33 -14.677 9.449 -6.072 976 HB VAL 33 HB VAL 33 -11.775 8.974 -5.442 977 1HG1 VAL 33 1HG1 VAL 33 -11.945 11.209 -5.807 978 2HG1 VAL 33 2HG1 VAL 33 -13.659 11.260 -5.391 979 3HG1 VAL 33 3HG1 VAL 33 -12.442 11.187 -4.116 980 1HG2 VAL 33 1HG2 VAL 33 -12.635 9.406 -3.015 981 2HG2 VAL 33 2HG2 VAL 33 -14.147 8.749 -3.641 982 3HG2 VAL 33 3HG2 VAL 33 -12.677 7.777 -3.690 983 H ASN 34 H ASN 34 -13.672 11.025 -7.493 984 HA ASN 34 HA ASN 34 -12.597 9.750 -9.914 985 1HB ASN 34 1HB ASN 34 -13.343 11.938 -11.008 986 2HB ASN 34 2HB ASN 34 -14.616 10.852 -10.458 987 1HD2 ASN 34 1HD2 ASN 34 -15.979 12.725 -10.493 988 2HD2 ASN 34 2HD2 ASN 34 -15.965 13.826 -9.161 989 H THR 35 H THR 35 -11.426 11.694 -11.258 990 HA THR 35 HA THR 35 -8.946 12.049 -9.963 991 HB THR 35 HB THR 35 -9.049 13.938 -12.035 992 HG1 THR 35 HG1 THR 35 -10.790 13.263 -13.079 993 1HG2 THR 35 1HG2 THR 35 -7.965 11.190 -11.653 994 2HG2 THR 35 2HG2 THR 35 -7.115 12.708 -11.943 995 3HG2 THR 35 3HG2 THR 35 -7.931 11.886 -13.272 996 H GLU 36 H GLU 36 -11.825 13.951 -10.031 997 HA GLU 36 HA GLU 36 -10.587 16.433 -9.300 998 1HB GLU 36 1HB GLU 36 -13.378 15.434 -9.594 999 2HB GLU 36 2HB GLU 36 -13.120 16.863 -8.603 1000 1HG GLU 36 1HG GLU 36 -11.675 17.511 -10.789 1001 2HG GLU 36 2HG GLU 36 -12.940 16.520 -11.513 1002 H GLY 37 H GLY 37 -12.446 13.948 -7.561 1003 1HA GLY 37 1HA GLY 37 -11.380 13.438 -5.316 1004 2HA GLY 37 2HA GLY 37 -11.532 15.165 -5.032 1005 H ILE 38 H ILE 38 -14.151 14.333 -6.818 1006 HA ILE 38 HA ILE 38 -15.868 14.357 -4.478 1007 HB ILE 38 HB ILE 38 -16.631 14.333 -7.401 1008 1HG1 ILE 38 1HG1 ILE 38 -16.485 16.670 -5.486 1009 2HG1 ILE 38 2HG1 ILE 38 -15.273 16.311 -6.710 1010 1HG2 ILE 38 1HG2 ILE 38 -18.812 15.063 -6.647 1011 2HG2 ILE 38 2HG2 ILE 38 -18.387 13.539 -5.868 1012 3HG2 ILE 38 3HG2 ILE 38 -18.264 15.053 -4.971 1013 1HD1 ILE 38 1HD1 ILE 38 -17.229 16.449 -8.372 1014 2HD1 ILE 38 2HD1 ILE 38 -18.080 17.269 -7.063 1015 3HD1 ILE 38 3HD1 ILE 38 -16.579 17.943 -7.698 1016 HA PRO 39 HA PRO 39 -16.413 9.967 -4.430 1017 1HB PRO 39 1HB PRO 39 -18.558 9.904 -2.767 1018 2HB PRO 39 2HB PRO 39 -16.913 10.219 -2.201 1019 1HG PRO 39 1HG PRO 39 -19.120 12.157 -2.781 1020 2HG PRO 39 2HG PRO 39 -17.982 12.130 -1.420 1021 1HD PRO 39 1HD PRO 39 -17.666 13.770 -3.552 1022 2HD PRO 39 2HD PRO 39 -16.291 13.097 -2.652 1023 H ILE 40 H ILE 40 -17.062 10.020 -6.728 1024 HA ILE 40 HA ILE 40 -19.565 10.546 -7.732 1025 HB ILE 40 HB ILE 40 -19.071 8.629 -9.372 1026 1HG1 ILE 40 1HG1 ILE 40 -16.381 8.743 -7.995 1027 2HG1 ILE 40 2HG1 ILE 40 -17.546 7.445 -7.759 1028 1HG2 ILE 40 1HG2 ILE 40 -16.739 10.357 -9.560 1029 2HG2 ILE 40 2HG2 ILE 40 -18.124 10.201 -10.640 1030 3HG2 ILE 40 3HG2 ILE 40 -18.225 11.244 -9.221 1031 1HD1 ILE 40 1HD1 ILE 40 -16.682 8.120 -10.523 1032 2HD1 ILE 40 2HD1 ILE 40 -15.599 7.202 -9.477 1033 3HD1 ILE 40 3HD1 ILE 40 -17.206 6.578 -9.847 1034 H LYS 41 H LYS 41 -18.460 7.667 -6.027 1035 HA LYS 41 HA LYS 41 -21.249 6.900 -5.611 1036 1HB LYS 41 1HB LYS 41 -19.334 5.444 -7.253 1037 2HB LYS 41 2HB LYS 41 -19.973 4.455 -5.947 1038 1HG LYS 41 1HG LYS 41 -22.008 5.990 -7.376 1039 2HG LYS 41 2HG LYS 41 -21.152 4.814 -8.375 1040 1HD LYS 41 1HD LYS 41 -22.929 3.584 -7.518 1041 2HD LYS 41 2HD LYS 41 -21.601 3.176 -6.429 1042 1HE LYS 41 1HE LYS 41 -22.637 4.085 -4.671 1043 2HE LYS 41 2HE LYS 41 -23.063 5.539 -5.573 1044 1HZ LYS 41 1HZ LYS 41 -24.525 2.974 -5.841 1045 2HZ LYS 41 2HZ LYS 41 -24.990 4.491 -6.426 1046 3HZ LYS 41 3HZ LYS 41 -24.982 4.193 -4.761 1047 H SER 42 H SER 42 -21.632 5.776 -3.705 1048 HA SER 42 HA SER 42 -19.551 4.761 -2.050 1049 1HB SER 42 1HB SER 42 -19.218 7.229 -1.761 1050 2HB SER 42 2HB SER 42 -20.848 7.324 -1.095 1051 HG SER 42 HG SER 42 -18.523 6.308 0.023 1052 H THR 43 H THR 43 -20.338 3.662 -0.234 1053 HA THR 43 HA THR 43 -23.277 3.485 -0.069 1054 HB THR 43 HB THR 43 -22.857 1.397 -0.893 1055 HG1 THR 43 HG1 THR 43 -22.023 0.591 1.650 1056 1HG2 THR 43 1HG2 THR 43 -20.686 0.146 -0.036 1057 2HG2 THR 43 2HG2 THR 43 -20.135 1.798 0.244 1058 3HG2 THR 43 3HG2 THR 43 -20.620 1.293 -1.374 1059 H MET 44 H MET 44 -20.302 3.888 1.595 1060 HA MET 44 HA MET 44 -21.092 3.102 4.189 1061 1HB MET 44 1HB MET 44 -18.769 4.078 2.999 1062 2HB MET 44 2HB MET 44 -19.206 5.310 4.175 1063 1HG MET 44 1HG MET 44 -19.182 3.708 5.954 1064 2HG MET 44 2HG MET 44 -18.947 2.384 4.815 1065 1HE MET 44 1HE MET 44 -15.325 2.969 3.537 1066 2HE MET 44 2HE MET 44 -16.633 1.793 3.663 1067 3HE MET 44 3HE MET 44 -16.891 3.310 2.800 1068 H ASP 45 H ASP 45 -20.614 5.227 5.851 1069 HA ASP 45 HA ASP 45 -23.133 6.543 5.844 1070 1HB ASP 45 1HB ASP 45 -21.415 5.946 7.800 1071 2HB ASP 45 2HB ASP 45 -20.903 7.606 7.506 1072 H ASN 46 H ASN 46 -23.346 8.945 6.041 1073 HA ASN 46 HA ASN 46 -22.356 10.191 3.704 1074 1HB ASN 46 1HB ASN 46 -24.361 10.712 5.608 1075 2HB ASN 46 2HB ASN 46 -23.292 12.111 5.645 1076 1HD2 ASN 46 1HD2 ASN 46 -22.476 12.207 3.019 1077 2HD2 ASN 46 2HD2 ASN 46 -23.830 12.585 2.015 1078 HA PRO 47 HA PRO 47 -19.631 12.828 6.703 1079 1HB PRO 47 1HB PRO 47 -19.428 11.970 9.271 1080 2HB PRO 47 2HB PRO 47 -20.678 13.098 8.730 1081 1HG PRO 47 1HG PRO 47 -20.857 10.143 9.179 1082 2HG PRO 47 2HG PRO 47 -22.009 11.415 9.626 1083 1HD PRO 47 1HD PRO 47 -22.344 9.847 7.444 1084 2HD PRO 47 2HD PRO 47 -22.896 11.534 7.501 1085 H THR 48 H THR 48 -19.763 9.350 7.029 1086 HA THR 48 HA THR 48 -16.990 9.025 7.685 1087 HB THR 48 HB THR 48 -18.997 7.003 6.672 1088 HG1 THR 48 HG1 THR 48 -19.041 6.417 8.914 1089 1HG2 THR 48 1HG2 THR 48 -16.736 6.246 6.226 1090 2HG2 THR 48 2HG2 THR 48 -17.412 5.330 7.573 1091 3HG2 THR 48 3HG2 THR 48 -16.255 6.625 7.880 1092 H THR 49 H THR 49 -18.914 8.983 4.746 1093 HA THR 49 HA THR 49 -16.860 7.965 3.055 1094 HB THR 49 HB THR 49 -19.366 9.517 2.387 1095 HG1 THR 49 HG1 THR 49 -19.435 7.282 3.322 1096 1HG2 THR 49 1HG2 THR 49 -17.464 8.041 0.562 1097 2HG2 THR 49 2HG2 THR 49 -17.727 9.785 0.606 1098 3HG2 THR 49 3HG2 THR 49 -19.024 8.710 0.085 1099 H THR 50 H THR 50 -17.962 11.203 3.926 1100 HA THR 50 HA THR 50 -16.547 12.713 2.080 1101 HB THR 50 HB THR 50 -16.539 13.888 4.764 1102 HG1 THR 50 HG1 THR 50 -18.960 13.996 4.624 1103 1HG2 THR 50 1HG2 THR 50 -17.389 14.576 2.003 1104 2HG2 THR 50 2HG2 THR 50 -16.429 15.503 3.156 1105 3HG2 THR 50 3HG2 THR 50 -18.182 15.423 3.331 1106 H GLN 51 H GLN 51 -15.488 11.498 5.243 1107 HA GLN 51 HA GLN 51 -12.897 12.669 5.090 1108 1HB GLN 51 1HB GLN 51 -13.827 12.125 7.247 1109 2HB GLN 51 2HB GLN 51 -13.994 10.433 6.799 1110 1HG GLN 51 1HG GLN 51 -11.278 11.174 6.452 1111 2HG GLN 51 2HG GLN 51 -11.806 11.729 8.039 1112 1HE2 GLN 51 1HE2 GLN 51 -11.944 8.888 5.926 1113 2HE2 GLN 51 2HE2 GLN 51 -11.781 7.723 7.192 1114 H TYR 52 H TYR 52 -14.144 9.400 4.493 1115 HA TYR 52 HA TYR 52 -11.729 8.133 3.938 1116 1HB TYR 52 1HB TYR 52 -14.539 7.564 3.599 1117 2HB TYR 52 2HB TYR 52 -13.628 6.998 2.203 1118 HD1 TYR 52 HD1 TYR 52 -15.020 5.788 4.988 1119 HD2 TYR 52 HD2 TYR 52 -11.150 6.028 3.237 1120 HE1 TYR 52 HE1 TYR 52 -14.331 3.795 6.255 1121 HE2 TYR 52 HE2 TYR 52 -10.450 4.035 4.498 1122 HH TYR 52 HH TYR 52 -12.629 2.466 6.813 1123 H ALA 53 H ALA 53 -14.013 9.624 1.643 1124 HA ALA 53 HA ALA 53 -12.346 9.261 -0.622 1125 1HB ALA 53 1HB ALA 53 -13.887 10.988 -1.655 1126 2HB ALA 53 2HB ALA 53 -14.652 9.525 -1.034 1127 3HB ALA 53 3HB ALA 53 -14.727 11.022 -0.104 1128 H SER 54 H SER 54 -12.355 11.552 1.928 1129 HA SER 54 HA SER 54 -11.055 13.671 0.494 1130 1HB SER 54 1HB SER 54 -11.814 13.154 3.332 1131 2HB SER 54 2HB SER 54 -10.555 14.350 3.020 1132 HG SER 54 HG SER 54 -11.975 15.590 1.942 1133 H LEU 55 H LEU 55 -10.033 11.062 2.643 1134 HA LEU 55 HA LEU 55 -7.251 11.876 2.473 1135 1HB LEU 55 1HB LEU 55 -6.835 10.435 4.192 1136 2HB LEU 55 2HB LEU 55 -8.531 10.808 4.492 1137 HG LEU 55 HG LEU 55 -8.862 8.620 3.006 1138 1HD1 LEU 55 1HD1 LEU 55 -7.155 7.146 2.964 1139 2HD1 LEU 55 2HD1 LEU 55 -6.514 7.673 4.519 1140 3HD1 LEU 55 3HD1 LEU 55 -6.178 8.611 3.063 1141 1HD2 LEU 55 1HD2 LEU 55 -8.077 8.126 5.831 1142 2HD2 LEU 55 2HD2 LEU 55 -9.502 7.589 4.941 1143 3HD2 LEU 55 3HD2 LEU 55 -9.394 9.255 5.513 1144 H MET 56 H MET 56 -9.424 9.770 0.861 1145 HA MET 56 HA MET 56 -7.688 7.775 -0.055 1146 1HB MET 56 1HB MET 56 -10.368 8.626 -0.571 1147 2HB MET 56 2HB MET 56 -9.561 8.354 -2.110 1148 1HG MET 56 1HG MET 56 -10.711 6.356 -1.333 1149 2HG MET 56 2HG MET 56 -8.970 6.104 -1.432 1150 1HE MET 56 1HE MET 56 -7.557 5.416 1.496 1151 2HE MET 56 2HE MET 56 -8.597 4.030 1.166 1152 3HE MET 56 3HE MET 56 -7.900 4.949 -0.170 1153 H HIS 57 H HIS 57 -8.917 10.462 -2.051 1154 HA HIS 57 HA HIS 57 -7.043 10.237 -4.083 1155 1HB HIS 57 1HB HIS 57 -9.013 11.576 -4.405 1156 2HB HIS 57 2HB HIS 57 -8.556 12.658 -3.093 1157 HD1 HIS 57 HD1 HIS 57 -7.962 11.978 -6.692 1158 HD2 HIS 57 HD2 HIS 57 -6.504 14.505 -3.734 1159 HE1 HIS 57 HE1 HIS 57 -6.640 13.740 -7.905 1160 H SER 58 H SER 58 -6.863 11.999 -1.042 1161 HA SER 58 HA SER 58 -4.460 13.393 -1.637 1162 1HB SER 58 1HB SER 58 -5.793 14.297 0.104 1163 2HB SER 58 2HB SER 58 -5.886 12.749 0.942 1164 HG SER 58 HG SER 58 -4.323 13.686 2.049 1165 H PHE 59 H PHE 59 -5.160 10.179 -0.619 1166 HA PHE 59 HA PHE 59 -2.579 9.630 0.511 1167 1HB PHE 59 1HB PHE 59 -4.557 8.370 1.225 1168 2HB PHE 59 2HB PHE 59 -4.760 7.746 -0.409 1169 HD1 PHE 59 HD1 PHE 59 -1.912 8.031 1.992 1170 HD2 PHE 59 HD2 PHE 59 -4.194 5.540 -0.597 1171 HE1 PHE 59 HE1 PHE 59 -0.455 6.128 2.545 1172 HE2 PHE 59 HE2 PHE 59 -2.741 3.632 -0.047 1173 HZ PHE 59 HZ PHE 59 -0.869 3.924 1.526 1174 H ILE 60 H ILE 60 -4.222 8.522 -2.456 1175 HA ILE 60 HA ILE 60 -2.105 7.183 -3.619 1176 HB ILE 60 HB ILE 60 -4.226 8.793 -5.045 1177 1HG1 ILE 60 1HG1 ILE 60 -5.140 7.098 -3.502 1178 2HG1 ILE 60 2HG1 ILE 60 -5.451 6.682 -5.184 1179 1HG2 ILE 60 1HG2 ILE 60 -3.208 8.229 -6.933 1180 2HG2 ILE 60 2HG2 ILE 60 -1.964 7.363 -6.033 1181 3HG2 ILE 60 3HG2 ILE 60 -3.436 6.528 -6.528 1182 1HD1 ILE 60 1HD1 ILE 60 -4.491 4.719 -4.884 1183 2HD1 ILE 60 2HD1 ILE 60 -2.987 5.504 -4.400 1184 3HD1 ILE 60 3HD1 ILE 60 -4.213 5.124 -3.190 1185 H LEU 61 H LEU 61 -2.956 10.618 -3.913 1186 HA LEU 61 HA LEU 61 -0.936 11.336 -5.717 1187 1HB LEU 61 1HB LEU 61 -2.923 12.647 -4.149 1188 2HB LEU 61 2HB LEU 61 -1.396 13.505 -3.955 1189 HG LEU 61 HG LEU 61 -1.253 13.872 -6.338 1190 1HD1 LEU 61 1HD1 LEU 61 -3.274 13.229 -7.741 1191 2HD1 LEU 61 2HD1 LEU 61 -3.689 12.120 -6.434 1192 3HD1 LEU 61 3HD1 LEU 61 -2.162 11.933 -7.296 1193 1HD2 LEU 61 1HD2 LEU 61 -3.753 14.927 -6.502 1194 2HD2 LEU 61 2HD2 LEU 61 -2.392 15.688 -5.677 1195 3HD2 LEU 61 3HD2 LEU 61 -3.565 14.742 -4.758 1196 H LYS 62 H LYS 62 -0.854 10.703 -2.316 1197 HA LYS 62 HA LYS 62 1.623 12.052 -1.803 1198 1HB LYS 62 1HB LYS 62 -0.393 10.786 -0.266 1199 2HB LYS 62 2HB LYS 62 1.119 9.964 0.095 1200 1HG LYS 62 1HG LYS 62 0.759 11.765 1.657 1201 2HG LYS 62 2HG LYS 62 2.150 12.127 0.632 1202 1HD LYS 62 1HD LYS 62 1.114 13.871 -0.386 1203 2HD LYS 62 2HD LYS 62 -0.477 13.111 -0.308 1204 1HE LYS 62 1HE LYS 62 -0.912 13.921 1.786 1205 2HE LYS 62 2HE LYS 62 0.791 13.966 2.241 1206 1HZ LYS 62 1HZ LYS 62 -0.820 15.972 0.882 1207 2HZ LYS 62 2HZ LYS 62 0.772 15.803 0.338 1208 3HZ LYS 62 3HZ LYS 62 0.468 16.166 1.962 1209 H ALA 63 H ALA 63 0.700 8.620 -2.077 1210 HA ALA 63 HA ALA 63 3.350 7.635 -1.937 1211 1HB ALA 63 1HB ALA 63 0.990 6.267 -3.214 1212 2HB ALA 63 2HB ALA 63 2.436 5.514 -2.542 1213 3HB ALA 63 3HB ALA 63 1.281 6.313 -1.475 1214 H ARG 64 H ARG 64 1.276 8.605 -4.609 1215 HA ARG 64 HA ARG 64 2.770 7.559 -6.728 1216 1HB ARG 64 1HB ARG 64 0.446 8.650 -6.765 1217 2HB ARG 64 2HB ARG 64 1.302 10.183 -6.867 1218 1HG ARG 64 1HG ARG 64 2.457 8.572 -8.828 1219 2HG ARG 64 2HG ARG 64 0.722 8.268 -8.930 1220 1HD ARG 64 1HD ARG 64 1.850 11.049 -8.793 1221 2HD ARG 64 2HD ARG 64 1.671 10.189 -10.322 1222 HE ARG 64 HE ARG 64 -0.419 11.362 -8.737 1223 1HH1 ARG 64 1HH1 ARG 64 0.352 8.949 -11.126 1224 2HH1 ARG 64 2HH1 ARG 64 -1.256 8.884 -11.768 1225 1HH2 ARG 64 1HH2 ARG 64 -2.540 11.285 -9.575 1226 2HH2 ARG 64 2HH2 ARG 64 -2.899 10.214 -10.886 1227 H SER 65 H SER 65 3.011 10.676 -5.060 1228 HA SER 65 HA SER 65 5.027 11.763 -6.711 1229 1HB SER 65 1HB SER 65 3.470 12.806 -4.790 1230 2HB SER 65 2HB SER 65 4.940 12.558 -3.847 1231 HG SER 65 HG SER 65 5.414 14.438 -4.708 1232 H THR 66 H THR 66 5.095 9.510 -4.085 1233 HA THR 66 HA THR 66 7.926 9.805 -3.584 1234 HB THR 66 HB THR 66 6.842 7.339 -2.553 1235 HG1 THR 66 HG1 THR 66 5.367 9.721 -2.022 1236 1HG2 THR 66 1HG2 THR 66 8.017 7.966 -0.738 1237 2HG2 THR 66 2HG2 THR 66 7.295 9.575 -0.707 1238 3HG2 THR 66 3HG2 THR 66 8.649 9.236 -1.785 1239 H VAL 67 H VAL 67 5.810 7.341 -5.032 1240 HA VAL 67 HA VAL 67 7.703 5.431 -5.672 1241 HB VAL 67 HB VAL 67 5.302 6.201 -7.338 1242 1HG1 VAL 67 1HG1 VAL 67 5.559 3.559 -7.693 1243 2HG1 VAL 67 2HG1 VAL 67 6.313 4.751 -8.753 1244 3HG1 VAL 67 3HG1 VAL 67 7.255 3.987 -7.472 1245 1HG2 VAL 67 1HG2 VAL 67 4.775 3.887 -5.861 1246 2HG2 VAL 67 2HG2 VAL 67 5.528 5.008 -4.726 1247 3HG2 VAL 67 3HG2 VAL 67 4.084 5.491 -5.616 1248 H ARG 68 H ARG 68 6.619 8.170 -7.674 1249 HA ARG 68 HA ARG 68 8.167 7.726 -9.915 1250 1HB ARG 68 1HB ARG 68 8.015 10.155 -10.321 1251 2HB ARG 68 2HB ARG 68 6.472 9.463 -9.841 1252 1HG ARG 68 1HG ARG 68 6.768 10.311 -7.584 1253 2HG ARG 68 2HG ARG 68 8.347 10.965 -8.026 1254 1HD ARG 68 1HD ARG 68 6.542 12.664 -8.021 1255 2HD ARG 68 2HD ARG 68 7.337 12.490 -9.586 1256 HE ARG 68 HE ARG 68 5.041 10.838 -9.442 1257 1HH1 ARG 68 1HH1 ARG 68 6.020 14.159 -9.803 1258 2HH1 ARG 68 2HH1 ARG 68 4.603 14.617 -10.689 1259 1HH2 ARG 68 1HH2 ARG 68 3.171 11.428 -10.607 1260 2HH2 ARG 68 2HH2 ARG 68 2.982 13.063 -11.145 1261 H ASP 69 H ASP 69 9.112 8.961 -6.796 1262 HA ASP 69 HA ASP 69 11.586 10.101 -7.524 1263 1HB ASP 69 1HB ASP 69 10.122 9.851 -5.184 1264 2HB ASP 69 2HB ASP 69 11.566 8.892 -4.869 1265 H ILE 70 H ILE 70 10.675 6.834 -6.532 1266 HA ILE 70 HA ILE 70 13.162 5.684 -6.211 1267 HB ILE 70 HB ILE 70 10.734 4.401 -7.470 1268 1HG1 ILE 70 1HG1 ILE 70 11.618 4.205 -4.596 1269 2HG1 ILE 70 2HG1 ILE 70 10.526 5.471 -5.145 1270 1HG2 ILE 70 1HG2 ILE 70 13.231 3.222 -6.270 1271 2HG2 ILE 70 2HG2 ILE 70 11.763 2.296 -6.578 1272 3HG2 ILE 70 3HG2 ILE 70 12.634 3.039 -7.920 1273 1HD1 ILE 70 1HD1 ILE 70 9.014 3.663 -5.989 1274 2HD1 ILE 70 2HD1 ILE 70 10.061 2.505 -5.167 1275 3HD1 ILE 70 3HD1 ILE 70 9.203 3.734 -4.237 1276 H ASP 71 H ASP 71 11.305 6.056 -9.217 1277 HA ASP 71 HA ASP 71 13.590 6.425 -10.819 1278 1HB ASP 71 1HB ASP 71 12.716 3.649 -10.408 1279 2HB ASP 71 2HB ASP 71 12.877 4.110 -12.100 1280 HA PRO 72 HA PRO 72 10.577 7.886 -13.651 1281 1HB PRO 72 1HB PRO 72 11.741 7.396 -16.054 1282 2HB PRO 72 2HB PRO 72 12.308 8.655 -14.952 1283 1HG PRO 72 1HG PRO 72 13.381 5.895 -15.387 1284 2HG PRO 72 2HG PRO 72 14.264 7.421 -15.198 1285 1HD PRO 72 1HD PRO 72 13.976 5.645 -13.174 1286 2HD PRO 72 2HD PRO 72 14.066 7.397 -12.902 1287 H GLN 73 H GLN 73 11.842 4.662 -14.419 1288 HA GLN 73 HA GLN 73 9.553 3.959 -16.013 1289 1HB GLN 73 1HB GLN 73 11.748 2.203 -14.899 1290 2HB GLN 73 2HB GLN 73 10.582 1.739 -16.132 1291 1HG GLN 73 1HG GLN 73 11.663 2.845 -17.769 1292 2HG GLN 73 2HG GLN 73 12.169 4.154 -16.701 1293 1HE2 GLN 73 1HE2 GLN 73 14.284 4.284 -16.616 1294 2HE2 GLN 73 2HE2 GLN 73 15.391 2.959 -16.567 1295 H ASN 74 H ASN 74 8.296 4.741 -13.919 1296 HA ASN 74 HA ASN 74 7.387 2.282 -12.621 1297 1HB ASN 74 1HB ASN 74 8.368 4.756 -11.227 1298 2HB ASN 74 2HB ASN 74 7.149 3.734 -10.473 1299 1HD2 ASN 74 1HD2 ASN 74 10.387 3.720 -11.856 1300 2HD2 ASN 74 2HD2 ASN 74 10.988 2.417 -10.894 1301 H ASP 75 H ASP 75 5.217 2.309 -11.964 1302 HA ASP 75 HA ASP 75 3.614 4.680 -12.328 1303 1HB ASP 75 1HB ASP 75 3.901 2.783 -14.473 1304 2HB ASP 75 2HB ASP 75 2.238 2.778 -13.893 1305 H LEU 76 H LEU 76 2.125 4.668 -10.786 1306 HA LEU 76 HA LEU 76 1.713 2.477 -9.069 1307 1HB LEU 76 1HB LEU 76 0.340 5.102 -9.476 1308 2HB LEU 76 2HB LEU 76 -0.349 3.904 -8.381 1309 HG LEU 76 HG LEU 76 0.939 5.535 -7.143 1310 1HD1 LEU 76 1HD1 LEU 76 1.218 2.783 -6.977 1311 2HD1 LEU 76 2HD1 LEU 76 1.635 3.963 -5.735 1312 3HD1 LEU 76 3HD1 LEU 76 2.868 3.398 -6.863 1313 1HD2 LEU 76 1HD2 LEU 76 3.284 4.667 -8.829 1314 2HD2 LEU 76 2HD2 LEU 76 3.338 5.792 -7.472 1315 3HD2 LEU 76 3HD2 LEU 76 2.456 6.220 -8.939 1316 H THR 77 H THR 77 0.330 0.818 -9.115 1317 HA THR 77 HA THR 77 -2.081 0.930 -10.729 1318 HB THR 77 HB THR 77 -0.307 0.129 -12.294 1319 HG1 THR 77 HG1 THR 77 -2.645 -0.613 -12.214 1320 1HG2 THR 77 1HG2 THR 77 -0.202 -2.225 -10.402 1321 2HG2 THR 77 2HG2 THR 77 1.096 -1.070 -10.701 1322 3HG2 THR 77 3HG2 THR 77 0.565 -2.152 -11.988 1323 H PHE 78 H PHE 78 -1.074 0.516 -7.873 1324 HA PHE 78 HA PHE 78 -3.110 -1.182 -6.994 1325 1HB PHE 78 1HB PHE 78 -0.910 -2.630 -7.971 1326 2HB PHE 78 2HB PHE 78 -0.780 -2.703 -6.216 1327 HD1 PHE 78 HD1 PHE 78 -1.760 -4.610 -8.752 1328 HD2 PHE 78 HD2 PHE 78 -3.468 -2.863 -5.267 1329 HE1 PHE 78 HE1 PHE 78 -3.468 -6.380 -8.706 1330 HE2 PHE 78 HE2 PHE 78 -5.178 -4.630 -5.215 1331 HZ PHE 78 HZ PHE 78 -5.180 -6.393 -6.936 1332 H LEU 79 H LEU 79 -3.420 -0.964 -4.827 1333 HA LEU 79 HA LEU 79 -1.286 -0.209 -3.052 1334 1HB LEU 79 1HB LEU 79 -2.441 1.858 -4.389 1335 2HB LEU 79 2HB LEU 79 -3.448 1.775 -2.944 1336 HG LEU 79 HG LEU 79 -1.467 2.072 -1.542 1337 1HD1 LEU 79 1HD1 LEU 79 0.248 1.053 -2.825 1338 2HD1 LEU 79 2HD1 LEU 79 0.664 2.760 -2.679 1339 3HD1 LEU 79 3HD1 LEU 79 -0.025 2.147 -4.182 1340 1HD2 LEU 79 1HD2 LEU 79 -2.739 4.028 -2.331 1341 2HD2 LEU 79 2HD2 LEU 79 -1.649 4.160 -3.712 1342 3HD2 LEU 79 3HD2 LEU 79 -1.033 4.392 -2.075 1343 H ARG 80 H ARG 80 -1.792 -1.800 -1.643 1344 HA ARG 80 HA ARG 80 -4.493 -1.731 -0.465 1345 1HB ARG 80 1HB ARG 80 -2.753 -4.189 -0.577 1346 2HB ARG 80 2HB ARG 80 -4.466 -4.087 -0.189 1347 1HG ARG 80 1HG ARG 80 -4.945 -3.445 -2.504 1348 2HG ARG 80 2HG ARG 80 -3.227 -3.579 -2.886 1349 1HD ARG 80 1HD ARG 80 -5.122 -5.767 -2.062 1350 2HD ARG 80 2HD ARG 80 -4.253 -5.602 -3.587 1351 HE ARG 80 HE ARG 80 -2.253 -5.762 -1.797 1352 1HH1 ARG 80 1HH1 ARG 80 -5.098 -7.699 -2.321 1353 2HH1 ARG 80 2HH1 ARG 80 -4.366 -9.162 -1.751 1354 1HH2 ARG 80 1HH2 ARG 80 -1.278 -7.682 -1.044 1355 2HH2 ARG 80 2HH2 ARG 80 -2.193 -9.151 -1.024 1356 H ILE 81 H ILE 81 -4.662 -1.787 1.740 1357 HA ILE 81 HA ILE 81 -2.197 -2.037 3.310 1358 HB ILE 81 HB ILE 81 -4.182 0.178 3.804 1359 1HG1 ILE 81 1HG1 ILE 81 -1.469 0.384 2.480 1360 2HG1 ILE 81 2HG1 ILE 81 -3.007 0.473 1.628 1361 1HG2 ILE 81 1HG2 ILE 81 -1.825 0.910 4.943 1362 2HG2 ILE 81 2HG2 ILE 81 -3.142 0.101 5.790 1363 3HG2 ILE 81 3HG2 ILE 81 -1.790 -0.839 5.158 1364 1HD1 ILE 81 1HD1 ILE 81 -3.118 2.640 2.028 1365 2HD1 ILE 81 2HD1 ILE 81 -3.038 2.348 3.766 1366 3HD1 ILE 81 3HD1 ILE 81 -1.553 2.557 2.837 1367 H ARG 82 H ARG 82 -2.907 -4.026 4.086 1368 HA ARG 82 HA ARG 82 -5.480 -4.465 5.187 1369 1HB ARG 82 1HB ARG 82 -4.373 -6.493 6.222 1370 2HB ARG 82 2HB ARG 82 -4.270 -6.374 4.470 1371 1HG ARG 82 1HG ARG 82 -2.034 -6.188 4.484 1372 2HG ARG 82 2HG ARG 82 -2.025 -5.169 5.925 1373 1HD ARG 82 1HD ARG 82 -1.171 -6.984 6.934 1374 2HD ARG 82 2HD ARG 82 -2.844 -7.543 6.959 1375 HE ARG 82 HE ARG 82 -1.973 -8.430 4.575 1376 1HH1 ARG 82 1HH1 ARG 82 -0.657 -8.659 7.790 1377 2HH1 ARG 82 2HH1 ARG 82 0.129 -10.175 7.501 1378 1HH2 ARG 82 1HH2 ARG 82 -0.942 -10.427 4.182 1379 2HH2 ARG 82 2HH2 ARG 82 -0.033 -11.180 5.448 1380 H SER 83 H SER 83 -6.197 -3.326 6.871 1381 HA SER 83 HA SER 83 -4.355 -2.655 9.046 1382 1HB SER 83 1HB SER 83 -6.959 -1.584 9.501 1383 2HB SER 83 2HB SER 83 -5.476 -0.718 9.099 1384 HG SER 83 HG SER 83 -7.620 -1.369 7.513 1385 H LYS 84 H LYS 84 -5.100 -2.894 11.277 1386 HA LYS 84 HA LYS 84 -5.790 -5.481 11.943 1387 1HB LYS 84 1HB LYS 84 -6.288 -2.999 13.596 1388 2HB LYS 84 2HB LYS 84 -6.204 -4.645 14.210 1389 1HG LYS 84 1HG LYS 84 -3.831 -4.637 13.150 1390 2HG LYS 84 2HG LYS 84 -4.013 -2.882 13.213 1391 1HD LYS 84 1HD LYS 84 -3.046 -3.266 15.255 1392 2HD LYS 84 2HD LYS 84 -4.752 -3.384 15.692 1393 1HE LYS 84 1HE LYS 84 -4.595 -5.848 15.389 1394 2HE LYS 84 2HE LYS 84 -2.862 -5.663 15.118 1395 1HZ LYS 84 1HZ LYS 84 -2.472 -5.252 17.292 1396 2HZ LYS 84 2HZ LYS 84 -3.880 -6.166 17.493 1397 3HZ LYS 84 3HZ LYS 84 -3.953 -4.477 17.548 1398 H LYS 85 H LYS 85 -7.868 -2.731 11.321 1399 HA LYS 85 HA LYS 85 -10.260 -4.010 12.261 1400 1HB LYS 85 1HB LYS 85 -9.734 -1.509 10.664 1401 2HB LYS 85 2HB LYS 85 -11.364 -2.073 11.009 1402 1HG LYS 85 1HG LYS 85 -9.444 -1.726 13.259 1403 2HG LYS 85 2HG LYS 85 -10.207 -0.304 12.542 1404 1HD LYS 85 1HD LYS 85 -11.969 -2.591 13.216 1405 2HD LYS 85 2HD LYS 85 -11.300 -1.667 14.563 1406 1HE LYS 85 1HE LYS 85 -12.109 0.345 12.969 1407 2HE LYS 85 2HE LYS 85 -13.285 -0.890 12.519 1408 1HZ LYS 85 1HZ LYS 85 -14.139 0.408 14.327 1409 2HZ LYS 85 2HZ LYS 85 -12.755 0.129 15.257 1410 3HZ LYS 85 3HZ LYS 85 -13.803 -1.149 14.896 1411 H ASN 86 H ASN 86 -8.931 -3.243 9.050 1412 HA ASN 86 HA ASN 86 -9.788 -5.626 7.859 1413 1HB ASN 86 1HB ASN 86 -11.539 -4.430 6.317 1414 2HB ASN 86 2HB ASN 86 -12.033 -5.046 7.892 1415 1HD2 ASN 86 1HD2 ASN 86 -10.817 -2.127 6.306 1416 2HD2 ASN 86 2HD2 ASN 86 -11.711 -1.015 7.281 1417 H GLU 87 H GLU 87 -9.557 -5.574 5.458 1418 HA GLU 87 HA GLU 87 -7.330 -3.835 4.764 1419 1HB GLU 87 1HB GLU 87 -6.901 -5.318 2.963 1420 2HB GLU 87 2HB GLU 87 -7.332 -6.328 4.336 1421 1HG GLU 87 1HG GLU 87 -8.826 -7.322 3.048 1422 2HG GLU 87 2HG GLU 87 -9.739 -5.815 3.031 1423 H ILE 88 H ILE 88 -7.278 -2.487 2.953 1424 HA ILE 88 HA ILE 88 -9.864 -1.941 1.664 1425 HB ILE 88 HB ILE 88 -7.948 0.177 2.648 1426 1HG1 ILE 88 1HG1 ILE 88 -10.432 0.578 3.823 1427 2HG1 ILE 88 2HG1 ILE 88 -10.216 -1.167 3.894 1428 1HG2 ILE 88 1HG2 ILE 88 -10.308 0.214 0.869 1429 2HG2 ILE 88 2HG2 ILE 88 -10.185 1.514 2.053 1430 3HG2 ILE 88 3HG2 ILE 88 -8.885 1.255 0.890 1431 1HD1 ILE 88 1HD1 ILE 88 -8.655 0.994 5.210 1432 2HD1 ILE 88 2HD1 ILE 88 -9.273 -0.521 5.871 1433 3HD1 ILE 88 3HD1 ILE 88 -7.857 -0.529 4.820 1434 H MET 89 H MET 89 -9.383 -2.774 -0.310 1435 HA MET 89 HA MET 89 -6.860 -2.374 -1.596 1436 1HB MET 89 1HB MET 89 -9.450 -3.654 -2.302 1437 2HB MET 89 2HB MET 89 -8.397 -3.179 -3.627 1438 1HG MET 89 1HG MET 89 -6.620 -4.443 -2.062 1439 2HG MET 89 2HG MET 89 -8.087 -5.319 -1.631 1440 1HE MET 89 1HE MET 89 -9.325 -6.436 -5.198 1441 2HE MET 89 2HE MET 89 -9.841 -5.746 -3.659 1442 3HE MET 89 3HE MET 89 -9.346 -4.686 -4.980 1443 H VAL 90 H VAL 90 -6.221 -0.768 -2.893 1444 HA VAL 90 HA VAL 90 -8.189 0.933 -4.207 1445 HB VAL 90 HB VAL 90 -6.096 2.045 -2.333 1446 1HG1 VAL 90 1HG1 VAL 90 -6.230 3.452 -4.271 1447 2HG1 VAL 90 2HG1 VAL 90 -7.994 3.432 -4.219 1448 3HG1 VAL 90 3HG1 VAL 90 -7.083 4.246 -2.947 1449 1HG2 VAL 90 1HG2 VAL 90 -8.008 1.241 -1.117 1450 2HG2 VAL 90 2HG2 VAL 90 -8.068 3.003 -1.163 1451 3HG2 VAL 90 3HG2 VAL 90 -9.109 2.058 -2.226 1452 H ALA 91 H ALA 91 -7.554 1.432 -6.204 1453 HA ALA 91 HA ALA 91 -4.732 1.722 -6.838 1454 1HB ALA 91 1HB ALA 91 -5.701 -0.751 -7.138 1455 2HB ALA 91 2HB ALA 91 -6.174 -0.071 -8.696 1456 3HB ALA 91 3HB ALA 91 -4.479 -0.063 -8.209 1457 HA PRO 92 HA PRO 92 -6.205 4.777 -9.626 1458 1HB PRO 92 1HB PRO 92 -4.293 4.702 -11.552 1459 2HB PRO 92 2HB PRO 92 -4.010 5.376 -9.942 1460 1HG PRO 92 1HG PRO 92 -3.291 2.677 -11.019 1461 2HG PRO 92 2HG PRO 92 -2.327 3.773 -10.013 1462 1HD PRO 92 1HD PRO 92 -3.645 1.639 -8.992 1463 2HD PRO 92 2HD PRO 92 -3.399 3.138 -8.074 1464 H ASP 93 H ASP 93 -8.002 4.432 -10.776 1465 HA ASP 93 HA ASP 93 -8.090 2.274 -12.741 1466 1HB ASP 93 1HB ASP 93 -9.962 3.268 -10.949 1467 2HB ASP 93 2HB ASP 93 -10.502 3.894 -12.505 1468 H LYS 94 H LYS 94 -9.935 3.236 -14.532 1469 HA LYS 94 HA LYS 94 -8.423 4.488 -16.454 1470 1HB LYS 94 1HB LYS 94 -11.164 3.736 -16.128 1471 2HB LYS 94 2HB LYS 94 -11.104 5.340 -16.847 1472 1HG LYS 94 1HG LYS 94 -9.231 3.462 -18.055 1473 2HG LYS 94 2HG LYS 94 -10.920 2.972 -18.201 1474 1HD LYS 94 1HD LYS 94 -10.730 4.283 -20.066 1475 2HD LYS 94 2HD LYS 94 -11.230 5.503 -18.892 1476 1HE LYS 94 1HE LYS 94 -8.666 5.773 -18.505 1477 2HE LYS 94 2HE LYS 94 -8.534 5.005 -20.086 1478 1HZ LYS 94 1HZ LYS 94 -10.315 7.321 -19.703 1479 2HZ LYS 94 2HZ LYS 94 -9.584 6.763 -21.122 1480 3HZ LYS 94 3HZ LYS 94 -8.657 7.554 -19.949 1481 H ASP 95 H ASP 95 -10.798 6.041 -14.298 1482 HA ASP 95 HA ASP 95 -9.213 8.468 -14.291 1483 1HB ASP 95 1HB ASP 95 -11.168 9.888 -14.928 1484 2HB ASP 95 2HB ASP 95 -10.567 8.880 -16.243 1485 H TYR 96 H TYR 96 -10.421 6.296 -12.499 1486 HA TYR 96 HA TYR 96 -11.267 8.143 -10.399 1487 1HB TYR 96 1HB TYR 96 -13.075 6.470 -9.747 1488 2HB TYR 96 2HB TYR 96 -13.392 7.449 -11.176 1489 HD1 TYR 96 HD1 TYR 96 -12.900 4.100 -9.888 1490 HD2 TYR 96 HD2 TYR 96 -13.176 6.430 -13.438 1491 HE1 TYR 96 HE1 TYR 96 -13.290 2.053 -11.195 1492 HE2 TYR 96 HE2 TYR 96 -13.567 4.390 -14.754 1493 HH TYR 96 HH TYR 96 -14.607 1.746 -13.785 1494 H PHE 97 H PHE 97 -11.387 6.980 -8.245 1495 HA PHE 97 HA PHE 97 -9.253 4.953 -8.115 1496 1HB PHE 97 1HB PHE 97 -9.888 7.291 -6.346 1497 2HB PHE 97 2HB PHE 97 -9.042 5.893 -5.689 1498 HD1 PHE 97 HD1 PHE 97 -6.995 5.088 -7.181 1499 HD2 PHE 97 HD2 PHE 97 -8.625 9.019 -7.158 1500 HE1 PHE 97 HE1 PHE 97 -4.865 5.972 -8.040 1501 HE2 PHE 97 HE2 PHE 97 -6.498 9.910 -8.017 1502 HZ PHE 97 HZ PHE 97 -4.615 8.386 -8.460 1503 H LEU 98 H LEU 98 -10.273 3.049 -7.906 1504 HA LEU 98 HA LEU 98 -12.742 2.723 -6.523 1505 1HB LEU 98 1HB LEU 98 -11.388 1.273 -8.370 1506 2HB LEU 98 2HB LEU 98 -11.049 0.348 -6.909 1507 HG LEU 98 HG LEU 98 -13.879 1.031 -7.288 1508 1HD1 LEU 98 1HD1 LEU 98 -13.097 0.641 -9.629 1509 2HD1 LEU 98 2HD1 LEU 98 -14.307 -0.507 -9.059 1510 3HD1 LEU 98 3HD1 LEU 98 -12.610 -0.981 -9.136 1511 1HD2 LEU 98 1HD2 LEU 98 -12.419 -0.723 -5.775 1512 2HD2 LEU 98 2HD2 LEU 98 -13.051 -1.761 -7.053 1513 3HD2 LEU 98 3HD2 LEU 98 -14.157 -0.815 -6.056 1514 H ILE 99 H ILE 99 -13.160 1.799 -4.532 1515 HA ILE 99 HA ILE 99 -10.867 1.216 -2.798 1516 HB ILE 99 HB ILE 99 -13.169 3.004 -2.007 1517 1HG1 ILE 99 1HG1 ILE 99 -10.734 4.319 -1.610 1518 2HG1 ILE 99 2HG1 ILE 99 -10.569 3.540 -3.180 1519 1HG2 ILE 99 1HG2 ILE 99 -11.975 3.262 0.111 1520 2HG2 ILE 99 2HG2 ILE 99 -12.424 1.582 -0.174 1521 3HG2 ILE 99 3HG2 ILE 99 -10.760 2.106 -0.432 1522 1HD1 ILE 99 1HD1 ILE 99 -12.645 4.617 -3.912 1523 2HD1 ILE 99 2HD1 ILE 99 -12.759 5.427 -2.349 1524 3HD1 ILE 99 3HD1 ILE 99 -11.414 5.785 -3.432 1525 H VAL 100 H VAL 100 -11.185 -0.889 -2.405 1526 HA VAL 100 HA VAL 100 -13.891 -1.788 -1.675 1527 HB VAL 100 HB VAL 100 -11.541 -3.470 -2.556 1528 1HG1 VAL 100 1HG1 VAL 100 -14.321 -4.088 -1.681 1529 2HG1 VAL 100 2HG1 VAL 100 -13.573 -5.093 -2.923 1530 3HG1 VAL 100 3HG1 VAL 100 -12.815 -4.939 -1.337 1531 1HG2 VAL 100 1HG2 VAL 100 -13.915 -2.396 -4.056 1532 2HG2 VAL 100 2HG2 VAL 100 -12.203 -2.235 -4.451 1533 3HG2 VAL 100 3HG2 VAL 100 -13.002 -3.799 -4.611 1534 H ILE 101 H ILE 101 -14.201 -1.885 0.446 1535 HA ILE 101 HA ILE 101 -11.938 -2.598 2.184 1536 HB ILE 101 HB ILE 101 -14.556 -1.368 3.039 1537 1HG1 ILE 101 1HG1 ILE 101 -11.920 0.004 2.464 1538 2HG1 ILE 101 2HG1 ILE 101 -13.372 0.127 1.475 1539 1HG2 ILE 101 1HG2 ILE 101 -12.564 -2.588 4.508 1540 2HG2 ILE 101 2HG2 ILE 101 -12.192 -0.871 4.651 1541 3HG2 ILE 101 3HG2 ILE 101 -13.780 -1.472 5.128 1542 1HD1 ILE 101 1HD1 ILE 101 -14.510 1.048 3.550 1543 2HD1 ILE 101 2HD1 ILE 101 -12.888 1.214 4.223 1544 3HD1 ILE 101 3HD1 ILE 101 -13.325 2.081 2.751 1545 H GLN 102 H GLN 102 -11.948 -4.447 3.303 1546 HA GLN 102 HA GLN 102 -14.319 -5.768 4.157 1547 1HB GLN 102 1HB GLN 102 -14.313 -7.692 2.775 1548 2HB GLN 102 2HB GLN 102 -14.231 -6.315 1.684 1549 1HG GLN 102 1HG GLN 102 -11.784 -6.647 1.524 1550 2HG GLN 102 2HG GLN 102 -11.954 -8.098 2.510 1551 1HE2 GLN 102 1HE2 GLN 102 -11.906 -6.877 -0.593 1552 2HE2 GLN 102 2HE2 GLN 102 -12.549 -8.245 -1.428 1553 H ASN 103 H ASN 103 -13.758 -8.015 5.049 1554 HA ASN 103 HA ASN 103 -11.811 -7.796 6.991 1555 1HB ASN 103 1HB ASN 103 -13.450 -9.982 5.890 1556 2HB ASN 103 2HB ASN 103 -11.968 -10.504 6.685 1557 1HD2 ASN 103 1HD2 ASN 103 -15.044 -8.949 7.085 1558 2HD2 ASN 103 2HD2 ASN 103 -15.074 -8.999 8.812 1559 HA PRO 104 HA PRO 104 -7.909 -8.702 5.203 1560 1HB PRO 104 1HB PRO 104 -6.742 -10.267 7.089 1561 2HB PRO 104 2HB PRO 104 -7.006 -8.533 7.309 1562 1HG PRO 104 1HG PRO 104 -8.620 -10.839 8.328 1563 2HG PRO 104 2HG PRO 104 -8.137 -9.354 9.168 1564 1HD PRO 104 1HD PRO 104 -10.610 -9.696 8.120 1565 2HD PRO 104 2HD PRO 104 -9.818 -8.110 8.199 1566 H THR 105 H THR 105 -6.790 -10.209 3.992 1567 HA THR 105 HA THR 105 -8.095 -12.836 3.728 1568 HB THR 105 HB THR 105 -7.164 -12.921 1.453 1569 HG1 THR 105 HG1 THR 105 -5.363 -11.648 1.545 1570 1HG2 THR 105 1HG2 THR 105 -8.859 -11.710 0.552 1571 2HG2 THR 105 2HG2 THR 105 -8.448 -10.257 1.462 1572 3HG2 THR 105 3HG2 THR 105 -9.345 -11.560 2.240 1573 H GLU 106 H GLU 106 -4.962 -11.209 3.898 1574 HA GLU 106 HA GLU 106 -3.745 -13.805 4.576 1575 1HB GLU 106 1HB GLU 106 -3.050 -11.975 2.464 1576 2HB GLU 106 2HB GLU 106 -1.712 -12.119 3.595 1577 1HG GLU 106 1HG GLU 106 -3.090 -14.523 2.453 1578 2HG GLU 106 2HG GLU 106 -1.761 -13.718 1.622 Start of MODEL 11 1 H MET 11 H MET 11 17.402 -8.149 15.002 2 HA MET 11 HA MET 11 17.693 -7.788 12.283 3 1HB MET 11 1HB MET 11 19.227 -6.899 14.024 4 2HB MET 11 2HB MET 11 19.897 -8.513 14.221 5 1HG MET 11 1HG MET 11 21.402 -7.922 12.704 6 2HG MET 11 2HG MET 11 20.109 -8.080 11.517 7 1HE MET 11 1HE MET 11 21.613 -6.712 10.082 8 2HE MET 11 2HE MET 11 20.058 -5.971 9.702 9 3HE MET 11 3HE MET 11 21.473 -4.956 9.983 10 H ALA 12 H ALA 12 18.849 -10.566 14.196 11 HA ALA 12 HA ALA 12 19.916 -12.087 12.155 12 1HB ALA 12 1HB ALA 12 19.963 -13.842 13.633 13 2HB ALA 12 2HB ALA 12 19.784 -12.481 14.741 14 3HB ALA 12 3HB ALA 12 18.380 -13.458 14.310 15 H GLU 13 H GLU 13 16.547 -11.847 13.201 16 HA GLU 13 HA GLU 13 15.427 -13.911 11.744 17 1HB GLU 13 1HB GLU 13 14.425 -12.007 13.360 18 2HB GLU 13 2HB GLU 13 13.909 -11.364 11.807 19 1HG GLU 13 1HG GLU 13 12.580 -13.224 11.343 20 2HG GLU 13 2HG GLU 13 13.376 -14.211 12.568 21 H VAL 14 H VAL 14 15.883 -10.533 10.710 22 HA VAL 14 HA VAL 14 14.898 -10.886 8.095 23 HB VAL 14 HB VAL 14 16.961 -8.857 8.952 24 1HG1 VAL 14 1HG1 VAL 14 15.291 -7.643 7.177 25 2HG1 VAL 14 2HG1 VAL 14 16.838 -8.383 6.762 26 3HG1 VAL 14 3HG1 VAL 14 15.340 -9.290 6.550 27 1HG2 VAL 14 1HG2 VAL 14 14.031 -9.023 9.467 28 2HG2 VAL 14 2HG2 VAL 14 15.326 -8.437 10.510 29 3HG2 VAL 14 3HG2 VAL 14 14.758 -7.444 9.168 30 H GLU 15 H GLU 15 18.119 -11.226 9.481 31 HA GLU 15 HA GLU 15 19.548 -11.460 7.068 32 1HB GLU 15 1HB GLU 15 20.086 -12.423 9.869 33 2HB GLU 15 2HB GLU 15 21.205 -12.747 8.552 34 1HG GLU 15 1HG GLU 15 21.515 -10.382 8.182 35 2HG GLU 15 2HG GLU 15 20.310 -10.005 9.411 36 H GLU 16 H GLU 16 17.929 -13.855 9.099 37 HA GLU 16 HA GLU 16 18.829 -16.153 7.753 38 1HB GLU 16 1HB GLU 16 17.332 -15.704 9.977 39 2HB GLU 16 2HB GLU 16 16.094 -16.248 8.854 40 1HG GLU 16 1HG GLU 16 18.337 -17.980 8.632 41 2HG GLU 16 2HG GLU 16 17.928 -17.798 10.337 42 H THR 17 H THR 17 16.088 -14.013 7.189 43 HA THR 17 HA THR 17 14.984 -15.646 5.094 44 HB THR 17 HB THR 17 14.360 -12.797 5.893 45 HG1 THR 17 HG1 THR 17 13.640 -14.076 7.511 46 1HG2 THR 17 1HG2 THR 17 12.276 -13.142 4.592 47 2HG2 THR 17 2HG2 THR 17 12.931 -14.671 4.005 48 3HG2 THR 17 3HG2 THR 17 13.725 -13.153 3.587 49 H LEU 18 H LEU 18 17.304 -13.089 5.328 50 HA LEU 18 HA LEU 18 17.172 -12.214 2.622 51 1HB LEU 18 1HB LEU 18 18.641 -11.563 4.981 52 2HB LEU 18 2HB LEU 18 19.771 -11.781 3.647 53 HG LEU 18 HG LEU 18 17.928 -10.175 2.483 54 1HD1 LEU 18 1HD1 LEU 18 16.584 -9.860 4.430 55 2HD1 LEU 18 2HD1 LEU 18 17.470 -8.365 4.134 56 3HD1 LEU 18 3HD1 LEU 18 17.997 -9.464 5.408 57 1HD2 LEU 18 1HD2 LEU 18 20.114 -8.995 4.157 58 2HD2 LEU 18 2HD2 LEU 18 19.563 -8.522 2.550 59 3HD2 LEU 18 3HD2 LEU 18 20.484 -10.011 2.764 60 H LYS 19 H LYS 19 19.203 -14.532 4.364 61 HA LYS 19 HA LYS 19 20.992 -15.156 2.322 62 1HB LYS 19 1HB LYS 19 20.304 -16.192 4.892 63 2HB LYS 19 2HB LYS 19 20.412 -17.539 3.766 64 1HG LYS 19 1HG LYS 19 22.590 -17.489 4.262 65 2HG LYS 19 2HG LYS 19 22.646 -16.142 3.124 66 1HD LYS 19 1HD LYS 19 23.604 -15.074 4.871 67 2HD LYS 19 2HD LYS 19 21.926 -14.831 5.362 68 1HE LYS 19 1HE LYS 19 22.662 -17.365 6.318 69 2HE LYS 19 2HE LYS 19 24.019 -16.298 6.675 70 1HZ LYS 19 1HZ LYS 19 21.990 -16.520 8.301 71 2HZ LYS 19 2HZ LYS 19 21.320 -15.344 7.286 72 3HZ LYS 19 3HZ LYS 19 22.779 -15.039 8.086 73 H ARG 20 H ARG 20 17.843 -16.605 3.090 74 HA ARG 20 HA ARG 20 17.930 -18.505 0.974 75 1HB ARG 20 1HB ARG 20 16.517 -18.709 3.031 76 2HB ARG 20 2HB ARG 20 15.493 -17.427 2.398 77 1HG ARG 20 1HG ARG 20 14.285 -19.082 1.521 78 2HG ARG 20 2HG ARG 20 15.563 -19.182 0.308 79 1HD ARG 20 1HD ARG 20 15.674 -20.708 2.895 80 2HD ARG 20 2HD ARG 20 14.882 -21.349 1.457 81 HE ARG 20 HE ARG 20 17.500 -20.501 0.826 82 1HH1 ARG 20 1HH1 ARG 20 15.779 -23.026 2.494 83 2HH1 ARG 20 2HH1 ARG 20 17.017 -24.212 2.246 84 1HH2 ARG 20 1HH2 ARG 20 19.137 -22.054 0.493 85 2HH2 ARG 20 2HH2 ARG 20 18.927 -23.658 1.108 86 H LEU 21 H LEU 21 16.445 -15.311 1.344 87 HA LEU 21 HA LEU 21 15.060 -15.242 -1.087 88 1HB LEU 21 1HB LEU 21 15.937 -13.313 0.932 89 2HB LEU 21 2HB LEU 21 15.781 -12.636 -0.687 90 HG LEU 21 HG LEU 21 13.454 -13.245 -0.773 91 1HD1 LEU 21 1HD1 LEU 21 12.772 -15.044 0.334 92 2HD1 LEU 21 2HD1 LEU 21 12.803 -14.071 1.805 93 3HD1 LEU 21 3HD1 LEU 21 14.209 -15.037 1.357 94 1HD2 LEU 21 1HD2 LEU 21 12.602 -11.920 1.167 95 2HD2 LEU 21 2HD2 LEU 21 13.877 -11.126 0.242 96 3HD2 LEU 21 3HD2 LEU 21 14.250 -11.881 1.793 97 H GLN 22 H GLN 22 18.341 -14.144 -0.282 98 HA GLN 22 HA GLN 22 19.043 -13.066 -2.742 99 1HB GLN 22 1HB GLN 22 20.345 -13.655 -0.326 100 2HB GLN 22 2HB GLN 22 21.275 -14.476 -1.572 101 1HG GLN 22 1HG GLN 22 22.260 -12.565 -2.064 102 2HG GLN 22 2HG GLN 22 20.701 -11.905 -2.557 103 1HE2 GLN 22 1HE2 GLN 22 19.389 -10.906 -0.879 104 2HE2 GLN 22 2HE2 GLN 22 20.175 -10.093 0.426 105 H SER 23 H SER 23 18.696 -16.375 -1.780 106 HA SER 23 HA SER 23 20.161 -17.429 -4.037 107 1HB SER 23 1HB SER 23 20.155 -18.670 -1.929 108 2HB SER 23 2HB SER 23 18.398 -18.811 -1.998 109 HG SER 23 HG SER 23 20.193 -19.858 -3.933 110 H GLN 24 H GLN 24 16.874 -16.638 -3.232 111 HA GLN 24 HA GLN 24 15.518 -18.188 -5.128 112 1HB GLN 24 1HB GLN 24 14.823 -15.475 -3.993 113 2HB GLN 24 2HB GLN 24 13.720 -16.472 -4.932 114 1HG GLN 24 1HG GLN 24 13.941 -18.244 -3.214 115 2HG GLN 24 2HG GLN 24 14.920 -17.135 -2.255 116 1HE2 GLN 24 1HE2 GLN 24 13.588 -14.777 -2.604 117 2HE2 GLN 24 2HE2 GLN 24 12.014 -14.884 -1.899 118 H LYS 25 H LYS 25 14.523 -17.501 -7.138 119 HA LYS 25 HA LYS 25 16.330 -15.774 -8.678 120 1HB LYS 25 1HB LYS 25 16.096 -18.048 -9.525 121 2HB LYS 25 2HB LYS 25 14.348 -17.868 -9.591 122 1HG LYS 25 1HG LYS 25 14.418 -16.836 -11.566 123 2HG LYS 25 2HG LYS 25 15.771 -15.810 -11.085 124 1HD LYS 25 1HD LYS 25 17.331 -17.618 -11.531 125 2HD LYS 25 2HD LYS 25 15.994 -18.699 -11.932 126 1HE LYS 25 1HE LYS 25 15.825 -17.883 -14.006 127 2HE LYS 25 2HE LYS 25 15.936 -16.214 -13.448 128 1HZ LYS 25 1HZ LYS 25 18.456 -17.278 -13.129 129 2HZ LYS 25 2HZ LYS 25 17.961 -16.177 -14.313 130 3HZ LYS 25 3HZ LYS 25 17.935 -17.836 -14.638 131 H GLY 26 H GLY 26 15.459 -13.761 -8.148 132 1HA GLY 26 1HA GLY 26 13.726 -12.514 -9.757 133 2HA GLY 26 2HA GLY 26 12.630 -13.272 -8.611 134 H VAL 27 H VAL 27 14.889 -12.902 -6.552 135 HA VAL 27 HA VAL 27 13.886 -10.449 -5.486 136 HB VAL 27 HB VAL 27 16.212 -12.146 -4.569 137 1HG1 VAL 27 1HG1 VAL 27 15.108 -10.725 -2.423 138 2HG1 VAL 27 2HG1 VAL 27 16.688 -10.486 -3.171 139 3HG1 VAL 27 3HG1 VAL 27 15.297 -9.555 -3.729 140 1HG2 VAL 27 1HG2 VAL 27 13.887 -13.178 -4.621 141 2HG2 VAL 27 2HG2 VAL 27 14.733 -13.204 -3.074 142 3HG2 VAL 27 3HG2 VAL 27 13.462 -12.016 -3.363 143 H GLN 28 H GLN 28 14.590 -8.456 -5.853 144 HA GLN 28 HA GLN 28 16.988 -8.041 -7.424 145 1HB GLN 28 1HB GLN 28 14.570 -6.525 -6.791 146 2HB GLN 28 2HB GLN 28 16.026 -5.539 -6.769 147 1HG GLN 28 1HG GLN 28 16.462 -5.894 -9.009 148 2HG GLN 28 2HG GLN 28 15.488 -7.362 -9.070 149 1HE2 GLN 28 1HE2 GLN 28 13.946 -6.978 -10.503 150 2HE2 GLN 28 2HE2 GLN 28 12.902 -5.602 -10.515 151 H GLY 29 H GLY 29 15.869 -7.533 -4.141 152 1HA GLY 29 1HA GLY 29 18.290 -7.603 -2.887 153 2HA GLY 29 2HA GLY 29 18.125 -5.922 -3.371 154 H ILE 30 H ILE 30 18.078 -7.438 -0.716 155 HA ILE 30 HA ILE 30 15.478 -6.481 0.269 156 HB ILE 30 HB ILE 30 17.406 -8.281 1.732 157 1HG1 ILE 30 1HG1 ILE 30 15.288 -9.865 1.003 158 2HG1 ILE 30 2HG1 ILE 30 15.498 -8.861 -0.427 159 1HG2 ILE 30 1HG2 ILE 30 14.487 -7.654 2.149 160 2HG2 ILE 30 2HG2 ILE 30 15.415 -8.837 3.069 161 3HG2 ILE 30 3HG2 ILE 30 15.830 -7.125 3.162 162 1HD1 ILE 30 1HD1 ILE 30 18.029 -9.536 -0.075 163 2HD1 ILE 30 2HD1 ILE 30 17.284 -10.916 0.731 164 3HD1 ILE 30 3HD1 ILE 30 16.896 -10.563 -0.953 165 H ILE 31 H ILE 31 15.356 -4.823 1.656 166 HA ILE 31 HA ILE 31 17.871 -3.803 2.809 167 HB ILE 31 HB ILE 31 15.511 -2.182 1.846 168 1HG1 ILE 31 1HG1 ILE 31 18.266 -1.833 0.776 169 2HG1 ILE 31 2HG1 ILE 31 17.374 -3.259 0.258 170 1HG2 ILE 31 1HG2 ILE 31 17.118 -0.263 2.327 171 2HG2 ILE 31 2HG2 ILE 31 16.359 -1.044 3.713 172 3HG2 ILE 31 3HG2 ILE 31 18.029 -1.423 3.293 173 1HD1 ILE 31 1HD1 ILE 31 17.270 -0.847 -0.956 174 2HD1 ILE 31 2HD1 ILE 31 16.005 -2.072 -1.052 175 3HD1 ILE 31 3HD1 ILE 31 15.868 -0.752 0.109 176 H VAL 32 H VAL 32 17.825 -3.034 4.906 177 HA VAL 32 HA VAL 32 15.297 -3.351 6.380 178 HB VAL 32 HB VAL 32 17.936 -4.112 7.599 179 1HG1 VAL 32 1HG1 VAL 32 15.900 -3.624 9.000 180 2HG1 VAL 32 2HG1 VAL 32 15.154 -5.046 8.269 181 3HG1 VAL 32 3HG1 VAL 32 16.621 -5.216 9.235 182 1HG2 VAL 32 1HG2 VAL 32 17.383 -6.466 7.110 183 2HG2 VAL 32 2HG2 VAL 32 16.037 -5.922 6.109 184 3HG2 VAL 32 3HG2 VAL 32 17.693 -5.528 5.649 185 H VAL 33 H VAL 33 14.751 -1.460 7.223 186 HA VAL 33 HA VAL 33 16.890 0.367 8.103 187 HB VAL 33 HB VAL 33 14.078 1.217 7.447 188 1HG1 VAL 33 1HG1 VAL 33 15.204 2.864 8.695 189 2HG1 VAL 33 2HG1 VAL 33 16.707 2.631 7.800 190 3HG1 VAL 33 3HG1 VAL 33 15.321 3.391 7.016 191 1HG2 VAL 33 1HG2 VAL 33 15.291 2.045 5.276 192 2HG2 VAL 33 2HG2 VAL 33 16.372 0.694 5.615 193 3HG2 VAL 33 3HG2 VAL 33 14.650 0.404 5.374 194 H ASN 34 H ASN 34 16.873 1.147 10.148 195 HA ASN 34 HA ASN 34 15.017 -0.086 12.013 196 1HB ASN 34 1HB ASN 34 16.503 0.918 13.748 197 2HB ASN 34 2HB ASN 34 17.355 -0.136 12.624 198 1HD2 ASN 34 1HD2 ASN 34 19.298 0.907 13.199 199 2HD2 ASN 34 2HD2 ASN 34 19.700 2.459 12.556 200 H THR 35 H THR 35 14.716 1.627 14.025 201 HA THR 35 HA THR 35 12.683 3.365 13.145 202 HB THR 35 HB THR 35 13.527 4.284 15.672 203 HG1 THR 35 HG1 THR 35 14.382 2.608 16.634 204 1HG2 THR 35 1HG2 THR 35 11.521 2.957 16.436 205 2HG2 THR 35 2HG2 THR 35 11.389 2.353 14.784 206 3HG2 THR 35 3HG2 THR 35 11.224 4.078 15.108 207 H GLU 36 H GLU 36 16.057 3.922 14.027 208 HA GLU 36 HA GLU 36 16.002 6.729 14.010 209 1HB GLU 36 1HB GLU 36 18.103 4.641 13.802 210 2HB GLU 36 2HB GLU 36 18.533 6.256 13.257 211 1HG GLU 36 1HG GLU 36 17.363 6.817 15.630 212 2HG GLU 36 2HG GLU 36 18.066 5.236 15.966 213 H GLY 37 H GLY 37 16.069 4.401 11.437 214 1HA GLY 37 1HA GLY 37 15.336 5.019 9.241 215 2HA GLY 37 2HA GLY 37 16.010 6.620 9.506 216 H ILE 38 H ILE 38 18.064 4.185 10.615 217 HA ILE 38 HA ILE 38 19.827 4.610 8.323 218 HB ILE 38 HB ILE 38 20.456 3.257 10.948 219 1HG1 ILE 38 1HG1 ILE 38 21.013 6.098 10.069 220 2HG1 ILE 38 2HG1 ILE 38 19.805 5.620 11.256 221 1HG2 ILE 38 1HG2 ILE 38 22.778 3.580 10.310 222 2HG2 ILE 38 2HG2 ILE 38 21.927 2.638 9.087 223 3HG2 ILE 38 3HG2 ILE 38 22.275 4.343 8.802 224 1HD1 ILE 38 1HD1 ILE 38 21.693 4.636 12.599 225 2HD1 ILE 38 2HD1 ILE 38 22.791 5.452 11.485 226 3HD1 ILE 38 3HD1 ILE 38 21.667 6.394 12.466 227 HA PRO 39 HA PRO 39 18.879 0.609 6.685 228 1HB PRO 39 1HB PRO 39 20.923 0.478 4.903 229 2HB PRO 39 2HB PRO 39 19.489 1.480 4.648 230 1HG PRO 39 1HG PRO 39 22.198 2.269 5.649 231 2HG PRO 39 2HG PRO 39 21.150 3.100 4.485 232 1HD PRO 39 1HD PRO 39 21.340 3.863 7.075 233 2HD PRO 39 2HD PRO 39 19.843 4.036 6.137 234 H ILE 40 H ILE 40 19.472 -0.346 8.809 235 HA ILE 40 HA ILE 40 21.992 -1.058 9.647 236 HB ILE 40 HB ILE 40 20.833 -3.153 10.601 237 1HG1 ILE 40 1HG1 ILE 40 18.344 -1.660 9.779 238 2HG1 ILE 40 2HG1 ILE 40 18.991 -2.996 8.833 239 1HG2 ILE 40 1HG2 ILE 40 20.626 -1.876 12.406 240 2HG2 ILE 40 2HG2 ILE 40 20.902 -0.470 11.379 241 3HG2 ILE 40 3HG2 ILE 40 19.257 -1.016 11.703 242 1HD1 ILE 40 1HD1 ILE 40 17.137 -3.302 10.721 243 2HD1 ILE 40 2HD1 ILE 40 18.319 -4.549 10.323 244 3HD1 ILE 40 3HD1 ILE 40 18.583 -3.494 11.712 245 H LYS 41 H LYS 41 19.990 -2.591 7.193 246 HA LYS 41 HA LYS 41 22.333 -4.053 6.250 247 1HB LYS 41 1HB LYS 41 20.239 -5.302 7.693 248 2HB LYS 41 2HB LYS 41 20.061 -5.786 6.012 249 1HG LYS 41 1HG LYS 41 22.792 -6.007 6.578 250 2HG LYS 41 2HG LYS 41 21.949 -6.681 7.975 251 1HD LYS 41 1HD LYS 41 20.627 -8.104 6.453 252 2HD LYS 41 2HD LYS 41 21.544 -7.464 5.087 253 1HE LYS 41 1HE LYS 41 22.737 -8.938 7.433 254 2HE LYS 41 2HE LYS 41 22.364 -9.664 5.871 255 1HZ LYS 41 1HZ LYS 41 24.254 -8.900 5.037 256 2HZ LYS 41 2HZ LYS 41 24.704 -8.413 6.593 257 3HZ LYS 41 3HZ LYS 41 23.936 -7.321 5.554 258 H SER 42 H SER 42 22.312 -4.512 4.050 259 HA SER 42 HA SER 42 20.017 -4.134 2.406 260 1HB SER 42 1HB SER 42 20.866 -2.142 1.169 261 2HB SER 42 2HB SER 42 20.419 -1.780 2.836 262 HG SER 42 HG SER 42 23.011 -2.098 1.745 263 H THR 43 H THR 43 20.386 -4.704 0.236 264 HA THR 43 HA THR 43 23.069 -5.791 -0.319 265 HB THR 43 HB THR 43 22.154 -7.700 -1.386 266 HG1 THR 43 HG1 THR 43 20.356 -7.294 -2.445 267 1HG2 THR 43 1HG2 THR 43 21.629 -8.777 0.505 268 2HG2 THR 43 2HG2 THR 43 20.171 -7.813 0.741 269 3HG2 THR 43 3HG2 THR 43 21.729 -7.207 1.301 270 H MET 44 H MET 44 20.811 -3.554 -1.211 271 HA MET 44 HA MET 44 21.104 -3.746 -4.072 272 1HB MET 44 1HB MET 44 19.987 -1.483 -2.407 273 2HB MET 44 2HB MET 44 19.799 -1.687 -4.143 274 1HG MET 44 1HG MET 44 18.897 -3.970 -2.548 275 2HG MET 44 2HG MET 44 18.002 -2.478 -2.272 276 1HE MET 44 1HE MET 44 18.588 -4.081 -6.550 277 2HE MET 44 2HE MET 44 19.649 -2.895 -5.790 278 3HE MET 44 3HE MET 44 19.596 -4.550 -5.180 279 H ASP 45 H ASP 45 21.507 -1.229 -4.954 280 HA ASP 45 HA ASP 45 24.325 -0.946 -4.762 281 1HB ASP 45 1HB ASP 45 22.422 1.114 -5.876 282 2HB ASP 45 2HB ASP 45 24.103 0.838 -6.325 283 H ASN 46 H ASN 46 25.403 1.147 -4.230 284 HA ASN 46 HA ASN 46 24.942 1.842 -1.554 285 1HB ASN 46 1HB ASN 46 26.915 2.357 -3.499 286 2HB ASN 46 2HB ASN 46 26.365 3.933 -2.936 287 1HD2 ASN 46 1HD2 ASN 46 25.754 3.359 -0.315 288 2HD2 ASN 46 2HD2 ASN 46 27.205 2.957 0.534 289 HA PRO 47 HA PRO 47 23.094 5.998 -3.192 290 1HB PRO 47 1HB PRO 47 22.515 6.139 -5.841 291 2HB PRO 47 2HB PRO 47 24.085 6.604 -5.174 292 1HG PRO 47 1HG PRO 47 23.276 4.051 -6.511 293 2HG PRO 47 2HG PRO 47 24.759 5.001 -6.718 294 1HD PRO 47 1HD PRO 47 24.658 2.774 -5.182 295 2HD PRO 47 2HD PRO 47 25.725 4.144 -4.809 296 H THR 48 H THR 48 22.076 2.944 -4.551 297 HA THR 48 HA THR 48 19.319 3.692 -4.852 298 HB THR 48 HB THR 48 20.611 0.958 -4.853 299 HG1 THR 48 HG1 THR 48 20.262 1.212 -7.159 300 1HG2 THR 48 1HG2 THR 48 17.799 1.872 -5.247 301 2HG2 THR 48 2HG2 THR 48 18.410 0.423 -4.449 302 3HG2 THR 48 3HG2 THR 48 18.397 0.522 -6.210 303 H THR 49 H THR 49 21.251 2.005 -2.437 304 HA THR 49 HA THR 49 19.099 1.093 -0.845 305 HB THR 49 HB THR 49 21.969 1.665 -0.084 306 HG1 THR 49 HG1 THR 49 22.336 -0.273 -0.858 307 1HG2 THR 49 1HG2 THR 49 19.832 0.151 1.423 308 2HG2 THR 49 2HG2 THR 49 20.546 1.692 1.897 309 3HG2 THR 49 3HG2 THR 49 21.536 0.232 1.869 310 H THR 50 H THR 50 21.242 3.919 -0.505 311 HA THR 50 HA THR 50 20.064 4.993 1.788 312 HB THR 50 HB THR 50 20.996 7.016 -0.117 313 HG1 THR 50 HG1 THR 50 22.592 5.848 -0.869 314 1HG2 THR 50 1HG2 THR 50 20.936 7.671 2.124 315 2HG2 THR 50 2HG2 THR 50 22.643 7.323 1.848 316 3HG2 THR 50 3HG2 THR 50 21.628 6.150 2.686 317 H GLN 51 H GLN 51 19.442 5.776 -1.632 318 HA GLN 51 HA GLN 51 17.505 7.711 -1.298 319 1HB GLN 51 1HB GLN 51 18.353 7.285 -3.484 320 2HB GLN 51 2HB GLN 51 17.823 5.609 -3.436 321 1HG GLN 51 1HG GLN 51 15.705 7.626 -3.122 322 2HG GLN 51 2HG GLN 51 16.496 7.576 -4.697 323 1HE2 GLN 51 1HE2 GLN 51 14.256 6.098 -2.610 324 2HE2 GLN 51 2HE2 GLN 51 13.845 4.755 -3.615 325 H TYR 52 H TYR 52 17.035 4.194 -1.542 326 HA TYR 52 HA TYR 52 14.243 4.210 -1.287 327 1HB TYR 52 1HB TYR 52 16.378 2.161 -0.847 328 2HB TYR 52 2HB TYR 52 14.735 1.810 -0.321 329 HD1 TYR 52 HD1 TYR 52 16.113 3.519 -3.348 330 HD2 TYR 52 HD2 TYR 52 13.753 0.336 -1.799 331 HE1 TYR 52 HE1 TYR 52 15.529 2.844 -5.640 332 HE2 TYR 52 HE2 TYR 52 13.164 -0.349 -4.087 333 HH TYR 52 HH TYR 52 14.700 1.054 -6.878 334 H ALA 53 H ALA 53 16.738 3.622 1.189 335 HA ALA 53 HA ALA 53 15.004 3.393 3.372 336 1HB ALA 53 1HB ALA 53 17.151 2.649 3.797 337 2HB ALA 53 2HB ALA 53 17.900 4.085 3.098 338 3HB ALA 53 3HB ALA 53 17.109 4.180 4.671 339 H SER 54 H SER 54 15.973 6.146 1.571 340 HA SER 54 HA SER 54 15.511 8.086 3.636 341 1HB SER 54 1HB SER 54 17.023 8.409 1.623 342 2HB SER 54 2HB SER 54 15.559 8.592 0.657 343 HG SER 54 HG SER 54 16.112 10.624 1.261 344 H LEU 55 H LEU 55 13.646 6.674 1.014 345 HA LEU 55 HA LEU 55 11.370 8.403 1.606 346 1HB LEU 55 1HB LEU 55 10.520 7.841 -0.433 347 2HB LEU 55 2HB LEU 55 12.242 7.640 -0.746 348 HG LEU 55 HG LEU 55 11.674 5.135 -0.039 349 1HD1 LEU 55 1HD1 LEU 55 9.535 4.520 -0.132 350 2HD1 LEU 55 2HD1 LEU 55 9.235 5.470 -1.587 351 3HD1 LEU 55 3HD1 LEU 55 9.153 6.237 -0.001 352 1HD2 LEU 55 1HD2 LEU 55 10.817 5.687 -2.789 353 2HD2 LEU 55 2HD2 LEU 55 12.133 4.678 -2.188 354 3HD2 LEU 55 3HD2 LEU 55 12.354 6.423 -2.335 355 H MET 56 H MET 56 12.597 5.387 2.501 356 HA MET 56 HA MET 56 10.205 3.917 2.839 357 1HB MET 56 1HB MET 56 12.990 3.708 3.898 358 2HB MET 56 2HB MET 56 11.726 2.751 4.658 359 1HG MET 56 1HG MET 56 12.359 2.703 1.718 360 2HG MET 56 2HG MET 56 12.986 1.553 2.896 361 1HE MET 56 1HE MET 56 9.368 1.701 0.537 362 2HE MET 56 2HE MET 56 11.074 2.069 0.286 363 3HE MET 56 3HE MET 56 10.516 0.397 0.231 364 H HIS 57 H HIS 57 12.247 5.367 5.382 365 HA HIS 57 HA HIS 57 10.424 5.161 7.454 366 1HB HIS 57 1HB HIS 57 12.861 5.810 7.618 367 2HB HIS 57 2HB HIS 57 12.386 7.436 7.135 368 HD1 HIS 57 HD1 HIS 57 10.306 5.409 9.511 369 HD2 HIS 57 HD2 HIS 57 13.006 8.565 9.598 370 HE1 HIS 57 HE1 HIS 57 10.162 6.352 11.837 371 H SER 58 H SER 58 10.689 7.594 4.945 372 HA SER 58 HA SER 58 8.796 9.387 6.146 373 1HB SER 58 1HB SER 58 10.666 9.550 4.070 374 2HB SER 58 2HB SER 58 9.099 9.733 3.283 375 HG SER 58 HG SER 58 10.381 11.387 5.108 376 H PHE 59 H PHE 59 8.653 6.653 4.026 377 HA PHE 59 HA PHE 59 6.100 7.173 2.893 378 1HB PHE 59 1HB PHE 59 7.551 5.622 1.778 379 2HB PHE 59 2HB PHE 59 7.687 4.624 3.222 380 HD1 PHE 59 HD1 PHE 59 4.728 6.093 1.499 381 HD2 PHE 59 HD2 PHE 59 6.760 2.571 2.755 382 HE1 PHE 59 HE1 PHE 59 2.832 4.728 0.726 383 HE2 PHE 59 HE2 PHE 59 4.869 1.200 1.984 384 HZ PHE 59 HZ PHE 59 2.902 2.278 0.967 385 H ILE 60 H ILE 60 7.104 4.893 5.447 386 HA ILE 60 HA ILE 60 4.568 4.043 6.198 387 HB ILE 60 HB ILE 60 6.992 4.359 7.973 388 1HG1 ILE 60 1HG1 ILE 60 7.496 2.967 6.054 389 2HG1 ILE 60 2HG1 ILE 60 7.331 1.944 7.477 390 1HG2 ILE 60 1HG2 ILE 60 5.673 3.704 9.634 391 2HG2 ILE 60 2HG2 ILE 60 4.307 3.519 8.535 392 3HG2 ILE 60 3HG2 ILE 60 5.428 2.180 8.783 393 1HD1 ILE 60 1HD1 ILE 60 4.791 1.972 6.440 394 2HD1 ILE 60 2HD1 ILE 60 5.815 1.960 5.004 395 3HD1 ILE 60 3HD1 ILE 60 5.990 0.698 6.223 396 H LEU 61 H LEU 61 6.497 6.732 7.493 397 HA LEU 61 HA LEU 61 4.673 7.549 9.462 398 1HB LEU 61 1HB LEU 61 7.100 8.547 8.256 399 2HB LEU 61 2HB LEU 61 5.963 9.856 8.570 400 HG LEU 61 HG LEU 61 5.918 9.321 10.917 401 1HD1 LEU 61 1HD1 LEU 61 6.056 7.037 11.149 402 2HD1 LEU 61 2HD1 LEU 61 7.669 7.536 11.658 403 3HD1 LEU 61 3HD1 LEU 61 7.415 6.895 10.035 404 1HD2 LEU 61 1HD2 LEU 61 7.728 10.579 11.149 405 2HD2 LEU 61 2HD2 LEU 61 8.220 10.174 9.505 406 3HD2 LEU 61 3HD2 LEU 61 8.758 9.177 10.858 407 H LYS 62 H LYS 62 4.691 7.977 6.037 408 HA LYS 62 HA LYS 62 2.919 10.226 5.971 409 1HB LYS 62 1HB LYS 62 4.530 9.565 4.139 410 2HB LYS 62 2HB LYS 62 3.437 8.241 3.755 411 1HG LYS 62 1HG LYS 62 2.779 9.841 2.249 412 2HG LYS 62 2HG LYS 62 1.652 10.126 3.577 413 1HD LYS 62 1HD LYS 62 2.403 12.263 3.005 414 2HD LYS 62 2HD LYS 62 3.379 11.833 4.412 415 1HE LYS 62 1HE LYS 62 5.295 11.595 3.180 416 2HE LYS 62 2HE LYS 62 4.425 11.158 1.710 417 1HZ LYS 62 1HZ LYS 62 3.717 13.773 2.369 418 2HZ LYS 62 2HZ LYS 62 4.617 13.243 1.039 419 3HZ LYS 62 3HZ LYS 62 5.403 13.675 2.473 420 H ALA 63 H ALA 63 2.507 6.760 5.250 421 HA ALA 63 HA ALA 63 -0.307 6.927 4.917 422 1HB ALA 63 1HB ALA 63 1.385 5.101 4.142 423 2HB ALA 63 2HB ALA 63 1.039 4.385 5.716 424 3HB ALA 63 3HB ALA 63 -0.268 4.651 4.563 425 H ARG 64 H ARG 64 1.780 6.146 7.653 426 HA ARG 64 HA ARG 64 -0.153 5.192 9.424 427 1HB ARG 64 1HB ARG 64 2.408 5.247 9.671 428 2HB ARG 64 2HB ARG 64 2.184 6.876 10.295 429 1HG ARG 64 1HG ARG 64 0.373 5.189 11.662 430 2HG ARG 64 2HG ARG 64 1.950 4.398 11.659 431 1HD ARG 64 1HD ARG 64 1.695 7.299 12.354 432 2HD ARG 64 2HD ARG 64 1.372 6.055 13.561 433 HE ARG 64 HE ARG 64 3.839 5.498 12.376 434 1HH1 ARG 64 1HH1 ARG 64 2.369 7.915 14.406 435 2HH1 ARG 64 2HH1 ARG 64 3.848 8.327 15.209 436 1HH2 ARG 64 1HH2 ARG 64 5.792 6.031 13.426 437 2HH2 ARG 64 2HH2 ARG 64 5.795 7.256 14.650 438 H SER 65 H SER 65 0.700 8.460 8.505 439 HA SER 65 HA SER 65 -0.835 9.697 10.599 440 1HB SER 65 1HB SER 65 1.161 10.550 8.863 441 2HB SER 65 2HB SER 65 -0.280 11.395 8.296 442 HG SER 65 HG SER 65 1.218 11.965 10.399 443 H THR 66 H THR 66 -1.425 8.545 7.396 444 HA THR 66 HA THR 66 -3.853 10.064 7.021 445 HB THR 66 HB THR 66 -3.631 7.759 5.283 446 HG1 THR 66 HG1 THR 66 -1.644 8.391 4.310 447 1HG2 THR 66 1HG2 THR 66 -4.639 10.252 5.108 448 2HG2 THR 66 2HG2 THR 66 -4.237 9.267 3.702 449 3HG2 THR 66 3HG2 THR 66 -3.101 10.487 4.279 450 H VAL 67 H VAL 67 -3.022 6.656 7.614 451 HA VAL 67 HA VAL 67 -5.553 5.556 7.636 452 HB VAL 67 HB VAL 67 -3.301 4.800 9.502 453 1HG1 VAL 67 1HG1 VAL 67 -5.903 3.853 9.390 454 2HG1 VAL 67 2HG1 VAL 67 -4.970 2.662 8.483 455 3HG1 VAL 67 3HG1 VAL 67 -4.525 3.053 10.145 456 1HG2 VAL 67 1HG2 VAL 67 -3.346 3.026 7.369 457 2HG2 VAL 67 2HG2 VAL 67 -3.554 4.610 6.623 458 3HG2 VAL 67 3HG2 VAL 67 -2.158 4.298 7.655 459 H ARG 68 H ARG 68 -3.870 7.281 10.216 460 HA ARG 68 HA ARG 68 -5.570 6.772 12.341 461 1HB ARG 68 1HB ARG 68 -3.910 9.179 11.627 462 2HB ARG 68 2HB ARG 68 -4.866 9.130 13.102 463 1HG ARG 68 1HG ARG 68 -2.710 7.165 12.357 464 2HG ARG 68 2HG ARG 68 -2.533 8.508 13.487 465 1HD ARG 68 1HD ARG 68 -4.244 6.052 13.765 466 2HD ARG 68 2HD ARG 68 -2.919 6.580 14.801 467 HE ARG 68 HE ARG 68 -5.656 7.463 14.894 468 1HH1 ARG 68 1HH1 ARG 68 -2.357 8.240 15.692 469 2HH1 ARG 68 2HH1 ARG 68 -2.785 9.332 16.966 470 1HH2 ARG 68 1HH2 ARG 68 -6.232 8.899 16.570 471 2HH2 ARG 68 2HH2 ARG 68 -4.990 9.706 17.466 472 H ASP 69 H ASP 69 -6.039 8.814 9.569 473 HA ASP 69 HA ASP 69 -8.232 10.302 10.656 474 1HB ASP 69 1HB ASP 69 -6.617 10.462 8.364 475 2HB ASP 69 2HB ASP 69 -8.250 10.175 7.769 476 H ILE 70 H ILE 70 -7.869 7.356 8.789 477 HA ILE 70 HA ILE 70 -10.532 7.032 7.970 478 HB ILE 70 HB ILE 70 -8.570 4.839 8.647 479 1HG1 ILE 70 1HG1 ILE 70 -9.044 6.246 6.010 480 2HG1 ILE 70 2HG1 ILE 70 -7.647 6.495 7.051 481 1HG2 ILE 70 1HG2 ILE 70 -11.051 4.895 6.941 482 2HG2 ILE 70 2HG2 ILE 70 -9.878 3.579 6.933 483 3HG2 ILE 70 3HG2 ILE 70 -10.775 3.952 8.405 484 1HD1 ILE 70 1HD1 ILE 70 -7.402 3.893 6.774 485 2HD1 ILE 70 2HD1 ILE 70 -8.329 4.198 5.305 486 3HD1 ILE 70 3HD1 ILE 70 -6.786 5.013 5.559 487 H ASP 71 H ASP 71 -8.846 5.858 10.869 488 HA ASP 71 HA ASP 71 -11.411 5.734 12.256 489 1HB ASP 71 1HB ASP 71 -9.665 3.401 11.649 490 2HB ASP 71 2HB ASP 71 -10.398 3.469 13.250 491 HA PRO 72 HA PRO 72 -9.186 7.302 15.694 492 1HB PRO 72 1HB PRO 72 -10.404 6.077 17.789 493 2HB PRO 72 2HB PRO 72 -11.177 7.352 16.839 494 1HG PRO 72 1HG PRO 72 -11.511 4.383 16.651 495 2HG PRO 72 2HG PRO 72 -12.746 5.654 16.592 496 1HD PRO 72 1HD PRO 72 -11.799 4.438 14.365 497 2HD PRO 72 2HD PRO 72 -12.327 6.133 14.376 498 H GLN 73 H GLN 73 -9.748 3.797 16.065 499 HA GLN 73 HA GLN 73 -6.966 3.548 17.003 500 1HB GLN 73 1HB GLN 73 -9.302 1.805 17.800 501 2HB GLN 73 2HB GLN 73 -7.654 1.685 18.403 502 1HG GLN 73 1HG GLN 73 -7.879 3.926 19.392 503 2HG GLN 73 2HG GLN 73 -9.552 3.979 18.839 504 1HE2 GLN 73 1HE2 GLN 73 -10.994 3.455 20.303 505 2HE2 GLN 73 2HE2 GLN 73 -10.747 2.406 21.653 506 H ASN 74 H ASN 74 -5.816 2.734 15.374 507 HA ASN 74 HA ASN 74 -6.646 0.204 14.207 508 1HB ASN 74 1HB ASN 74 -5.916 1.241 11.899 509 2HB ASN 74 2HB ASN 74 -7.564 1.442 12.485 510 1HD2 ASN 74 1HD2 ASN 74 -4.402 3.001 12.388 511 2HD2 ASN 74 2HD2 ASN 74 -5.003 4.621 12.388 512 H ASP 75 H ASP 75 -4.808 -0.367 12.455 513 HA ASP 75 HA ASP 75 -2.182 0.563 13.098 514 1HB ASP 75 1HB ASP 75 -3.254 -1.554 14.689 515 2HB ASP 75 2HB ASP 75 -1.976 -2.216 13.672 516 H LEU 76 H LEU 76 -0.922 0.290 11.370 517 HA LEU 76 HA LEU 76 -1.929 -1.105 9.079 518 1HB LEU 76 1HB LEU 76 0.557 0.460 9.668 519 2HB LEU 76 2HB LEU 76 0.397 -0.452 8.168 520 HG LEU 76 HG LEU 76 -0.146 1.859 7.769 521 1HD1 LEU 76 1HD1 LEU 76 -1.527 -0.098 6.786 522 2HD1 LEU 76 2HD1 LEU 76 -2.113 1.554 6.594 523 3HD1 LEU 76 3HD1 LEU 76 -2.813 0.509 7.830 524 1HD2 LEU 76 1HD2 LEU 76 -2.567 1.896 9.431 525 2HD2 LEU 76 2HD2 LEU 76 -1.385 3.166 9.112 526 3HD2 LEU 76 3HD2 LEU 76 -1.047 1.931 10.326 527 H THR 77 H THR 77 -1.416 -3.075 8.334 528 HA THR 77 HA THR 77 0.368 -4.718 9.965 529 HB THR 77 HB THR 77 -0.630 -6.639 8.923 530 HG1 THR 77 HG1 THR 77 -1.891 -6.502 7.133 531 1HG2 THR 77 1HG2 THR 77 -2.663 -4.531 9.645 532 2HG2 THR 77 2HG2 THR 77 -1.963 -5.758 10.701 533 3HG2 THR 77 3HG2 THR 77 -3.061 -6.231 9.405 534 H PHE 78 H PHE 78 -0.032 -3.554 6.667 535 HA PHE 78 HA PHE 78 2.725 -3.729 6.094 536 1HB PHE 78 1HB PHE 78 2.801 -5.527 4.510 537 2HB PHE 78 2HB PHE 78 2.105 -6.164 5.995 538 HD1 PHE 78 HD1 PHE 78 -0.166 -6.912 6.083 539 HD2 PHE 78 HD2 PHE 78 1.410 -5.168 2.535 540 HE1 PHE 78 HE1 PHE 78 -2.118 -7.721 4.823 541 HE2 PHE 78 HE2 PHE 78 -0.539 -5.974 1.269 542 HZ PHE 78 HZ PHE 78 -2.307 -7.251 2.413 543 H LEU 79 H LEU 79 3.260 -2.644 4.219 544 HA LEU 79 HA LEU 79 0.990 -1.505 2.724 545 1HB LEU 79 1HB LEU 79 3.420 -0.308 3.876 546 2HB LEU 79 2HB LEU 79 3.007 0.236 2.251 547 HG LEU 79 HG LEU 79 0.904 1.091 2.994 548 1HD1 LEU 79 1HD1 LEU 79 1.555 -0.162 5.656 549 2HD1 LEU 79 2HD1 LEU 79 0.269 -0.641 4.549 550 3HD1 LEU 79 3HD1 LEU 79 0.202 0.928 5.352 551 1HD2 LEU 79 1HD2 LEU 79 2.047 2.903 3.575 552 2HD2 LEU 79 2HD2 LEU 79 3.406 1.930 4.138 553 3HD2 LEU 79 3HD2 LEU 79 2.070 2.297 5.231 554 H ARG 80 H ARG 80 0.884 -2.755 0.936 555 HA ARG 80 HA ARG 80 3.357 -3.312 -0.539 556 1HB ARG 80 1HB ARG 80 0.694 -4.618 -0.358 557 2HB ARG 80 2HB ARG 80 1.522 -4.703 -1.907 558 1HG ARG 80 1HG ARG 80 3.525 -5.413 -0.245 559 2HG ARG 80 2HG ARG 80 2.129 -6.033 0.639 560 1HD ARG 80 1HD ARG 80 1.750 -6.701 -2.075 561 2HD ARG 80 2HD ARG 80 3.420 -7.102 -1.677 562 HE ARG 80 HE ARG 80 2.662 -8.785 -0.312 563 1HH1 ARG 80 1HH1 ARG 80 0.009 -6.701 -1.173 564 2HH1 ARG 80 2HH1 ARG 80 -1.200 -7.749 -0.509 565 1HH2 ARG 80 1HH2 ARG 80 1.079 -10.173 0.565 566 2HH2 ARG 80 2HH2 ARG 80 -0.590 -9.724 0.480 567 H ILE 81 H ILE 81 3.826 -2.274 -2.366 568 HA ILE 81 HA ILE 81 1.681 -0.742 -3.688 569 HB ILE 81 HB ILE 81 4.585 0.055 -3.699 570 1HG1 ILE 81 1HG1 ILE 81 2.388 1.030 -1.860 571 2HG1 ILE 81 2HG1 ILE 81 3.785 0.074 -1.380 572 1HG2 ILE 81 1HG2 ILE 81 3.240 0.954 -5.506 573 2HG2 ILE 81 2HG2 ILE 81 2.047 1.546 -4.351 574 3HG2 ILE 81 3HG2 ILE 81 3.670 2.235 -4.372 575 1HD1 ILE 81 1HD1 ILE 81 4.778 2.000 -0.918 576 2HD1 ILE 81 2HD1 ILE 81 4.883 2.262 -2.659 577 3HD1 ILE 81 3HD1 ILE 81 3.528 2.927 -1.747 578 H ARG 82 H ARG 82 1.232 -2.334 -5.211 579 HA ARG 82 HA ARG 82 3.188 -3.676 -6.743 580 1HB ARG 82 1HB ARG 82 0.713 -4.280 -6.399 581 2HB ARG 82 2HB ARG 82 0.383 -3.126 -7.685 582 1HG ARG 82 1HG ARG 82 0.611 -4.873 -9.050 583 2HG ARG 82 2HG ARG 82 2.345 -4.661 -8.797 584 1HD ARG 82 1HD ARG 82 2.209 -6.845 -8.213 585 2HD ARG 82 2HD ARG 82 1.780 -6.150 -6.651 586 HE ARG 82 HE ARG 82 -0.568 -6.473 -8.122 587 1HH1 ARG 82 1HH1 ARG 82 1.914 -8.429 -6.662 588 2HH1 ARG 82 2HH1 ARG 82 0.865 -9.777 -6.374 589 1HH2 ARG 82 1HH2 ARG 82 -1.960 -8.241 -7.748 590 2HH2 ARG 82 2HH2 ARG 82 -1.338 -9.669 -6.992 591 H SER 83 H SER 83 4.295 -3.094 -8.505 592 HA SER 83 HA SER 83 3.465 -0.658 -9.936 593 1HB SER 83 1HB SER 83 6.344 -1.101 -9.979 594 2HB SER 83 2HB SER 83 5.439 0.357 -9.575 595 HG SER 83 HG SER 83 6.742 -1.183 -7.923 596 H LYS 84 H LYS 84 5.310 -0.611 -11.926 597 HA LYS 84 HA LYS 84 4.635 -3.039 -13.426 598 1HB LYS 84 1HB LYS 84 5.587 -0.339 -14.402 599 2HB LYS 84 2HB LYS 84 5.162 -1.699 -15.433 600 1HG LYS 84 1HG LYS 84 2.866 -1.600 -14.332 601 2HG LYS 84 2HG LYS 84 3.364 -0.022 -13.718 602 1HD LYS 84 1HD LYS 84 3.577 0.869 -15.892 603 2HD LYS 84 2HD LYS 84 3.519 -0.731 -16.636 604 1HE LYS 84 1HE LYS 84 1.150 -0.688 -15.322 605 2HE LYS 84 2HE LYS 84 1.337 1.019 -15.722 606 1HZ LYS 84 1HZ LYS 84 1.383 0.557 -17.990 607 2HZ LYS 84 2HZ LYS 84 0.165 -0.459 -17.403 608 3HZ LYS 84 3HZ LYS 84 1.693 -1.090 -17.761 609 H LYS 85 H LYS 85 7.357 -0.962 -12.561 610 HA LYS 85 HA LYS 85 9.297 -2.506 -13.984 611 1HB LYS 85 1HB LYS 85 9.235 -0.039 -12.582 612 2HB LYS 85 2HB LYS 85 10.488 -1.027 -11.842 613 1HG LYS 85 1HG LYS 85 10.475 -0.963 -14.787 614 2HG LYS 85 2HG LYS 85 10.889 0.550 -13.976 615 1HD LYS 85 1HD LYS 85 12.187 -1.920 -12.975 616 2HD LYS 85 2HD LYS 85 12.703 -1.324 -14.554 617 1HE LYS 85 1HE LYS 85 12.602 0.942 -12.949 618 2HE LYS 85 2HE LYS 85 13.283 -0.305 -11.906 619 1HZ LYS 85 1HZ LYS 85 14.313 0.625 -14.524 620 2HZ LYS 85 2HZ LYS 85 14.866 -0.784 -13.769 621 3HZ LYS 85 3HZ LYS 85 15.078 0.716 -13.017 622 H ASN 86 H ASN 86 8.558 -2.126 -10.516 623 HA ASN 86 HA ASN 86 9.140 -4.904 -10.032 624 1HB ASN 86 1HB ASN 86 11.405 -4.099 -9.957 625 2HB ASN 86 2HB ASN 86 10.945 -2.746 -8.929 626 1HD2 ASN 86 1HD2 ASN 86 11.765 -6.075 -9.071 627 2HD2 ASN 86 2HD2 ASN 86 11.767 -6.374 -7.369 628 H GLU 87 H GLU 87 8.672 -5.541 -7.808 629 HA GLU 87 HA GLU 87 6.778 -3.679 -6.534 630 1HB GLU 87 1HB GLU 87 5.782 -5.807 -5.552 631 2HB GLU 87 2HB GLU 87 5.537 -5.543 -7.272 632 1HG GLU 87 1HG GLU 87 7.072 -7.191 -7.869 633 2HG GLU 87 2HG GLU 87 7.812 -7.209 -6.269 634 H ILE 88 H ILE 88 7.335 -2.919 -4.611 635 HA ILE 88 HA ILE 88 9.266 -4.456 -2.998 636 HB ILE 88 HB ILE 88 8.926 -1.455 -3.043 637 1HG1 ILE 88 1HG1 ILE 88 11.431 -1.823 -3.906 638 2HG1 ILE 88 2HG1 ILE 88 10.726 -3.321 -4.506 639 1HG2 ILE 88 1HG2 ILE 88 9.970 -1.505 -1.084 640 2HG2 ILE 88 2HG2 ILE 88 10.174 -3.254 -1.184 641 3HG2 ILE 88 3HG2 ILE 88 11.376 -2.184 -1.904 642 1HD1 ILE 88 1HD1 ILE 88 10.773 -1.065 -5.916 643 2HD1 ILE 88 2HD1 ILE 88 9.491 -2.267 -6.073 644 3HD1 ILE 88 3HD1 ILE 88 9.241 -0.835 -5.075 645 H MET 89 H MET 89 8.448 -5.232 -1.178 646 HA MET 89 HA MET 89 5.945 -4.184 -0.142 647 1HB MET 89 1HB MET 89 7.624 -6.536 0.746 648 2HB MET 89 2HB MET 89 6.042 -6.122 1.392 649 1HG MET 89 1HG MET 89 5.132 -6.388 -0.926 650 2HG MET 89 2HG MET 89 6.705 -7.029 -1.394 651 1HE MET 89 1HE MET 89 6.819 -10.037 1.314 652 2HE MET 89 2HE MET 89 7.822 -9.044 0.257 653 3HE MET 89 3HE MET 89 7.132 -8.351 1.725 654 H VAL 90 H VAL 90 5.654 -3.283 1.880 655 HA VAL 90 HA VAL 90 7.990 -2.859 3.580 656 HB VAL 90 HB VAL 90 6.277 -0.534 2.704 657 1HG1 VAL 90 1HG1 VAL 90 8.880 -0.619 4.226 658 2HG1 VAL 90 2HG1 VAL 90 7.949 0.823 3.817 659 3HG1 VAL 90 3HG1 VAL 90 7.289 -0.365 4.942 660 1HG2 VAL 90 1HG2 VAL 90 8.149 0.205 1.353 661 2HG2 VAL 90 2HG2 VAL 90 9.078 -1.221 1.816 662 3HG2 VAL 90 3HG2 VAL 90 7.626 -1.397 0.830 663 H ALA 91 H ALA 91 7.206 -3.870 5.343 664 HA ALA 91 HA ALA 91 4.643 -2.896 6.425 665 1HB ALA 91 1HB ALA 91 4.493 -5.224 5.593 666 2HB ALA 91 2HB ALA 91 5.745 -5.684 6.748 667 3HB ALA 91 3HB ALA 91 4.191 -5.083 7.325 668 HA PRO 92 HA PRO 92 6.800 -1.776 10.084 669 1HB PRO 92 1HB PRO 92 4.848 -2.110 11.941 670 2HB PRO 92 2HB PRO 92 4.848 -0.781 10.776 671 1HG PRO 92 1HG PRO 92 3.346 -3.369 10.697 672 2HG PRO 92 2HG PRO 92 2.781 -1.735 10.302 673 1HD PRO 92 1HD PRO 92 3.498 -3.528 8.403 674 2HD PRO 92 2HD PRO 92 3.730 -1.779 8.201 675 H ASP 93 H ASP 93 8.144 -2.754 11.479 676 HA ASP 93 HA ASP 93 7.580 -5.556 12.201 677 1HB ASP 93 1HB ASP 93 9.676 -4.739 10.711 678 2HB ASP 93 2HB ASP 93 10.374 -4.578 12.320 679 H LYS 94 H LYS 94 9.465 -5.970 14.115 680 HA LYS 94 HA LYS 94 8.297 -5.069 16.442 681 1HB LYS 94 1HB LYS 94 10.621 -6.574 15.724 682 2HB LYS 94 2HB LYS 94 11.061 -5.433 16.988 683 1HG LYS 94 1HG LYS 94 9.724 -6.425 18.546 684 2HG LYS 94 2HG LYS 94 8.580 -7.026 17.344 685 1HD LYS 94 1HD LYS 94 10.194 -8.711 16.636 686 2HD LYS 94 2HD LYS 94 11.368 -8.093 17.801 687 1HE LYS 94 1HE LYS 94 10.405 -9.964 18.841 688 2HE LYS 94 2HE LYS 94 9.612 -8.574 19.580 689 1HZ LYS 94 1HZ LYS 94 7.753 -8.909 18.027 690 2HZ LYS 94 2HZ LYS 94 7.988 -10.238 19.047 691 3HZ LYS 94 3HZ LYS 94 8.503 -10.305 17.437 692 H ASP 95 H ASP 95 11.246 -3.790 14.904 693 HA ASP 95 HA ASP 95 10.614 -1.139 15.900 694 1HB ASP 95 1HB ASP 95 12.987 -2.730 16.827 695 2HB ASP 95 2HB ASP 95 13.076 -0.973 16.730 696 H TYR 96 H TYR 96 11.127 -2.780 13.353 697 HA TYR 96 HA TYR 96 12.663 -0.691 12.021 698 1HB TYR 96 1HB TYR 96 13.971 -2.426 10.757 699 2HB TYR 96 2HB TYR 96 14.393 -2.289 12.460 700 HD1 TYR 96 HD1 TYR 96 13.142 -4.457 9.857 701 HD2 TYR 96 HD2 TYR 96 13.566 -4.021 14.068 702 HE1 TYR 96 HE1 TYR 96 12.752 -6.869 10.140 703 HE2 TYR 96 HE2 TYR 96 13.178 -6.432 14.363 704 HH TYR 96 HH TYR 96 13.516 -8.629 12.187 705 H PHE 97 H PHE 97 12.750 -1.441 9.518 706 HA PHE 97 HA PHE 97 10.040 -2.345 8.806 707 1HB PHE 97 1HB PHE 97 11.581 0.005 7.706 708 2HB PHE 97 2HB PHE 97 10.194 -0.695 6.878 709 HD1 PHE 97 HD1 PHE 97 8.120 -1.076 8.602 710 HD2 PHE 97 HD2 PHE 97 11.150 1.898 8.908 711 HE1 PHE 97 HE1 PHE 97 6.609 0.320 9.951 712 HE2 PHE 97 HE2 PHE 97 9.644 3.298 10.258 713 HZ PHE 97 HZ PHE 97 7.370 2.510 10.782 714 H LEU 98 H LEU 98 10.076 -4.080 7.554 715 HA LEU 98 HA LEU 98 12.531 -4.912 6.272 716 1HB LEU 98 1HB LEU 98 10.503 -6.271 7.447 717 2HB LEU 98 2HB LEU 98 10.059 -6.419 5.748 718 HG LEU 98 HG LEU 98 12.858 -7.055 6.231 719 1HD1 LEU 98 1HD1 LEU 98 12.237 -9.298 7.260 720 2HD1 LEU 98 2HD1 LEU 98 10.721 -8.532 7.735 721 3HD1 LEU 98 3HD1 LEU 98 12.255 -7.899 8.333 722 1HD2 LEU 98 1HD2 LEU 98 10.877 -9.010 5.210 723 2HD2 LEU 98 2HD2 LEU 98 12.486 -8.606 4.612 724 3HD2 LEU 98 3HD2 LEU 98 11.125 -7.536 4.274 725 H ILE 99 H ILE 99 12.942 -4.999 4.113 726 HA ILE 99 HA ILE 99 10.851 -3.994 2.298 727 HB ILE 99 HB ILE 99 13.781 -3.266 2.221 728 1HG1 ILE 99 1HG1 ILE 99 12.483 -0.916 2.348 729 2HG1 ILE 99 2HG1 ILE 99 11.334 -1.917 3.228 730 1HG2 ILE 99 1HG2 ILE 99 11.826 -3.351 0.150 731 2HG2 ILE 99 2HG2 ILE 99 12.236 -1.669 0.477 732 3HG2 ILE 99 3HG2 ILE 99 13.506 -2.821 0.065 733 1HD1 ILE 99 1HD1 ILE 99 13.197 -2.622 4.715 734 2HD1 ILE 99 2HD1 ILE 99 14.225 -1.445 3.897 735 3HD1 ILE 99 3HD1 ILE 99 12.808 -0.904 4.797 736 H VAL 100 H VAL 100 10.322 -5.634 1.014 737 HA VAL 100 HA VAL 100 12.440 -7.453 0.084 738 HB VAL 100 HB VAL 100 9.449 -7.883 0.102 739 1HG1 VAL 100 1HG1 VAL 100 11.591 -9.219 -1.283 740 2HG1 VAL 100 2HG1 VAL 100 10.793 -10.318 -0.156 741 3HG1 VAL 100 3HG1 VAL 100 9.851 -9.480 -1.390 742 1HG2 VAL 100 1HG2 VAL 100 9.968 -8.097 2.323 743 2HG2 VAL 100 2HG2 VAL 100 10.300 -9.738 1.769 744 3HG2 VAL 100 3HG2 VAL 100 11.627 -8.600 2.001 745 H ILE 101 H ILE 101 13.195 -6.957 -1.862 746 HA ILE 101 HA ILE 101 11.350 -5.816 -3.851 747 HB ILE 101 HB ILE 101 14.365 -5.741 -3.935 748 1HG1 ILE 101 1HG1 ILE 101 12.453 -3.578 -3.027 749 2HG1 ILE 101 2HG1 ILE 101 13.485 -4.525 -1.962 750 1HG2 ILE 101 1HG2 ILE 101 14.173 -4.331 -5.758 751 2HG2 ILE 101 2HG2 ILE 101 12.863 -5.478 -6.034 752 3HG2 ILE 101 3HG2 ILE 101 12.512 -3.883 -5.368 753 1HD1 ILE 101 1HD1 ILE 101 15.444 -3.545 -2.845 754 2HD1 ILE 101 2HD1 ILE 101 14.557 -2.811 -4.182 755 3HD1 ILE 101 3HD1 ILE 101 14.311 -2.230 -2.535 756 H GLN 102 H GLN 102 10.824 -6.980 -5.581 757 HA GLN 102 HA GLN 102 12.590 -8.777 -6.884 758 1HB GLN 102 1HB GLN 102 11.500 -10.878 -6.420 759 2HB GLN 102 2HB GLN 102 11.999 -10.149 -4.900 760 1HG GLN 102 1HG GLN 102 9.691 -9.334 -4.576 761 2HG GLN 102 2HG GLN 102 9.219 -10.177 -6.051 762 1HE2 GLN 102 1HE2 GLN 102 8.818 -10.410 -2.953 763 2HE2 GLN 102 2HE2 GLN 102 8.922 -12.116 -2.699 764 H ASN 103 H ASN 103 11.469 -9.977 -8.668 765 HA ASN 103 HA ASN 103 10.002 -8.278 -10.270 766 1HB ASN 103 1HB ASN 103 10.646 -11.157 -10.290 767 2HB ASN 103 2HB ASN 103 9.221 -10.708 -11.224 768 1HD2 ASN 103 1HD2 ASN 103 12.621 -10.713 -11.068 769 2HD2 ASN 103 2HD2 ASN 103 12.924 -9.901 -12.563 770 HA PRO 104 HA PRO 104 5.803 -8.399 -9.003 771 1HB PRO 104 1HB PRO 104 4.475 -8.476 -11.370 772 2HB PRO 104 2HB PRO 104 5.321 -7.036 -10.789 773 1HG PRO 104 1HG PRO 104 6.221 -9.094 -12.769 774 2HG PRO 104 2HG PRO 104 6.378 -7.329 -12.840 775 1HD PRO 104 1HD PRO 104 8.423 -8.945 -12.107 776 2HD PRO 104 2HD PRO 104 8.214 -7.310 -11.447 777 H THR 105 H THR 105 4.073 -9.761 -8.601 778 HA THR 105 HA THR 105 4.431 -12.535 -9.507 779 HB THR 105 HB THR 105 2.992 -13.141 -7.556 780 HG1 THR 105 HG1 THR 105 2.270 -11.610 -6.217 781 1HG2 THR 105 1HG2 THR 105 4.938 -13.485 -6.529 782 2HG2 THR 105 2HG2 THR 105 4.987 -11.791 -6.040 783 3HG2 THR 105 3HG2 THR 105 5.700 -12.287 -7.575 784 H GLU 106 H GLU 106 2.076 -9.939 -9.187 785 HA GLU 106 HA GLU 106 -0.040 -9.668 -9.994 786 1HB GLU 106 1HB GLU 106 1.052 -9.578 -12.115 787 2HB GLU 106 2HB GLU 106 1.226 -11.326 -12.172 788 1HG GLU 106 1HG GLU 106 -1.110 -11.627 -12.509 789 2HG GLU 106 2HG GLU 106 -1.432 -9.923 -12.193 790 H MET 11 H MET 11 -18.714 4.425 -15.854 791 HA MET 11 HA MET 11 -19.014 4.078 -13.265 792 1HB MET 11 1HB MET 11 -20.890 5.113 -15.305 793 2HB MET 11 2HB MET 11 -21.587 4.772 -13.727 794 1HG MET 11 1HG MET 11 -19.147 6.181 -13.351 795 2HG MET 11 2HG MET 11 -20.115 7.034 -14.551 796 1HE MET 11 1HE MET 11 -21.694 5.958 -10.350 797 2HE MET 11 2HE MET 11 -21.383 4.781 -11.626 798 3HE MET 11 3HE MET 11 -20.038 5.622 -10.854 799 H ALA 12 H ALA 12 -21.242 2.490 -15.551 800 HA ALA 12 HA ALA 12 -22.767 1.055 -13.755 801 1HB ALA 12 1HB ALA 12 -21.873 0.121 -16.480 802 2HB ALA 12 2HB ALA 12 -23.272 -0.464 -15.579 803 3HB ALA 12 3HB ALA 12 -23.232 1.199 -16.164 804 H GLU 13 H GLU 13 -19.606 0.240 -15.111 805 HA GLU 13 HA GLU 13 -19.357 -2.377 -14.255 806 1HB GLU 13 1HB GLU 13 -17.740 -0.857 -15.630 807 2HB GLU 13 2HB GLU 13 -17.033 -0.491 -14.063 808 1HG GLU 13 1HG GLU 13 -15.857 -2.292 -15.243 809 2HG GLU 13 2HG GLU 13 -16.521 -2.811 -13.695 810 H VAL 14 H VAL 14 -18.415 0.573 -12.494 811 HA VAL 14 HA VAL 14 -17.596 -0.743 -10.139 812 HB VAL 14 HB VAL 14 -18.662 2.075 -10.365 813 1HG1 VAL 14 1HG1 VAL 14 -17.096 0.595 -8.288 814 2HG1 VAL 14 2HG1 VAL 14 -16.940 2.345 -8.452 815 3HG1 VAL 14 3HG1 VAL 14 -18.512 1.628 -8.094 816 1HG2 VAL 14 1HG2 VAL 14 -16.357 2.765 -10.721 817 2HG2 VAL 14 2HG2 VAL 14 -15.830 1.082 -10.685 818 3HG2 VAL 14 3HG2 VAL 14 -16.870 1.653 -11.990 819 H GLU 15 H GLU 15 -20.711 0.493 -11.211 820 HA GLU 15 HA GLU 15 -22.054 0.254 -8.734 821 1HB GLU 15 1HB GLU 15 -23.038 0.312 -11.584 822 2HB GLU 15 2HB GLU 15 -24.129 0.214 -10.209 823 1HG GLU 15 1HG GLU 15 -23.402 2.336 -9.392 824 2HG GLU 15 2HG GLU 15 -22.115 2.414 -10.594 825 H GLU 16 H GLU 16 -21.598 -1.958 -11.448 826 HA GLU 16 HA GLU 16 -23.346 -3.981 -10.556 827 1HB GLU 16 1HB GLU 16 -21.772 -3.573 -12.784 828 2HB GLU 16 2HB GLU 16 -20.992 -4.941 -12.003 829 1HG GLU 16 1HG GLU 16 -23.249 -6.043 -11.921 830 2HG GLU 16 2HG GLU 16 -23.833 -4.740 -12.955 831 H THR 17 H THR 17 -20.028 -3.205 -9.774 832 HA THR 17 HA THR 17 -19.522 -5.677 -8.394 833 HB THR 17 HB THR 17 -17.979 -3.077 -8.418 834 HG1 THR 17 HG1 THR 17 -17.339 -3.863 -10.270 835 1HG2 THR 17 1HG2 THR 17 -17.539 -5.658 -6.993 836 2HG2 THR 17 2HG2 THR 17 -17.194 -4.009 -6.472 837 3HG2 THR 17 3HG2 THR 17 -16.140 -4.803 -7.642 838 H LEU 18 H LEU 18 -20.840 -2.580 -7.596 839 HA LEU 18 HA LEU 18 -20.402 -2.731 -4.778 840 1HB LEU 18 1HB LEU 18 -21.665 -0.918 -6.660 841 2HB LEU 18 2HB LEU 18 -22.589 -1.077 -5.168 842 HG LEU 18 HG LEU 18 -20.245 -0.617 -4.057 843 1HD1 LEU 18 1HD1 LEU 18 -18.885 -0.598 -6.005 844 2HD1 LEU 18 2HD1 LEU 18 -19.009 1.068 -5.441 845 3HD1 LEU 18 3HD1 LEU 18 -19.963 0.532 -6.824 846 1HD2 LEU 18 1HD2 LEU 18 -21.379 1.839 -5.233 847 2HD2 LEU 18 2HD2 LEU 18 -21.074 1.420 -3.547 848 3HD2 LEU 18 3HD2 LEU 18 -22.508 0.799 -4.365 849 H LYS 19 H LYS 19 -23.260 -3.241 -6.840 850 HA LYS 19 HA LYS 19 -25.018 -4.010 -4.799 851 1HB LYS 19 1HB LYS 19 -24.993 -4.817 -7.714 852 2HB LYS 19 2HB LYS 19 -26.346 -5.058 -6.616 853 1HG LYS 19 1HG LYS 19 -25.698 -2.349 -6.409 854 2HG LYS 19 2HG LYS 19 -25.613 -2.731 -8.130 855 1HD LYS 19 1HD LYS 19 -27.894 -4.012 -7.455 856 2HD LYS 19 2HD LYS 19 -27.931 -2.669 -6.310 857 1HE LYS 19 1HE LYS 19 -27.322 -1.273 -8.463 858 2HE LYS 19 2HE LYS 19 -28.065 -2.644 -9.285 859 1HZ LYS 19 1HZ LYS 19 -29.431 -0.546 -8.389 860 2HZ LYS 19 2HZ LYS 19 -29.554 -1.561 -7.042 861 3HZ LYS 19 3HZ LYS 19 -30.102 -2.091 -8.552 862 H ARG 20 H ARG 20 -22.552 -5.779 -6.513 863 HA ARG 20 HA ARG 20 -23.456 -8.367 -5.636 864 1HB ARG 20 1HB ARG 20 -22.181 -7.991 -7.755 865 2HB ARG 20 2HB ARG 20 -20.769 -7.597 -6.784 866 1HG ARG 20 1HG ARG 20 -20.244 -9.748 -6.870 867 2HG ARG 20 2HG ARG 20 -21.610 -10.043 -5.793 868 1HD ARG 20 1HD ARG 20 -23.040 -10.142 -7.895 869 2HD ARG 20 2HD ARG 20 -21.525 -10.220 -8.792 870 HE ARG 20 HE ARG 20 -21.531 -12.183 -6.772 871 1HH1 ARG 20 1HH1 ARG 20 -23.022 -11.439 -9.829 872 2HH1 ARG 20 2HH1 ARG 20 -23.291 -13.098 -10.249 873 1HH2 ARG 20 1HH2 ARG 20 -21.880 -14.371 -7.314 874 2HH2 ARG 20 2HH2 ARG 20 -22.642 -14.765 -8.818 875 H LEU 21 H LEU 21 -20.848 -6.134 -4.747 876 HA LEU 21 HA LEU 21 -19.702 -7.781 -2.757 877 1HB LEU 21 1HB LEU 21 -19.472 -4.985 -3.633 878 2HB LEU 21 2HB LEU 21 -19.080 -5.268 -1.938 879 HG LEU 21 HG LEU 21 -17.322 -6.791 -2.540 880 1HD1 LEU 21 1HD1 LEU 21 -17.612 -8.015 -4.377 881 2HD1 LEU 21 2HD1 LEU 21 -16.995 -6.627 -5.271 882 3HD1 LEU 21 3HD1 LEU 21 -18.734 -6.849 -5.078 883 1HD2 LEU 21 1HD2 LEU 21 -15.831 -5.283 -3.757 884 2HD2 LEU 21 2HD2 LEU 21 -16.767 -4.417 -2.539 885 3HD2 LEU 21 3HD2 LEU 21 -17.214 -4.302 -4.242 886 H GLN 22 H GLN 22 -22.070 -5.142 -2.592 887 HA GLN 22 HA GLN 22 -22.370 -4.971 0.153 888 1HB GLN 22 1HB GLN 22 -23.881 -4.171 -2.189 889 2HB GLN 22 2HB GLN 22 -24.946 -4.629 -0.867 890 1HG GLN 22 1HG GLN 22 -24.675 -2.569 -0.100 891 2HG GLN 22 2HG GLN 22 -23.043 -3.055 0.357 892 1HE2 GLN 22 1HE2 GLN 22 -21.510 -1.760 -0.327 893 2HE2 GLN 22 2HE2 GLN 22 -21.560 -0.772 -1.743 894 H SER 23 H SER 23 -23.495 -7.413 -2.047 895 HA SER 23 HA SER 23 -25.375 -8.575 -0.202 896 1HB SER 23 1HB SER 23 -25.567 -8.715 -2.717 897 2HB SER 23 2HB SER 23 -24.214 -9.845 -2.689 898 HG SER 23 HG SER 23 -25.444 -11.296 -1.584 899 H GLN 24 H GLN 24 -22.019 -9.009 -1.039 900 HA GLN 24 HA GLN 24 -21.587 -11.565 0.012 901 1HB GLN 24 1HB GLN 24 -19.699 -9.208 -0.115 902 2HB GLN 24 2HB GLN 24 -19.216 -10.867 0.215 903 1HG GLN 24 1HG GLN 24 -20.045 -11.536 -1.993 904 2HG GLN 24 2HG GLN 24 -20.485 -9.861 -2.322 905 1HE2 GLN 24 1HE2 GLN 24 -18.334 -8.513 -1.320 906 2HE2 GLN 24 2HE2 GLN 24 -16.919 -8.909 -2.228 907 H LYS 25 H LYS 25 -20.116 -11.930 1.982 908 HA LYS 25 HA LYS 25 -21.254 -10.436 4.251 909 1HB LYS 25 1HB LYS 25 -20.988 -13.257 3.723 910 2HB LYS 25 2HB LYS 25 -20.119 -12.835 5.192 911 1HG LYS 25 1HG LYS 25 -22.347 -11.551 5.745 912 2HG LYS 25 2HG LYS 25 -23.029 -12.713 4.605 913 1HD LYS 25 1HD LYS 25 -21.317 -13.505 6.955 914 2HD LYS 25 2HD LYS 25 -23.078 -13.411 7.025 915 1HE LYS 25 1HE LYS 25 -22.457 -14.902 4.726 916 2HE LYS 25 2HE LYS 25 -21.405 -15.508 6.004 917 1HZ LYS 25 1HZ LYS 25 -23.638 -16.604 5.808 918 2HZ LYS 25 2HZ LYS 25 -24.324 -15.163 6.366 919 3HZ LYS 25 3HZ LYS 25 -23.250 -16.024 7.349 920 H GLY 26 H GLY 26 -19.672 -8.827 4.328 921 1HA GLY 26 1HA GLY 26 -17.611 -8.973 6.028 922 2HA GLY 26 2HA GLY 26 -16.877 -9.593 4.557 923 H VAL 27 H VAL 27 -18.799 -7.708 3.067 924 HA VAL 27 HA VAL 27 -16.927 -5.575 2.775 925 HB VAL 27 HB VAL 27 -19.729 -5.863 1.681 926 1HG1 VAL 27 1HG1 VAL 27 -17.556 -3.863 1.111 927 2HG1 VAL 27 2HG1 VAL 27 -18.898 -4.163 0.005 928 3HG1 VAL 27 3HG1 VAL 27 -19.212 -3.555 1.631 929 1HG2 VAL 27 1HG2 VAL 27 -17.125 -6.251 0.226 930 2HG2 VAL 27 2HG2 VAL 27 -17.982 -7.575 1.015 931 3HG2 VAL 27 3HG2 VAL 27 -18.749 -6.691 -0.303 932 H GLN 28 H GLN 28 -16.822 -3.702 3.825 933 HA GLN 28 HA GLN 28 -18.946 -3.037 5.717 934 1HB GLN 28 1HB GLN 28 -16.073 -2.683 5.629 935 2HB GLN 28 2HB GLN 28 -16.887 -1.163 5.978 936 1HG GLN 28 1HG GLN 28 -17.894 -2.026 7.918 937 2HG GLN 28 2HG GLN 28 -17.499 -3.687 7.479 938 1HE2 GLN 28 1HE2 GLN 28 -15.624 -4.537 8.142 939 2HE2 GLN 28 2HE2 GLN 28 -14.397 -3.674 8.999 940 H GLY 29 H GLY 29 -17.416 -1.860 2.807 941 1HA GLY 29 1HA GLY 29 -19.544 -0.275 1.999 942 2HA GLY 29 2HA GLY 29 -18.459 0.781 2.891 943 H ILE 30 H ILE 30 -19.126 1.004 0.123 944 HA ILE 30 HA ILE 30 -16.447 0.623 -1.034 945 HB ILE 30 HB ILE 30 -19.065 0.256 -2.496 946 1HG1 ILE 30 1HG1 ILE 30 -16.978 -1.865 -2.264 947 2HG1 ILE 30 2HG1 ILE 30 -18.016 -1.566 -0.875 948 1HG2 ILE 30 1HG2 ILE 30 -16.209 0.195 -3.443 949 2HG2 ILE 30 2HG2 ILE 30 -17.554 -0.471 -4.368 950 3HG2 ILE 30 3HG2 ILE 30 -17.510 1.251 -3.991 951 1HD1 ILE 30 1HD1 ILE 30 -19.962 -1.829 -2.500 952 2HD1 ILE 30 2HD1 ILE 30 -18.775 -2.517 -3.608 953 3HD1 ILE 30 3HD1 ILE 30 -19.069 -3.279 -2.045 954 H ILE 31 H ILE 31 -15.558 2.463 -1.682 955 HA ILE 31 HA ILE 31 -17.320 4.764 -2.203 956 HB ILE 31 HB ILE 31 -14.428 4.761 -1.331 957 1HG1 ILE 31 1HG1 ILE 31 -16.506 6.017 0.344 958 2HG1 ILE 31 2HG1 ILE 31 -16.608 4.263 0.227 959 1HG2 ILE 31 1HG2 ILE 31 -15.305 7.283 -0.926 960 2HG2 ILE 31 2HG2 ILE 31 -14.448 6.756 -2.373 961 3HG2 ILE 31 3HG2 ILE 31 -16.209 6.854 -2.378 962 1HD1 ILE 31 1HD1 ILE 31 -14.678 3.941 1.372 963 2HD1 ILE 31 2HD1 ILE 31 -13.957 5.448 0.808 964 3HD1 ILE 31 3HD1 ILE 31 -15.175 5.476 2.083 965 H VAL 32 H VAL 32 -17.007 6.028 -4.016 966 HA VAL 32 HA VAL 32 -14.976 5.141 -5.944 967 HB VAL 32 HB VAL 32 -17.756 5.847 -6.843 968 1HG1 VAL 32 1HG1 VAL 32 -17.123 4.939 -8.906 969 2HG1 VAL 32 2HG1 VAL 32 -15.707 5.850 -8.376 970 3HG1 VAL 32 3HG1 VAL 32 -15.740 4.094 -8.211 971 1HG2 VAL 32 1HG2 VAL 32 -16.703 3.098 -6.186 972 2HG2 VAL 32 2HG2 VAL 32 -18.004 3.950 -5.353 973 3HG2 VAL 32 3HG2 VAL 32 -18.217 3.434 -7.025 974 H VAL 33 H VAL 33 -13.711 6.843 -6.276 975 HA VAL 33 HA VAL 33 -14.972 9.495 -6.549 976 HB VAL 33 HB VAL 33 -12.120 9.098 -5.681 977 1HG1 VAL 33 1HG1 VAL 33 -12.376 11.300 -6.310 978 2HG1 VAL 33 2HG1 VAL 33 -14.058 11.367 -5.782 979 3HG1 VAL 33 3HG1 VAL 33 -12.757 11.380 -4.591 980 1HG2 VAL 33 1HG2 VAL 33 -13.219 7.974 -3.961 981 2HG2 VAL 33 2HG2 VAL 33 -13.082 9.624 -3.351 982 3HG2 VAL 33 3HG2 VAL 33 -14.612 9.054 -4.016 983 H ASN 34 H ASN 34 -13.886 10.990 -7.996 984 HA ASN 34 HA ASN 34 -12.409 9.608 -10.140 985 1HB ASN 34 1HB ASN 34 -13.471 11.619 -11.519 986 2HB ASN 34 2HB ASN 34 -14.350 10.115 -11.256 987 1HD2 ASN 34 1HD2 ASN 34 -14.380 13.453 -10.893 988 2HD2 ASN 34 2HD2 ASN 34 -15.783 13.587 -9.894 989 H THR 35 H THR 35 -11.527 11.590 -11.662 990 HA THR 35 HA THR 35 -9.271 12.562 -10.422 991 HB THR 35 HB THR 35 -8.950 14.032 -12.292 992 HG1 THR 35 HG1 THR 35 -10.705 14.444 -13.744 993 1HG2 THR 35 1HG2 THR 35 -8.642 12.335 -13.713 994 2HG2 THR 35 2HG2 THR 35 -10.378 12.070 -13.878 995 3HG2 THR 35 3HG2 THR 35 -9.492 11.318 -12.551 996 H GLU 36 H GLU 36 -12.340 14.282 -10.958 997 HA GLU 36 HA GLU 36 -11.630 16.734 -9.861 998 1HB GLU 36 1HB GLU 36 -14.131 15.319 -10.457 999 2HB GLU 36 2HB GLU 36 -14.270 16.487 -9.150 1000 1HG GLU 36 1HG GLU 36 -12.813 17.727 -11.225 1001 2HG GLU 36 2HG GLU 36 -14.208 16.937 -11.958 1002 H GLY 37 H GLY 37 -12.456 13.726 -8.303 1003 1HA GLY 37 1HA GLY 37 -11.768 13.212 -6.092 1004 2HA GLY 37 2HA GLY 37 -11.751 14.930 -5.725 1005 H ILE 38 H ILE 38 -14.499 13.867 -7.440 1006 HA ILE 38 HA ILE 38 -16.121 14.202 -5.028 1007 HB ILE 38 HB ILE 38 -17.053 14.036 -7.894 1008 1HG1 ILE 38 1HG1 ILE 38 -16.553 16.480 -6.180 1009 2HG1 ILE 38 2HG1 ILE 38 -15.553 15.964 -7.533 1010 1HG2 ILE 38 1HG2 ILE 38 -19.119 14.994 -7.046 1011 2HG2 ILE 38 2HG2 ILE 38 -18.750 13.486 -6.211 1012 3HG2 ILE 38 3HG2 ILE 38 -18.451 15.031 -5.415 1013 1HD1 ILE 38 1HD1 ILE 38 -17.849 16.117 -8.822 1014 2HD1 ILE 38 2HD1 ILE 38 -18.218 17.252 -7.523 1015 3HD1 ILE 38 3HD1 ILE 38 -16.824 17.530 -8.567 1016 HA PRO 39 HA PRO 39 -16.785 9.834 -4.755 1017 1HB PRO 39 1HB PRO 39 -18.825 9.914 -2.966 1018 2HB PRO 39 2HB PRO 39 -17.139 10.194 -2.514 1019 1HG PRO 39 1HG PRO 39 -19.313 12.182 -3.042 1020 2HG PRO 39 2HG PRO 39 -18.096 12.172 -1.753 1021 1HD PRO 39 1HD PRO 39 -17.858 13.711 -3.968 1022 2HD PRO 39 2HD PRO 39 -16.453 13.028 -3.124 1023 H ILE 40 H ILE 40 -17.581 9.922 -7.040 1024 HA ILE 40 HA ILE 40 -20.153 10.449 -7.856 1025 HB ILE 40 HB ILE 40 -19.776 8.531 -9.530 1026 1HG1 ILE 40 1HG1 ILE 40 -16.987 8.668 -8.375 1027 2HG1 ILE 40 2HG1 ILE 40 -18.120 7.366 -8.029 1028 1HG2 ILE 40 1HG2 ILE 40 -18.383 11.096 -9.235 1029 2HG2 ILE 40 2HG2 ILE 40 -17.647 9.981 -10.385 1030 3HG2 ILE 40 3HG2 ILE 40 -19.331 10.465 -10.582 1031 1HD1 ILE 40 1HD1 ILE 40 -17.863 6.422 -10.063 1032 2HD1 ILE 40 2HD1 ILE 40 -17.607 7.967 -10.874 1033 3HD1 ILE 40 3HD1 ILE 40 -16.297 7.226 -9.956 1034 H LYS 41 H LYS 41 -18.923 7.585 -6.220 1035 HA LYS 41 HA LYS 41 -21.684 6.784 -5.663 1036 1HB LYS 41 1HB LYS 41 -19.934 5.401 -7.445 1037 2HB LYS 41 2HB LYS 41 -20.161 4.404 -6.014 1038 1HG LYS 41 1HG LYS 41 -22.455 5.608 -7.536 1039 2HG LYS 41 2HG LYS 41 -21.774 4.024 -7.913 1040 1HD LYS 41 1HD LYS 41 -22.129 3.718 -5.280 1041 2HD LYS 41 2HD LYS 41 -23.404 4.896 -5.598 1042 1HE LYS 41 1HE LYS 41 -23.089 2.422 -7.268 1043 2HE LYS 41 2HE LYS 41 -23.997 2.407 -5.758 1044 1HZ LYS 41 1HZ LYS 41 -25.207 4.414 -6.808 1045 2HZ LYS 41 2HZ LYS 41 -25.616 2.852 -7.310 1046 3HZ LYS 41 3HZ LYS 41 -24.608 3.811 -8.271 1047 H SER 42 H SER 42 -21.994 5.844 -3.678 1048 HA SER 42 HA SER 42 -19.873 4.835 -2.069 1049 1HB SER 42 1HB SER 42 -19.432 7.290 -1.914 1050 2HB SER 42 2HB SER 42 -21.035 7.494 -1.207 1051 HG SER 42 HG SER 42 -18.719 6.460 -0.097 1052 H THR 43 H THR 43 -20.610 3.868 -0.154 1053 HA THR 43 HA THR 43 -23.542 3.799 0.148 1054 HB THR 43 HB THR 43 -23.488 1.479 0.652 1055 HG1 THR 43 HG1 THR 43 -20.741 1.943 0.962 1056 1HG2 THR 43 1HG2 THR 43 -21.520 1.239 -1.501 1057 2HG2 THR 43 2HG2 THR 43 -22.775 2.437 -1.817 1058 3HG2 THR 43 3HG2 THR 43 -23.219 0.768 -1.461 1059 H MET 44 H MET 44 -20.658 4.618 1.589 1060 HA MET 44 HA MET 44 -21.294 3.854 4.290 1061 1HB MET 44 1HB MET 44 -18.997 4.726 2.928 1062 2HB MET 44 2HB MET 44 -19.348 5.980 4.110 1063 1HG MET 44 1HG MET 44 -19.271 4.398 5.904 1064 2HG MET 44 2HG MET 44 -19.129 3.055 4.772 1065 1HE MET 44 1HE MET 44 -15.564 3.598 3.275 1066 2HE MET 44 2HE MET 44 -16.950 2.510 3.368 1067 3HE MET 44 3HE MET 44 -17.124 4.100 2.623 1068 H ASP 45 H ASP 45 -20.711 6.053 5.793 1069 HA ASP 45 HA ASP 45 -23.178 7.456 5.772 1070 1HB ASP 45 1HB ASP 45 -21.045 7.078 7.580 1071 2HB ASP 45 2HB ASP 45 -21.180 8.817 7.334 1072 H ASN 46 H ASN 46 -23.392 9.823 5.709 1073 HA ASN 46 HA ASN 46 -22.431 10.888 3.298 1074 1HB ASN 46 1HB ASN 46 -24.317 11.620 5.256 1075 2HB ASN 46 2HB ASN 46 -23.201 12.977 5.132 1076 1HD2 ASN 46 1HD2 ASN 46 -22.522 12.851 2.471 1077 2HD2 ASN 46 2HD2 ASN 46 -23.914 13.201 1.509 1078 HA PRO 47 HA PRO 47 -19.471 13.623 5.969 1079 1HB PRO 47 1HB PRO 47 -19.176 12.945 8.581 1080 2HB PRO 47 2HB PRO 47 -20.409 14.078 8.016 1081 1HG PRO 47 1HG PRO 47 -20.672 11.173 8.689 1082 2HG PRO 47 2HG PRO 47 -21.755 12.517 9.093 1083 1HD PRO 47 1HD PRO 47 -22.251 10.811 7.049 1084 2HD PRO 47 2HD PRO 47 -22.737 12.518 7.008 1085 H THR 48 H THR 48 -19.711 10.185 6.558 1086 HA THR 48 HA THR 48 -16.918 9.805 7.101 1087 HB THR 48 HB THR 48 -19.053 7.792 6.367 1088 HG1 THR 48 HG1 THR 48 -18.575 7.384 8.777 1089 1HG2 THR 48 1HG2 THR 48 -16.256 7.396 7.438 1090 2HG2 THR 48 2HG2 THR 48 -16.854 6.909 5.852 1091 3HG2 THR 48 3HG2 THR 48 -17.477 6.131 7.307 1092 H THR 49 H THR 49 -18.995 9.643 4.278 1093 HA THR 49 HA THR 49 -17.100 8.387 2.565 1094 HB THR 49 HB THR 49 -19.530 10.057 1.896 1095 HG1 THR 49 HG1 THR 49 -19.063 7.320 2.365 1096 1HG2 THR 49 1HG2 THR 49 -17.865 8.271 0.116 1097 2HG2 THR 49 2HG2 THR 49 -17.947 10.031 0.031 1098 3HG2 THR 49 3HG2 THR 49 -19.373 9.063 -0.340 1099 H THR 50 H THR 50 -18.079 11.762 3.072 1100 HA THR 50 HA THR 50 -16.547 12.970 1.100 1101 HB THR 50 HB THR 50 -16.593 14.488 3.606 1102 HG1 THR 50 HG1 THR 50 -18.615 14.157 4.130 1103 1HG2 THR 50 1HG2 THR 50 -17.145 16.217 2.228 1104 2HG2 THR 50 2HG2 THR 50 -18.205 15.224 1.227 1105 3HG2 THR 50 3HG2 THR 50 -16.457 15.135 1.019 1106 H GLN 51 H GLN 51 -15.645 12.158 4.437 1107 HA GLN 51 HA GLN 51 -13.029 13.235 4.283 1108 1HB GLN 51 1HB GLN 51 -14.147 12.835 6.422 1109 2HB GLN 51 2HB GLN 51 -14.145 11.104 6.114 1110 1HG GLN 51 1HG GLN 51 -11.505 11.708 5.858 1111 2HG GLN 51 2HG GLN 51 -12.016 12.846 7.103 1112 1HE2 GLN 51 1HE2 GLN 51 -10.859 9.813 6.558 1113 2HE2 GLN 51 2HE2 GLN 51 -11.324 9.057 8.040 1114 H TYR 52 H TYR 52 -14.362 10.017 3.712 1115 HA TYR 52 HA TYR 52 -11.912 8.661 3.413 1116 1HB TYR 52 1HB TYR 52 -14.671 8.034 3.209 1117 2HB TYR 52 2HB TYR 52 -13.906 7.502 1.715 1118 HD1 TYR 52 HD1 TYR 52 -14.496 6.745 5.152 1119 HD2 TYR 52 HD2 TYR 52 -11.832 6.008 1.918 1120 HE1 TYR 52 HE1 TYR 52 -13.668 4.734 6.300 1121 HE2 TYR 52 HE2 TYR 52 -10.998 3.994 3.056 1122 HH TYR 52 HH TYR 52 -12.549 2.517 5.552 1123 H ALA 53 H ALA 53 -14.107 10.057 0.983 1124 HA ALA 53 HA ALA 53 -12.733 9.414 -1.316 1125 1HB ALA 53 1HB ALA 53 -13.704 11.615 -2.206 1126 2HB ALA 53 2HB ALA 53 -14.829 10.393 -1.613 1127 3HB ALA 53 3HB ALA 53 -14.427 11.783 -0.606 1128 H SER 54 H SER 54 -12.159 12.105 0.903 1129 HA SER 54 HA SER 54 -10.060 13.230 -0.707 1130 1HB SER 54 1HB SER 54 -11.365 13.867 1.877 1131 2HB SER 54 2HB SER 54 -9.694 14.402 1.699 1132 HG SER 54 HG SER 54 -10.771 16.034 0.810 1133 H LEU 55 H LEU 55 -10.229 11.332 2.283 1134 HA LEU 55 HA LEU 55 -7.567 11.290 2.995 1135 1HB LEU 55 1HB LEU 55 -9.640 10.229 4.117 1136 2HB LEU 55 2HB LEU 55 -9.244 8.813 3.147 1137 HG LEU 55 HG LEU 55 -8.404 8.665 5.459 1138 1HD1 LEU 55 1HD1 LEU 55 -6.182 8.879 3.435 1139 2HD1 LEU 55 2HD1 LEU 55 -7.283 7.509 3.576 1140 3HD1 LEU 55 3HD1 LEU 55 -6.194 7.904 4.905 1141 1HD2 LEU 55 1HD2 LEU 55 -7.983 11.114 5.711 1142 2HD2 LEU 55 2HD2 LEU 55 -6.552 10.918 4.699 1143 3HD2 LEU 55 3HD2 LEU 55 -6.655 10.087 6.252 1144 H MET 56 H MET 56 -9.218 8.865 0.961 1145 HA MET 56 HA MET 56 -6.851 7.508 0.233 1146 1HB MET 56 1HB MET 56 -9.409 7.599 -1.366 1147 2HB MET 56 2HB MET 56 -8.196 6.326 -1.358 1148 1HG MET 56 1HG MET 56 -10.102 7.053 0.848 1149 2HG MET 56 2HG MET 56 -10.070 5.572 -0.107 1150 1HE MET 56 1HE MET 56 -6.298 5.569 0.401 1151 2HE MET 56 2HE MET 56 -6.758 3.953 0.936 1152 3HE MET 56 3HE MET 56 -7.542 4.673 -0.471 1153 H HIS 57 H HIS 57 -8.713 10.073 -1.340 1154 HA HIS 57 HA HIS 57 -7.441 10.197 -3.784 1155 1HB HIS 57 1HB HIS 57 -9.361 11.571 -3.372 1156 2HB HIS 57 2HB HIS 57 -8.544 12.421 -2.063 1157 HD1 HIS 57 HD1 HIS 57 -6.748 14.191 -2.745 1158 HD2 HIS 57 HD2 HIS 57 -8.829 12.515 -5.927 1159 HE1 HIS 57 HE1 HIS 57 -6.262 15.670 -4.720 1160 H SER 58 H SER 58 -6.453 11.676 -0.719 1161 HA SER 58 HA SER 58 -4.114 12.894 -1.852 1162 1HB SER 58 1HB SER 58 -5.540 13.021 0.628 1163 2HB SER 58 2HB SER 58 -3.844 12.678 0.968 1164 HG SER 58 HG SER 58 -4.612 14.984 0.678 1165 H PHE 59 H PHE 59 -4.893 9.848 -0.397 1166 HA PHE 59 HA PHE 59 -2.334 9.040 0.430 1167 1HB PHE 59 1HB PHE 59 -4.546 7.918 0.962 1168 2HB PHE 59 2HB PHE 59 -4.478 7.207 -0.647 1169 HD1 PHE 59 HD1 PHE 59 -1.776 7.736 1.853 1170 HD2 PHE 59 HD2 PHE 59 -4.139 4.944 -0.324 1171 HE1 PHE 59 HE1 PHE 59 -0.402 5.893 2.731 1172 HE2 PHE 59 HE2 PHE 59 -2.769 3.097 0.550 1173 HZ PHE 59 HZ PHE 59 -0.898 3.570 2.080 1174 H ILE 60 H ILE 60 -4.079 8.235 -2.576 1175 HA ILE 60 HA ILE 60 -2.042 6.854 -3.850 1176 HB ILE 60 HB ILE 60 -4.087 8.637 -5.177 1177 1HG1 ILE 60 1HG1 ILE 60 -5.144 7.015 -3.678 1178 2HG1 ILE 60 2HG1 ILE 60 -5.448 6.593 -5.359 1179 1HG2 ILE 60 1HG2 ILE 60 -3.560 6.408 -6.762 1180 2HG2 ILE 60 2HG2 ILE 60 -3.053 8.070 -7.060 1181 3HG2 ILE 60 3HG2 ILE 60 -1.981 6.960 -6.206 1182 1HD1 ILE 60 1HD1 ILE 60 -4.772 4.551 -4.833 1183 2HD1 ILE 60 2HD1 ILE 60 -3.140 5.211 -4.731 1184 3HD1 ILE 60 3HD1 ILE 60 -4.132 5.084 -3.279 1185 H LEU 61 H LEU 61 -2.741 10.333 -3.901 1186 HA LEU 61 HA LEU 61 -0.717 11.058 -5.714 1187 1HB LEU 61 1HB LEU 61 -2.638 12.369 -4.054 1188 2HB LEU 61 2HB LEU 61 -1.077 13.167 -3.871 1189 HG LEU 61 HG LEU 61 -0.989 13.476 -6.324 1190 1HD1 LEU 61 1HD1 LEU 61 -2.293 11.767 -7.225 1191 2HD1 LEU 61 2HD1 LEU 61 -3.261 13.218 -7.482 1192 3HD1 LEU 61 3HD1 LEU 61 -3.656 12.117 -6.161 1193 1HD2 LEU 61 1HD2 LEU 61 -2.671 15.241 -6.424 1194 2HD2 LEU 61 2HD2 LEU 61 -1.830 15.251 -4.874 1195 3HD2 LEU 61 3HD2 LEU 61 -3.459 14.582 -4.991 1196 H LYS 62 H LYS 62 -0.716 10.624 -2.224 1197 HA LYS 62 HA LYS 62 1.850 11.727 -1.749 1198 1HB LYS 62 1HB LYS 62 -0.228 10.556 -0.212 1199 2HB LYS 62 2HB LYS 62 1.249 9.675 0.154 1200 1HG LYS 62 1HG LYS 62 0.893 11.535 1.693 1201 2HG LYS 62 2HG LYS 62 2.368 11.745 0.746 1202 1HD LYS 62 1HD LYS 62 1.617 13.641 -0.165 1203 2HD LYS 62 2HD LYS 62 0.053 12.922 -0.554 1204 1HE LYS 62 1HE LYS 62 0.464 13.445 2.298 1205 2HE LYS 62 2HE LYS 62 0.469 14.892 1.291 1206 1HZ LYS 62 1HZ LYS 62 -1.650 13.047 0.667 1207 2HZ LYS 62 2HZ LYS 62 -1.710 14.719 0.912 1208 3HZ LYS 62 3HZ LYS 62 -1.741 13.670 2.238 1209 H ALA 63 H ALA 63 0.755 8.345 -2.014 1210 HA ALA 63 HA ALA 63 3.320 7.197 -1.842 1211 1HB ALA 63 1HB ALA 63 0.627 6.270 -2.643 1212 2HB ALA 63 2HB ALA 63 2.001 5.309 -3.192 1213 3HB ALA 63 3HB ALA 63 1.758 5.597 -1.469 1214 H ARG 64 H ARG 64 1.302 8.005 -4.657 1215 HA ARG 64 HA ARG 64 2.939 7.045 -6.669 1216 1HB ARG 64 1HB ARG 64 0.612 8.044 -6.880 1217 2HB ARG 64 2HB ARG 64 1.386 9.623 -6.864 1218 1HG ARG 64 1HG ARG 64 2.771 8.162 -8.790 1219 2HG ARG 64 2HG ARG 64 1.070 7.756 -9.030 1220 1HD ARG 64 1HD ARG 64 1.969 10.598 -8.696 1221 2HD ARG 64 2HD ARG 64 2.024 9.798 -10.266 1222 HE ARG 64 HE ARG 64 -0.309 10.739 -8.882 1223 1HH1 ARG 64 1HH1 ARG 64 0.895 8.468 -11.230 1224 2HH1 ARG 64 2HH1 ARG 64 -0.628 8.296 -12.038 1225 1HH2 ARG 64 1HH2 ARG 64 -2.319 10.521 -9.937 1226 2HH2 ARG 64 2HH2 ARG 64 -2.455 9.465 -11.302 1227 H SER 65 H SER 65 3.050 10.178 -5.022 1228 HA SER 65 HA SER 65 5.072 11.339 -6.587 1229 1HB SER 65 1HB SER 65 3.506 12.356 -4.730 1230 2HB SER 65 2HB SER 65 4.854 11.960 -3.664 1231 HG SER 65 HG SER 65 4.967 14.095 -4.562 1232 H THR 66 H THR 66 5.183 9.089 -3.924 1233 HA THR 66 HA THR 66 8.033 9.370 -3.533 1234 HB THR 66 HB THR 66 6.731 6.971 -2.430 1235 HG1 THR 66 HG1 THR 66 4.968 8.284 -2.160 1236 1HG2 THR 66 1HG2 THR 66 8.970 7.728 -1.762 1237 2HG2 THR 66 2HG2 THR 66 7.856 7.720 -0.395 1238 3HG2 THR 66 3HG2 THR 66 8.280 9.242 -1.178 1239 H VAL 67 H VAL 67 5.829 7.156 -5.146 1240 HA VAL 67 HA VAL 67 7.488 5.009 -5.658 1241 HB VAL 67 HB VAL 67 5.419 6.197 -7.513 1242 1HG1 VAL 67 1HG1 VAL 67 5.983 4.634 -8.984 1243 2HG1 VAL 67 2HG1 VAL 67 7.257 4.056 -7.907 1244 3HG1 VAL 67 3HG1 VAL 67 5.628 3.389 -7.787 1245 1HG2 VAL 67 1HG2 VAL 67 4.055 5.619 -5.824 1246 2HG2 VAL 67 2HG2 VAL 67 4.306 3.974 -6.410 1247 3HG2 VAL 67 3HG2 VAL 67 5.266 4.587 -5.064 1248 H ARG 68 H ARG 68 7.191 8.043 -7.467 1249 HA ARG 68 HA ARG 68 8.850 7.441 -9.612 1250 1HB ARG 68 1HB ARG 68 8.493 10.099 -8.215 1251 2HB ARG 68 2HB ARG 68 9.192 9.879 -9.814 1252 1HG ARG 68 1HG ARG 68 7.193 9.788 -10.778 1253 2HG ARG 68 2HG ARG 68 6.586 8.635 -9.588 1254 1HD ARG 68 1HD ARG 68 6.055 10.403 -8.058 1255 2HD ARG 68 2HD ARG 68 6.842 11.595 -9.091 1256 HE ARG 68 HE ARG 68 4.188 10.569 -9.362 1257 1HH1 ARG 68 1HH1 ARG 68 6.903 11.868 -11.112 1258 2HH1 ARG 68 2HH1 ARG 68 5.940 12.460 -12.425 1259 1HH2 ARG 68 1HH2 ARG 68 2.909 11.344 -11.085 1260 2HH2 ARG 68 2HH2 ARG 68 3.668 12.162 -12.408 1261 H ASP 69 H ASP 69 9.636 8.121 -6.311 1262 HA ASP 69 HA ASP 69 12.410 8.716 -6.812 1263 1HB ASP 69 1HB ASP 69 10.616 8.907 -4.600 1264 2HB ASP 69 2HB ASP 69 12.003 7.940 -4.103 1265 H ILE 70 H ILE 70 10.492 5.898 -6.171 1266 HA ILE 70 HA ILE 70 12.602 4.199 -5.303 1267 HB ILE 70 HB ILE 70 10.045 3.327 -6.645 1268 1HG1 ILE 70 1HG1 ILE 70 10.542 3.937 -3.722 1269 2HG1 ILE 70 2HG1 ILE 70 9.535 4.883 -4.813 1270 1HG2 ILE 70 1HG2 ILE 70 10.346 1.278 -5.429 1271 2HG2 ILE 70 2HG2 ILE 70 11.828 1.631 -6.316 1272 3HG2 ILE 70 3HG2 ILE 70 11.746 1.936 -4.582 1273 1HD1 ILE 70 1HD1 ILE 70 8.997 2.292 -3.496 1274 2HD1 ILE 70 2HD1 ILE 70 7.923 3.656 -3.809 1275 3HD1 ILE 70 3HD1 ILE 70 8.333 2.539 -5.111 1276 H ASP 71 H ASP 71 11.174 4.932 -8.443 1277 HA ASP 71 HA ASP 71 13.533 3.846 -9.749 1278 1HB ASP 71 1HB ASP 71 10.917 2.532 -9.788 1279 2HB ASP 71 2HB ASP 71 11.556 2.856 -11.397 1280 HA PRO 72 HA PRO 72 12.966 7.173 -12.549 1281 1HB PRO 72 1HB PRO 72 13.797 6.109 -14.904 1282 2HB PRO 72 2HB PRO 72 14.905 6.508 -13.586 1283 1HG PRO 72 1HG PRO 72 13.743 3.856 -14.346 1284 2HG PRO 72 2HG PRO 72 15.403 4.254 -13.866 1285 1HD PRO 72 1HD PRO 72 13.618 3.146 -12.157 1286 2HD PRO 72 2HD PRO 72 14.884 4.269 -11.620 1287 H GLN 73 H GLN 73 11.843 4.114 -14.006 1288 HA GLN 73 HA GLN 73 9.463 5.559 -14.968 1289 1HB GLN 73 1HB GLN 73 10.754 3.224 -16.379 1290 2HB GLN 73 2HB GLN 73 9.450 4.244 -16.972 1291 1HG GLN 73 1HG GLN 73 11.033 6.161 -16.969 1292 2HG GLN 73 2HG GLN 73 12.321 5.033 -16.548 1293 1HE2 GLN 73 1HE2 GLN 73 13.495 5.290 -18.395 1294 2HE2 GLN 73 2HE2 GLN 73 12.950 4.775 -19.952 1295 H ASN 74 H ASN 74 7.777 4.913 -13.807 1296 HA ASN 74 HA ASN 74 7.241 2.065 -13.551 1297 1HB ASN 74 1HB ASN 74 6.574 2.603 -11.065 1298 2HB ASN 74 2HB ASN 74 8.242 2.212 -11.470 1299 1HD2 ASN 74 1HD2 ASN 74 9.133 3.317 -9.775 1300 2HD2 ASN 74 2HD2 ASN 74 9.118 5.041 -9.659 1301 H ASP 75 H ASP 75 5.030 1.911 -12.192 1302 HA ASP 75 HA ASP 75 3.204 4.078 -12.640 1303 1HB ASP 75 1HB ASP 75 3.602 2.582 -14.860 1304 2HB ASP 75 2HB ASP 75 2.306 1.665 -14.098 1305 H LEU 76 H LEU 76 1.740 4.009 -11.071 1306 HA LEU 76 HA LEU 76 1.609 1.814 -9.266 1307 1HB LEU 76 1HB LEU 76 0.146 4.405 -9.551 1308 2HB LEU 76 2HB LEU 76 -0.429 3.189 -8.412 1309 HG LEU 76 HG LEU 76 0.920 4.856 -7.279 1310 1HD1 LEU 76 1HD1 LEU 76 2.185 3.401 -6.007 1311 2HD1 LEU 76 2HD1 LEU 76 2.663 2.431 -7.399 1312 3HD1 LEU 76 3HD1 LEU 76 1.020 2.315 -6.767 1313 1HD2 LEU 76 1HD2 LEU 76 3.338 3.981 -8.804 1314 2HD2 LEU 76 2HD2 LEU 76 3.079 5.447 -7.858 1315 3HD2 LEU 76 3HD2 LEU 76 2.307 5.265 -9.434 1316 H THR 77 H THR 77 0.322 0.088 -9.269 1317 HA THR 77 HA THR 77 -2.007 0.088 -11.077 1318 HB THR 77 HB THR 77 -0.453 -1.386 -12.083 1319 HG1 THR 77 HG1 THR 77 -1.704 -3.150 -12.126 1320 1HG2 THR 77 1HG2 THR 77 1.256 -2.043 -10.782 1321 2HG2 THR 77 2HG2 THR 77 0.215 -3.398 -10.344 1322 3HG2 THR 77 3HG2 THR 77 0.284 -1.969 -9.312 1323 H PHE 78 H PHE 78 -0.666 -0.891 -7.996 1324 HA PHE 78 HA PHE 78 -3.377 -1.268 -6.978 1325 1HB PHE 78 1HB PHE 78 -1.581 -3.426 -7.479 1326 2HB PHE 78 2HB PHE 78 -1.748 -3.249 -5.736 1327 HD1 PHE 78 HD1 PHE 78 -4.415 -2.594 -5.196 1328 HD2 PHE 78 HD2 PHE 78 -2.918 -5.086 -8.304 1329 HE1 PHE 78 HE1 PHE 78 -6.571 -3.777 -5.281 1330 HE2 PHE 78 HE2 PHE 78 -5.071 -6.272 -8.396 1331 HZ PHE 78 HZ PHE 78 -6.902 -5.618 -6.883 1332 H LEU 79 H LEU 79 -3.606 -0.880 -4.762 1333 HA LEU 79 HA LEU 79 -1.321 -0.291 -3.117 1334 1HB LEU 79 1HB LEU 79 -1.798 1.760 -4.604 1335 2HB LEU 79 2HB LEU 79 -3.216 1.985 -3.582 1336 HG LEU 79 HG LEU 79 -1.726 2.169 -1.617 1337 1HD1 LEU 79 1HD1 LEU 79 0.734 2.778 -2.751 1338 2HD1 LEU 79 2HD1 LEU 79 0.233 1.288 -3.549 1339 3HD1 LEU 79 3HD1 LEU 79 0.333 1.354 -1.790 1340 1HD2 LEU 79 1HD2 LEU 79 -1.653 4.036 -3.919 1341 2HD2 LEU 79 2HD2 LEU 79 -0.541 4.342 -2.585 1342 3HD2 LEU 79 3HD2 LEU 79 -2.279 4.270 -2.287 1343 H ARG 80 H ARG 80 -2.047 -1.604 -1.526 1344 HA ARG 80 HA ARG 80 -4.610 -0.872 -0.275 1345 1HB ARG 80 1HB ARG 80 -3.517 -3.678 -0.266 1346 2HB ARG 80 2HB ARG 80 -5.137 -3.137 0.152 1347 1HG ARG 80 1HG ARG 80 -5.752 -3.682 -1.904 1348 2HG ARG 80 2HG ARG 80 -4.783 -2.326 -2.483 1349 1HD ARG 80 1HD ARG 80 -3.615 -5.049 -1.973 1350 2HD ARG 80 2HD ARG 80 -4.322 -4.599 -3.524 1351 HE ARG 80 HE ARG 80 -2.545 -2.615 -3.055 1352 1HH1 ARG 80 1HH1 ARG 80 -2.311 -6.088 -3.060 1353 2HH1 ARG 80 2HH1 ARG 80 -0.652 -6.107 -3.557 1354 1HH2 ARG 80 1HH2 ARG 80 -0.360 -2.626 -3.710 1355 2HH2 ARG 80 2HH2 ARG 80 0.458 -4.136 -3.925 1356 H ILE 81 H ILE 81 -4.742 -1.471 2.035 1357 HA ILE 81 HA ILE 81 -2.203 -1.840 3.405 1358 HB ILE 81 HB ILE 81 -2.754 0.120 4.938 1359 1HG1 ILE 81 1HG1 ILE 81 -4.119 1.423 2.649 1360 2HG1 ILE 81 2HG1 ILE 81 -5.073 0.267 3.573 1361 1HG2 ILE 81 1HG2 ILE 81 -2.095 1.216 2.266 1362 2HG2 ILE 81 2HG2 ILE 81 -1.266 1.413 3.809 1363 3HG2 ILE 81 3HG2 ILE 81 -1.072 -0.078 2.888 1364 1HD1 ILE 81 1HD1 ILE 81 -3.617 2.614 4.761 1365 2HD1 ILE 81 2HD1 ILE 81 -5.329 2.594 4.338 1366 3HD1 ILE 81 3HD1 ILE 81 -4.718 1.515 5.591 1367 H ARG 82 H ARG 82 -3.050 -3.777 4.175 1368 HA ARG 82 HA ARG 82 -5.569 -4.063 5.399 1369 1HB ARG 82 1HB ARG 82 -4.441 -6.025 4.645 1370 2HB ARG 82 2HB ARG 82 -3.022 -5.663 5.619 1371 1HG ARG 82 1HG ARG 82 -4.201 -6.152 7.640 1372 2HG ARG 82 2HG ARG 82 -5.726 -6.308 6.767 1373 1HD ARG 82 1HD ARG 82 -5.281 -8.494 6.679 1374 2HD ARG 82 2HD ARG 82 -4.074 -8.080 5.463 1375 HE ARG 82 HE ARG 82 -3.080 -7.879 8.142 1376 1HH1 ARG 82 1HH1 ARG 82 -3.699 -10.058 5.499 1377 2HH1 ARG 82 2HH1 ARG 82 -2.500 -11.207 5.993 1378 1HH2 ARG 82 1HH2 ARG 82 -1.498 -9.384 8.804 1379 2HH2 ARG 82 2HH2 ARG 82 -1.249 -10.823 7.874 1380 H SER 83 H SER 83 -6.254 -3.129 7.200 1381 HA SER 83 HA SER 83 -4.298 -2.550 9.324 1382 1HB SER 83 1HB SER 83 -6.853 -1.169 9.571 1383 2HB SER 83 2HB SER 83 -5.217 -0.512 9.577 1384 HG SER 83 HG SER 83 -6.935 -0.992 7.398 1385 H LYS 84 H LYS 84 -5.217 -2.570 11.555 1386 HA LYS 84 HA LYS 84 -6.230 -5.075 12.211 1387 1HB LYS 84 1HB LYS 84 -6.035 -2.481 13.706 1388 2HB LYS 84 2HB LYS 84 -6.838 -3.864 14.439 1389 1HG LYS 84 1HG LYS 84 -4.529 -5.001 13.597 1390 2HG LYS 84 2HG LYS 84 -3.987 -3.363 13.969 1391 1HD LYS 84 1HD LYS 84 -3.851 -4.041 16.093 1392 2HD LYS 84 2HD LYS 84 -5.616 -4.004 16.105 1393 1HE LYS 84 1HE LYS 84 -5.797 -6.284 15.852 1394 2HE LYS 84 2HE LYS 84 -4.222 -6.430 15.074 1395 1HZ LYS 84 1HZ LYS 84 -3.154 -6.547 17.048 1396 2HZ LYS 84 2HZ LYS 84 -4.643 -7.157 17.569 1397 3HZ LYS 84 3HZ LYS 84 -4.248 -5.536 17.849 1398 H LYS 85 H LYS 85 -7.875 -2.185 11.265 1399 HA LYS 85 HA LYS 85 -10.442 -2.931 12.304 1400 1HB LYS 85 1HB LYS 85 -9.306 -0.700 10.771 1401 2HB LYS 85 2HB LYS 85 -10.959 -1.102 10.324 1402 1HG LYS 85 1HG LYS 85 -10.131 -0.660 13.175 1403 2HG LYS 85 2HG LYS 85 -10.650 0.656 12.119 1404 1HD LYS 85 1HD LYS 85 -12.345 -1.792 12.435 1405 2HD LYS 85 2HD LYS 85 -12.392 -0.511 13.648 1406 1HE LYS 85 1HE LYS 85 -12.570 0.826 11.221 1407 2HE LYS 85 2HE LYS 85 -13.571 -0.609 11.001 1408 1HZ LYS 85 1HZ LYS 85 -13.815 1.271 13.286 1409 2HZ LYS 85 2HZ LYS 85 -14.835 -0.032 12.935 1410 3HZ LYS 85 3HZ LYS 85 -14.794 1.311 11.907 1411 H ASN 86 H ASN 86 -9.116 -2.722 8.998 1412 HA ASN 86 HA ASN 86 -10.133 -5.172 8.129 1413 1HB ASN 86 1HB ASN 86 -11.909 -4.040 6.534 1414 2HB ASN 86 2HB ASN 86 -12.350 -4.536 8.165 1415 1HD2 ASN 86 1HD2 ASN 86 -10.984 -1.746 6.453 1416 2HD2 ASN 86 2HD2 ASN 86 -11.864 -0.555 7.343 1417 H GLU 87 H GLU 87 -10.127 -5.332 5.680 1418 HA GLU 87 HA GLU 87 -7.792 -3.913 4.708 1419 1HB GLU 87 1HB GLU 87 -7.856 -5.474 2.842 1420 2HB GLU 87 2HB GLU 87 -7.993 -6.341 4.365 1421 1HG GLU 87 1HG GLU 87 -10.215 -6.870 4.019 1422 2HG GLU 87 2HG GLU 87 -10.449 -5.568 2.855 1423 H ILE 88 H ILE 88 -7.714 -2.665 2.825 1424 HA ILE 88 HA ILE 88 -10.274 -1.891 1.626 1425 HB ILE 88 HB ILE 88 -8.235 0.158 2.487 1426 1HG1 ILE 88 1HG1 ILE 88 -10.865 -0.558 3.801 1427 2HG1 ILE 88 2HG1 ILE 88 -9.269 -0.909 4.455 1428 1HG2 ILE 88 1HG2 ILE 88 -10.492 0.214 0.740 1429 2HG2 ILE 88 2HG2 ILE 88 -10.813 1.242 2.135 1430 3HG2 ILE 88 3HG2 ILE 88 -9.375 1.515 1.152 1431 1HD1 ILE 88 1HD1 ILE 88 -8.830 1.534 4.514 1432 2HD1 ILE 88 2HD1 ILE 88 -10.506 1.797 4.030 1433 3HD1 ILE 88 3HD1 ILE 88 -10.144 1.008 5.566 1434 H MET 89 H MET 89 -9.881 -2.696 -0.369 1435 HA MET 89 HA MET 89 -7.340 -2.497 -1.661 1436 1HB MET 89 1HB MET 89 -10.064 -3.444 -2.462 1437 2HB MET 89 2HB MET 89 -8.849 -3.169 -3.704 1438 1HG MET 89 1HG MET 89 -7.489 -4.648 -1.834 1439 2HG MET 89 2HG MET 89 -9.110 -5.338 -1.787 1440 1HE MET 89 1HE MET 89 -9.688 -6.741 -5.279 1441 2HE MET 89 2HE MET 89 -10.340 -6.345 -3.689 1442 3HE MET 89 3HE MET 89 -10.128 -5.076 -4.896 1443 H VAL 90 H VAL 90 -6.557 -0.915 -2.902 1444 HA VAL 90 HA VAL 90 -8.379 1.003 -4.142 1445 HB VAL 90 HB VAL 90 -6.041 1.908 -2.458 1446 1HG1 VAL 90 1HG1 VAL 90 -8.059 3.873 -3.140 1447 2HG1 VAL 90 2HG1 VAL 90 -6.308 3.933 -3.350 1448 3HG1 VAL 90 3HG1 VAL 90 -7.319 3.162 -4.573 1449 1HG2 VAL 90 1HG2 VAL 90 -7.907 0.999 -1.103 1450 2HG2 VAL 90 2HG2 VAL 90 -7.643 2.724 -0.853 1451 3HG2 VAL 90 3HG2 VAL 90 -8.985 2.174 -1.857 1452 H ALA 91 H ALA 91 -7.833 1.175 -6.204 1453 HA ALA 91 HA ALA 91 -5.012 1.312 -6.951 1454 1HB ALA 91 1HB ALA 91 -5.333 -0.986 -7.281 1455 2HB ALA 91 2HB ALA 91 -6.945 -0.753 -7.959 1456 3HB ALA 91 3HB ALA 91 -5.522 -0.273 -8.884 1457 HA PRO 92 HA PRO 92 -6.411 4.440 -9.701 1458 1HB PRO 92 1HB PRO 92 -4.499 4.299 -11.622 1459 2HB PRO 92 2HB PRO 92 -4.198 4.969 -10.015 1460 1HG PRO 92 1HG PRO 92 -3.562 2.245 -11.081 1461 2HG PRO 92 2HG PRO 92 -2.566 3.313 -10.076 1462 1HD PRO 92 1HD PRO 92 -3.953 1.225 -9.052 1463 2HD PRO 92 2HD PRO 92 -3.661 2.719 -8.137 1464 H ASP 93 H ASP 93 -8.347 3.731 -10.556 1465 HA ASP 93 HA ASP 93 -8.489 1.685 -12.556 1466 1HB ASP 93 1HB ASP 93 -10.304 2.876 -10.844 1467 2HB ASP 93 2HB ASP 93 -10.780 3.496 -12.423 1468 H LYS 94 H LYS 94 -10.264 2.684 -14.412 1469 HA LYS 94 HA LYS 94 -8.660 3.695 -16.398 1470 1HB LYS 94 1HB LYS 94 -11.456 3.205 -16.032 1471 2HB LYS 94 2HB LYS 94 -11.257 4.751 -16.846 1472 1HG LYS 94 1HG LYS 94 -11.199 3.498 -18.699 1473 2HG LYS 94 2HG LYS 94 -9.518 3.218 -18.242 1474 1HD LYS 94 1HD LYS 94 -9.934 1.090 -17.492 1475 2HD LYS 94 2HD LYS 94 -11.618 1.443 -17.098 1476 1HE LYS 94 1HE LYS 94 -12.309 1.218 -19.310 1477 2HE LYS 94 2HE LYS 94 -10.679 1.445 -19.943 1478 1HZ LYS 94 1HZ LYS 94 -10.063 -0.712 -19.092 1479 2HZ LYS 94 2HZ LYS 94 -11.419 -0.865 -20.091 1480 3HZ LYS 94 3HZ LYS 94 -11.596 -0.928 -18.410 1481 H ASP 95 H ASP 95 -10.887 5.566 -14.339 1482 HA ASP 95 HA ASP 95 -9.096 7.837 -14.432 1483 1HB ASP 95 1HB ASP 95 -10.859 9.397 -15.232 1484 2HB ASP 95 2HB ASP 95 -10.362 8.233 -16.458 1485 H TYR 96 H TYR 96 -10.519 5.904 -12.551 1486 HA TYR 96 HA TYR 96 -11.282 7.944 -10.603 1487 1HB TYR 96 1HB TYR 96 -13.203 6.348 -9.913 1488 2HB TYR 96 2HB TYR 96 -13.443 7.403 -11.302 1489 HD1 TYR 96 HD1 TYR 96 -13.385 6.477 -13.588 1490 HD2 TYR 96 HD2 TYR 96 -13.120 3.966 -10.163 1491 HE1 TYR 96 HE1 TYR 96 -13.924 4.525 -14.985 1492 HE2 TYR 96 HE2 TYR 96 -13.656 2.007 -11.551 1493 HH TYR 96 HH TYR 96 -14.323 1.304 -13.564 1494 H PHE 97 H PHE 97 -11.382 7.077 -8.384 1495 HA PHE 97 HA PHE 97 -9.404 4.931 -8.047 1496 1HB PHE 97 1HB PHE 97 -10.155 7.314 -6.380 1497 2HB PHE 97 2HB PHE 97 -9.341 5.936 -5.646 1498 HD1 PHE 97 HD1 PHE 97 -7.375 5.099 -7.513 1499 HD2 PHE 97 HD2 PHE 97 -8.685 9.052 -6.635 1500 HE1 PHE 97 HE1 PHE 97 -5.203 5.981 -8.262 1501 HE2 PHE 97 HE2 PHE 97 -6.516 9.941 -7.383 1502 HZ PHE 97 HZ PHE 97 -4.772 8.405 -8.198 1503 H LEU 98 H LEU 98 -10.457 3.043 -7.863 1504 HA LEU 98 HA LEU 98 -12.999 2.818 -6.542 1505 1HB LEU 98 1HB LEU 98 -12.018 1.422 -8.505 1506 2HB LEU 98 2HB LEU 98 -11.257 0.484 -7.222 1507 HG LEU 98 HG LEU 98 -14.177 0.916 -6.996 1508 1HD1 LEU 98 1HD1 LEU 98 -14.811 -0.602 -8.645 1509 2HD1 LEU 98 2HD1 LEU 98 -13.164 -1.186 -8.877 1510 3HD1 LEU 98 3HD1 LEU 98 -13.619 0.418 -9.452 1511 1HD2 LEU 98 1HD2 LEU 98 -12.750 -0.396 -5.399 1512 2HD2 LEU 98 2HD2 LEU 98 -12.505 -1.571 -6.692 1513 3HD2 LEU 98 3HD2 LEU 98 -14.128 -1.272 -6.067 1514 H ILE 99 H ILE 99 -13.411 2.266 -4.490 1515 HA ILE 99 HA ILE 99 -11.196 1.251 -2.841 1516 HB ILE 99 HB ILE 99 -13.218 3.263 -1.862 1517 1HG1 ILE 99 1HG1 ILE 99 -10.648 4.407 -1.882 1518 2HG1 ILE 99 2HG1 ILE 99 -10.846 3.656 -3.462 1519 1HG2 ILE 99 1HG2 ILE 99 -10.707 2.101 -0.674 1520 2HG2 ILE 99 2HG2 ILE 99 -11.553 3.497 -0.007 1521 3HG2 ILE 99 3HG2 ILE 99 -12.359 1.930 -0.082 1522 1HD1 ILE 99 1HD1 ILE 99 -12.868 4.918 -3.842 1523 2HD1 ILE 99 2HD1 ILE 99 -12.766 5.613 -2.224 1524 3HD1 ILE 99 3HD1 ILE 99 -11.542 6.005 -3.431 1525 H VAL 100 H VAL 100 -11.702 -0.641 -1.980 1526 HA VAL 100 HA VAL 100 -14.519 -1.173 -1.291 1527 HB VAL 100 HB VAL 100 -12.506 -3.159 -2.357 1528 1HG1 VAL 100 1HG1 VAL 100 -13.907 -4.252 -0.757 1529 2HG1 VAL 100 2HG1 VAL 100 -15.355 -3.507 -1.437 1530 3HG1 VAL 100 3HG1 VAL 100 -14.461 -4.710 -2.367 1531 1HG2 VAL 100 1HG2 VAL 100 -14.971 -2.898 -3.837 1532 2HG2 VAL 100 2HG2 VAL 100 -14.121 -1.355 -3.737 1533 3HG2 VAL 100 3HG2 VAL 100 -13.304 -2.771 -4.400 1534 H ILE 101 H ILE 101 -14.709 -1.222 0.845 1535 HA ILE 101 HA ILE 101 -12.464 -2.189 2.467 1536 HB ILE 101 HB ILE 101 -14.939 -0.679 3.316 1537 1HG1 ILE 101 1HG1 ILE 101 -12.471 0.704 3.780 1538 2HG1 ILE 101 2HG1 ILE 101 -12.541 0.212 2.091 1539 1HG2 ILE 101 1HG2 ILE 101 -13.123 -0.398 5.324 1540 2HG2 ILE 101 2HG2 ILE 101 -14.444 -1.565 5.315 1541 3HG2 ILE 101 3HG2 ILE 101 -12.829 -2.057 4.807 1542 1HD1 ILE 101 1HD1 ILE 101 -13.862 1.926 1.667 1543 2HD1 ILE 101 2HD1 ILE 101 -15.069 1.269 2.772 1544 3HD1 ILE 101 3HD1 ILE 101 -13.840 2.383 3.370 1545 H GLN 102 H GLN 102 -12.599 -3.966 3.729 1546 HA GLN 102 HA GLN 102 -15.041 -5.159 4.550 1547 1HB GLN 102 1HB GLN 102 -15.090 -7.123 3.211 1548 2HB GLN 102 2HB GLN 102 -14.968 -5.764 2.101 1549 1HG GLN 102 1HG GLN 102 -12.528 -6.172 1.952 1550 2HG GLN 102 2HG GLN 102 -12.749 -7.610 2.947 1551 1HE2 GLN 102 1HE2 GLN 102 -12.284 -6.671 -0.093 1552 2HE2 GLN 102 2HE2 GLN 102 -13.112 -7.922 -0.948 1553 H ASN 103 H ASN 103 -14.678 -7.241 5.684 1554 HA ASN 103 HA ASN 103 -12.633 -7.097 7.525 1555 1HB ASN 103 1HB ASN 103 -14.566 -9.164 6.688 1556 2HB ASN 103 2HB ASN 103 -13.134 -9.774 7.512 1557 1HD2 ASN 103 1HD2 ASN 103 -16.198 -8.673 7.945 1558 2HD2 ASN 103 2HD2 ASN 103 -16.106 -8.209 9.607 1559 HA PRO 104 HA PRO 104 -8.956 -8.648 5.703 1560 1HB PRO 104 1HB PRO 104 -7.894 -10.139 7.708 1561 2HB PRO 104 2HB PRO 104 -7.940 -8.373 7.746 1562 1HG PRO 104 1HG PRO 104 -9.765 -10.344 9.066 1563 2HG PRO 104 2HG PRO 104 -9.070 -8.850 9.721 1564 1HD PRO 104 1HD PRO 104 -11.614 -8.993 8.804 1565 2HD PRO 104 2HD PRO 104 -10.636 -7.517 8.681 1566 H THR 105 H THR 105 -8.066 -10.409 4.645 1567 HA THR 105 HA THR 105 -9.738 -12.824 4.622 1568 HB THR 105 HB THR 105 -8.679 -13.312 2.433 1569 HG1 THR 105 HG1 THR 105 -7.628 -10.684 2.478 1570 1HG2 THR 105 1HG2 THR 105 -10.757 -11.738 2.876 1571 2HG2 THR 105 2HG2 THR 105 -10.102 -11.955 1.253 1572 3HG2 THR 105 3HG2 THR 105 -9.685 -10.520 2.188 1573 H GLU 106 H GLU 106 -6.402 -11.713 4.887 1574 HA GLU 106 HA GLU 106 -5.651 -14.420 5.777 1575 1HB GLU 106 1HB GLU 106 -4.651 -13.201 3.568 1576 2HB GLU 106 2HB GLU 106 -3.502 -12.656 4.783 1577 1HG GLU 106 1HG GLU 106 -3.310 -15.117 5.442 1578 2HG GLU 106 2HG GLU 106 -4.119 -15.455 3.913 Start of MODEL 12 1 H MET 11 H MET 11 17.965 -9.251 15.158 2 HA MET 11 HA MET 11 18.228 -8.153 12.460 3 1HB MET 11 1HB MET 11 19.982 -7.535 14.006 4 2HB MET 11 2HB MET 11 20.282 -9.223 14.401 5 1HG MET 11 1HG MET 11 21.618 -9.506 12.647 6 2HG MET 11 2HG MET 11 20.505 -8.683 11.557 7 1HE MET 11 1HE MET 11 20.385 -6.269 11.117 8 2HE MET 11 2HE MET 11 20.328 -5.639 12.764 9 3HE MET 11 3HE MET 11 21.538 -5.036 11.630 10 H ALA 12 H ALA 12 19.008 -11.172 14.192 11 HA ALA 12 HA ALA 12 19.717 -12.738 12.035 12 1HB ALA 12 1HB ALA 12 19.403 -14.610 13.407 13 2HB ALA 12 2HB ALA 12 19.779 -13.299 14.526 14 3HB ALA 12 3HB ALA 12 18.110 -13.833 14.321 15 H GLU 13 H GLU 13 16.485 -12.023 13.275 16 HA GLU 13 HA GLU 13 14.979 -13.811 11.800 17 1HB GLU 13 1HB GLU 13 14.229 -12.119 13.586 18 2HB GLU 13 2HB GLU 13 14.094 -10.972 12.261 19 1HG GLU 13 1HG GLU 13 12.401 -12.236 11.209 20 2HG GLU 13 2HG GLU 13 12.689 -13.625 12.257 21 H VAL 14 H VAL 14 15.931 -10.505 10.879 22 HA VAL 14 HA VAL 14 14.774 -10.571 8.309 23 HB VAL 14 HB VAL 14 17.170 -8.932 9.137 24 1HG1 VAL 14 1HG1 VAL 14 15.478 -9.044 6.777 25 2HG1 VAL 14 2HG1 VAL 14 15.543 -7.430 7.489 26 3HG1 VAL 14 3HG1 VAL 14 17.033 -8.248 7.017 27 1HG2 VAL 14 1HG2 VAL 14 14.233 -8.466 9.609 28 2HG2 VAL 14 2HG2 VAL 14 15.523 -8.554 10.808 29 3HG2 VAL 14 3HG2 VAL 14 15.444 -7.186 9.698 30 H GLU 15 H GLU 15 17.930 -11.535 9.519 31 HA GLU 15 HA GLU 15 19.185 -11.865 7.005 32 1HB GLU 15 1HB GLU 15 19.738 -13.001 9.740 33 2HB GLU 15 2HB GLU 15 20.725 -13.413 8.345 34 1HG GLU 15 1HG GLU 15 21.330 -11.093 8.042 35 2HG GLU 15 2HG GLU 15 20.270 -10.620 9.368 36 H GLU 16 H GLU 16 17.256 -13.998 9.035 37 HA GLU 16 HA GLU 16 17.746 -16.382 7.594 38 1HB GLU 16 1HB GLU 16 16.433 -15.743 9.919 39 2HB GLU 16 2HB GLU 16 15.103 -16.166 8.850 40 1HG GLU 16 1HG GLU 16 17.297 -18.060 8.700 41 2HG GLU 16 2HG GLU 16 16.633 -17.911 10.326 42 H THR 17 H THR 17 15.422 -13.781 7.220 43 HA THR 17 HA THR 17 13.901 -15.164 5.197 44 HB THR 17 HB THR 17 13.818 -12.272 6.076 45 HG1 THR 17 HG1 THR 17 13.088 -14.246 7.447 46 1HG2 THR 17 1HG2 THR 17 12.337 -13.794 3.998 47 2HG2 THR 17 2HG2 THR 17 12.809 -12.095 4.034 48 3HG2 THR 17 3HG2 THR 17 11.425 -12.647 4.978 49 H LEU 18 H LEU 18 16.607 -13.000 5.317 50 HA LEU 18 HA LEU 18 16.445 -12.131 2.595 51 1HB LEU 18 1HB LEU 18 18.175 -11.701 4.886 52 2HB LEU 18 2HB LEU 18 19.085 -11.851 3.384 53 HG LEU 18 HG LEU 18 17.285 -10.081 2.559 54 1HD1 LEU 18 1HD1 LEU 18 16.807 -8.470 4.353 55 2HD1 LEU 18 2HD1 LEU 18 17.470 -9.603 5.530 56 3HD1 LEU 18 3HD1 LEU 18 16.019 -10.025 4.621 57 1HD2 LEU 18 1HD2 LEU 18 19.678 -9.752 2.482 58 2HD2 LEU 18 2HD2 LEU 18 19.724 -9.455 4.220 59 3HD2 LEU 18 3HD2 LEU 18 18.903 -8.316 3.151 60 H LYS 19 H LYS 19 18.143 -14.689 4.322 61 HA LYS 19 HA LYS 19 19.865 -15.524 2.286 62 1HB LYS 19 1HB LYS 19 19.174 -16.393 4.864 63 2HB LYS 19 2HB LYS 19 18.862 -17.766 3.810 64 1HG LYS 19 1HG LYS 19 21.099 -17.917 4.649 65 2HG LYS 19 2HG LYS 19 21.162 -17.555 2.922 66 1HD LYS 19 1HD LYS 19 22.508 -15.853 3.431 67 2HD LYS 19 2HD LYS 19 21.108 -15.064 4.161 68 1HE LYS 19 1HE LYS 19 21.646 -15.949 6.314 69 2HE LYS 19 2HE LYS 19 22.900 -16.986 5.635 70 1HZ LYS 19 1HZ LYS 19 23.769 -14.619 4.834 71 2HZ LYS 19 2HZ LYS 19 24.207 -15.300 6.319 72 3HZ LYS 19 3HZ LYS 19 22.974 -14.144 6.249 73 H ARG 20 H ARG 20 16.609 -16.710 3.111 74 HA ARG 20 HA ARG 20 16.443 -18.547 0.970 75 1HB ARG 20 1HB ARG 20 15.012 -18.416 3.105 76 2HB ARG 20 2HB ARG 20 14.066 -17.211 2.243 77 1HG ARG 20 1HG ARG 20 12.850 -18.989 1.619 78 2HG ARG 20 2HG ARG 20 14.117 -19.180 0.405 79 1HD ARG 20 1HD ARG 20 14.458 -21.220 1.228 80 2HD ARG 20 2HD ARG 20 15.125 -20.442 2.663 81 HE ARG 20 HE ARG 20 12.312 -20.593 2.858 82 1HH1 ARG 20 1HH1 ARG 20 15.168 -22.577 3.018 83 2HH1 ARG 20 2HH1 ARG 20 14.455 -23.746 4.080 84 1HH2 ARG 20 1HH2 ARG 20 11.362 -22.125 4.256 85 2HH2 ARG 20 2HH2 ARG 20 12.290 -23.488 4.783 86 H LEU 21 H LEU 21 15.449 -15.176 1.321 87 HA LEU 21 HA LEU 21 14.042 -14.942 -1.098 88 1HB LEU 21 1HB LEU 21 15.188 -13.130 0.901 89 2HB LEU 21 2HB LEU 21 15.080 -12.450 -0.721 90 HG LEU 21 HG LEU 21 12.697 -12.762 -0.752 91 1HD1 LEU 21 1HD1 LEU 21 13.267 -14.626 1.377 92 2HD1 LEU 21 2HD1 LEU 21 11.829 -14.472 0.368 93 3HD1 LEU 21 3HD1 LEU 21 11.988 -13.500 1.831 94 1HD2 LEU 21 1HD2 LEU 21 12.094 -11.411 1.338 95 2HD2 LEU 21 2HD2 LEU 21 13.247 -10.703 0.206 96 3HD2 LEU 21 3HD2 LEU 21 13.820 -11.447 1.700 97 H GLN 22 H GLN 22 17.418 -14.114 -0.318 98 HA GLN 22 HA GLN 22 18.121 -13.373 -2.953 99 1HB GLN 22 1HB GLN 22 19.371 -13.428 -0.427 100 2HB GLN 22 2HB GLN 22 20.383 -14.391 -1.496 101 1HG GLN 22 1HG GLN 22 21.145 -12.595 -2.554 102 2HG GLN 22 2HG GLN 22 19.527 -11.919 -2.739 103 1HE2 GLN 22 1HE2 GLN 22 18.610 -11.134 -0.542 104 2HE2 GLN 22 2HE2 GLN 22 19.679 -10.139 0.380 105 H SER 23 H SER 23 17.794 -16.425 -1.388 106 HA SER 23 HA SER 23 19.464 -17.884 -3.218 107 1HB SER 23 1HB SER 23 17.841 -18.490 -0.842 108 2HB SER 23 2HB SER 23 17.849 -19.772 -2.053 109 HG SER 23 HG SER 23 19.600 -20.141 -0.778 110 H GLN 24 H GLN 24 16.196 -16.804 -3.146 111 HA GLN 24 HA GLN 24 15.444 -18.624 -5.318 112 1HB GLN 24 1HB GLN 24 13.152 -17.922 -4.904 113 2HB GLN 24 2HB GLN 24 13.902 -18.459 -3.407 114 1HG GLN 24 1HG GLN 24 14.085 -16.277 -2.582 115 2HG GLN 24 2HG GLN 24 13.801 -15.563 -4.169 116 1HE2 GLN 24 1HE2 GLN 24 12.327 -14.501 -2.332 117 2HE2 GLN 24 2HE2 GLN 24 10.701 -15.085 -2.346 118 H LYS 25 H LYS 25 14.480 -17.810 -7.243 119 HA LYS 25 HA LYS 25 15.748 -15.424 -8.207 120 1HB LYS 25 1HB LYS 25 15.088 -17.671 -9.448 121 2HB LYS 25 2HB LYS 25 13.593 -16.795 -9.751 122 1HG LYS 25 1HG LYS 25 15.687 -15.026 -10.370 123 2HG LYS 25 2HG LYS 25 16.114 -16.585 -11.079 124 1HD LYS 25 1HD LYS 25 13.431 -15.256 -11.433 125 2HD LYS 25 2HD LYS 25 14.770 -15.085 -12.571 126 1HE LYS 25 1HE LYS 25 14.672 -17.318 -13.211 127 2HE LYS 25 2HE LYS 25 13.804 -17.799 -11.754 128 1HZ LYS 25 1HZ LYS 25 12.637 -16.070 -13.862 129 2HZ LYS 25 2HZ LYS 25 11.830 -16.781 -12.557 130 3HZ LYS 25 3HZ LYS 25 12.431 -17.748 -13.808 131 H GLY 26 H GLY 26 14.691 -13.574 -9.080 132 1HA GLY 26 1HA GLY 26 12.664 -12.309 -9.468 133 2HA GLY 26 2HA GLY 26 11.933 -13.163 -8.118 134 H VAL 27 H VAL 27 13.803 -12.915 -6.152 135 HA VAL 27 HA VAL 27 13.294 -10.411 -5.076 136 HB VAL 27 HB VAL 27 15.622 -12.231 -4.441 137 1HG1 VAL 27 1HG1 VAL 27 15.619 -11.106 -2.254 138 2HG1 VAL 27 2HG1 VAL 27 15.988 -9.994 -3.574 139 3HG1 VAL 27 3HG1 VAL 27 14.383 -9.994 -2.841 140 1HG2 VAL 27 1HG2 VAL 27 13.553 -13.418 -4.187 141 2HG2 VAL 27 2HG2 VAL 27 14.148 -12.994 -2.582 142 3HG2 VAL 27 3HG2 VAL 27 12.832 -12.070 -3.307 143 H GLN 28 H GLN 28 13.971 -8.468 -5.667 144 HA GLN 28 HA GLN 28 16.304 -8.169 -7.356 145 1HB GLN 28 1HB GLN 28 13.968 -6.536 -6.627 146 2HB GLN 28 2HB GLN 28 15.456 -5.624 -6.845 147 1HG GLN 28 1HG GLN 28 15.609 -6.137 -9.076 148 2HG GLN 28 2HG GLN 28 14.659 -7.613 -8.912 149 1HE2 GLN 28 1HE2 GLN 28 12.907 -7.408 -10.105 150 2HE2 GLN 28 2HE2 GLN 28 11.868 -6.029 -10.158 151 H GLY 29 H GLY 29 15.379 -7.591 -4.041 152 1HA GLY 29 1HA GLY 29 17.821 -7.624 -2.886 153 2HA GLY 29 2HA GLY 29 17.700 -5.967 -3.459 154 H ILE 30 H ILE 30 17.721 -7.296 -0.719 155 HA ILE 30 HA ILE 30 15.233 -6.094 0.303 156 HB ILE 30 HB ILE 30 16.939 -8.103 1.764 157 1HG1 ILE 30 1HG1 ILE 30 14.633 -9.421 1.036 158 2HG1 ILE 30 2HG1 ILE 30 15.007 -8.485 -0.407 159 1HG2 ILE 30 1HG2 ILE 30 15.379 -6.604 3.041 160 2HG2 ILE 30 2HG2 ILE 30 14.049 -7.373 2.176 161 3HG2 ILE 30 3HG2 ILE 30 15.085 -8.332 3.233 162 1HD1 ILE 30 1HD1 ILE 30 17.381 -9.736 0.592 163 2HD1 ILE 30 2HD1 ILE 30 16.100 -10.930 0.378 164 3HD1 ILE 30 3HD1 ILE 30 16.593 -9.913 -0.976 165 H ILE 31 H ILE 31 15.320 -4.594 1.920 166 HA ILE 31 HA ILE 31 17.982 -3.846 2.928 167 HB ILE 31 HB ILE 31 15.832 -1.926 2.024 168 1HG1 ILE 31 1HG1 ILE 31 18.560 -1.841 0.881 169 2HG1 ILE 31 2HG1 ILE 31 17.587 -3.237 0.430 170 1HG2 ILE 31 1HG2 ILE 31 17.721 -0.249 2.471 171 2HG2 ILE 31 2HG2 ILE 31 16.842 -0.893 3.856 172 3HG2 ILE 31 3HG2 ILE 31 18.438 -1.526 3.453 173 1HD1 ILE 31 1HD1 ILE 31 16.611 -0.413 0.149 174 2HD1 ILE 31 2HD1 ILE 31 17.487 -1.265 -1.122 175 3HD1 ILE 31 3HD1 ILE 31 15.933 -1.879 -0.559 176 H VAL 32 H VAL 32 18.082 -3.127 5.034 177 HA VAL 32 HA VAL 32 15.570 -3.278 6.571 178 HB VAL 32 HB VAL 32 18.252 -3.932 7.755 179 1HG1 VAL 32 1HG1 VAL 32 17.000 -4.992 9.464 180 2HG1 VAL 32 2HG1 VAL 32 16.222 -3.435 9.172 181 3HG1 VAL 32 3HG1 VAL 32 15.512 -4.913 8.522 182 1HG2 VAL 32 1HG2 VAL 32 17.684 -6.332 7.392 183 2HG2 VAL 32 2HG2 VAL 32 16.380 -5.813 6.323 184 3HG2 VAL 32 3HG2 VAL 32 18.056 -5.451 5.909 185 H VAL 33 H VAL 33 15.054 -1.213 6.984 186 HA VAL 33 HA VAL 33 17.173 0.584 7.962 187 HB VAL 33 HB VAL 33 14.473 1.476 6.975 188 1HG1 VAL 33 1HG1 VAL 33 15.502 3.203 8.164 189 2HG1 VAL 33 2HG1 VAL 33 17.102 2.811 7.530 190 3HG1 VAL 33 3HG1 VAL 33 15.893 3.553 6.481 191 1HG2 VAL 33 1HG2 VAL 33 15.583 1.975 4.813 192 2HG2 VAL 33 2HG2 VAL 33 16.996 1.076 5.369 193 3HG2 VAL 33 3HG2 VAL 33 15.454 0.248 5.149 194 H ASN 34 H ASN 34 16.630 2.053 9.693 195 HA ASN 34 HA ASN 34 14.831 0.800 11.631 196 1HB ASN 34 1HB ASN 34 16.608 3.098 12.334 197 2HB ASN 34 2HB ASN 34 16.127 1.716 13.313 198 1HD2 ASN 34 1HD2 ASN 34 18.769 2.950 12.542 199 2HD2 ASN 34 2HD2 ASN 34 19.711 1.615 11.980 200 H THR 35 H THR 35 14.228 2.859 13.294 201 HA THR 35 HA THR 35 12.089 4.136 11.913 202 HB THR 35 HB THR 35 11.462 5.089 14.000 203 HG1 THR 35 HG1 THR 35 13.137 5.943 15.016 204 1HG2 THR 35 1HG2 THR 35 11.831 2.391 13.690 205 2HG2 THR 35 2HG2 THR 35 10.950 3.151 15.015 206 3HG2 THR 35 3HG2 THR 35 12.644 2.707 15.222 207 H GLU 36 H GLU 36 15.354 4.990 12.579 208 HA GLU 36 HA GLU 36 14.930 7.835 12.243 209 1HB GLU 36 1HB GLU 36 17.222 6.077 12.922 210 2HB GLU 36 2HB GLU 36 17.603 7.592 12.115 211 1HG GLU 36 1HG GLU 36 15.835 8.369 14.065 212 2HG GLU 36 2HG GLU 36 16.759 7.090 14.851 213 H GLY 37 H GLY 37 16.352 5.155 10.413 214 1HA GLY 37 1HA GLY 37 15.727 5.404 7.946 215 2HA GLY 37 2HA GLY 37 16.564 6.944 8.078 216 H ILE 38 H ILE 38 18.213 4.998 10.087 217 HA ILE 38 HA ILE 38 20.366 4.656 8.208 218 HB ILE 38 HB ILE 38 20.166 3.790 11.095 219 1HG1 ILE 38 1HG1 ILE 38 21.530 6.202 9.878 220 2HG1 ILE 38 2HG1 ILE 38 19.986 6.244 10.722 221 1HG2 ILE 38 1HG2 ILE 38 21.831 2.507 9.866 222 2HG2 ILE 38 2HG2 ILE 38 22.563 3.998 9.277 223 3HG2 ILE 38 3HG2 ILE 38 22.606 3.614 10.998 224 1HD1 ILE 38 1HD1 ILE 38 22.628 6.373 11.785 225 2HD1 ILE 38 2HD1 ILE 38 21.081 6.566 12.610 226 3HD1 ILE 38 3HD1 ILE 38 21.797 4.964 12.442 227 HA PRO 39 HA PRO 39 18.941 0.576 7.041 228 1HB PRO 39 1HB PRO 39 20.874 0.165 5.180 229 2HB PRO 39 2HB PRO 39 19.452 1.170 4.881 230 1HG PRO 39 1HG PRO 39 22.232 1.994 5.626 231 2HG PRO 39 2HG PRO 39 21.137 2.707 4.426 232 1HD PRO 39 1HD PRO 39 21.496 3.777 6.888 233 2HD PRO 39 2HD PRO 39 19.952 3.878 6.019 234 H ILE 40 H ILE 40 19.531 -0.325 9.111 235 HA ILE 40 HA ILE 40 22.048 -0.918 10.043 236 HB ILE 40 HB ILE 40 20.930 -3.005 11.061 237 1HG1 ILE 40 1HG1 ILE 40 18.445 -1.626 10.035 238 2HG1 ILE 40 2HG1 ILE 40 19.139 -3.056 9.279 239 1HG2 ILE 40 1HG2 ILE 40 20.404 -0.149 11.555 240 2HG2 ILE 40 2HG2 ILE 40 19.320 -1.282 12.361 241 3HG2 ILE 40 3HG2 ILE 40 21.060 -1.387 12.626 242 1HD1 ILE 40 1HD1 ILE 40 18.573 -3.194 12.178 243 2HD1 ILE 40 2HD1 ILE 40 17.199 -3.193 11.072 244 3HD1 ILE 40 3HD1 ILE 40 18.442 -4.435 10.933 245 H LYS 41 H LYS 41 20.161 -2.625 7.614 246 HA LYS 41 HA LYS 41 22.575 -4.047 6.794 247 1HB LYS 41 1HB LYS 41 20.150 -5.302 7.930 248 2HB LYS 41 2HB LYS 41 20.779 -6.049 6.467 249 1HG LYS 41 1HG LYS 41 22.916 -5.510 8.311 250 2HG LYS 41 2HG LYS 41 21.641 -6.448 9.093 251 1HD LYS 41 1HD LYS 41 23.269 -7.933 8.076 252 2HD LYS 41 2HD LYS 41 21.721 -8.064 7.237 253 1HE LYS 41 1HE LYS 41 22.562 -6.536 5.499 254 2HE LYS 41 2HE LYS 41 24.116 -6.470 6.328 255 1HZ LYS 41 1HZ LYS 41 23.748 -9.112 6.054 256 2HZ LYS 41 2HZ LYS 41 24.627 -8.157 4.970 257 3HZ LYS 41 3HZ LYS 41 23.012 -8.540 4.642 258 H SER 42 H SER 42 22.621 -4.611 4.618 259 HA SER 42 HA SER 42 20.321 -4.277 2.930 260 1HB SER 42 1HB SER 42 21.417 -2.474 1.532 261 2HB SER 42 2HB SER 42 20.829 -1.945 3.108 262 HG SER 42 HG SER 42 23.457 -2.294 2.205 263 H THR 43 H THR 43 20.608 -5.152 0.886 264 HA THR 43 HA THR 43 23.225 -6.424 0.408 265 HB THR 43 HB THR 43 21.946 -8.290 0.815 266 HG1 THR 43 HG1 THR 43 21.007 -8.146 -1.807 267 1HG2 THR 43 1HG2 THR 43 19.510 -8.319 -0.279 268 2HG2 THR 43 2HG2 THR 43 19.689 -6.577 -0.066 269 3HG2 THR 43 3HG2 THR 43 19.817 -7.654 1.324 270 H MET 44 H MET 44 20.952 -4.242 -0.730 271 HA MET 44 HA MET 44 21.366 -4.687 -3.548 272 1HB MET 44 1HB MET 44 19.444 -3.379 -2.045 273 2HB MET 44 2HB MET 44 20.330 -2.062 -2.802 274 1HG MET 44 1HG MET 44 19.880 -2.917 -4.982 275 2HG MET 44 2HG MET 44 19.196 -4.398 -4.316 276 1HE MET 44 1HE MET 44 16.217 -4.289 -3.389 277 2HE MET 44 2HE MET 44 17.595 -4.084 -2.307 278 3HE MET 44 3HE MET 44 16.261 -2.930 -2.265 279 H ASP 45 H ASP 45 21.702 -2.183 -4.587 280 HA ASP 45 HA ASP 45 24.515 -1.823 -4.336 281 1HB ASP 45 1HB ASP 45 22.441 -0.993 -6.130 282 2HB ASP 45 2HB ASP 45 23.381 0.418 -5.655 283 H ASN 46 H ASN 46 25.611 0.147 -3.746 284 HA ASN 46 HA ASN 46 24.891 1.124 -1.231 285 1HB ASN 46 1HB ASN 46 27.088 1.372 -2.974 286 2HB ASN 46 2HB ASN 46 26.561 3.017 -2.629 287 1HD2 ASN 46 1HD2 ASN 46 25.631 2.720 -0.051 288 2HD2 ASN 46 2HD2 ASN 46 26.958 2.351 0.992 289 HA PRO 47 HA PRO 47 23.445 5.186 -3.419 290 1HB PRO 47 1HB PRO 47 23.155 5.104 -6.117 291 2HB PRO 47 2HB PRO 47 24.668 5.563 -5.327 292 1HG PRO 47 1HG PRO 47 23.873 2.933 -6.515 293 2HG PRO 47 2HG PRO 47 25.416 3.797 -6.642 294 1HD PRO 47 1HD PRO 47 25.040 1.728 -4.935 295 2HD PRO 47 2HD PRO 47 26.131 3.081 -4.571 296 H THR 48 H THR 48 22.418 2.064 -4.603 297 HA THR 48 HA THR 48 19.751 2.894 -5.271 298 HB THR 48 HB THR 48 20.902 0.124 -4.889 299 HG1 THR 48 HG1 THR 48 20.633 0.234 -7.288 300 1HG2 THR 48 1HG2 THR 48 18.493 0.094 -4.557 301 2HG2 THR 48 2HG2 THR 48 18.898 -0.642 -6.107 302 3HG2 THR 48 3HG2 THR 48 18.255 0.999 -6.051 303 H THR 49 H THR 49 21.355 1.500 -2.483 304 HA THR 49 HA THR 49 18.933 0.883 -1.077 305 HB THR 49 HB THR 49 21.787 1.088 -0.100 306 HG1 THR 49 HG1 THR 49 20.139 -1.014 -1.027 307 1HG2 THR 49 1HG2 THR 49 20.262 -0.553 1.598 308 2HG2 THR 49 2HG2 THR 49 19.324 0.923 1.372 309 3HG2 THR 49 3HG2 THR 49 20.978 1.013 1.975 310 H THR 50 H THR 50 21.413 3.417 -0.778 311 HA THR 50 HA THR 50 20.340 4.809 1.368 312 HB THR 50 HB THR 50 21.591 6.303 -0.912 313 HG1 THR 50 HG1 THR 50 23.644 5.572 0.019 314 1HG2 THR 50 1HG2 THR 50 20.892 7.469 1.171 315 2HG2 THR 50 2HG2 THR 50 22.625 7.575 0.859 316 3HG2 THR 50 3HG2 THR 50 22.014 6.452 2.074 317 H GLN 51 H GLN 51 19.422 4.842 -2.012 318 HA GLN 51 HA GLN 51 17.748 7.148 -1.839 319 1HB GLN 51 1HB GLN 51 18.638 6.508 -3.983 320 2HB GLN 51 2HB GLN 51 17.903 4.914 -3.865 321 1HG GLN 51 1HG GLN 51 15.975 7.082 -3.636 322 2HG GLN 51 2HG GLN 51 16.852 7.085 -5.165 323 1HE2 GLN 51 1HE2 GLN 51 14.571 5.427 -3.172 324 2HE2 GLN 51 2HE2 GLN 51 14.078 4.257 -4.343 325 H TYR 52 H TYR 52 17.129 3.650 -1.850 326 HA TYR 52 HA TYR 52 14.322 3.849 -1.614 327 1HB TYR 52 1HB TYR 52 16.340 1.687 -1.235 328 2HB TYR 52 2HB TYR 52 14.728 1.436 -0.574 329 HD1 TYR 52 HD1 TYR 52 16.235 2.714 -3.755 330 HD2 TYR 52 HD2 TYR 52 13.273 0.273 -1.921 331 HE1 TYR 52 HE1 TYR 52 15.440 2.020 -5.977 332 HE2 TYR 52 HE2 TYR 52 12.470 -0.429 -4.137 333 HH TYR 52 HH TYR 52 13.549 -0.588 -6.520 334 H ALA 53 H ALA 53 16.821 3.162 0.832 335 HA ALA 53 HA ALA 53 15.141 3.039 3.053 336 1HB ALA 53 1HB ALA 53 18.040 3.735 2.738 337 2HB ALA 53 2HB ALA 53 17.256 3.752 4.318 338 3HB ALA 53 3HB ALA 53 17.315 2.260 3.379 339 H SER 54 H SER 54 16.193 5.749 1.205 340 HA SER 54 HA SER 54 15.784 7.730 3.231 341 1HB SER 54 1HB SER 54 17.299 8.166 1.364 342 2HB SER 54 2HB SER 54 15.968 7.997 0.220 343 HG SER 54 HG SER 54 16.454 10.195 0.755 344 H LEU 55 H LEU 55 13.968 6.856 0.289 345 HA LEU 55 HA LEU 55 11.723 8.477 1.002 346 1HB LEU 55 1HB LEU 55 10.841 7.905 -1.023 347 2HB LEU 55 2HB LEU 55 12.553 7.622 -1.330 348 HG LEU 55 HG LEU 55 11.881 5.161 -0.573 349 1HD1 LEU 55 1HD1 LEU 55 9.407 6.374 -0.558 350 2HD1 LEU 55 2HD1 LEU 55 9.717 4.640 -0.630 351 3HD1 LEU 55 3HD1 LEU 55 9.453 5.551 -2.117 352 1HD2 LEU 55 1HD2 LEU 55 12.070 4.571 -2.784 353 2HD2 LEU 55 2HD2 LEU 55 12.770 6.190 -2.810 354 3HD2 LEU 55 3HD2 LEU 55 11.108 5.939 -3.346 355 H MET 56 H MET 56 12.794 5.417 1.959 356 HA MET 56 HA MET 56 10.366 4.042 2.311 357 1HB MET 56 1HB MET 56 13.115 3.636 2.949 358 2HB MET 56 2HB MET 56 12.168 3.332 4.400 359 1HG MET 56 1HG MET 56 12.507 1.296 3.125 360 2HG MET 56 2HG MET 56 10.800 1.729 3.193 361 1HE MET 56 1HE MET 56 9.438 1.526 1.665 362 2HE MET 56 2HE MET 56 9.521 2.773 0.420 363 3HE MET 56 3HE MET 56 9.713 1.074 -0.018 364 H HIS 57 H HIS 57 12.340 5.451 4.924 365 HA HIS 57 HA HIS 57 10.355 5.438 6.864 366 1HB HIS 57 1HB HIS 57 12.643 5.785 7.501 367 2HB HIS 57 2HB HIS 57 12.749 7.251 6.532 368 HD1 HIS 57 HD1 HIS 57 10.562 6.058 9.421 369 HD2 HIS 57 HD2 HIS 57 12.570 9.442 8.087 370 HE1 HIS 57 HE1 HIS 57 10.176 7.808 11.185 371 H SER 58 H SER 58 10.976 7.726 4.303 372 HA SER 58 HA SER 58 9.272 9.780 5.343 373 1HB SER 58 1HB SER 58 11.024 10.461 3.859 374 2HB SER 58 2HB SER 58 10.497 9.325 2.618 375 HG SER 58 HG SER 58 9.665 11.246 2.000 376 H PHE 59 H PHE 59 8.834 6.935 3.428 377 HA PHE 59 HA PHE 59 6.306 7.712 2.310 378 1HB PHE 59 1HB PHE 59 7.653 6.106 1.109 379 2HB PHE 59 2HB PHE 59 7.691 5.031 2.503 380 HD1 PHE 59 HD1 PHE 59 6.623 3.094 1.836 381 HD2 PHE 59 HD2 PHE 59 4.841 6.858 0.961 382 HE1 PHE 59 HE1 PHE 59 4.613 1.944 1.004 383 HE2 PHE 59 HE2 PHE 59 2.828 5.715 0.128 384 HZ PHE 59 HZ PHE 59 2.711 3.255 0.149 385 H ILE 60 H ILE 60 7.249 5.276 4.739 386 HA ILE 60 HA ILE 60 4.706 4.542 5.560 387 HB ILE 60 HB ILE 60 7.196 4.707 7.262 388 1HG1 ILE 60 1HG1 ILE 60 7.528 3.331 5.274 389 2HG1 ILE 60 2HG1 ILE 60 7.437 2.311 6.706 390 1HG2 ILE 60 1HG2 ILE 60 4.489 3.979 7.895 391 2HG2 ILE 60 2HG2 ILE 60 5.561 2.594 8.095 392 3HG2 ILE 60 3HG2 ILE 60 5.893 4.098 8.955 393 1HD1 ILE 60 1HD1 ILE 60 4.819 2.527 5.719 394 2HD1 ILE 60 2HD1 ILE 60 5.865 2.230 4.330 395 3HD1 ILE 60 3HD1 ILE 60 5.879 1.118 5.698 396 H LEU 61 H LEU 61 6.701 7.257 6.600 397 HA LEU 61 HA LEU 61 5.089 8.080 8.762 398 1HB LEU 61 1HB LEU 61 7.358 9.100 7.269 399 2HB LEU 61 2HB LEU 61 6.252 10.385 7.750 400 HG LEU 61 HG LEU 61 6.517 9.816 10.073 401 1HD1 LEU 61 1HD1 LEU 61 8.109 8.042 10.756 402 2HD1 LEU 61 2HD1 LEU 61 8.202 7.527 9.073 403 3HD1 LEU 61 3HD1 LEU 61 6.671 7.424 9.943 404 1HD2 LEU 61 1HD2 LEU 61 8.163 11.332 9.357 405 2HD2 LEU 61 2HD2 LEU 61 9.067 10.080 8.504 406 3HD2 LEU 61 3HD2 LEU 61 9.040 10.102 10.268 407 H LYS 62 H LYS 62 4.800 8.485 5.336 408 HA LYS 62 HA LYS 62 2.961 10.686 5.446 409 1HB LYS 62 1HB LYS 62 4.429 9.332 3.440 410 2HB LYS 62 2HB LYS 62 2.730 9.185 3.010 411 1HG LYS 62 1HG LYS 62 3.734 11.143 1.982 412 2HG LYS 62 2HG LYS 62 2.478 11.606 3.133 413 1HD LYS 62 1HD LYS 62 3.944 12.619 4.520 414 2HD LYS 62 2HD LYS 62 5.204 11.417 4.235 415 1HE LYS 62 1HE LYS 62 6.092 13.333 3.275 416 2HE LYS 62 2HE LYS 62 5.379 12.498 1.895 417 1HZ LYS 62 1HZ LYS 62 4.790 15.066 2.902 418 2HZ LYS 62 2HZ LYS 62 3.396 14.111 2.972 419 3HZ LYS 62 3HZ LYS 62 4.207 14.318 1.501 420 H ALA 63 H ALA 63 2.625 7.222 4.673 421 HA ALA 63 HA ALA 63 -0.203 7.277 4.525 422 1HB ALA 63 1HB ALA 63 0.743 5.481 3.414 423 2HB ALA 63 2HB ALA 63 1.837 5.100 4.745 424 3HB ALA 63 3HB ALA 63 0.118 4.730 4.883 425 H ARG 64 H ARG 64 2.039 6.280 7.098 426 HA ARG 64 HA ARG 64 0.184 5.398 8.963 427 1HB ARG 64 1HB ARG 64 2.728 5.278 9.075 428 2HB ARG 64 2HB ARG 64 2.680 6.926 9.687 429 1HG ARG 64 1HG ARG 64 0.850 5.498 11.244 430 2HG ARG 64 2HG ARG 64 2.259 4.448 11.073 431 1HD ARG 64 1HD ARG 64 2.545 5.827 13.022 432 2HD ARG 64 2HD ARG 64 3.694 6.339 11.786 433 HE ARG 64 HE ARG 64 2.670 8.379 11.745 434 1HH1 ARG 64 1HH1 ARG 64 0.523 6.074 13.228 435 2HH1 ARG 64 2HH1 ARG 64 -0.651 7.264 13.684 436 1HH2 ARG 64 1HH2 ARG 64 1.132 9.955 12.340 437 2HH2 ARG 64 2HH2 ARG 64 -0.304 9.471 13.178 438 H SER 65 H SER 65 1.160 8.658 8.128 439 HA SER 65 HA SER 65 -0.188 9.882 10.352 440 1HB SER 65 1HB SER 65 1.821 10.830 9.071 441 2HB SER 65 2HB SER 65 0.664 11.284 7.820 442 HG SER 65 HG SER 65 0.516 12.067 10.546 443 H THR 66 H THR 66 -1.016 8.922 7.130 444 HA THR 66 HA THR 66 -3.399 10.553 6.998 445 HB THR 66 HB THR 66 -2.788 8.229 5.183 446 HG1 THR 66 HG1 THR 66 -1.014 9.298 4.709 447 1HG2 THR 66 1HG2 THR 66 -4.228 9.227 3.685 448 2HG2 THR 66 2HG2 THR 66 -3.981 10.839 4.357 449 3HG2 THR 66 3HG2 THR 66 -4.982 9.669 5.216 450 H VAL 67 H VAL 67 -2.550 7.244 7.792 451 HA VAL 67 HA VAL 67 -5.005 5.987 7.669 452 HB VAL 67 HB VAL 67 -2.917 5.570 9.813 453 1HG1 VAL 67 1HG1 VAL 67 -3.839 3.222 9.750 454 2HG1 VAL 67 2HG1 VAL 67 -4.901 4.443 10.451 455 3HG1 VAL 67 3HG1 VAL 67 -5.184 3.865 8.809 456 1HG2 VAL 67 1HG2 VAL 67 -2.682 5.264 7.035 457 2HG2 VAL 67 2HG2 VAL 67 -1.578 4.678 8.279 458 3HG2 VAL 67 3HG2 VAL 67 -2.875 3.638 7.690 459 H ARG 68 H ARG 68 -3.684 8.002 10.262 460 HA ARG 68 HA ARG 68 -5.622 7.604 12.202 461 1HB ARG 68 1HB ARG 68 -3.893 9.961 11.510 462 2HB ARG 68 2HB ARG 68 -5.061 10.059 12.821 463 1HG ARG 68 1HG ARG 68 -3.003 7.881 12.688 464 2HG ARG 68 2HG ARG 68 -2.670 9.450 13.425 465 1HD ARG 68 1HD ARG 68 -3.671 8.806 15.298 466 2HD ARG 68 2HD ARG 68 -5.162 8.492 14.413 467 HE ARG 68 HE ARG 68 -3.433 6.332 14.013 468 1HH1 ARG 68 1HH1 ARG 68 -5.250 7.831 16.577 469 2HH1 ARG 68 2HH1 ARG 68 -5.460 6.358 17.466 470 1HH2 ARG 68 1HH2 ARG 68 -3.703 4.387 15.173 471 2HH2 ARG 68 2HH2 ARG 68 -4.579 4.400 16.666 472 H ASP 69 H ASP 69 -5.794 9.386 9.232 473 HA ASP 69 HA ASP 69 -8.008 11.031 9.846 474 1HB ASP 69 1HB ASP 69 -6.445 11.307 7.886 475 2HB ASP 69 2HB ASP 69 -7.274 9.955 7.119 476 H ILE 70 H ILE 70 -7.717 7.704 8.851 477 HA ILE 70 HA ILE 70 -10.411 7.333 8.032 478 HB ILE 70 HB ILE 70 -8.537 5.220 9.095 479 1HG1 ILE 70 1HG1 ILE 70 -8.888 6.117 6.228 480 2HG1 ILE 70 2HG1 ILE 70 -7.543 6.604 7.254 481 1HG2 ILE 70 1HG2 ILE 70 -10.176 3.794 8.654 482 2HG2 ILE 70 2HG2 ILE 70 -11.218 5.139 8.194 483 3HG2 ILE 70 3HG2 ILE 70 -10.220 4.341 6.979 484 1HD1 ILE 70 1HD1 ILE 70 -8.176 3.899 6.146 485 2HD1 ILE 70 2HD1 ILE 70 -6.697 4.849 5.993 486 3HD1 ILE 70 3HD1 ILE 70 -7.108 4.098 7.535 487 H ASP 71 H ASP 71 -8.694 6.645 11.067 488 HA ASP 71 HA ASP 71 -10.830 7.302 12.736 489 1HB ASP 71 1HB ASP 71 -10.935 4.592 11.635 490 2HB ASP 71 2HB ASP 71 -10.966 4.625 13.396 491 HA PRO 72 HA PRO 72 -7.634 7.022 15.728 492 1HB PRO 72 1HB PRO 72 -9.054 6.618 18.006 493 2HB PRO 72 2HB PRO 72 -9.024 8.166 17.155 494 1HG PRO 72 1HG PRO 72 -11.094 6.005 17.083 495 2HG PRO 72 2HG PRO 72 -11.314 7.761 17.181 496 1HD PRO 72 1HD PRO 72 -11.590 6.385 14.865 497 2HD PRO 72 2HD PRO 72 -10.988 8.054 14.918 498 H GLN 73 H GLN 73 -10.070 4.451 15.866 499 HA GLN 73 HA GLN 73 -8.409 2.659 17.356 500 1HB GLN 73 1HB GLN 73 -10.913 2.131 15.747 501 2HB GLN 73 2HB GLN 73 -10.152 0.985 16.842 502 1HG GLN 73 1HG GLN 73 -10.997 1.968 18.670 503 2HG GLN 73 2HG GLN 73 -10.778 3.594 18.025 504 1HE2 GLN 73 1HE2 GLN 73 -12.585 4.653 17.698 505 2HE2 GLN 73 2HE2 GLN 73 -14.120 3.965 17.306 506 H ASN 74 H ASN 74 -9.667 2.462 14.020 507 HA ASN 74 HA ASN 74 -8.147 0.349 13.132 508 1HB ASN 74 1HB ASN 74 -8.849 0.896 11.013 509 2HB ASN 74 2HB ASN 74 -9.989 1.853 11.955 510 1HD2 ASN 74 1HD2 ASN 74 -7.676 1.896 9.536 511 2HD2 ASN 74 2HD2 ASN 74 -7.483 3.607 9.393 512 H ASP 75 H ASP 75 -6.251 0.271 11.756 513 HA ASP 75 HA ASP 75 -4.458 2.506 11.654 514 1HB ASP 75 1HB ASP 75 -4.354 1.170 14.020 515 2HB ASP 75 2HB ASP 75 -3.168 0.267 13.081 516 H LEU 76 H LEU 76 -2.255 1.755 10.775 517 HA LEU 76 HA LEU 76 -2.782 -0.272 8.715 518 1HB LEU 76 1HB LEU 76 -1.688 2.327 8.618 519 2HB LEU 76 2HB LEU 76 -0.379 1.207 8.249 520 HG LEU 76 HG LEU 76 -1.560 2.089 6.249 521 1HD1 LEU 76 1HD1 LEU 76 -0.411 -0.209 6.472 522 2HD1 LEU 76 2HD1 LEU 76 -1.446 0.091 5.077 523 3HD1 LEU 76 3HD1 LEU 76 -2.051 -0.858 6.435 524 1HD2 LEU 76 1HD2 LEU 76 -3.849 0.294 6.623 525 2HD2 LEU 76 2HD2 LEU 76 -3.775 1.914 5.929 526 3HD2 LEU 76 3HD2 LEU 76 -3.840 1.706 7.680 527 H THR 77 H THR 77 -1.240 -1.858 8.228 528 HA THR 77 HA THR 77 1.133 -2.109 9.869 529 HB THR 77 HB THR 77 -0.584 -3.102 11.322 530 HG1 THR 77 HG1 THR 77 0.856 -5.299 10.309 531 1HG2 THR 77 1HG2 THR 77 -1.743 -5.149 10.647 532 2HG2 THR 77 2HG2 THR 77 -1.023 -5.034 9.041 533 3HG2 THR 77 3HG2 THR 77 -2.165 -3.806 9.586 534 H PHE 78 H PHE 78 0.179 -1.992 6.984 535 HA PHE 78 HA PHE 78 2.129 -3.731 5.906 536 1HB PHE 78 1HB PHE 78 -0.294 -5.010 6.423 537 2HB PHE 78 2HB PHE 78 -0.349 -4.649 4.700 538 HD1 PHE 78 HD1 PHE 78 0.114 -7.275 6.591 539 HD2 PHE 78 HD2 PHE 78 2.439 -4.936 3.901 540 HE1 PHE 78 HE1 PHE 78 1.550 -9.222 6.145 541 HE2 PHE 78 HE2 PHE 78 3.878 -6.879 3.449 542 HZ PHE 78 HZ PHE 78 3.434 -9.026 4.570 543 H LEU 79 H LEU 79 2.808 -2.867 4.052 544 HA LEU 79 HA LEU 79 0.925 -1.245 2.478 545 1HB LEU 79 1HB LEU 79 3.304 -0.386 3.858 546 2HB LEU 79 2HB LEU 79 3.461 -0.118 2.124 547 HG LEU 79 HG LEU 79 1.532 1.300 2.101 548 1HD1 LEU 79 1HD1 LEU 79 0.324 1.818 4.217 549 2HD1 LEU 79 2HD1 LEU 79 1.188 0.483 4.980 550 3HD1 LEU 79 3HD1 LEU 79 0.090 0.169 3.636 551 1HD2 LEU 79 1HD2 LEU 79 3.884 1.933 3.325 552 2HD2 LEU 79 2HD2 LEU 79 2.703 2.392 4.552 553 3HD2 LEU 79 3HD2 LEU 79 2.606 3.082 2.931 554 H ARG 80 H ARG 80 0.657 -2.532 0.743 555 HA ARG 80 HA ARG 80 3.074 -3.536 -0.607 556 1HB ARG 80 1HB ARG 80 0.288 -4.618 -0.389 557 2HB ARG 80 2HB ARG 80 1.286 -5.046 -1.772 558 1HG ARG 80 1HG ARG 80 2.445 -6.523 -0.588 559 2HG ARG 80 2HG ARG 80 2.719 -5.370 0.719 560 1HD ARG 80 1HD ARG 80 1.463 -7.400 1.415 561 2HD ARG 80 2HD ARG 80 0.598 -5.891 1.705 562 HE ARG 80 HE ARG 80 -0.115 -6.974 -0.810 563 1HH1 ARG 80 1HH1 ARG 80 -0.591 -7.433 2.608 564 2HH1 ARG 80 2HH1 ARG 80 -2.144 -8.178 2.424 565 1HH2 ARG 80 1HH2 ARG 80 -2.159 -7.953 -1.065 566 2HH2 ARG 80 2HH2 ARG 80 -3.035 -8.474 0.334 567 H ILE 81 H ILE 81 3.635 -2.277 -2.252 568 HA ILE 81 HA ILE 81 1.510 -1.018 -3.855 569 HB ILE 81 HB ILE 81 4.399 -0.175 -3.840 570 1HG1 ILE 81 1HG1 ILE 81 2.148 0.877 -2.112 571 2HG1 ILE 81 2HG1 ILE 81 3.558 -0.012 -1.545 572 1HG2 ILE 81 1HG2 ILE 81 3.743 1.261 -5.398 573 2HG2 ILE 81 2HG2 ILE 81 2.126 0.562 -5.348 574 3HG2 ILE 81 3HG2 ILE 81 2.531 1.923 -4.302 575 1HD1 ILE 81 1HD1 ILE 81 4.445 2.230 -3.050 576 2HD1 ILE 81 2HD1 ILE 81 3.253 2.768 -1.867 577 3HD1 ILE 81 3HD1 ILE 81 4.679 1.876 -1.338 578 H ARG 82 H ARG 82 1.093 -2.232 -5.589 579 HA ARG 82 HA ARG 82 3.190 -3.770 -6.874 580 1HB ARG 82 1HB ARG 82 0.505 -4.197 -6.521 581 2HB ARG 82 2HB ARG 82 0.570 -3.654 -8.192 582 1HG ARG 82 1HG ARG 82 2.209 -5.912 -7.062 583 2HG ARG 82 2HG ARG 82 0.694 -6.105 -7.947 584 1HD ARG 82 1HD ARG 82 2.880 -4.517 -9.195 585 2HD ARG 82 2HD ARG 82 3.034 -6.273 -9.158 586 HE ARG 82 HE ARG 82 0.485 -5.484 -10.131 587 1HH1 ARG 82 1HH1 ARG 82 3.835 -5.755 -11.037 588 2HH1 ARG 82 2HH1 ARG 82 3.498 -5.948 -12.725 589 1HH2 ARG 82 1HH2 ARG 82 0.028 -5.738 -12.351 590 2HH2 ARG 82 2HH2 ARG 82 1.332 -5.938 -13.472 591 H SER 83 H SER 83 4.524 -2.666 -8.162 592 HA SER 83 HA SER 83 3.447 -0.518 -9.839 593 1HB SER 83 1HB SER 83 6.318 -0.894 -10.027 594 2HB SER 83 2HB SER 83 5.408 0.529 -9.521 595 HG SER 83 HG SER 83 6.478 -1.548 -7.988 596 H LYS 84 H LYS 84 5.207 -0.454 -11.903 597 HA LYS 84 HA LYS 84 4.363 -2.762 -13.455 598 1HB LYS 84 1HB LYS 84 5.682 -0.152 -14.200 599 2HB LYS 84 2HB LYS 84 5.388 -1.439 -15.362 600 1HG LYS 84 1HG LYS 84 2.932 -1.270 -14.515 601 2HG LYS 84 2HG LYS 84 3.438 0.327 -13.959 602 1HD LYS 84 1HD LYS 84 2.555 0.665 -16.117 603 2HD LYS 84 2HD LYS 84 4.308 0.706 -16.318 604 1HE LYS 84 1HE LYS 84 4.264 -1.640 -17.041 605 2HE LYS 84 2HE LYS 84 2.511 -1.656 -16.863 606 1HZ LYS 84 1HZ LYS 84 2.270 -0.726 -18.847 607 2HZ LYS 84 2HZ LYS 84 3.924 -0.963 -19.111 608 3HZ LYS 84 3HZ LYS 84 3.369 0.511 -18.495 609 H LYS 85 H LYS 85 7.220 -1.484 -11.982 610 HA LYS 85 HA LYS 85 9.013 -3.181 -13.504 611 1HB LYS 85 1HB LYS 85 9.329 -1.084 -11.403 612 2HB LYS 85 2HB LYS 85 10.627 -2.252 -11.620 613 1HG LYS 85 1HG LYS 85 9.719 -1.141 -14.140 614 2HG LYS 85 2HG LYS 85 10.283 0.099 -13.018 615 1HD LYS 85 1HD LYS 85 12.164 -0.605 -14.299 616 2HD LYS 85 2HD LYS 85 12.351 -1.284 -12.680 617 1HE LYS 85 1HE LYS 85 11.427 -3.417 -13.502 618 2HE LYS 85 2HE LYS 85 11.324 -2.729 -15.122 619 1HZ LYS 85 1HZ LYS 85 13.912 -2.638 -13.764 620 2HZ LYS 85 2HZ LYS 85 13.561 -2.826 -15.408 621 3HZ LYS 85 3HZ LYS 85 13.389 -4.136 -14.351 622 H ASN 86 H ASN 86 7.789 -2.954 -10.182 623 HA ASN 86 HA ASN 86 7.696 -5.716 -9.769 624 1HB ASN 86 1HB ASN 86 9.620 -5.669 -7.967 625 2HB ASN 86 2HB ASN 86 9.984 -6.002 -9.658 626 1HD2 ASN 86 1HD2 ASN 86 10.120 -3.632 -7.108 627 2HD2 ASN 86 2HD2 ASN 86 11.279 -2.597 -7.863 628 H GLU 87 H GLU 87 7.300 -6.277 -7.455 629 HA GLU 87 HA GLU 87 5.870 -4.068 -6.169 630 1HB GLU 87 1HB GLU 87 4.629 -6.154 -6.666 631 2HB GLU 87 2HB GLU 87 5.726 -7.036 -5.612 632 1HG GLU 87 1HG GLU 87 4.985 -5.649 -3.720 633 2HG GLU 87 2HG GLU 87 3.841 -4.839 -4.789 634 H ILE 88 H ILE 88 6.568 -3.161 -4.348 635 HA ILE 88 HA ILE 88 8.778 -4.471 -2.908 636 HB ILE 88 HB ILE 88 8.094 -1.534 -2.849 637 1HG1 ILE 88 1HG1 ILE 88 10.413 -1.635 -4.226 638 2HG1 ILE 88 2HG1 ILE 88 9.680 -3.140 -4.771 639 1HG2 ILE 88 1HG2 ILE 88 10.047 -3.244 -1.505 640 2HG2 ILE 88 2HG2 ILE 88 10.745 -1.807 -2.251 641 3HG2 ILE 88 3HG2 ILE 88 9.447 -1.644 -1.068 642 1HD1 ILE 88 1HD1 ILE 88 8.447 -0.403 -4.967 643 2HD1 ILE 88 2HD1 ILE 88 9.176 -1.318 -6.287 644 3HD1 ILE 88 3HD1 ILE 88 7.708 -1.909 -5.509 645 H MET 89 H MET 89 7.814 -5.602 -1.305 646 HA MET 89 HA MET 89 5.535 -4.657 0.130 647 1HB MET 89 1HB MET 89 7.348 -7.011 0.295 648 2HB MET 89 2HB MET 89 6.411 -6.607 1.726 649 1HG MET 89 1HG MET 89 4.502 -6.490 -0.191 650 2HG MET 89 2HG MET 89 5.557 -7.746 -0.834 651 1HE MET 89 1HE MET 89 6.782 -9.152 1.090 652 2HE MET 89 2HE MET 89 6.296 -8.779 2.744 653 3HE MET 89 3HE MET 89 5.771 -10.285 1.988 654 H VAL 90 H VAL 90 5.422 -3.474 1.940 655 HA VAL 90 HA VAL 90 7.761 -3.182 3.654 656 HB VAL 90 HB VAL 90 6.394 -0.805 2.385 657 1HG1 VAL 90 1HG1 VAL 90 8.023 0.538 3.649 658 2HG1 VAL 90 2HG1 VAL 90 6.931 -0.357 4.709 659 3HG1 VAL 90 3HG1 VAL 90 8.582 -0.926 4.459 660 1HG2 VAL 90 1HG2 VAL 90 9.134 -2.003 2.056 661 2HG2 VAL 90 2HG2 VAL 90 7.914 -1.714 0.815 662 3HG2 VAL 90 3HG2 VAL 90 8.746 -0.353 1.568 663 H ALA 91 H ALA 91 7.158 -3.280 5.712 664 HA ALA 91 HA ALA 91 4.593 -2.160 6.540 665 1HB ALA 91 1HB ALA 91 4.055 -4.224 7.828 666 2HB ALA 91 2HB ALA 91 3.990 -4.430 6.077 667 3HB ALA 91 3HB ALA 91 5.375 -5.036 6.985 668 HA PRO 92 HA PRO 92 6.826 -0.882 10.098 669 1HB PRO 92 1HB PRO 92 4.862 -0.865 11.972 670 2HB PRO 92 2HB PRO 92 4.966 0.336 10.679 671 1HG PRO 92 1HG PRO 92 3.255 -2.114 10.855 672 2HG PRO 92 2HG PRO 92 2.825 -0.487 10.296 673 1HD PRO 92 1HD PRO 92 3.382 -2.515 8.590 674 2HD PRO 92 2HD PRO 92 3.757 -0.820 8.214 675 H ASP 93 H ASP 93 8.203 -1.968 11.344 676 HA ASP 93 HA ASP 93 7.365 -4.570 12.437 677 1HB ASP 93 1HB ASP 93 9.576 -3.936 10.892 678 2HB ASP 93 2HB ASP 93 10.228 -4.006 12.527 679 H LYS 94 H LYS 94 9.312 -4.949 14.328 680 HA LYS 94 HA LYS 94 8.290 -3.781 16.598 681 1HB LYS 94 1HB LYS 94 10.516 -5.452 15.940 682 2HB LYS 94 2HB LYS 94 11.054 -4.224 17.079 683 1HG LYS 94 1HG LYS 94 9.071 -4.867 18.508 684 2HG LYS 94 2HG LYS 94 8.874 -6.258 17.439 685 1HD LYS 94 1HD LYS 94 11.341 -6.747 17.939 686 2HD LYS 94 2HD LYS 94 11.162 -5.606 19.273 687 1HE LYS 94 1HE LYS 94 8.951 -7.314 19.437 688 2HE LYS 94 2HE LYS 94 10.328 -8.357 19.087 689 1HZ LYS 94 1HZ LYS 94 11.290 -6.684 20.985 690 2HZ LYS 94 2HZ LYS 94 10.710 -8.247 21.266 691 3HZ LYS 94 3HZ LYS 94 9.691 -6.915 21.488 692 H ASP 95 H ASP 95 11.231 -2.786 14.851 693 HA ASP 95 HA ASP 95 10.746 -0.025 15.558 694 1HB ASP 95 1HB ASP 95 12.534 -1.625 17.121 695 2HB ASP 95 2HB ASP 95 13.472 -0.424 16.237 696 H TYR 96 H TYR 96 11.162 -1.920 13.210 697 HA TYR 96 HA TYR 96 12.907 -0.116 11.717 698 1HB TYR 96 1HB TYR 96 13.944 -2.156 10.591 699 2HB TYR 96 2HB TYR 96 14.479 -1.807 12.231 700 HD1 TYR 96 HD1 TYR 96 12.794 -4.179 10.068 701 HD2 TYR 96 HD2 TYR 96 13.657 -3.200 14.117 702 HE1 TYR 96 HE1 TYR 96 12.188 -6.465 10.743 703 HE2 TYR 96 HE2 TYR 96 13.054 -5.484 14.804 704 HH TYR 96 HH TYR 96 13.006 -7.816 13.598 705 H PHE 97 H PHE 97 12.769 -0.576 9.324 706 HA PHE 97 HA PHE 97 10.030 -1.426 8.647 707 1HB PHE 97 1HB PHE 97 11.757 0.776 7.539 708 2HB PHE 97 2HB PHE 97 10.403 0.126 6.620 709 HD1 PHE 97 HD1 PHE 97 8.219 -0.161 8.285 710 HD2 PHE 97 HD2 PHE 97 11.302 2.760 8.570 711 HE1 PHE 97 HE1 PHE 97 6.683 1.338 9.489 712 HE2 PHE 97 HE2 PHE 97 9.772 4.263 9.775 713 HZ PHE 97 HZ PHE 97 7.459 3.553 10.237 714 H LEU 98 H LEU 98 10.130 -3.405 7.797 715 HA LEU 98 HA LEU 98 12.418 -4.361 6.361 716 1HB LEU 98 1HB LEU 98 10.593 -5.618 7.802 717 2HB LEU 98 2HB LEU 98 9.794 -5.757 6.237 718 HG LEU 98 HG LEU 98 12.613 -6.578 6.241 719 1HD1 LEU 98 1HD1 LEU 98 12.134 -7.422 8.412 720 2HD1 LEU 98 2HD1 LEU 98 12.044 -8.780 7.291 721 3HD1 LEU 98 3HD1 LEU 98 10.563 -8.036 7.895 722 1HD2 LEU 98 1HD2 LEU 98 10.416 -8.373 5.428 723 2HD2 LEU 98 2HD2 LEU 98 11.915 -7.960 4.596 724 3HD2 LEU 98 3HD2 LEU 98 10.545 -6.849 4.549 725 H ILE 99 H ILE 99 12.756 -4.465 4.216 726 HA ILE 99 HA ILE 99 10.536 -3.760 2.420 727 HB ILE 99 HB ILE 99 13.358 -2.772 2.029 728 1HG1 ILE 99 1HG1 ILE 99 11.711 -0.578 2.519 729 2HG1 ILE 99 2HG1 ILE 99 11.236 -1.755 3.737 730 1HG2 ILE 99 1HG2 ILE 99 10.750 -2.078 0.686 731 2HG2 ILE 99 2HG2 ILE 99 12.294 -1.284 0.379 732 3HG2 ILE 99 3HG2 ILE 99 12.085 -2.990 -0.017 733 1HD1 ILE 99 1HD1 ILE 99 13.530 -1.921 4.499 734 2HD1 ILE 99 2HD1 ILE 99 14.043 -0.792 3.244 735 3HD1 ILE 99 3HD1 ILE 99 12.977 -0.247 4.539 736 H VAL 100 H VAL 100 10.177 -5.465 1.170 737 HA VAL 100 HA VAL 100 12.495 -6.995 0.179 738 HB VAL 100 HB VAL 100 9.691 -8.000 0.686 739 1HG1 VAL 100 1HG1 VAL 100 10.886 -10.240 0.242 740 2HG1 VAL 100 2HG1 VAL 100 10.435 -9.238 -1.140 741 3HG1 VAL 100 3HG1 VAL 100 12.105 -9.257 -0.569 742 1HG2 VAL 100 1HG2 VAL 100 11.811 -9.368 2.081 743 2HG2 VAL 100 2HG2 VAL 100 11.810 -7.647 2.469 744 3HG2 VAL 100 3HG2 VAL 100 10.354 -8.609 2.722 745 H ILE 101 H ILE 101 12.871 -6.528 -1.882 746 HA ILE 101 HA ILE 101 10.601 -5.890 -3.637 747 HB ILE 101 HB ILE 101 13.542 -5.382 -4.105 748 1HG1 ILE 101 1HG1 ILE 101 11.885 -3.028 -3.866 749 2HG1 ILE 101 2HG1 ILE 101 11.746 -4.023 -2.421 750 1HG2 ILE 101 1HG2 ILE 101 11.131 -4.399 -5.625 751 2HG2 ILE 101 2HG2 ILE 101 12.818 -4.035 -5.984 752 3HG2 ILE 101 3HG2 ILE 101 12.216 -5.684 -6.156 753 1HD1 ILE 101 1HD1 ILE 101 14.069 -3.896 -2.006 754 2HD1 ILE 101 2HD1 ILE 101 14.382 -3.191 -3.593 755 3HD1 ILE 101 3HD1 ILE 101 13.522 -2.259 -2.367 756 H GLN 102 H GLN 102 10.154 -7.078 -5.420 757 HA GLN 102 HA GLN 102 11.984 -8.892 -6.620 758 1HB GLN 102 1HB GLN 102 11.029 -10.987 -6.006 759 2HB GLN 102 2HB GLN 102 11.355 -10.117 -4.512 760 1HG GLN 102 1HG GLN 102 8.967 -9.430 -4.466 761 2HG GLN 102 2HG GLN 102 8.691 -10.470 -5.862 762 1HE2 GLN 102 1HE2 GLN 102 8.460 -10.308 -2.606 763 2HE2 GLN 102 2HE2 GLN 102 8.511 -11.991 -2.219 764 H ASN 103 H ASN 103 10.735 -10.397 -8.198 765 HA ASN 103 HA ASN 103 9.346 -8.825 -10.009 766 1HB ASN 103 1HB ASN 103 9.925 -11.686 -9.696 767 2HB ASN 103 2HB ASN 103 8.454 -11.353 -10.604 768 1HD2 ASN 103 1HD2 ASN 103 11.385 -12.218 -11.164 769 2HD2 ASN 103 2HD2 ASN 103 11.791 -11.286 -12.561 770 HA PRO 104 HA PRO 104 5.158 -8.616 -8.720 771 1HB PRO 104 1HB PRO 104 3.803 -8.940 -11.051 772 2HB PRO 104 2HB PRO 104 4.712 -7.474 -10.663 773 1HG PRO 104 1HG PRO 104 5.509 -9.800 -12.369 774 2HG PRO 104 2HG PRO 104 5.735 -8.067 -12.665 775 1HD PRO 104 1HD PRO 104 7.722 -9.657 -11.743 776 2HD PRO 104 2HD PRO 104 7.584 -7.945 -11.295 777 H THR 105 H THR 105 3.392 -9.850 -8.123 778 HA THR 105 HA THR 105 3.581 -12.719 -8.758 779 HB THR 105 HB THR 105 2.304 -13.083 -6.643 780 HG1 THR 105 HG1 THR 105 2.351 -11.213 -5.180 781 1HG2 THR 105 1HG2 THR 105 5.021 -11.863 -6.729 782 2HG2 THR 105 2HG2 THR 105 4.532 -13.497 -6.282 783 3HG2 THR 105 3HG2 THR 105 4.285 -12.163 -5.155 784 H GLU 106 H GLU 106 1.388 -9.982 -8.459 785 HA GLU 106 HA GLU 106 -1.058 -11.219 -8.785 786 1HB GLU 106 1HB GLU 106 -0.052 -8.572 -8.915 787 2HB GLU 106 2HB GLU 106 -1.028 -8.823 -10.355 788 1HG GLU 106 1HG GLU 106 -1.964 -9.369 -7.549 789 2HG GLU 106 2HG GLU 106 -2.281 -7.882 -8.442 790 H MET 11 H MET 11 -18.810 4.701 -15.406 791 HA MET 11 HA MET 11 -19.108 4.178 -12.758 792 1HB MET 11 1HB MET 11 -21.021 5.125 -14.847 793 2HB MET 11 2HB MET 11 -21.639 4.772 -13.239 794 1HG MET 11 1HG MET 11 -19.490 6.292 -12.628 795 2HG MET 11 2HG MET 11 -19.959 6.985 -14.179 796 1HE MET 11 1HE MET 11 -20.968 6.280 -10.487 797 2HE MET 11 2HE MET 11 -22.654 6.795 -10.440 798 3HE MET 11 3HE MET 11 -22.197 5.352 -11.347 799 H ALA 12 H ALA 12 -21.064 2.655 -15.324 800 HA ALA 12 HA ALA 12 -22.552 0.933 -13.763 801 1HB ALA 12 1HB ALA 12 -22.562 1.397 -16.337 802 2HB ALA 12 2HB ALA 12 -21.526 -0.029 -16.393 803 3HB ALA 12 3HB ALA 12 -23.146 -0.143 -15.705 804 H GLU 13 H GLU 13 -19.281 0.494 -15.033 805 HA GLU 13 HA GLU 13 -18.866 -2.170 -14.422 806 1HB GLU 13 1HB GLU 13 -17.320 -0.250 -15.475 807 2HB GLU 13 2HB GLU 13 -16.632 -0.295 -13.858 808 1HG GLU 13 1HG GLU 13 -15.876 -2.466 -14.094 809 2HG GLU 13 2HG GLU 13 -17.004 -2.824 -15.401 810 H VAL 14 H VAL 14 -18.227 0.651 -12.343 811 HA VAL 14 HA VAL 14 -17.398 -0.822 -10.089 812 HB VAL 14 HB VAL 14 -18.716 1.892 -10.038 813 1HG1 VAL 14 1HG1 VAL 14 -16.717 1.879 -8.178 814 2HG1 VAL 14 2HG1 VAL 14 -18.422 1.576 -7.839 815 3HG1 VAL 14 3HG1 VAL 14 -17.317 0.224 -8.085 816 1HG2 VAL 14 1HG2 VAL 14 -16.193 2.590 -10.057 817 2HG2 VAL 14 2HG2 VAL 14 -15.984 1.050 -10.891 818 3HG2 VAL 14 3HG2 VAL 14 -17.045 2.284 -11.571 819 H GLU 15 H GLU 15 -20.564 0.274 -11.172 820 HA GLU 15 HA GLU 15 -21.986 -0.307 -8.808 821 1HB GLU 15 1HB GLU 15 -22.818 -0.070 -11.692 822 2HB GLU 15 2HB GLU 15 -23.973 -0.449 -10.422 823 1HG GLU 15 1HG GLU 15 -23.498 1.635 -9.308 824 2HG GLU 15 2HG GLU 15 -22.235 2.006 -10.480 825 H GLU 16 H GLU 16 -21.088 -2.262 -11.588 826 HA GLU 16 HA GLU 16 -22.711 -4.499 -10.958 827 1HB GLU 16 1HB GLU 16 -21.167 -3.779 -13.095 828 2HB GLU 16 2HB GLU 16 -20.192 -5.051 -12.372 829 1HG GLU 16 1HG GLU 16 -23.100 -5.513 -12.836 830 2HG GLU 16 2HG GLU 16 -21.970 -5.619 -14.185 831 H THR 17 H THR 17 -19.453 -3.533 -10.066 832 HA THR 17 HA THR 17 -18.849 -6.034 -8.768 833 HB THR 17 HB THR 17 -17.400 -3.380 -8.685 834 HG1 THR 17 HG1 THR 17 -16.787 -4.044 -10.597 835 1HG2 THR 17 1HG2 THR 17 -16.700 -4.497 -6.747 836 2HG2 THR 17 2HG2 THR 17 -15.480 -4.920 -7.947 837 3HG2 THR 17 3HG2 THR 17 -16.746 -6.075 -7.532 838 H LEU 18 H LEU 18 -20.256 -2.994 -7.880 839 HA LEU 18 HA LEU 18 -19.830 -3.234 -5.065 840 1HB LEU 18 1HB LEU 18 -21.051 -1.360 -6.887 841 2HB LEU 18 2HB LEU 18 -22.072 -1.620 -5.474 842 HG LEU 18 HG LEU 18 -19.756 -1.194 -4.223 843 1HD1 LEU 18 1HD1 LEU 18 -18.339 -0.873 -6.074 844 2HD1 LEU 18 2HD1 LEU 18 -18.657 0.741 -5.437 845 3HD1 LEU 18 3HD1 LEU 18 -19.499 0.181 -6.883 846 1HD2 LEU 18 1HD2 LEU 18 -21.959 0.023 -4.046 847 2HD2 LEU 18 2HD2 LEU 18 -21.370 1.101 -5.311 848 3HD2 LEU 18 3HD2 LEU 18 -20.517 1.001 -3.770 849 H LYS 19 H LYS 19 -22.550 -3.911 -7.236 850 HA LYS 19 HA LYS 19 -24.447 -4.632 -5.332 851 1HB LYS 19 1HB LYS 19 -24.001 -5.406 -8.194 852 2HB LYS 19 2HB LYS 19 -25.278 -6.179 -7.265 853 1HG LYS 19 1HG LYS 19 -25.352 -3.308 -6.965 854 2HG LYS 19 2HG LYS 19 -25.438 -3.788 -8.661 855 1HD LYS 19 1HD LYS 19 -27.167 -5.004 -6.516 856 2HD LYS 19 2HD LYS 19 -27.650 -3.591 -7.457 857 1HE LYS 19 1HE LYS 19 -27.254 -4.972 -9.523 858 2HE LYS 19 2HE LYS 19 -27.063 -6.368 -8.465 859 1HZ LYS 19 1HZ LYS 19 -29.449 -4.857 -7.938 860 2HZ LYS 19 2HZ LYS 19 -29.253 -6.521 -8.168 861 3HZ LYS 19 3HZ LYS 19 -29.405 -5.495 -9.504 862 H ARG 20 H ARG 20 -22.110 -6.699 -7.045 863 HA ARG 20 HA ARG 20 -22.843 -9.106 -5.790 864 1HB ARG 20 1HB ARG 20 -21.364 -8.718 -7.871 865 2HB ARG 20 2HB ARG 20 -20.047 -8.511 -6.725 866 1HG ARG 20 1HG ARG 20 -19.795 -10.720 -7.060 867 2HG ARG 20 2HG ARG 20 -21.054 -10.826 -5.828 868 1HD ARG 20 1HD ARG 20 -22.130 -12.081 -7.346 869 2HD ARG 20 2HD ARG 20 -22.538 -10.533 -8.084 870 HE ARG 20 HE ARG 20 -20.101 -11.253 -9.145 871 1HH1 ARG 20 1HH1 ARG 20 -23.311 -12.596 -9.034 872 2HH1 ARG 20 2HH1 ARG 20 -23.162 -13.413 -10.555 873 1HH2 ARG 20 1HH2 ARG 20 -19.893 -12.324 -11.148 874 2HH2 ARG 20 2HH2 ARG 20 -21.217 -13.259 -11.756 875 H LEU 21 H LEU 21 -20.376 -6.692 -4.983 876 HA LEU 21 HA LEU 21 -19.212 -8.058 -2.829 877 1HB LEU 21 1HB LEU 21 -19.191 -5.358 -3.916 878 2HB LEU 21 2HB LEU 21 -19.020 -5.388 -2.163 879 HG LEU 21 HG LEU 21 -17.035 -6.739 -2.328 880 1HD1 LEU 21 1HD1 LEU 21 -17.464 -6.714 -5.311 881 2HD1 LEU 21 2HD1 LEU 21 -17.721 -8.100 -4.251 882 3HD1 LEU 21 3HD1 LEU 21 -16.101 -7.434 -4.453 883 1HD2 LEU 21 1HD2 LEU 21 -17.174 -4.282 -4.028 884 2HD2 LEU 21 2HD2 LEU 21 -15.662 -5.178 -3.879 885 3HD2 LEU 21 3HD2 LEU 21 -16.435 -4.507 -2.442 886 H GLN 22 H GLN 22 -21.686 -5.488 -2.786 887 HA GLN 22 HA GLN 22 -22.174 -5.591 -0.025 888 1HB GLN 22 1HB GLN 22 -23.229 -4.212 -2.292 889 2HB GLN 22 2HB GLN 22 -24.574 -4.853 -1.357 890 1HG GLN 22 1HG GLN 22 -24.028 -2.600 -0.658 891 2HG GLN 22 2HG GLN 22 -23.721 -3.751 0.641 892 1HE2 GLN 22 1HE2 GLN 22 -22.477 -1.216 -1.139 893 2HE2 GLN 22 2HE2 GLN 22 -20.820 -1.350 -0.669 894 H SER 23 H SER 23 -23.119 -7.686 -2.572 895 HA SER 23 HA SER 23 -25.402 -8.800 -1.208 896 1HB SER 23 1HB SER 23 -24.087 -9.139 -3.816 897 2HB SER 23 2HB SER 23 -24.756 -10.627 -3.147 898 HG SER 23 HG SER 23 -26.105 -8.198 -3.692 899 H GLN 24 H GLN 24 -21.995 -9.397 -1.370 900 HA GLN 24 HA GLN 24 -22.293 -11.990 -0.043 901 1HB GLN 24 1HB GLN 24 -19.884 -12.256 -0.450 902 2HB GLN 24 2HB GLN 24 -20.763 -11.927 -1.937 903 1HG GLN 24 1HG GLN 24 -19.878 -9.813 -2.155 904 2HG GLN 24 2HG GLN 24 -19.507 -9.678 -0.437 905 1HE2 GLN 24 1HE2 GLN 24 -17.599 -8.947 -2.144 906 2HE2 GLN 24 2HE2 GLN 24 -16.327 -10.114 -2.200 907 H LYS 25 H LYS 25 -20.864 -12.458 1.810 908 HA LYS 25 HA LYS 25 -21.044 -10.325 3.748 909 1HB LYS 25 1HB LYS 25 -21.175 -13.100 3.865 910 2HB LYS 25 2HB LYS 25 -19.641 -12.716 4.635 911 1HG LYS 25 1HG LYS 25 -21.137 -10.935 5.895 912 2HG LYS 25 2HG LYS 25 -22.409 -12.091 5.494 913 1HD LYS 25 1HD LYS 25 -21.481 -13.762 6.788 914 2HD LYS 25 2HD LYS 25 -19.860 -13.070 6.705 915 1HE LYS 25 1HE LYS 25 -20.442 -12.558 8.867 916 2HE LYS 25 2HE LYS 25 -20.964 -11.098 8.027 917 1HZ LYS 25 1HZ LYS 25 -23.143 -11.592 8.323 918 2HZ LYS 25 2HZ LYS 25 -22.532 -12.382 9.688 919 3HZ LYS 25 3HZ LYS 25 -22.904 -13.266 8.295 920 H GLY 26 H GLY 26 -19.217 -9.782 5.176 921 1HA GLY 26 1HA GLY 26 -16.875 -9.624 5.589 922 2HA GLY 26 2HA GLY 26 -16.580 -10.121 3.930 923 H VAL 27 H VAL 27 -18.154 -8.383 2.512 924 HA VAL 27 HA VAL 27 -16.563 -6.123 2.281 925 HB VAL 27 HB VAL 27 -19.459 -6.416 1.472 926 1HG1 VAL 27 1HG1 VAL 27 -17.384 -4.344 0.888 927 2HG1 VAL 27 2HG1 VAL 27 -18.644 -4.699 -0.296 928 3HG1 VAL 27 3HG1 VAL 27 -19.082 -4.138 1.318 929 1HG2 VAL 27 1HG2 VAL 27 -16.924 -6.904 -0.088 930 2HG2 VAL 27 2HG2 VAL 27 -18.019 -8.146 0.518 931 3HG2 VAL 27 3HG2 VAL 27 -18.565 -7.018 -0.722 932 H GLN 28 H GLN 28 -16.414 -4.263 3.357 933 HA GLN 28 HA GLN 28 -18.344 -3.735 5.489 934 1HB GLN 28 1HB GLN 28 -15.497 -3.192 5.064 935 2HB GLN 28 2HB GLN 28 -16.380 -1.820 5.721 936 1HG GLN 28 1HG GLN 28 -15.376 -3.237 7.458 937 2HG GLN 28 2HG GLN 28 -17.131 -3.131 7.589 938 1HE2 GLN 28 1HE2 GLN 28 -14.436 -5.168 6.731 939 2HE2 GLN 28 2HE2 GLN 28 -15.294 -6.666 6.788 940 H GLY 29 H GLY 29 -17.167 -2.433 2.476 941 1HA GLY 29 1HA GLY 29 -19.331 -0.950 1.787 942 2HA GLY 29 2HA GLY 29 -18.427 0.139 2.828 943 H ILE 30 H ILE 30 -19.067 0.027 -0.156 944 HA ILE 30 HA ILE 30 -16.297 0.281 -1.130 945 HB ILE 30 HB ILE 30 -18.737 -0.170 -2.844 946 1HG1 ILE 30 1HG1 ILE 30 -17.134 -2.469 -2.882 947 2HG1 ILE 30 2HG1 ILE 30 -17.272 -2.034 -1.182 948 1HG2 ILE 30 1HG2 ILE 30 -17.036 -0.846 -4.518 949 2HG2 ILE 30 2HG2 ILE 30 -16.910 0.844 -4.032 950 3HG2 ILE 30 3HG2 ILE 30 -15.778 -0.345 -3.388 951 1HD1 ILE 30 1HD1 ILE 30 -19.165 -3.328 -2.861 952 2HD1 ILE 30 2HD1 ILE 30 -19.263 -2.982 -1.134 953 3HD1 ILE 30 3HD1 ILE 30 -19.844 -1.798 -2.306 954 H ILE 31 H ILE 31 -15.643 2.165 -2.008 955 HA ILE 31 HA ILE 31 -17.666 4.266 -2.421 956 HB ILE 31 HB ILE 31 -14.933 4.649 -1.194 957 1HG1 ILE 31 1HG1 ILE 31 -17.309 5.491 0.305 958 2HG1 ILE 31 2HG1 ILE 31 -17.227 3.754 0.037 959 1HG2 ILE 31 1HG2 ILE 31 -17.040 6.553 -2.126 960 2HG2 ILE 31 2HG2 ILE 31 -15.983 6.989 -0.784 961 3HG2 ILE 31 3HG2 ILE 31 -15.294 6.611 -2.363 962 1HD1 ILE 31 1HD1 ILE 31 -16.025 5.110 2.075 963 2HD1 ILE 31 2HD1 ILE 31 -15.580 3.499 1.513 964 3HD1 ILE 31 3HD1 ILE 31 -14.705 4.912 0.923 965 H VAL 32 H VAL 32 -17.338 5.662 -4.129 966 HA VAL 32 HA VAL 32 -15.043 5.064 -5.880 967 HB VAL 32 HB VAL 32 -17.680 5.922 -7.015 968 1HG1 VAL 32 1HG1 VAL 32 -15.549 4.142 -8.178 969 2HG1 VAL 32 2HG1 VAL 32 -16.860 4.968 -9.024 970 3HG1 VAL 32 3HG1 VAL 32 -15.529 5.898 -8.334 971 1HG2 VAL 32 1HG2 VAL 32 -18.254 3.997 -5.684 972 2HG2 VAL 32 2HG2 VAL 32 -18.232 3.533 -7.385 973 3HG2 VAL 32 3HG2 VAL 32 -16.886 3.093 -6.333 974 H VAL 33 H VAL 33 -13.769 6.779 -6.028 975 HA VAL 33 HA VAL 33 -15.003 9.458 -6.016 976 HB VAL 33 HB VAL 33 -12.168 8.911 -5.169 977 1HG1 VAL 33 1HG1 VAL 33 -13.881 11.157 -4.210 978 2HG1 VAL 33 2HG1 VAL 33 -12.129 11.084 -4.414 979 3HG1 VAL 33 3HG1 VAL 33 -13.177 11.234 -5.825 980 1HG2 VAL 33 1HG2 VAL 33 -13.487 7.601 -3.670 981 2HG2 VAL 33 2HG2 VAL 33 -13.020 9.074 -2.821 982 3HG2 VAL 33 3HG2 VAL 33 -14.654 8.908 -3.465 983 H ASN 34 H ASN 34 -14.489 10.845 -7.624 984 HA ASN 34 HA ASN 34 -13.120 9.785 -9.923 985 1HB ASN 34 1HB ASN 34 -13.689 12.022 -10.929 986 2HB ASN 34 2HB ASN 34 -15.075 11.107 -10.341 987 1HD2 ASN 34 1HD2 ASN 34 -16.148 13.179 -10.354 988 2HD2 ASN 34 2HD2 ASN 34 -15.958 14.243 -9.006 989 H THR 35 H THR 35 -11.736 11.676 -11.098 990 HA THR 35 HA THR 35 -9.378 11.917 -9.449 991 HB THR 35 HB THR 35 -9.026 11.279 -11.739 992 HG1 THR 35 HG1 THR 35 -7.286 12.464 -11.628 993 1HG2 THR 35 1HG2 THR 35 -10.905 12.116 -12.890 994 2HG2 THR 35 2HG2 THR 35 -9.531 12.999 -13.557 995 3HG2 THR 35 3HG2 THR 35 -10.586 13.772 -12.374 996 H GLU 36 H GLU 36 -12.082 13.709 -9.618 997 HA GLU 36 HA GLU 36 -10.791 16.324 -9.590 998 1HB GLU 36 1HB GLU 36 -13.512 15.323 -10.002 999 2HB GLU 36 2HB GLU 36 -13.441 16.755 -8.985 1000 1HG GLU 36 1HG GLU 36 -11.738 17.137 -11.237 1001 2HG GLU 36 2HG GLU 36 -13.320 16.597 -11.794 1002 H GLY 37 H GLY 37 -12.493 14.111 -7.436 1003 1HA GLY 37 1HA GLY 37 -11.565 14.133 -5.114 1004 2HA GLY 37 2HA GLY 37 -11.766 15.878 -5.180 1005 H ILE 38 H ILE 38 -14.262 14.299 -6.789 1006 HA ILE 38 HA ILE 38 -16.016 14.639 -4.448 1007 HB ILE 38 HB ILE 38 -16.883 14.621 -7.336 1008 1HG1 ILE 38 1HG1 ILE 38 -16.259 16.985 -5.552 1009 2HG1 ILE 38 2HG1 ILE 38 -15.349 16.494 -6.977 1010 1HG2 ILE 38 1HG2 ILE 38 -18.296 15.739 -4.926 1011 2HG2 ILE 38 2HG2 ILE 38 -18.950 15.471 -6.541 1012 3HG2 ILE 38 3HG2 ILE 38 -18.541 14.095 -5.516 1013 1HD1 ILE 38 1HD1 ILE 38 -17.387 16.910 -8.336 1014 2HD1 ILE 38 2HD1 ILE 38 -18.156 17.563 -6.889 1015 3HD1 ILE 38 3HD1 ILE 38 -16.725 18.347 -7.557 1016 HA PRO 39 HA PRO 39 -16.627 10.254 -4.512 1017 1HB PRO 39 1HB PRO 39 -18.734 10.184 -2.802 1018 2HB PRO 39 2HB PRO 39 -17.070 10.449 -2.266 1019 1HG PRO 39 1HG PRO 39 -19.250 12.446 -2.736 1020 2HG PRO 39 2HG PRO 39 -18.083 12.356 -1.404 1021 1HD PRO 39 1HD PRO 39 -17.782 14.052 -3.493 1022 2HD PRO 39 2HD PRO 39 -16.401 13.327 -2.646 1023 H ILE 40 H ILE 40 -17.322 10.279 -6.763 1024 HA ILE 40 HA ILE 40 -19.813 10.927 -7.737 1025 HB ILE 40 HB ILE 40 -19.431 8.987 -9.378 1026 1HG1 ILE 40 1HG1 ILE 40 -16.715 8.974 -8.053 1027 2HG1 ILE 40 2HG1 ILE 40 -17.940 7.742 -7.769 1028 1HG2 ILE 40 1HG2 ILE 40 -18.165 10.365 -10.686 1029 2HG2 ILE 40 2HG2 ILE 40 -18.673 11.513 -9.448 1030 3HG2 ILE 40 3HG2 ILE 40 -17.067 10.788 -9.372 1031 1HD1 ILE 40 1HD1 ILE 40 -16.022 7.460 -9.572 1032 2HD1 ILE 40 2HD1 ILE 40 -17.634 6.779 -9.794 1033 3HD1 ILE 40 3HD1 ILE 40 -17.203 8.299 -10.578 1034 H LYS 41 H LYS 41 -18.822 8.030 -6.002 1035 HA LYS 41 HA LYS 41 -21.613 7.416 -5.469 1036 1HB LYS 41 1HB LYS 41 -19.946 5.880 -7.309 1037 2HB LYS 41 2HB LYS 41 -20.606 4.894 -6.010 1038 1HG LYS 41 1HG LYS 41 -22.824 6.206 -6.705 1039 2HG LYS 41 2HG LYS 41 -21.974 6.249 -8.251 1040 1HD LYS 41 1HD LYS 41 -23.029 4.248 -8.496 1041 2HD LYS 41 2HD LYS 41 -21.584 3.683 -7.655 1042 1HE LYS 41 1HE LYS 41 -23.360 2.668 -6.517 1043 2HE LYS 41 2HE LYS 41 -22.913 4.039 -5.503 1044 1HZ LYS 41 1HZ LYS 41 -25.400 3.553 -6.146 1045 2HZ LYS 41 2HZ LYS 41 -24.991 4.454 -7.518 1046 3HZ LYS 41 3HZ LYS 41 -24.828 5.136 -5.978 1047 H SER 42 H SER 42 -21.925 6.081 -3.643 1048 HA SER 42 HA SER 42 -19.758 4.936 -2.195 1049 1HB SER 42 1HB SER 42 -19.349 7.340 -1.720 1050 2HB SER 42 2HB SER 42 -20.966 7.454 -1.026 1051 HG SER 42 HG SER 42 -20.183 6.675 0.749 1052 H THR 43 H THR 43 -20.444 3.740 -0.385 1053 HA THR 43 HA THR 43 -23.372 3.477 -0.152 1054 HB THR 43 HB THR 43 -23.098 1.130 0.329 1055 HG1 THR 43 HG1 THR 43 -21.143 0.207 0.635 1056 1HG2 THR 43 1HG2 THR 43 -23.096 0.733 -1.862 1057 2HG2 THR 43 2HG2 THR 43 -21.344 0.928 -1.912 1058 3HG2 THR 43 3HG2 THR 43 -22.395 2.326 -2.141 1059 H MET 44 H MET 44 -20.398 3.988 1.494 1060 HA MET 44 HA MET 44 -21.127 3.168 4.090 1061 1HB MET 44 1HB MET 44 -19.208 5.365 3.296 1062 2HB MET 44 2HB MET 44 -19.270 4.558 4.857 1063 1HG MET 44 1HG MET 44 -18.956 2.756 2.572 1064 2HG MET 44 2HG MET 44 -17.622 3.881 2.812 1065 1HE MET 44 1HE MET 44 -20.064 1.617 4.860 1066 2HE MET 44 2HE MET 44 -19.104 1.260 6.295 1067 3HE MET 44 3HE MET 44 -19.663 2.906 5.995 1068 H ASP 45 H ASP 45 -20.834 5.219 5.809 1069 HA ASP 45 HA ASP 45 -23.390 6.488 5.694 1070 1HB ASP 45 1HB ASP 45 -21.748 5.778 7.730 1071 2HB ASP 45 2HB ASP 45 -21.400 7.502 7.632 1072 H ASN 46 H ASN 46 -23.544 8.908 6.199 1073 HA ASN 46 HA ASN 46 -22.535 10.343 3.997 1074 1HB ASN 46 1HB ASN 46 -24.445 10.769 6.021 1075 2HB ASN 46 2HB ASN 46 -23.301 12.102 6.152 1076 1HD2 ASN 46 1HD2 ASN 46 -22.571 12.421 3.520 1077 2HD2 ASN 46 2HD2 ASN 46 -23.937 12.964 2.610 1078 HA PRO 47 HA PRO 47 -19.575 12.513 7.142 1079 1HB PRO 47 1HB PRO 47 -19.341 11.390 9.603 1080 2HB PRO 47 2HB PRO 47 -20.541 12.631 9.223 1081 1HG PRO 47 1HG PRO 47 -20.872 9.660 9.382 1082 2HG PRO 47 2HG PRO 47 -21.937 10.938 9.995 1083 1HD PRO 47 1HD PRO 47 -22.427 9.620 7.681 1084 2HD PRO 47 2HD PRO 47 -22.880 11.318 7.926 1085 H THR 48 H THR 48 -19.891 9.035 7.108 1086 HA THR 48 HA THR 48 -17.111 8.512 7.617 1087 HB THR 48 HB THR 48 -19.276 6.690 6.549 1088 HG1 THR 48 HG1 THR 48 -18.829 5.882 8.862 1089 1HG2 THR 48 1HG2 THR 48 -16.450 6.145 7.441 1090 2HG2 THR 48 2HG2 THR 48 -17.194 5.757 5.890 1091 3HG2 THR 48 3HG2 THR 48 -17.685 4.891 7.345 1092 H THR 49 H THR 49 -19.155 8.895 4.798 1093 HA THR 49 HA THR 49 -17.223 7.913 2.925 1094 HB THR 49 HB THR 49 -19.708 9.583 2.500 1095 HG1 THR 49 HG1 THR 49 -20.694 7.711 2.495 1096 1HG2 THR 49 1HG2 THR 49 -18.143 9.925 0.664 1097 2HG2 THR 49 2HG2 THR 49 -19.502 8.934 0.132 1098 3HG2 THR 49 3HG2 THR 49 -17.946 8.182 0.485 1099 H THR 50 H THR 50 -18.389 11.161 3.800 1100 HA THR 50 HA THR 50 -16.800 12.653 2.084 1101 HB THR 50 HB THR 50 -17.267 13.690 4.846 1102 HG1 THR 50 HG1 THR 50 -19.362 13.440 4.710 1103 1HG2 THR 50 1HG2 THR 50 -16.363 15.286 3.380 1104 2HG2 THR 50 2HG2 THR 50 -18.089 15.646 3.405 1105 3HG2 THR 50 3HG2 THR 50 -17.390 14.770 2.044 1106 H GLN 51 H GLN 51 -16.023 11.243 5.213 1107 HA GLN 51 HA GLN 51 -13.498 12.548 5.477 1108 1HB GLN 51 1HB GLN 51 -14.582 11.775 7.467 1109 2HB GLN 51 2HB GLN 51 -14.696 10.136 6.838 1110 1HG GLN 51 1HG GLN 51 -11.972 11.209 7.006 1111 2HG GLN 51 2HG GLN 51 -12.793 11.002 8.552 1112 1HE2 GLN 51 1HE2 GLN 51 -11.308 9.450 5.880 1113 2HE2 GLN 51 2HE2 GLN 51 -11.445 7.829 6.459 1114 H TYR 52 H TYR 52 -14.444 9.230 4.595 1115 HA TYR 52 HA TYR 52 -11.876 8.253 4.093 1116 1HB TYR 52 1HB TYR 52 -14.623 7.466 3.209 1117 2HB TYR 52 2HB TYR 52 -13.232 6.703 2.447 1118 HD1 TYR 52 HD1 TYR 52 -12.957 4.568 3.273 1119 HD2 TYR 52 HD2 TYR 52 -13.983 7.690 5.975 1120 HE1 TYR 52 HE1 TYR 52 -12.791 2.988 5.151 1121 HE2 TYR 52 HE2 TYR 52 -13.819 6.119 7.861 1122 HH TYR 52 HH TYR 52 -13.334 2.682 7.353 1123 H ALA 53 H ALA 53 -14.266 9.547 1.788 1124 HA ALA 53 HA ALA 53 -12.648 9.391 -0.493 1125 1HB ALA 53 1HB ALA 53 -14.201 11.049 -1.468 1126 2HB ALA 53 2HB ALA 53 -15.030 9.708 -0.675 1127 3HB ALA 53 3HB ALA 53 -14.918 11.275 0.128 1128 H SER 54 H SER 54 -12.519 11.511 2.186 1129 HA SER 54 HA SER 54 -11.281 13.723 0.850 1130 1HB SER 54 1HB SER 54 -12.243 13.135 3.495 1131 2HB SER 54 2HB SER 54 -10.609 13.789 3.596 1132 HG SER 54 HG SER 54 -11.446 15.662 3.198 1133 H LEU 55 H LEU 55 -10.084 11.169 3.024 1134 HA LEU 55 HA LEU 55 -7.335 11.907 2.515 1135 1HB LEU 55 1HB LEU 55 -6.770 10.522 4.239 1136 2HB LEU 55 2HB LEU 55 -8.427 10.927 4.684 1137 HG LEU 55 HG LEU 55 -8.924 8.693 3.326 1138 1HD1 LEU 55 1HD1 LEU 55 -6.134 8.713 3.359 1139 2HD1 LEU 55 2HD1 LEU 55 -7.190 7.370 2.923 1140 3HD1 LEU 55 3HD1 LEU 55 -6.609 7.532 4.580 1141 1HD2 LEU 55 1HD2 LEU 55 -9.446 7.815 5.341 1142 2HD2 LEU 55 2HD2 LEU 55 -9.079 9.448 5.898 1143 3HD2 LEU 55 3HD2 LEU 55 -7.864 8.175 6.032 1144 H MET 56 H MET 56 -9.633 10.061 0.938 1145 HA MET 56 HA MET 56 -8.197 7.829 0.053 1146 1HB MET 56 1HB MET 56 -10.717 8.945 -0.426 1147 2HB MET 56 2HB MET 56 -9.943 8.884 -2.004 1148 1HG MET 56 1HG MET 56 -10.717 6.796 -2.076 1149 2HG MET 56 2HG MET 56 -9.354 6.422 -1.025 1150 1HE MET 56 1HE MET 56 -10.859 5.958 2.435 1151 2HE MET 56 2HE MET 56 -9.562 5.495 1.333 1152 3HE MET 56 3HE MET 56 -9.801 7.192 1.750 1153 H HIS 57 H HIS 57 -8.867 10.765 -1.864 1154 HA HIS 57 HA HIS 57 -6.977 10.236 -3.854 1155 1HB HIS 57 1HB HIS 57 -8.912 11.983 -3.765 1156 2HB HIS 57 2HB HIS 57 -7.689 13.046 -3.076 1157 HD1 HIS 57 HD1 HIS 57 -8.112 14.475 -5.302 1158 HD2 HIS 57 HD2 HIS 57 -6.280 10.782 -5.823 1159 HE1 HIS 57 HE1 HIS 57 -7.094 14.547 -7.601 1160 H SER 58 H SER 58 -6.707 12.077 -0.848 1161 HA SER 58 HA SER 58 -4.161 13.155 -1.255 1162 1HB SER 58 1HB SER 58 -6.042 13.148 0.809 1163 2HB SER 58 2HB SER 58 -4.603 12.415 1.518 1164 HG SER 58 HG SER 58 -4.146 14.486 1.766 1165 H PHE 59 H PHE 59 -5.166 9.945 -0.453 1166 HA PHE 59 HA PHE 59 -2.680 9.052 0.625 1167 1HB PHE 59 1HB PHE 59 -4.842 7.924 1.081 1168 2HB PHE 59 2HB PHE 59 -4.913 7.424 -0.605 1169 HD1 PHE 59 HD1 PHE 59 -4.171 5.320 -1.138 1170 HD2 PHE 59 HD2 PHE 59 -2.597 7.250 2.314 1171 HE1 PHE 59 HE1 PHE 59 -2.891 3.291 -0.591 1172 HE2 PHE 59 HE2 PHE 59 -1.313 5.225 2.865 1173 HZ PHE 59 HZ PHE 59 -1.458 3.242 1.412 1174 H ILE 60 H ILE 60 -4.280 8.422 -2.501 1175 HA ILE 60 HA ILE 60 -2.136 7.092 -3.703 1176 HB ILE 60 HB ILE 60 -4.270 8.765 -5.036 1177 1HG1 ILE 60 1HG1 ILE 60 -5.162 6.943 -3.632 1178 2HG1 ILE 60 2HG1 ILE 60 -5.450 6.646 -5.343 1179 1HG2 ILE 60 1HG2 ILE 60 -3.121 8.414 -6.908 1180 2HG2 ILE 60 2HG2 ILE 60 -1.990 7.338 -6.089 1181 3HG2 ILE 60 3HG2 ILE 60 -3.503 6.701 -6.733 1182 1HD1 ILE 60 1HD1 ILE 60 -4.441 4.690 -5.189 1183 2HD1 ILE 60 2HD1 ILE 60 -2.966 5.465 -4.609 1184 3HD1 ILE 60 3HD1 ILE 60 -4.209 4.963 -3.463 1185 H LEU 61 H LEU 61 -3.005 10.532 -3.734 1186 HA LEU 61 HA LEU 61 -0.988 11.394 -5.483 1187 1HB LEU 61 1HB LEU 61 -2.990 12.573 -3.829 1188 2HB LEU 61 2HB LEU 61 -1.470 13.426 -3.572 1189 HG LEU 61 HG LEU 61 -1.326 13.959 -5.926 1190 1HD1 LEU 61 1HD1 LEU 61 -3.774 12.231 -6.147 1191 2HD1 LEU 61 2HD1 LEU 61 -2.240 12.074 -7.000 1192 3HD1 LEU 61 3HD1 LEU 61 -3.327 13.410 -7.380 1193 1HD2 LEU 61 1HD2 LEU 61 -2.619 15.447 -4.459 1194 2HD2 LEU 61 2HD2 LEU 61 -4.085 14.550 -4.856 1195 3HD2 LEU 61 3HD2 LEU 61 -3.233 15.449 -6.113 1196 H LYS 62 H LYS 62 -0.898 10.467 -2.161 1197 HA LYS 62 HA LYS 62 1.553 11.812 -1.519 1198 1HB LYS 62 1HB LYS 62 -0.441 10.343 -0.114 1199 2HB LYS 62 2HB LYS 62 1.111 9.580 0.203 1200 1HG LYS 62 1HG LYS 62 0.630 11.238 1.890 1201 2HG LYS 62 2HG LYS 62 2.017 11.742 0.921 1202 1HD LYS 62 1HD LYS 62 0.983 13.619 0.320 1203 2HD LYS 62 2HD LYS 62 -0.424 12.718 -0.246 1204 1HE LYS 62 1HE LYS 62 -1.164 12.585 2.156 1205 2HE LYS 62 2HE LYS 62 0.129 13.720 2.540 1206 1HZ LYS 62 1HZ LYS 62 -0.957 15.146 0.715 1207 2HZ LYS 62 2HZ LYS 62 -1.688 15.084 2.239 1208 3HZ LYS 62 3HZ LYS 62 -2.317 14.170 0.962 1209 H ALA 63 H ALA 63 0.687 8.402 -2.093 1210 HA ALA 63 HA ALA 63 3.364 7.467 -2.044 1211 1HB ALA 63 1HB ALA 63 2.008 5.598 -3.513 1212 2HB ALA 63 2HB ALA 63 2.109 5.639 -1.753 1213 3HB ALA 63 3HB ALA 63 0.719 6.349 -2.573 1214 H ARG 64 H ARG 64 1.214 8.543 -4.622 1215 HA ARG 64 HA ARG 64 2.695 7.703 -6.829 1216 1HB ARG 64 1HB ARG 64 0.360 8.743 -6.770 1217 2HB ARG 64 2HB ARG 64 1.173 10.301 -6.727 1218 1HG ARG 64 1HG ARG 64 2.355 8.908 -8.838 1219 2HG ARG 64 2HG ARG 64 0.624 8.587 -8.963 1220 1HD ARG 64 1HD ARG 64 1.676 11.364 -8.539 1221 2HD ARG 64 2HD ARG 64 1.571 10.661 -10.152 1222 HE ARG 64 HE ARG 64 -0.909 10.313 -8.971 1223 1HH1 ARG 64 1HH1 ARG 64 1.148 12.963 -9.904 1224 2HH1 ARG 64 2HH1 ARG 64 -0.167 14.048 -10.206 1225 1HH2 ARG 64 1HH2 ARG 64 -2.649 11.733 -9.366 1226 2HH2 ARG 64 2HH2 ARG 64 -2.327 13.349 -9.899 1227 H SER 65 H SER 65 3.047 10.541 -4.781 1228 HA SER 65 HA SER 65 5.017 11.798 -6.435 1229 1HB SER 65 1HB SER 65 3.422 12.700 -4.438 1230 2HB SER 65 2HB SER 65 4.935 12.488 -3.558 1231 HG SER 65 HG SER 65 4.341 14.544 -4.932 1232 H THR 66 H THR 66 5.051 9.425 -3.915 1233 HA THR 66 HA THR 66 7.872 9.708 -3.355 1234 HB THR 66 HB THR 66 6.525 7.221 -2.515 1235 HG1 THR 66 HG1 THR 66 5.106 8.197 -1.147 1236 1HG2 THR 66 1HG2 THR 66 7.679 7.608 -0.486 1237 2HG2 THR 66 2HG2 THR 66 7.895 9.321 -0.848 1238 3HG2 THR 66 3HG2 THR 66 8.786 8.106 -1.764 1239 H VAL 67 H VAL 67 5.790 7.602 -5.250 1240 HA VAL 67 HA VAL 67 7.510 5.521 -5.837 1241 HB VAL 67 HB VAL 67 5.519 6.816 -7.706 1242 1HG1 VAL 67 1HG1 VAL 67 5.580 4.196 -8.387 1243 2HG1 VAL 67 2HG1 VAL 67 6.510 5.456 -9.202 1244 3HG1 VAL 67 3HG1 VAL 67 7.268 4.465 -7.955 1245 1HG2 VAL 67 1HG2 VAL 67 4.594 4.361 -6.650 1246 2HG2 VAL 67 2HG2 VAL 67 5.174 5.331 -5.296 1247 3HG2 VAL 67 3HG2 VAL 67 3.945 5.979 -6.382 1248 H ARG 68 H ARG 68 7.382 8.754 -7.218 1249 HA ARG 68 HA ARG 68 9.022 8.410 -9.432 1250 1HB ARG 68 1HB ARG 68 9.010 10.848 -7.651 1251 2HB ARG 68 2HB ARG 68 9.409 10.781 -9.362 1252 1HG ARG 68 1HG ARG 68 6.821 9.721 -9.118 1253 2HG ARG 68 2HG ARG 68 6.869 11.166 -8.107 1254 1HD ARG 68 1HD ARG 68 7.289 12.561 -9.884 1255 2HD ARG 68 2HD ARG 68 8.042 11.287 -10.842 1256 HE ARG 68 HE ARG 68 5.985 10.763 -11.697 1257 1HH1 ARG 68 1HH1 ARG 68 5.572 12.749 -8.868 1258 2HH1 ARG 68 2HH1 ARG 68 3.867 12.950 -9.098 1259 1HH2 ARG 68 1HH2 ARG 68 3.740 11.020 -12.011 1260 2HH2 ARG 68 2HH2 ARG 68 2.826 11.965 -10.885 1261 H ASP 69 H ASP 69 9.817 8.479 -6.063 1262 HA ASP 69 HA ASP 69 12.634 8.942 -6.474 1263 1HB ASP 69 1HB ASP 69 11.208 9.521 -4.382 1264 2HB ASP 69 2HB ASP 69 11.447 7.831 -3.948 1265 H ILE 70 H ILE 70 10.510 6.191 -5.987 1266 HA ILE 70 HA ILE 70 12.526 4.261 -5.519 1267 HB ILE 70 HB ILE 70 9.794 3.805 -6.721 1268 1HG1 ILE 70 1HG1 ILE 70 10.612 3.675 -3.813 1269 2HG1 ILE 70 2HG1 ILE 70 9.779 5.045 -4.539 1270 1HG2 ILE 70 1HG2 ILE 70 11.565 1.918 -5.177 1271 2HG2 ILE 70 2HG2 ILE 70 10.016 1.545 -5.931 1272 3HG2 ILE 70 3HG2 ILE 70 11.412 1.938 -6.934 1273 1HD1 ILE 70 1HD1 ILE 70 8.721 2.550 -3.564 1274 2HD1 ILE 70 2HD1 ILE 70 7.885 4.044 -3.987 1275 3HD1 ILE 70 3HD1 ILE 70 8.238 2.848 -5.234 1276 H ASP 71 H ASP 71 10.835 5.297 -8.459 1277 HA ASP 71 HA ASP 71 13.023 4.138 -10.035 1278 1HB ASP 71 1HB ASP 71 10.168 3.421 -10.142 1279 2HB ASP 71 2HB ASP 71 10.895 3.771 -11.708 1280 HA PRO 72 HA PRO 72 13.034 7.898 -12.291 1281 1HB PRO 72 1HB PRO 72 13.555 7.066 -14.822 1282 2HB PRO 72 2HB PRO 72 14.765 7.039 -13.534 1283 1HG PRO 72 1HG PRO 72 13.073 4.807 -14.590 1284 2HG PRO 72 2HG PRO 72 14.794 4.801 -14.164 1285 1HD PRO 72 1HD PRO 72 12.884 3.809 -12.521 1286 2HD PRO 72 2HD PRO 72 14.365 4.573 -11.911 1287 H GLN 73 H GLN 73 10.847 5.383 -13.283 1288 HA GLN 73 HA GLN 73 8.984 7.415 -14.250 1289 1HB GLN 73 1HB GLN 73 9.836 4.980 -15.816 1290 2HB GLN 73 2HB GLN 73 8.378 5.896 -16.176 1291 1HG GLN 73 1HG GLN 73 10.088 7.910 -16.217 1292 2HG GLN 73 2HG GLN 73 11.224 6.614 -16.588 1293 1HE2 GLN 73 1HE2 GLN 73 11.621 7.012 -18.685 1294 2HE2 GLN 73 2HE2 GLN 73 10.423 6.998 -19.930 1295 H ASN 74 H ASN 74 8.990 3.862 -14.365 1296 HA ASN 74 HA ASN 74 7.519 2.323 -13.559 1297 1HB ASN 74 1HB ASN 74 8.584 3.541 -11.425 1298 2HB ASN 74 2HB ASN 74 6.899 3.985 -11.172 1299 1HD2 ASN 74 1HD2 ASN 74 8.502 2.295 -9.524 1300 2HD2 ASN 74 2HD2 ASN 74 7.756 0.737 -9.510 1301 H ASP 75 H ASP 75 5.208 2.282 -12.262 1302 HA ASP 75 HA ASP 75 3.406 4.373 -12.991 1303 1HB ASP 75 1HB ASP 75 3.956 2.430 -14.982 1304 2HB ASP 75 2HB ASP 75 2.338 2.098 -14.370 1305 H LEU 76 H LEU 76 2.040 4.393 -11.345 1306 HA LEU 76 HA LEU 76 1.710 2.215 -9.567 1307 1HB LEU 76 1HB LEU 76 0.378 4.871 -9.908 1308 2HB LEU 76 2HB LEU 76 -0.275 3.691 -8.772 1309 HG LEU 76 HG LEU 76 1.113 5.293 -7.610 1310 1HD1 LEU 76 1HD1 LEU 76 2.508 3.789 -6.414 1311 2HD1 LEU 76 2HD1 LEU 76 2.623 2.696 -7.792 1312 3HD1 LEU 76 3HD1 LEU 76 1.092 2.877 -6.936 1313 1HD2 LEU 76 1HD2 LEU 76 3.184 5.958 -8.241 1314 2HD2 LEU 76 2HD2 LEU 76 2.583 5.496 -9.833 1315 3HD2 LEU 76 3HD2 LEU 76 3.605 4.385 -8.920 1316 H THR 77 H THR 77 0.455 0.489 -9.750 1317 HA THR 77 HA THR 77 -2.047 0.688 -11.270 1318 HB THR 77 HB THR 77 -0.315 -0.321 -12.744 1319 HG1 THR 77 HG1 THR 77 -2.544 -0.929 -12.924 1320 1HG2 THR 77 1HG2 THR 77 0.546 -2.539 -12.257 1321 2HG2 THR 77 2HG2 THR 77 -0.323 -2.565 -10.722 1322 3HG2 THR 77 3HG2 THR 77 0.999 -1.425 -10.968 1323 H PHE 78 H PHE 78 -1.004 0.361 -8.368 1324 HA PHE 78 HA PHE 78 -3.184 -1.070 -7.368 1325 1HB PHE 78 1HB PHE 78 -1.233 -2.803 -8.336 1326 2HB PHE 78 2HB PHE 78 -0.949 -2.767 -6.599 1327 HD1 PHE 78 HD1 PHE 78 -2.917 -3.241 -5.062 1328 HD2 PHE 78 HD2 PHE 78 -2.961 -4.077 -9.235 1329 HE1 PHE 78 HE1 PHE 78 -4.777 -4.815 -4.724 1330 HE2 PHE 78 HE2 PHE 78 -4.821 -5.652 -8.903 1331 HZ PHE 78 HZ PHE 78 -5.733 -6.022 -6.646 1332 H LEU 79 H LEU 79 -3.389 -0.803 -5.176 1333 HA LEU 79 HA LEU 79 -1.141 -0.120 -3.518 1334 1HB LEU 79 1HB LEU 79 -2.029 1.979 -4.859 1335 2HB LEU 79 2HB LEU 79 -3.245 1.981 -3.583 1336 HG LEU 79 HG LEU 79 -1.473 2.195 -1.902 1337 1HD1 LEU 79 1HD1 LEU 79 0.339 2.212 -4.306 1338 2HD1 LEU 79 2HD1 LEU 79 0.352 1.081 -2.953 1339 3HD1 LEU 79 3HD1 LEU 79 0.826 2.761 -2.702 1340 1HD2 LEU 79 1HD2 LEU 79 -0.738 4.494 -2.526 1341 2HD2 LEU 79 2HD2 LEU 79 -2.474 4.223 -2.687 1342 3HD2 LEU 79 3HD2 LEU 79 -1.446 4.235 -4.121 1343 H ARG 80 H ARG 80 -1.681 -1.628 -2.032 1344 HA ARG 80 HA ARG 80 -4.372 -1.460 -0.844 1345 1HB ARG 80 1HB ARG 80 -3.600 -3.634 -1.985 1346 2HB ARG 80 2HB ARG 80 -2.535 -3.830 -0.600 1347 1HG ARG 80 1HG ARG 80 -4.386 -3.941 0.901 1348 2HG ARG 80 2HG ARG 80 -5.515 -3.493 -0.379 1349 1HD ARG 80 1HD ARG 80 -4.931 -5.574 -1.574 1350 2HD ARG 80 2HD ARG 80 -3.884 -6.025 -0.229 1351 HE ARG 80 HE ARG 80 -6.474 -5.495 0.736 1352 1HH1 ARG 80 1HH1 ARG 80 -4.723 -7.843 -1.147 1353 2HH1 ARG 80 2HH1 ARG 80 -5.765 -9.158 -0.715 1354 1HH2 ARG 80 1HH2 ARG 80 -7.853 -7.219 1.311 1355 2HH2 ARG 80 2HH2 ARG 80 -7.545 -8.802 0.682 1356 H ILE 81 H ILE 81 -4.523 -1.844 1.469 1357 HA ILE 81 HA ILE 81 -2.081 -1.505 3.016 1358 HB ILE 81 HB ILE 81 -3.284 0.348 4.351 1359 1HG1 ILE 81 1HG1 ILE 81 -4.700 0.586 1.687 1360 2HG1 ILE 81 2HG1 ILE 81 -5.453 0.152 3.218 1361 1HG2 ILE 81 1HG2 ILE 81 -2.547 1.626 1.854 1362 2HG2 ILE 81 2HG2 ILE 81 -1.765 1.695 3.433 1363 3HG2 ILE 81 3HG2 ILE 81 -1.403 0.370 2.327 1364 1HD1 ILE 81 1HD1 ILE 81 -4.187 2.791 2.526 1365 2HD1 ILE 81 2HD1 ILE 81 -5.909 2.453 2.708 1366 3HD1 ILE 81 3HD1 ILE 81 -4.840 2.365 4.107 1367 H ARG 82 H ARG 82 -2.477 -3.514 3.928 1368 HA ARG 82 HA ARG 82 -4.939 -4.359 4.990 1369 1HB ARG 82 1HB ARG 82 -2.905 -5.785 4.452 1370 2HB ARG 82 2HB ARG 82 -2.228 -5.235 5.978 1371 1HG ARG 82 1HG ARG 82 -4.609 -6.093 6.846 1372 2HG ARG 82 2HG ARG 82 -4.407 -7.151 5.448 1373 1HD ARG 82 1HD ARG 82 -2.205 -7.832 6.307 1374 2HD ARG 82 2HD ARG 82 -2.450 -6.804 7.718 1375 HE ARG 82 HE ARG 82 -3.625 -9.388 7.223 1376 1HH1 ARG 82 1HH1 ARG 82 -3.877 -6.395 8.984 1377 2HH1 ARG 82 2HH1 ARG 82 -4.831 -7.076 10.261 1378 1HH2 ARG 82 1HH2 ARG 82 -4.879 -10.296 8.898 1379 2HH2 ARG 82 2HH2 ARG 82 -5.399 -9.295 10.211 1380 H SER 83 H SER 83 -6.012 -3.318 6.535 1381 HA SER 83 HA SER 83 -4.553 -1.927 8.646 1382 1HB SER 83 1HB SER 83 -7.513 -1.909 8.661 1383 2HB SER 83 2HB SER 83 -6.374 -0.578 8.868 1384 HG SER 83 HG SER 83 -7.643 -1.450 6.619 1385 H LYS 84 H LYS 84 -6.177 -2.014 10.775 1386 HA LYS 84 HA LYS 84 -5.840 -4.750 11.695 1387 1HB LYS 84 1HB LYS 84 -6.608 -2.219 13.159 1388 2HB LYS 84 2HB LYS 84 -6.396 -3.787 13.928 1389 1HG LYS 84 1HG LYS 84 -4.041 -3.775 13.024 1390 2HG LYS 84 2HG LYS 84 -4.312 -2.085 12.593 1391 1HD LYS 84 1HD LYS 84 -3.771 -1.501 14.668 1392 2HD LYS 84 2HD LYS 84 -5.169 -2.400 15.264 1393 1HE LYS 84 1HE LYS 84 -3.918 -4.244 15.811 1394 2HE LYS 84 2HE LYS 84 -2.684 -3.900 14.601 1395 1HZ LYS 84 1HZ LYS 84 -3.074 -2.482 17.180 1396 2HZ LYS 84 2HZ LYS 84 -1.956 -2.025 15.996 1397 3HZ LYS 84 3HZ LYS 84 -1.796 -3.516 16.780 1398 H LYS 85 H LYS 85 -8.387 -2.511 10.899 1399 HA LYS 85 HA LYS 85 -10.449 -4.224 12.025 1400 1HB LYS 85 1HB LYS 85 -10.341 -1.489 10.870 1401 2HB LYS 85 2HB LYS 85 -11.859 -2.363 10.706 1402 1HG LYS 85 1HG LYS 85 -11.713 -2.767 13.214 1403 2HG LYS 85 2HG LYS 85 -10.441 -1.543 13.219 1404 1HD LYS 85 1HD LYS 85 -12.052 0.016 12.107 1405 2HD LYS 85 2HD LYS 85 -13.307 -1.202 12.345 1406 1HE LYS 85 1HE LYS 85 -12.133 -0.951 14.840 1407 2HE LYS 85 2HE LYS 85 -12.174 0.700 14.224 1408 1HZ LYS 85 1HZ LYS 85 -14.314 -0.925 15.168 1409 2HZ LYS 85 2HZ LYS 85 -14.632 -0.347 13.610 1410 3HZ LYS 85 3HZ LYS 85 -14.286 0.739 14.860 1411 H ASN 86 H ASN 86 -9.143 -3.310 8.894 1412 HA ASN 86 HA ASN 86 -9.935 -5.667 7.622 1413 1HB ASN 86 1HB ASN 86 -11.615 -4.428 6.015 1414 2HB ASN 86 2HB ASN 86 -12.179 -5.123 7.532 1415 1HD2 ASN 86 1HD2 ASN 86 -10.802 -2.106 6.273 1416 2HD2 ASN 86 2HD2 ASN 86 -11.815 -1.058 7.200 1417 H GLU 87 H GLU 87 -9.610 -5.559 5.225 1418 HA GLU 87 HA GLU 87 -7.339 -3.835 4.671 1419 1HB GLU 87 1HB GLU 87 -8.543 -6.230 3.318 1420 2HB GLU 87 2HB GLU 87 -7.378 -5.220 2.474 1421 1HG GLU 87 1HG GLU 87 -6.351 -5.824 5.057 1422 2HG GLU 87 2HG GLU 87 -6.891 -7.319 4.296 1423 H ILE 88 H ILE 88 -7.176 -2.487 2.835 1424 HA ILE 88 HA ILE 88 -9.705 -1.805 1.508 1425 HB ILE 88 HB ILE 88 -7.787 0.287 2.529 1426 1HG1 ILE 88 1HG1 ILE 88 -10.437 -0.597 3.695 1427 2HG1 ILE 88 2HG1 ILE 88 -8.855 -0.864 4.419 1428 1HG2 ILE 88 1HG2 ILE 88 -10.479 1.157 2.031 1429 2HG2 ILE 88 2HG2 ILE 88 -8.968 1.734 1.329 1430 3HG2 ILE 88 3HG2 ILE 88 -9.814 0.368 0.600 1431 1HD1 ILE 88 1HD1 ILE 88 -8.853 1.832 4.079 1432 2HD1 ILE 88 2HD1 ILE 88 -10.552 1.510 4.426 1433 3HD1 ILE 88 3HD1 ILE 88 -9.306 0.994 5.563 1434 H MET 89 H MET 89 -9.214 -2.492 -0.504 1435 HA MET 89 HA MET 89 -6.611 -2.055 -1.664 1436 1HB MET 89 1HB MET 89 -9.174 -3.224 -2.742 1437 2HB MET 89 2HB MET 89 -7.725 -3.039 -3.721 1438 1HG MET 89 1HG MET 89 -6.678 -4.769 -2.743 1439 2HG MET 89 2HG MET 89 -7.345 -4.412 -1.151 1440 1HE MET 89 1HE MET 89 -9.958 -4.653 -4.085 1441 2HE MET 89 2HE MET 89 -8.494 -5.401 -4.724 1442 3HE MET 89 3HE MET 89 -9.924 -6.386 -4.415 1443 H VAL 90 H VAL 90 -6.018 -0.517 -3.097 1444 HA VAL 90 HA VAL 90 -8.037 1.194 -4.320 1445 HB VAL 90 HB VAL 90 -5.847 2.279 -2.544 1446 1HG1 VAL 90 1HG1 VAL 90 -7.767 3.725 -4.366 1447 2HG1 VAL 90 2HG1 VAL 90 -6.733 4.502 -3.165 1448 3HG1 VAL 90 3HG1 VAL 90 -6.013 3.644 -4.528 1449 1HG2 VAL 90 1HG2 VAL 90 -7.714 1.588 -1.234 1450 2HG2 VAL 90 2HG2 VAL 90 -7.797 3.344 -1.377 1451 3HG2 VAL 90 3HG2 VAL 90 -8.854 2.329 -2.357 1452 H ALA 91 H ALA 91 -7.507 1.670 -6.353 1453 HA ALA 91 HA ALA 91 -4.711 1.892 -7.138 1454 1HB ALA 91 1HB ALA 91 -6.585 -0.138 -8.342 1455 2HB ALA 91 2HB ALA 91 -5.043 0.337 -9.054 1456 3HB ALA 91 3HB ALA 91 -5.080 -0.451 -7.477 1457 HA PRO 92 HA PRO 92 -6.236 5.036 -9.797 1458 1HB PRO 92 1HB PRO 92 -4.421 4.941 -11.813 1459 2HB PRO 92 2HB PRO 92 -4.043 5.582 -10.209 1460 1HG PRO 92 1HG PRO 92 -3.451 2.882 -11.359 1461 2HG PRO 92 2HG PRO 92 -2.410 3.935 -10.384 1462 1HD PRO 92 1HD PRO 92 -3.736 1.822 -9.333 1463 2HD PRO 92 2HD PRO 92 -3.405 3.299 -8.405 1464 H ASP 93 H ASP 93 -8.117 4.706 -10.823 1465 HA ASP 93 HA ASP 93 -8.385 2.577 -12.784 1466 1HB ASP 93 1HB ASP 93 -10.128 3.718 -10.959 1467 2HB ASP 93 2HB ASP 93 -10.668 4.375 -12.502 1468 H LYS 94 H LYS 94 -10.183 3.590 -14.564 1469 HA LYS 94 HA LYS 94 -8.631 4.741 -16.527 1470 1HB LYS 94 1HB LYS 94 -11.389 4.073 -16.179 1471 2HB LYS 94 2HB LYS 94 -11.289 5.660 -16.929 1472 1HG LYS 94 1HG LYS 94 -11.099 4.555 -18.851 1473 2HG LYS 94 2HG LYS 94 -9.441 4.216 -18.347 1474 1HD LYS 94 1HD LYS 94 -10.212 2.127 -17.295 1475 2HD LYS 94 2HD LYS 94 -11.850 2.462 -17.861 1476 1HE LYS 94 1HE LYS 94 -11.395 1.705 -19.911 1477 2HE LYS 94 2HE LYS 94 -9.892 2.621 -19.998 1478 1HZ LYS 94 1HZ LYS 94 -9.447 0.271 -20.144 1479 2HZ LYS 94 2HZ LYS 94 -10.260 -0.019 -18.690 1480 3HZ LYS 94 3HZ LYS 94 -8.820 0.869 -18.691 1481 H ASP 95 H ASP 95 -10.952 6.410 -14.400 1482 HA ASP 95 HA ASP 95 -9.306 8.805 -14.513 1483 1HB ASP 95 1HB ASP 95 -11.012 10.267 -15.288 1484 2HB ASP 95 2HB ASP 95 -10.983 8.914 -16.415 1485 H TYR 96 H TYR 96 -10.498 6.678 -12.618 1486 HA TYR 96 HA TYR 96 -11.118 8.581 -10.493 1487 1HB TYR 96 1HB TYR 96 -13.004 7.089 -9.723 1488 2HB TYR 96 2HB TYR 96 -13.321 7.996 -11.197 1489 HD1 TYR 96 HD1 TYR 96 -13.011 4.714 -9.713 1490 HD2 TYR 96 HD2 TYR 96 -13.231 6.823 -13.402 1491 HE1 TYR 96 HE1 TYR 96 -13.579 2.619 -10.870 1492 HE2 TYR 96 HE2 TYR 96 -13.801 4.735 -14.569 1493 HH TYR 96 HH TYR 96 -14.904 2.076 -13.148 1494 H PHE 97 H PHE 97 -11.580 7.027 -8.403 1495 HA PHE 97 HA PHE 97 -9.390 5.060 -8.346 1496 1HB PHE 97 1HB PHE 97 -10.021 7.219 -6.335 1497 2HB PHE 97 2HB PHE 97 -9.010 5.830 -5.950 1498 HD1 PHE 97 HD1 PHE 97 -6.932 5.447 -7.375 1499 HD2 PHE 97 HD2 PHE 97 -9.113 9.102 -7.351 1500 HE1 PHE 97 HE1 PHE 97 -4.971 6.619 -8.288 1501 HE2 PHE 97 HE2 PHE 97 -7.156 10.280 -8.266 1502 HZ PHE 97 HZ PHE 97 -5.082 9.038 -8.736 1503 H LEU 98 H LEU 98 -10.196 3.117 -7.944 1504 HA LEU 98 HA LEU 98 -12.766 2.808 -6.653 1505 1HB LEU 98 1HB LEU 98 -11.669 1.457 -8.641 1506 2HB LEU 98 2HB LEU 98 -11.025 0.488 -7.317 1507 HG LEU 98 HG LEU 98 -13.948 1.013 -7.340 1508 1HD1 LEU 98 1HD1 LEU 98 -14.255 -0.963 -8.839 1509 2HD1 LEU 98 2HD1 LEU 98 -12.547 -0.836 -9.259 1510 3HD1 LEU 98 3HD1 LEU 98 -13.650 0.485 -9.644 1511 1HD2 LEU 98 1HD2 LEU 98 -13.227 -1.692 -6.929 1512 2HD2 LEU 98 2HD2 LEU 98 -13.828 -0.527 -5.749 1513 3HD2 LEU 98 3HD2 LEU 98 -12.093 -0.694 -6.019 1514 H ILE 99 H ILE 99 -13.149 2.075 -4.632 1515 HA ILE 99 HA ILE 99 -10.847 1.214 -3.015 1516 HB ILE 99 HB ILE 99 -13.035 3.015 -1.980 1517 1HG1 ILE 99 1HG1 ILE 99 -10.706 4.472 -1.887 1518 2HG1 ILE 99 2HG1 ILE 99 -10.551 3.624 -3.422 1519 1HG2 ILE 99 1HG2 ILE 99 -10.431 2.058 -0.803 1520 2HG2 ILE 99 2HG2 ILE 99 -11.447 3.310 -0.089 1521 3HG2 ILE 99 3HG2 ILE 99 -12.060 1.665 -0.254 1522 1HD1 ILE 99 1HD1 ILE 99 -11.579 5.816 -3.690 1523 2HD1 ILE 99 2HD1 ILE 99 -12.686 4.522 -4.148 1524 3HD1 ILE 99 3HD1 ILE 99 -12.880 5.342 -2.599 1525 H VAL 100 H VAL 100 -11.211 -0.812 -2.416 1526 HA VAL 100 HA VAL 100 -13.971 -1.623 -1.775 1527 HB VAL 100 HB VAL 100 -11.653 -3.351 -2.654 1528 1HG1 VAL 100 1HG1 VAL 100 -12.805 -4.885 -1.456 1529 2HG1 VAL 100 2HG1 VAL 100 -14.309 -3.964 -1.517 1530 3HG1 VAL 100 3HG1 VAL 100 -13.808 -4.929 -2.906 1531 1HG2 VAL 100 1HG2 VAL 100 -13.916 -2.076 -4.076 1532 2HG2 VAL 100 2HG2 VAL 100 -12.289 -2.453 -4.642 1533 3HG2 VAL 100 3HG2 VAL 100 -13.504 -3.727 -4.538 1534 H ILE 101 H ILE 101 -14.319 -1.682 0.342 1535 HA ILE 101 HA ILE 101 -12.110 -2.434 2.129 1536 HB ILE 101 HB ILE 101 -14.699 -1.024 2.788 1537 1HG1 ILE 101 1HG1 ILE 101 -12.138 0.347 3.230 1538 2HG1 ILE 101 2HG1 ILE 101 -12.494 0.026 1.537 1539 1HG2 ILE 101 1HG2 ILE 101 -12.718 -0.737 4.802 1540 2HG2 ILE 101 2HG2 ILE 101 -14.303 -1.500 4.916 1541 3HG2 ILE 101 3HG2 ILE 101 -12.897 -2.454 4.443 1542 1HD1 ILE 101 1HD1 ILE 101 -14.411 1.341 1.570 1543 2HD1 ILE 101 2HD1 ILE 101 -14.511 1.315 3.331 1544 3HD1 ILE 101 3HD1 ILE 101 -13.248 2.252 2.533 1545 H GLN 102 H GLN 102 -12.153 -4.328 3.146 1546 HA GLN 102 HA GLN 102 -14.548 -5.564 4.062 1547 1HB GLN 102 1HB GLN 102 -14.556 -7.532 2.669 1548 2HB GLN 102 2HB GLN 102 -14.667 -6.110 1.641 1549 1HG GLN 102 1HG GLN 102 -12.246 -6.287 1.195 1550 2HG GLN 102 2HG GLN 102 -12.209 -7.771 2.147 1551 1HE2 GLN 102 1HE2 GLN 102 -11.968 -6.873 -0.840 1552 2HE2 GLN 102 2HE2 GLN 102 -12.852 -8.106 -1.666 1553 H ASN 103 H ASN 103 -14.076 -7.786 4.980 1554 HA ASN 103 HA ASN 103 -12.014 -7.675 6.809 1555 1HB ASN 103 1HB ASN 103 -13.813 -9.804 5.802 1556 2HB ASN 103 2HB ASN 103 -12.361 -10.349 6.638 1557 1HD2 ASN 103 1HD2 ASN 103 -15.429 -10.000 7.175 1558 2HD2 ASN 103 2HD2 ASN 103 -15.448 -9.426 8.805 1559 HA PRO 104 HA PRO 104 -8.292 -8.878 4.824 1560 1HB PRO 104 1HB PRO 104 -7.125 -10.478 6.682 1561 2HB PRO 104 2HB PRO 104 -7.260 -8.725 6.871 1562 1HG PRO 104 1HG PRO 104 -8.963 -10.893 8.038 1563 2HG PRO 104 2HG PRO 104 -8.334 -9.427 8.811 1564 1HD PRO 104 1HD PRO 104 -10.880 -9.622 7.913 1565 2HD PRO 104 2HD PRO 104 -9.981 -8.092 7.906 1566 H THR 105 H THR 105 -7.320 -10.500 3.618 1567 HA THR 105 HA THR 105 -8.840 -13.014 3.455 1568 HB THR 105 HB THR 105 -7.809 -13.216 1.165 1569 HG1 THR 105 HG1 THR 105 -7.111 -10.491 1.638 1570 1HG2 THR 105 1HG2 THR 105 -9.719 -11.059 1.952 1571 2HG2 THR 105 2HG2 THR 105 -10.011 -12.544 1.046 1572 3HG2 THR 105 3HG2 THR 105 -9.206 -11.181 0.269 1573 H GLU 106 H GLU 106 -5.616 -11.644 3.705 1574 HA GLU 106 HA GLU 106 -4.253 -14.151 3.486 1575 1HB GLU 106 1HB GLU 106 -3.453 -11.580 3.247 1576 2HB GLU 106 2HB GLU 106 -2.923 -11.911 4.890 1577 1HG GLU 106 1HG GLU 106 -1.071 -12.694 3.940 1578 2HG GLU 106 2HG GLU 106 -2.037 -14.119 3.561 Start of MODEL 13 1 H MET 11 H MET 11 17.402 -8.947 15.141 2 HA MET 11 HA MET 11 17.601 -7.929 12.409 3 1HB MET 11 1HB MET 11 19.596 -8.633 14.534 4 2HB MET 11 2HB MET 11 20.101 -8.534 12.852 5 1HG MET 11 1HG MET 11 18.628 -6.213 13.311 6 2HG MET 11 2HG MET 11 19.617 -6.432 14.752 7 1HE MET 11 1HE MET 11 19.779 -7.255 11.144 8 2HE MET 11 2HE MET 11 20.158 -5.616 10.615 9 3HE MET 11 3HE MET 11 21.418 -6.851 10.633 10 H ALA 12 H ALA 12 18.409 -10.869 14.248 11 HA ALA 12 HA ALA 12 19.288 -12.471 12.179 12 1HB ALA 12 1HB ALA 12 17.559 -13.666 14.296 13 2HB ALA 12 2HB ALA 12 19.074 -14.256 13.612 14 3HB ALA 12 3HB ALA 12 19.086 -12.908 14.749 15 H GLU 13 H GLU 13 15.970 -11.808 13.203 16 HA GLU 13 HA GLU 13 14.601 -13.671 11.688 17 1HB GLU 13 1HB GLU 13 13.940 -11.420 13.219 18 2HB GLU 13 2HB GLU 13 13.237 -11.121 11.636 19 1HG GLU 13 1HG GLU 13 12.053 -13.235 11.735 20 2HG GLU 13 2HG GLU 13 12.793 -13.593 13.294 21 H VAL 14 H VAL 14 15.515 -10.362 10.739 22 HA VAL 14 HA VAL 14 14.522 -10.524 8.107 23 HB VAL 14 HB VAL 14 16.821 -8.801 9.033 24 1HG1 VAL 14 1HG1 VAL 14 15.276 -7.375 7.256 25 2HG1 VAL 14 2HG1 VAL 14 16.795 -8.193 6.883 26 3HG1 VAL 14 3HG1 VAL 14 15.258 -9.005 6.585 27 1HG2 VAL 14 1HG2 VAL 14 14.691 -7.165 9.164 28 2HG2 VAL 14 2HG2 VAL 14 13.934 -8.686 9.638 29 3HG2 VAL 14 3HG2 VAL 14 15.311 -8.065 10.548 30 H GLU 15 H GLU 15 17.638 -11.343 9.522 31 HA GLU 15 HA GLU 15 19.052 -11.705 7.106 32 1HB GLU 15 1HB GLU 15 19.449 -12.776 9.893 33 2HB GLU 15 2HB GLU 15 20.532 -13.197 8.574 34 1HG GLU 15 1HG GLU 15 21.122 -10.879 8.263 35 2HG GLU 15 2HG GLU 15 19.956 -10.389 9.491 36 H GLU 16 H GLU 16 17.244 -13.959 9.162 37 HA GLU 16 HA GLU 16 17.820 -16.319 7.802 38 1HB GLU 16 1HB GLU 16 16.315 -15.675 9.976 39 2HB GLU 16 2HB GLU 16 15.060 -16.068 8.810 40 1HG GLU 16 1HG GLU 16 17.371 -17.884 9.438 41 2HG GLU 16 2HG GLU 16 15.810 -17.963 10.254 42 H THR 17 H THR 17 15.392 -13.850 7.156 43 HA THR 17 HA THR 17 14.176 -15.336 5.009 44 HB THR 17 HB THR 17 13.845 -12.442 5.822 45 HG1 THR 17 HG1 THR 17 13.096 -14.413 7.164 46 1HG2 THR 17 1HG2 THR 17 13.106 -12.426 3.630 47 2HG2 THR 17 2HG2 THR 17 11.630 -12.854 4.495 48 3HG2 THR 17 3HG2 THR 17 12.573 -14.106 3.688 49 H LEU 18 H LEU 18 16.740 -13.032 5.356 50 HA LEU 18 HA LEU 18 16.804 -12.156 2.644 51 1HB LEU 18 1HB LEU 18 18.268 -11.674 5.072 52 2HB LEU 18 2HB LEU 18 19.379 -11.912 3.725 53 HG LEU 18 HG LEU 18 17.604 -10.150 2.651 54 1HD1 LEU 18 1HD1 LEU 18 16.346 -9.752 4.613 55 2HD1 LEU 18 2HD1 LEU 18 17.405 -8.357 4.411 56 3HD1 LEU 18 3HD1 LEU 18 17.799 -9.598 5.601 57 1HD2 LEU 18 1HD2 LEU 18 20.132 -9.602 4.199 58 2HD2 LEU 18 2HD2 LEU 18 19.346 -8.443 3.126 59 3HD2 LEU 18 3HD2 LEU 18 19.990 -9.952 2.476 60 H LYS 19 H LYS 19 18.462 -14.681 4.471 61 HA LYS 19 HA LYS 19 20.289 -15.463 2.491 62 1HB LYS 19 1HB LYS 19 18.998 -17.118 4.666 63 2HB LYS 19 2HB LYS 19 20.401 -17.608 3.727 64 1HG LYS 19 1HG LYS 19 20.498 -15.030 5.210 65 2HG LYS 19 2HG LYS 19 20.667 -16.543 6.104 66 1HD LYS 19 1HD LYS 19 22.334 -16.887 3.929 67 2HD LYS 19 2HD LYS 19 22.556 -15.188 4.352 68 1HE LYS 19 1HE LYS 19 22.755 -16.110 6.782 69 2HE LYS 19 2HE LYS 19 23.105 -17.638 5.975 70 1HZ LYS 19 1HZ LYS 19 24.993 -16.719 4.942 71 2HZ LYS 19 2HZ LYS 19 25.078 -16.225 6.557 72 3HZ LYS 19 3HZ LYS 19 24.570 -15.136 5.367 73 H ARG 20 H ARG 20 17.020 -16.640 3.223 74 HA ARG 20 HA ARG 20 16.989 -18.588 1.153 75 1HB ARG 20 1HB ARG 20 15.503 -18.465 3.242 76 2HB ARG 20 2HB ARG 20 14.545 -17.296 2.344 77 1HG ARG 20 1HG ARG 20 13.391 -19.060 1.627 78 2HG ARG 20 2HG ARG 20 14.765 -19.356 0.560 79 1HD ARG 20 1HD ARG 20 15.657 -20.989 1.965 80 2HD ARG 20 2HD ARG 20 14.727 -20.433 3.355 81 HE ARG 20 HE ARG 20 12.897 -21.291 1.461 82 1HH1 ARG 20 1HH1 ARG 20 15.487 -22.656 3.345 83 2HH1 ARG 20 2HH1 ARG 20 14.781 -24.237 3.410 84 1HH2 ARG 20 1HH2 ARG 20 11.958 -23.368 1.539 85 2HH2 ARG 20 2HH2 ARG 20 12.775 -24.641 2.381 86 H LEU 21 H LEU 21 16.148 -15.199 1.329 87 HA LEU 21 HA LEU 21 14.715 -15.093 -1.129 88 1HB LEU 21 1HB LEU 21 15.673 -13.209 0.891 89 2HB LEU 21 2HB LEU 21 15.675 -12.556 -0.746 90 HG LEU 21 HG LEU 21 13.310 -12.920 -0.955 91 1HD1 LEU 21 1HD1 LEU 21 13.752 -14.774 1.197 92 2HD1 LEU 21 2HD1 LEU 21 12.364 -14.612 0.123 93 3HD1 LEU 21 3HD1 LEU 21 12.452 -13.654 1.601 94 1HD2 LEU 21 1HD2 LEU 21 12.546 -11.602 1.150 95 2HD2 LEU 21 2HD2 LEU 21 13.644 -10.843 -0.002 96 3HD2 LEU 21 3HD2 LEU 21 14.272 -11.517 1.503 97 H GLN 22 H GLN 22 17.994 -14.012 -0.234 98 HA GLN 22 HA GLN 22 18.788 -13.353 -2.855 99 1HB GLN 22 1HB GLN 22 19.906 -13.204 -0.293 100 2HB GLN 22 2HB GLN 22 21.005 -14.224 -1.211 101 1HG GLN 22 1HG GLN 22 21.847 -12.471 -2.261 102 2HG GLN 22 2HG GLN 22 20.245 -11.948 -2.777 103 1HE2 GLN 22 1HE2 GLN 22 18.962 -11.136 -0.676 104 2HE2 GLN 22 2HE2 GLN 22 19.803 -9.898 0.188 105 H SER 23 H SER 23 18.517 -16.365 -1.217 106 HA SER 23 HA SER 23 20.353 -17.795 -2.911 107 1HB SER 23 1HB SER 23 19.916 -18.531 -0.598 108 2HB SER 23 2HB SER 23 18.233 -18.844 -1.019 109 HG SER 23 HG SER 23 19.408 -20.758 -1.146 110 H GLN 24 H GLN 24 17.033 -16.887 -3.021 111 HA GLN 24 HA GLN 24 16.480 -18.806 -5.168 112 1HB GLN 24 1HB GLN 24 14.143 -18.253 -4.870 113 2HB GLN 24 2HB GLN 24 14.852 -18.647 -3.310 114 1HG GLN 24 1HG GLN 24 14.871 -16.397 -2.632 115 2HG GLN 24 2HG GLN 24 14.567 -15.820 -4.269 116 1HE2 GLN 24 1HE2 GLN 24 12.972 -14.759 -2.534 117 2HE2 GLN 24 2HE2 GLN 24 11.399 -15.471 -2.537 118 H LYS 25 H LYS 25 15.523 -18.089 -7.148 119 HA LYS 25 HA LYS 25 16.724 -15.676 -8.136 120 1HB LYS 25 1HB LYS 25 15.878 -18.078 -9.259 121 2HB LYS 25 2HB LYS 25 14.756 -16.886 -9.903 122 1HG LYS 25 1HG LYS 25 17.404 -15.838 -10.052 123 2HG LYS 25 2HG LYS 25 17.379 -17.457 -10.755 124 1HD LYS 25 1HD LYS 25 15.732 -16.861 -12.329 125 2HD LYS 25 2HD LYS 25 15.325 -15.378 -11.462 126 1HE LYS 25 1HE LYS 25 16.605 -14.810 -13.414 127 2HE LYS 25 2HE LYS 25 17.590 -14.513 -11.983 128 1HZ LYS 25 1HZ LYS 25 17.841 -16.662 -13.985 129 2HZ LYS 25 2HZ LYS 25 18.470 -16.869 -12.429 130 3HZ LYS 25 3HZ LYS 25 19.027 -15.604 -13.405 131 H GLY 26 H GLY 26 15.622 -13.897 -9.087 132 1HA GLY 26 1HA GLY 26 13.551 -12.744 -9.594 133 2HA GLY 26 2HA GLY 26 12.811 -13.594 -8.245 134 H VAL 27 H VAL 27 14.541 -13.201 -6.203 135 HA VAL 27 HA VAL 27 13.889 -10.709 -5.215 136 HB VAL 27 HB VAL 27 16.293 -12.386 -4.482 137 1HG1 VAL 27 1HG1 VAL 27 16.857 -10.531 -3.338 138 2HG1 VAL 27 2HG1 VAL 27 15.231 -9.850 -3.435 139 3HG1 VAL 27 3HG1 VAL 27 15.605 -11.073 -2.220 140 1HG2 VAL 27 1HG2 VAL 27 13.508 -12.287 -3.326 141 2HG2 VAL 27 2HG2 VAL 27 14.211 -13.613 -4.252 142 3HG2 VAL 27 3HG2 VAL 27 14.856 -13.210 -2.661 143 H GLN 28 H GLN 28 14.541 -8.713 -5.654 144 HA GLN 28 HA GLN 28 16.881 -8.318 -7.343 145 1HB GLN 28 1HB GLN 28 14.380 -6.922 -6.883 146 2HB GLN 28 2HB GLN 28 15.751 -5.825 -6.797 147 1HG GLN 28 1HG GLN 28 16.156 -5.953 -8.995 148 2HG GLN 28 2HG GLN 28 15.814 -7.680 -9.062 149 1HE2 GLN 28 1HE2 GLN 28 13.302 -7.963 -8.348 150 2HE2 GLN 28 2HE2 GLN 28 12.232 -7.069 -9.367 151 H GLY 29 H GLY 29 15.780 -7.716 -4.085 152 1HA GLY 29 1HA GLY 29 18.203 -7.546 -2.864 153 2HA GLY 29 2HA GLY 29 17.929 -5.908 -3.438 154 H ILE 30 H ILE 30 18.060 -7.130 -0.694 155 HA ILE 30 HA ILE 30 15.431 -6.201 0.265 156 HB ILE 30 HB ILE 30 17.260 -8.104 1.725 157 1HG1 ILE 30 1HG1 ILE 30 14.945 -9.466 0.936 158 2HG1 ILE 30 2HG1 ILE 30 15.459 -8.582 -0.496 159 1HG2 ILE 30 1HG2 ILE 30 14.334 -7.543 2.159 160 2HG2 ILE 30 2HG2 ILE 30 15.423 -8.466 3.193 161 3HG2 ILE 30 3HG2 ILE 30 15.627 -6.722 3.034 162 1HD1 ILE 30 1HD1 ILE 30 16.981 -10.130 -0.889 163 2HD1 ILE 30 2HD1 ILE 30 17.753 -9.770 0.655 164 3HD1 ILE 30 3HD1 ILE 30 16.488 -10.995 0.566 165 H ILE 31 H ILE 31 15.391 -4.522 1.624 166 HA ILE 31 HA ILE 31 17.952 -3.619 2.774 167 HB ILE 31 HB ILE 31 15.625 -1.874 1.960 168 1HG1 ILE 31 1HG1 ILE 31 18.074 -1.362 0.540 169 2HG1 ILE 31 2HG1 ILE 31 17.629 -3.055 0.356 170 1HG2 ILE 31 1HG2 ILE 31 16.772 -0.854 3.765 171 2HG2 ILE 31 2HG2 ILE 31 18.346 -1.266 3.088 172 3HG2 ILE 31 3HG2 ILE 31 17.337 -0.055 2.299 173 1HD1 ILE 31 1HD1 ILE 31 16.695 -1.793 -1.448 174 2HD1 ILE 31 2HD1 ILE 31 15.386 -2.328 -0.393 175 3HD1 ILE 31 3HD1 ILE 31 15.947 -0.657 -0.324 176 H VAL 32 H VAL 32 17.995 -2.967 4.892 177 HA VAL 32 HA VAL 32 15.485 -3.238 6.412 178 HB VAL 32 HB VAL 32 18.173 -3.992 7.536 179 1HG1 VAL 32 1HG1 VAL 32 16.908 -5.097 9.234 180 2HG1 VAL 32 2HG1 VAL 32 16.258 -3.466 9.059 181 3HG1 VAL 32 3HG1 VAL 32 15.400 -4.838 8.357 182 1HG2 VAL 32 1HG2 VAL 32 17.581 -6.342 7.105 183 2HG2 VAL 32 2HG2 VAL 32 16.175 -5.806 6.186 184 3HG2 VAL 32 3HG2 VAL 32 17.799 -5.425 5.614 185 H VAL 33 H VAL 33 14.946 -1.296 7.151 186 HA VAL 33 HA VAL 33 17.085 0.527 8.034 187 HB VAL 33 HB VAL 33 14.258 1.332 7.373 188 1HG1 VAL 33 1HG1 VAL 33 16.068 3.394 6.857 189 2HG1 VAL 33 2HG1 VAL 33 14.944 3.274 8.213 190 3HG1 VAL 33 3HG1 VAL 33 16.597 2.680 8.380 191 1HG2 VAL 33 1HG2 VAL 33 14.911 0.538 5.308 192 2HG2 VAL 33 2HG2 VAL 33 15.455 2.214 5.229 193 3HG2 VAL 33 3HG2 VAL 33 16.610 0.928 5.577 194 H ASN 34 H ASN 34 17.040 1.404 10.056 195 HA ASN 34 HA ASN 34 15.215 0.155 11.955 196 1HB ASN 34 1HB ASN 34 16.726 1.162 13.670 197 2HB ASN 34 2HB ASN 34 17.555 0.085 12.549 198 1HD2 ASN 34 1HD2 ASN 34 19.512 1.119 13.115 199 2HD2 ASN 34 2HD2 ASN 34 19.929 2.656 12.445 200 H THR 35 H THR 35 14.948 1.884 13.959 201 HA THR 35 HA THR 35 12.913 3.621 13.104 202 HB THR 35 HB THR 35 13.149 4.622 15.440 203 HG1 THR 35 HG1 THR 35 14.495 3.347 16.846 204 1HG2 THR 35 1HG2 THR 35 11.638 3.080 15.997 205 2HG2 THR 35 2HG2 THR 35 12.881 1.832 16.089 206 3HG2 THR 35 3HG2 THR 35 12.091 2.179 14.551 207 H GLU 36 H GLU 36 16.319 4.173 13.840 208 HA GLU 36 HA GLU 36 16.256 6.990 13.761 209 1HB GLU 36 1HB GLU 36 18.366 4.901 13.569 210 2HB GLU 36 2HB GLU 36 18.776 6.518 13.014 211 1HG GLU 36 1HG GLU 36 17.536 6.947 15.446 212 2HG GLU 36 2HG GLU 36 18.499 5.493 15.705 213 H GLY 37 H GLY 37 16.273 4.578 11.270 214 1HA GLY 37 1HA GLY 37 15.486 5.167 9.071 215 2HA GLY 37 2HA GLY 37 16.254 6.736 9.264 216 H ILE 38 H ILE 38 18.329 4.469 10.479 217 HA ILE 38 HA ILE 38 19.996 4.621 8.102 218 HB ILE 38 HB ILE 38 20.638 3.414 10.795 219 1HG1 ILE 38 1HG1 ILE 38 21.377 6.136 9.702 220 2HG1 ILE 38 2HG1 ILE 38 20.103 5.847 10.882 221 1HG2 ILE 38 1HG2 ILE 38 22.947 3.532 10.088 222 2HG2 ILE 38 2HG2 ILE 38 22.015 2.592 8.925 223 3HG2 ILE 38 3HG2 ILE 38 22.468 4.255 8.552 224 1HD1 ILE 38 1HD1 ILE 38 22.006 4.727 12.252 225 2HD1 ILE 38 2HD1 ILE 38 23.058 5.680 11.205 226 3HD1 ILE 38 3HD1 ILE 38 21.856 6.483 12.215 227 HA PRO 39 HA PRO 39 18.875 0.572 6.713 228 1HB PRO 39 1HB PRO 39 20.872 0.267 4.899 229 2HB PRO 39 2HB PRO 39 19.469 1.305 4.618 230 1HG PRO 39 1HG PRO 39 22.226 2.048 5.517 231 2HG PRO 39 2HG PRO 39 21.182 2.851 4.329 232 1HD PRO 39 1HD PRO 39 21.459 3.750 6.869 233 2HD PRO 39 2HD PRO 39 19.948 3.925 5.953 234 H ILE 40 H ILE 40 19.481 -0.286 8.874 235 HA ILE 40 HA ILE 40 21.987 -1.040 9.707 236 HB ILE 40 HB ILE 40 20.783 -3.042 10.789 237 1HG1 ILE 40 1HG1 ILE 40 18.348 -1.527 9.839 238 2HG1 ILE 40 2HG1 ILE 40 18.926 -3.004 9.076 239 1HG2 ILE 40 1HG2 ILE 40 19.532 -0.405 11.462 240 2HG2 ILE 40 2HG2 ILE 40 20.056 -1.697 12.541 241 3HG2 ILE 40 3HG2 ILE 40 21.252 -0.689 11.728 242 1HD1 ILE 40 1HD1 ILE 40 18.483 -3.101 11.993 243 2HD1 ILE 40 2HD1 ILE 40 17.055 -2.981 10.964 244 3HD1 ILE 40 3HD1 ILE 40 18.185 -4.319 10.753 245 H LYS 41 H LYS 41 19.888 -2.649 7.383 246 HA LYS 41 HA LYS 41 22.159 -4.346 6.611 247 1HB LYS 41 1HB LYS 41 19.716 -5.239 7.777 248 2HB LYS 41 2HB LYS 41 19.740 -5.763 6.098 249 1HG LYS 41 1HG LYS 41 21.883 -6.303 8.144 250 2HG LYS 41 2HG LYS 41 20.674 -7.456 7.574 251 1HD LYS 41 1HD LYS 41 21.634 -6.893 5.223 252 2HD LYS 41 2HD LYS 41 23.030 -6.307 6.130 253 1HE LYS 41 1HE LYS 41 21.846 -9.078 6.279 254 2HE LYS 41 2HE LYS 41 23.333 -8.630 5.445 255 1HZ LYS 41 1HZ LYS 41 24.039 -9.466 7.480 256 2HZ LYS 41 2HZ LYS 41 22.805 -8.703 8.350 257 3HZ LYS 41 3HZ LYS 41 24.082 -7.791 7.717 258 H SER 42 H SER 42 22.311 -4.839 4.422 259 HA SER 42 HA SER 42 20.294 -4.152 2.532 260 1HB SER 42 1HB SER 42 20.911 -1.881 2.885 261 2HB SER 42 2HB SER 42 22.630 -2.273 2.889 262 HG SER 42 HG SER 42 20.862 -2.427 0.673 263 H THR 43 H THR 43 20.715 -4.992 0.516 264 HA THR 43 HA THR 43 23.331 -6.301 0.162 265 HB THR 43 HB THR 43 22.334 -8.239 -0.762 266 HG1 THR 43 HG1 THR 43 20.554 -7.972 -1.864 267 1HG2 THR 43 1HG2 THR 43 20.288 -7.922 1.327 268 2HG2 THR 43 2HG2 THR 43 21.936 -7.562 1.841 269 3HG2 THR 43 3HG2 THR 43 21.551 -9.139 1.153 270 H MET 44 H MET 44 21.292 -3.991 -0.984 271 HA MET 44 HA MET 44 21.819 -4.455 -3.813 272 1HB MET 44 1HB MET 44 19.736 -3.234 -2.407 273 2HB MET 44 2HB MET 44 20.583 -1.907 -3.190 274 1HG MET 44 1HG MET 44 20.381 -3.117 -5.343 275 2HG MET 44 2HG MET 44 19.411 -4.336 -4.520 276 1HE MET 44 1HE MET 44 17.048 -4.271 -4.171 277 2HE MET 44 2HE MET 44 17.213 -3.156 -2.814 278 3HE MET 44 3HE MET 44 16.017 -2.844 -4.073 279 H ASP 45 H ASP 45 22.063 -1.895 -4.772 280 HA ASP 45 HA ASP 45 24.820 -1.398 -4.437 281 1HB ASP 45 1HB ASP 45 22.612 -0.273 -5.999 282 2HB ASP 45 2HB ASP 45 23.823 0.922 -5.543 283 H ASN 46 H ASN 46 25.812 0.614 -3.704 284 HA ASN 46 HA ASN 46 25.020 1.279 -1.076 285 1HB ASN 46 1HB ASN 46 27.301 1.640 -2.664 286 2HB ASN 46 2HB ASN 46 26.768 3.266 -2.249 287 1HD2 ASN 46 1HD2 ASN 46 25.690 2.812 0.253 288 2HD2 ASN 46 2HD2 ASN 46 26.957 2.370 1.341 289 HA PRO 47 HA PRO 47 23.701 5.543 -2.940 290 1HB PRO 47 1HB PRO 47 23.506 5.703 -5.643 291 2HB PRO 47 2HB PRO 47 24.995 6.070 -4.764 292 1HG PRO 47 1HG PRO 47 24.215 3.565 -6.206 293 2HG PRO 47 2HG PRO 47 25.771 4.416 -6.202 294 1HD PRO 47 1HD PRO 47 25.314 2.211 -4.699 295 2HD PRO 47 2HD PRO 47 26.405 3.512 -4.179 296 H THR 48 H THR 48 22.685 2.549 -4.424 297 HA THR 48 HA THR 48 20.058 3.462 -5.129 298 HB THR 48 HB THR 48 21.181 0.663 -4.904 299 HG1 THR 48 HG1 THR 48 21.923 2.234 -6.602 300 1HG2 THR 48 1HG2 THR 48 18.547 1.620 -6.033 301 2HG2 THR 48 2HG2 THR 48 18.773 0.595 -4.616 302 3HG2 THR 48 3HG2 THR 48 19.196 -0.009 -6.217 303 H THR 49 H THR 49 21.474 1.649 -2.449 304 HA THR 49 HA THR 49 19.000 1.054 -1.174 305 HB THR 49 HB THR 49 21.822 1.099 -0.093 306 HG1 THR 49 HG1 THR 49 21.595 -0.577 -1.511 307 1HG2 THR 49 1HG2 THR 49 20.248 -0.575 1.490 308 2HG2 THR 49 2HG2 THR 49 19.295 0.896 1.295 309 3HG2 THR 49 3HG2 THR 49 20.929 0.984 1.949 310 H THR 50 H THR 50 21.495 3.522 -0.604 311 HA THR 50 HA THR 50 20.387 4.754 1.619 312 HB THR 50 HB THR 50 21.736 6.344 -0.550 313 HG1 THR 50 HG1 THR 50 23.717 5.578 0.275 314 1HG2 THR 50 1HG2 THR 50 21.347 7.831 1.131 315 2HG2 THR 50 2HG2 THR 50 22.849 7.141 1.746 316 3HG2 THR 50 3HG2 THR 50 21.299 6.580 2.373 317 H GLN 51 H GLN 51 19.575 5.100 -1.779 318 HA GLN 51 HA GLN 51 17.889 7.377 -1.437 319 1HB GLN 51 1HB GLN 51 18.849 6.961 -3.602 320 2HB GLN 51 2HB GLN 51 18.131 5.357 -3.667 321 1HG GLN 51 1HG GLN 51 16.173 7.481 -3.295 322 2HG GLN 51 2HG GLN 51 17.097 7.627 -4.790 323 1HE2 GLN 51 1HE2 GLN 51 14.733 5.829 -3.051 324 2HE2 GLN 51 2HE2 GLN 51 14.298 4.749 -4.327 325 H TYR 52 H TYR 52 17.297 3.894 -1.769 326 HA TYR 52 HA TYR 52 14.485 4.040 -1.662 327 1HB TYR 52 1HB TYR 52 16.497 1.866 -1.221 328 2HB TYR 52 2HB TYR 52 14.811 1.579 -0.805 329 HD1 TYR 52 HD1 TYR 52 13.813 0.255 -2.407 330 HD2 TYR 52 HD2 TYR 52 16.479 3.324 -3.663 331 HE1 TYR 52 HE1 TYR 52 13.323 -0.289 -4.755 332 HE2 TYR 52 HE2 TYR 52 15.995 2.789 -6.015 333 HH TYR 52 HH TYR 52 14.657 0.024 -7.033 334 H ALA 53 H ALA 53 16.868 3.274 0.872 335 HA ALA 53 HA ALA 53 15.050 2.999 2.983 336 1HB ALA 53 1HB ALA 53 17.108 3.643 4.398 337 2HB ALA 53 2HB ALA 53 17.179 2.179 3.417 338 3HB ALA 53 3HB ALA 53 17.969 3.653 2.859 339 H SER 54 H SER 54 16.137 5.793 1.325 340 HA SER 54 HA SER 54 15.687 7.668 3.444 341 1HB SER 54 1HB SER 54 17.241 8.133 1.571 342 2HB SER 54 2HB SER 54 15.871 8.156 0.461 343 HG SER 54 HG SER 54 16.799 10.121 2.036 344 H LEU 55 H LEU 55 13.933 6.908 0.435 345 HA LEU 55 HA LEU 55 11.663 8.486 1.205 346 1HB LEU 55 1HB LEU 55 10.836 8.077 -0.884 347 2HB LEU 55 2HB LEU 55 12.561 7.849 -1.168 348 HG LEU 55 HG LEU 55 11.914 5.321 -0.646 349 1HD1 LEU 55 1HD1 LEU 55 9.511 5.846 -2.208 350 2HD1 LEU 55 2HD1 LEU 55 9.424 6.464 -0.559 351 3HD1 LEU 55 3HD1 LEU 55 9.765 4.757 -0.844 352 1HD2 LEU 55 1HD2 LEU 55 12.311 4.961 -2.843 353 2HD2 LEU 55 2HD2 LEU 55 12.748 6.669 -2.803 354 3HD2 LEU 55 3HD2 LEU 55 11.150 6.180 -3.368 355 H MET 56 H MET 56 12.728 5.326 1.855 356 HA MET 56 HA MET 56 10.370 3.865 2.014 357 1HB MET 56 1HB MET 56 13.066 3.541 2.827 358 2HB MET 56 2HB MET 56 12.059 3.175 4.222 359 1HG MET 56 1HG MET 56 12.527 1.172 2.953 360 2HG MET 56 2HG MET 56 10.807 1.554 2.900 361 1HE MET 56 1HE MET 56 9.810 2.643 -0.168 362 2HE MET 56 2HE MET 56 9.891 0.882 -0.208 363 3HE MET 56 3HE MET 56 9.523 1.714 1.304 364 H HIS 57 H HIS 57 12.030 5.323 4.816 365 HA HIS 57 HA HIS 57 9.946 5.063 6.622 366 1HB HIS 57 1HB HIS 57 12.468 5.967 6.816 367 2HB HIS 57 2HB HIS 57 11.615 7.508 6.851 368 HD1 HIS 57 HD1 HIS 57 13.027 6.948 9.350 369 HD2 HIS 57 HD2 HIS 57 9.230 5.415 8.643 370 HE1 HIS 57 HE1 HIS 57 12.074 6.437 11.621 371 H SER 58 H SER 58 10.585 7.629 4.294 372 HA SER 58 HA SER 58 8.654 9.461 5.199 373 1HB SER 58 1HB SER 58 10.131 10.421 3.697 374 2HB SER 58 2HB SER 58 10.105 9.026 2.618 375 HG SER 58 HG SER 58 8.735 10.166 1.512 376 H PHE 59 H PHE 59 8.393 6.535 3.377 377 HA PHE 59 HA PHE 59 5.807 7.089 2.267 378 1HB PHE 59 1HB PHE 59 7.521 5.461 1.329 379 2HB PHE 59 2HB PHE 59 7.059 4.368 2.629 380 HD1 PHE 59 HD1 PHE 59 6.453 5.274 -0.693 381 HD2 PHE 59 HD2 PHE 59 4.467 3.933 2.824 382 HE1 PHE 59 HE1 PHE 59 4.593 4.435 -2.068 383 HE2 PHE 59 HE2 PHE 59 2.604 3.091 1.455 384 HZ PHE 59 HZ PHE 59 2.666 3.340 -0.995 385 H ILE 60 H ILE 60 6.930 4.824 4.785 386 HA ILE 60 HA ILE 60 4.422 3.998 5.664 387 HB ILE 60 HB ILE 60 6.945 4.277 7.302 388 1HG1 ILE 60 1HG1 ILE 60 7.297 2.877 5.344 389 2HG1 ILE 60 2HG1 ILE 60 7.238 1.870 6.787 390 1HG2 ILE 60 1HG2 ILE 60 5.346 2.120 8.169 391 2HG2 ILE 60 2HG2 ILE 60 5.750 3.598 9.041 392 3HG2 ILE 60 3HG2 ILE 60 4.295 3.531 8.047 393 1HD1 ILE 60 1HD1 ILE 60 5.706 0.630 5.793 394 2HD1 ILE 60 2HD1 ILE 60 4.610 2.012 5.818 395 3HD1 ILE 60 3HD1 ILE 60 5.649 1.736 4.420 396 H LEU 61 H LEU 61 6.404 6.737 6.717 397 HA LEU 61 HA LEU 61 4.745 7.557 8.842 398 1HB LEU 61 1HB LEU 61 7.006 8.645 7.335 399 2HB LEU 61 2HB LEU 61 5.909 9.872 7.966 400 HG LEU 61 HG LEU 61 6.255 9.050 10.228 401 1HD1 LEU 61 1HD1 LEU 61 6.659 6.821 10.265 402 2HD1 LEU 61 2HD1 LEU 61 8.330 7.382 10.324 403 3HD1 LEU 61 3HD1 LEU 61 7.630 6.856 8.793 404 1HD2 LEU 61 1HD2 LEU 61 8.262 10.085 10.537 405 2HD2 LEU 61 2HD2 LEU 61 7.930 10.596 8.882 406 3HD2 LEU 61 3HD2 LEU 61 9.029 9.250 9.187 407 H LYS 62 H LYS 62 4.563 8.019 5.407 408 HA LYS 62 HA LYS 62 2.698 10.200 5.506 409 1HB LYS 62 1HB LYS 62 4.222 8.853 3.508 410 2HB LYS 62 2HB LYS 62 2.533 8.816 3.020 411 1HG LYS 62 1HG LYS 62 3.606 10.758 2.092 412 2HG LYS 62 2HG LYS 62 2.422 11.259 3.301 413 1HD LYS 62 1HD LYS 62 4.070 12.491 4.176 414 2HD LYS 62 2HD LYS 62 4.730 10.967 4.774 415 1HE LYS 62 1HE LYS 62 6.566 11.623 3.644 416 2HE LYS 62 2HE LYS 62 5.702 10.961 2.258 417 1HZ LYS 62 1HZ LYS 62 6.622 13.523 2.528 418 2HZ LYS 62 2HZ LYS 62 4.955 13.662 2.780 419 3HZ LYS 62 3HZ LYS 62 5.540 12.966 1.353 420 H ALA 63 H ALA 63 2.427 6.755 4.630 421 HA ALA 63 HA ALA 63 -0.389 6.776 4.369 422 1HB ALA 63 1HB ALA 63 1.012 5.062 3.339 423 2HB ALA 63 2HB ALA 63 1.447 4.451 4.935 424 3HB ALA 63 3HB ALA 63 -0.222 4.342 4.373 425 H ARG 64 H ARG 64 1.708 5.587 6.998 426 HA ARG 64 HA ARG 64 -0.275 4.778 8.758 427 1HB ARG 64 1HB ARG 64 2.265 4.492 8.940 428 2HB ARG 64 2HB ARG 64 2.277 6.096 9.662 429 1HG ARG 64 1HG ARG 64 0.297 4.623 11.013 430 2HG ARG 64 2HG ARG 64 1.712 3.576 10.875 431 1HD ARG 64 1HD ARG 64 1.782 6.411 11.899 432 2HD ARG 64 2HD ARG 64 1.680 4.984 12.930 433 HE ARG 64 HE ARG 64 4.011 5.999 11.621 434 1HH1 ARG 64 1HH1 ARG 64 2.472 3.115 12.817 435 2HH1 ARG 64 2HH1 ARG 64 3.961 2.260 13.050 436 1HH2 ARG 64 1HH2 ARG 64 5.978 4.884 11.922 437 2HH2 ARG 64 2HH2 ARG 64 5.955 3.268 12.541 438 H SER 65 H SER 65 0.883 7.982 8.015 439 HA SER 65 HA SER 65 -0.315 9.265 10.272 440 1HB SER 65 1HB SER 65 1.519 10.403 9.274 441 2HB SER 65 2HB SER 65 0.807 10.294 7.665 442 HG SER 65 HG SER 65 0.079 12.214 8.120 443 H THR 66 H THR 66 -1.315 8.515 7.001 444 HA THR 66 HA THR 66 -3.712 10.114 7.149 445 HB THR 66 HB THR 66 -3.445 7.979 5.094 446 HG1 THR 66 HG1 THR 66 -2.003 10.358 4.693 447 1HG2 THR 66 1HG2 THR 66 -5.330 9.515 5.026 448 2HG2 THR 66 2HG2 THR 66 -4.274 9.791 3.640 449 3HG2 THR 66 3HG2 THR 66 -4.231 10.894 5.016 450 H VAL 67 H VAL 67 -2.803 6.768 7.636 451 HA VAL 67 HA VAL 67 -5.252 5.494 7.518 452 HB VAL 67 HB VAL 67 -3.013 4.948 9.472 453 1HG1 VAL 67 1HG1 VAL 67 -5.302 3.205 8.566 454 2HG1 VAL 67 2HG1 VAL 67 -3.939 2.665 9.549 455 3HG1 VAL 67 3HG1 VAL 67 -5.062 3.870 10.181 456 1HG2 VAL 67 1HG2 VAL 67 -2.984 4.811 6.705 457 2HG2 VAL 67 2HG2 VAL 67 -1.860 4.016 7.806 458 3HG2 VAL 67 3HG2 VAL 67 -3.277 3.149 7.215 459 H ARG 68 H ARG 68 -3.856 7.380 10.155 460 HA ARG 68 HA ARG 68 -5.669 6.783 12.173 461 1HB ARG 68 1HB ARG 68 -4.383 9.471 11.660 462 2HB ARG 68 2HB ARG 68 -5.015 8.888 13.194 463 1HG ARG 68 1HG ARG 68 -2.694 7.682 11.701 464 2HG ARG 68 2HG ARG 68 -2.569 8.778 13.079 465 1HD ARG 68 1HD ARG 68 -4.138 6.991 14.211 466 2HD ARG 68 2HD ARG 68 -3.449 5.934 12.979 467 HE ARG 68 HE ARG 68 -1.528 5.880 14.199 468 1HH1 ARG 68 1HH1 ARG 68 -3.313 8.736 15.081 469 2HH1 ARG 68 2HH1 ARG 68 -2.208 9.198 16.334 470 1HH2 ARG 68 1HH2 ARG 68 -0.066 6.477 15.845 471 2HH2 ARG 68 2HH2 ARG 68 -0.361 7.913 16.766 472 H ASP 69 H ASP 69 -6.059 8.722 9.331 473 HA ASP 69 HA ASP 69 -8.417 10.088 10.273 474 1HB ASP 69 1HB ASP 69 -6.616 10.351 8.079 475 2HB ASP 69 2HB ASP 69 -8.242 10.161 7.428 476 H ILE 70 H ILE 70 -7.669 7.215 8.432 477 HA ILE 70 HA ILE 70 -10.214 6.766 7.309 478 HB ILE 70 HB ILE 70 -8.186 4.674 8.100 479 1HG1 ILE 70 1HG1 ILE 70 -8.473 6.112 5.455 480 2HG1 ILE 70 2HG1 ILE 70 -7.257 6.504 6.665 481 1HG2 ILE 70 1HG2 ILE 70 -9.221 3.294 6.422 482 2HG2 ILE 70 2HG2 ILE 70 -10.456 3.849 7.550 483 3HG2 ILE 70 3HG2 ILE 70 -10.310 4.603 5.963 484 1HD1 ILE 70 1HD1 ILE 70 -5.950 5.074 5.581 485 2HD1 ILE 70 2HD1 ILE 70 -6.932 3.800 6.305 486 3HD1 ILE 70 3HD1 ILE 70 -7.304 4.387 4.685 487 H ASP 71 H ASP 71 -8.898 6.164 10.476 488 HA ASP 71 HA ASP 71 -11.486 5.695 11.574 489 1HB ASP 71 1HB ASP 71 -9.750 3.381 10.935 490 2HB ASP 71 2HB ASP 71 -10.485 3.377 12.535 491 HA PRO 72 HA PRO 72 -9.523 7.091 15.238 492 1HB PRO 72 1HB PRO 72 -10.893 5.776 17.178 493 2HB PRO 72 2HB PRO 72 -11.593 7.096 16.234 494 1HG PRO 72 1HG PRO 72 -11.914 4.140 15.884 495 2HG PRO 72 2HG PRO 72 -13.141 5.417 15.793 496 1HD PRO 72 1HD PRO 72 -12.032 4.302 13.588 497 2HD PRO 72 2HD PRO 72 -12.559 5.996 13.639 498 H GLN 73 H GLN 73 -10.111 3.574 15.401 499 HA GLN 73 HA GLN 73 -7.430 3.276 16.586 500 1HB GLN 73 1HB GLN 73 -9.809 1.451 16.963 501 2HB GLN 73 2HB GLN 73 -8.237 1.290 17.735 502 1HG GLN 73 1HG GLN 73 -8.644 3.532 18.792 503 2HG GLN 73 2HG GLN 73 -10.295 3.430 18.184 504 1HE2 GLN 73 1HE2 GLN 73 -11.623 2.910 19.756 505 2HE2 GLN 73 2HE2 GLN 73 -11.336 1.735 20.990 506 H ASN 74 H ASN 74 -5.996 2.072 15.515 507 HA ASN 74 HA ASN 74 -6.653 -0.183 13.937 508 1HB ASN 74 1HB ASN 74 -7.262 2.041 12.561 509 2HB ASN 74 2HB ASN 74 -5.552 1.927 12.157 510 1HD2 ASN 74 1HD2 ASN 74 -7.478 1.711 10.228 511 2HD2 ASN 74 2HD2 ASN 74 -7.517 0.092 9.625 512 H ASP 75 H ASP 75 -4.591 -0.511 12.305 513 HA ASP 75 HA ASP 75 -2.095 0.432 13.276 514 1HB ASP 75 1HB ASP 75 -3.174 -1.541 14.874 515 2HB ASP 75 2HB ASP 75 -2.119 -2.448 13.794 516 H LEU 76 H LEU 76 -0.650 0.244 11.684 517 HA LEU 76 HA LEU 76 -1.360 -1.047 9.245 518 1HB LEU 76 1HB LEU 76 0.492 0.899 10.089 519 2HB LEU 76 2HB LEU 76 1.430 -0.405 9.366 520 HG LEU 76 HG LEU 76 1.013 1.199 7.665 521 1HD1 LEU 76 1HD1 LEU 76 0.281 -0.207 6.043 522 2HD1 LEU 76 2HD1 LEU 76 -1.131 -0.721 6.966 523 3HD1 LEU 76 3HD1 LEU 76 0.459 -1.384 7.345 524 1HD2 LEU 76 1HD2 LEU 76 -1.939 0.978 8.216 525 2HD2 LEU 76 2HD2 LEU 76 -1.122 2.089 7.116 526 3HD2 LEU 76 3HD2 LEU 76 -0.920 2.266 8.860 527 H THR 77 H THR 77 -0.852 -3.012 8.502 528 HA THR 77 HA THR 77 1.033 -4.635 10.086 529 HB THR 77 HB THR 77 -0.244 -6.592 9.631 530 HG1 THR 77 HG1 THR 77 -1.213 -6.633 7.752 531 1HG2 THR 77 1HG2 THR 77 -2.477 -4.676 10.119 532 2HG2 THR 77 2HG2 THR 77 -1.147 -4.742 11.277 533 3HG2 THR 77 3HG2 THR 77 -2.093 -6.191 10.936 534 H PHE 78 H PHE 78 0.113 -3.505 6.952 535 HA PHE 78 HA PHE 78 2.580 -4.475 5.826 536 1HB PHE 78 1HB PHE 78 0.161 -5.976 5.447 537 2HB PHE 78 2HB PHE 78 0.675 -5.299 3.906 538 HD1 PHE 78 HD1 PHE 78 3.470 -5.428 3.806 539 HD2 PHE 78 HD2 PHE 78 0.795 -8.160 5.677 540 HE1 PHE 78 HE1 PHE 78 5.142 -7.218 3.576 541 HE2 PHE 78 HE2 PHE 78 2.464 -9.954 5.450 542 HZ PHE 78 HZ PHE 78 4.641 -9.484 4.400 543 H LEU 79 H LEU 79 3.079 -3.513 3.792 544 HA LEU 79 HA LEU 79 1.262 -1.629 2.599 545 1HB LEU 79 1HB LEU 79 2.317 -0.509 4.655 546 2HB LEU 79 2HB LEU 79 3.805 -0.491 3.712 547 HG LEU 79 HG LEU 79 2.701 0.892 2.012 548 1HD1 LEU 79 1HD1 LEU 79 0.357 0.794 3.904 549 2HD1 LEU 79 2HD1 LEU 79 0.422 0.155 2.262 550 3HD1 LEU 79 3HD1 LEU 79 0.504 1.895 2.534 551 1HD2 LEU 79 1HD2 LEU 79 2.303 2.912 3.553 552 2HD2 LEU 79 2HD2 LEU 79 3.899 2.160 3.553 553 3HD2 LEU 79 3HD2 LEU 79 2.763 1.821 4.861 554 H ARG 80 H ARG 80 1.576 -2.470 0.607 555 HA ARG 80 HA ARG 80 4.305 -2.309 -0.484 556 1HB ARG 80 1HB ARG 80 2.302 -4.385 -1.354 557 2HB ARG 80 2HB ARG 80 4.027 -4.327 -1.695 558 1HG ARG 80 1HG ARG 80 4.325 -5.705 0.011 559 2HG ARG 80 2HG ARG 80 3.848 -4.386 1.082 560 1HD ARG 80 1HD ARG 80 1.751 -5.214 1.395 561 2HD ARG 80 2HD ARG 80 1.679 -5.933 -0.213 562 HE ARG 80 HE ARG 80 3.537 -7.213 1.581 563 1HH1 ARG 80 1HH1 ARG 80 0.257 -7.100 0.419 564 2HH1 ARG 80 2HH1 ARG 80 -0.097 -8.736 0.868 565 1HH2 ARG 80 1HH2 ARG 80 3.084 -9.368 2.177 566 2HH2 ARG 80 2HH2 ARG 80 1.512 -10.024 1.869 567 H ILE 81 H ILE 81 4.338 -2.142 -2.883 568 HA ILE 81 HA ILE 81 1.921 -1.082 -4.106 569 HB ILE 81 HB ILE 81 3.316 0.904 -4.975 570 1HG1 ILE 81 1HG1 ILE 81 4.852 0.232 -2.455 571 2HG1 ILE 81 2HG1 ILE 81 5.478 0.129 -4.097 572 1HG2 ILE 81 1HG2 ILE 81 2.714 1.208 -2.075 573 2HG2 ILE 81 2HG2 ILE 81 2.313 2.264 -3.428 574 3HG2 ILE 81 3HG2 ILE 81 1.408 0.772 -3.177 575 1HD1 ILE 81 1HD1 ILE 81 6.088 2.248 -4.021 576 2HD1 ILE 81 2HD1 ILE 81 4.435 2.745 -3.658 577 3HD1 ILE 81 3HD1 ILE 81 5.538 2.324 -2.348 578 H ARG 82 H ARG 82 2.023 -2.822 -5.527 579 HA ARG 82 HA ARG 82 4.311 -3.615 -6.955 580 1HB ARG 82 1HB ARG 82 1.390 -4.089 -7.173 581 2HB ARG 82 2HB ARG 82 2.349 -4.402 -8.612 582 1HG ARG 82 1HG ARG 82 2.161 -6.445 -7.430 583 2HG ARG 82 2HG ARG 82 3.814 -5.868 -7.210 584 1HD ARG 82 1HD ARG 82 3.514 -5.434 -4.993 585 2HD ARG 82 2HD ARG 82 1.804 -5.055 -5.189 586 HE ARG 82 HE ARG 82 2.021 -7.749 -5.686 587 1HH1 ARG 82 1HH1 ARG 82 2.753 -5.611 -3.037 588 2HH1 ARG 82 2HH1 ARG 82 2.481 -6.814 -1.820 589 1HH2 ARG 82 1HH2 ARG 82 1.660 -9.341 -4.093 590 2HH2 ARG 82 2HH2 ARG 82 1.860 -8.936 -2.422 591 H SER 83 H SER 83 5.350 -2.704 -8.598 592 HA SER 83 HA SER 83 3.935 -0.668 -10.193 593 1HB SER 83 1HB SER 83 6.813 -0.354 -10.240 594 2HB SER 83 2HB SER 83 5.571 0.814 -9.790 595 HG SER 83 HG SER 83 7.073 -0.900 -8.193 596 H LYS 84 H LYS 84 5.745 -0.234 -12.167 597 HA LYS 84 HA LYS 84 5.457 -2.625 -13.754 598 1HB LYS 84 1HB LYS 84 6.316 0.193 -14.279 599 2HB LYS 84 2HB LYS 84 6.716 -1.057 -15.451 600 1HG LYS 84 1HG LYS 84 3.998 -1.397 -14.817 601 2HG LYS 84 2HG LYS 84 4.252 0.332 -15.061 602 1HD LYS 84 1HD LYS 84 3.913 -0.245 -17.228 603 2HD LYS 84 2HD LYS 84 5.639 -0.605 -17.150 604 1HE LYS 84 1HE LYS 84 5.139 -2.947 -16.693 605 2HE LYS 84 2HE LYS 84 3.412 -2.595 -16.720 606 1HZ LYS 84 1HZ LYS 84 4.977 -3.329 -18.856 607 2HZ LYS 84 2HZ LYS 84 4.683 -1.680 -19.092 608 3HZ LYS 84 3HZ LYS 84 3.387 -2.755 -18.919 609 H LYS 85 H LYS 85 7.947 -1.082 -11.935 610 HA LYS 85 HA LYS 85 10.131 -2.400 -13.275 611 1HB LYS 85 1HB LYS 85 9.898 -0.699 -10.806 612 2HB LYS 85 2HB LYS 85 11.395 -1.538 -11.191 613 1HG LYS 85 1HG LYS 85 10.101 0.200 -13.243 614 2HG LYS 85 2HG LYS 85 11.050 0.923 -11.943 615 1HD LYS 85 1HD LYS 85 12.708 0.629 -13.480 616 2HD LYS 85 2HD LYS 85 12.784 -0.946 -12.686 617 1HE LYS 85 1HE LYS 85 11.819 -2.036 -14.456 618 2HE LYS 85 2HE LYS 85 10.930 -0.610 -14.989 619 1HZ LYS 85 1HZ LYS 85 12.755 0.225 -16.089 620 2HZ LYS 85 2HZ LYS 85 12.938 -1.435 -16.357 621 3HZ LYS 85 3HZ LYS 85 13.868 -0.662 -15.174 622 H ASN 86 H ASN 86 8.706 -2.641 -10.013 623 HA ASN 86 HA ASN 86 8.652 -5.433 -9.940 624 1HB ASN 86 1HB ASN 86 10.563 -5.599 -8.144 625 2HB ASN 86 2HB ASN 86 10.951 -5.682 -9.860 626 1HD2 ASN 86 1HD2 ASN 86 10.792 -3.511 -7.094 627 2HD2 ASN 86 2HD2 ASN 86 12.023 -2.429 -7.642 628 H GLU 87 H GLU 87 8.243 -6.280 -7.721 629 HA GLU 87 HA GLU 87 6.595 -4.386 -6.278 630 1HB GLU 87 1HB GLU 87 5.701 -6.260 -5.123 631 2HB GLU 87 2HB GLU 87 5.900 -6.758 -6.797 632 1HG GLU 87 1HG GLU 87 6.935 -8.548 -5.998 633 2HG GLU 87 2HG GLU 87 8.290 -7.477 -5.644 634 H ILE 88 H ILE 88 6.891 -3.689 -4.193 635 HA ILE 88 HA ILE 88 9.405 -4.459 -2.870 636 HB ILE 88 HB ILE 88 8.308 -1.648 -3.016 637 1HG1 ILE 88 1HG1 ILE 88 10.789 -1.539 -4.118 638 2HG1 ILE 88 2HG1 ILE 88 10.276 -3.139 -4.641 639 1HG2 ILE 88 1HG2 ILE 88 10.683 -1.219 -2.045 640 2HG2 ILE 88 2HG2 ILE 88 9.381 -1.736 -0.975 641 3HG2 ILE 88 3HG2 ILE 88 10.578 -2.903 -1.535 642 1HD1 ILE 88 1HD1 ILE 88 9.240 -0.470 -5.391 643 2HD1 ILE 88 2HD1 ILE 88 9.505 -1.907 -6.379 644 3HD1 ILE 88 3HD1 ILE 88 8.096 -1.810 -5.323 645 H MET 89 H MET 89 8.567 -5.687 -1.260 646 HA MET 89 HA MET 89 6.186 -5.001 0.157 647 1HB MET 89 1HB MET 89 8.345 -7.054 0.580 648 2HB MET 89 2HB MET 89 7.051 -6.831 1.749 649 1HG MET 89 1HG MET 89 5.673 -7.035 -0.599 650 2HG MET 89 2HG MET 89 7.025 -8.133 -0.860 651 1HE MET 89 1HE MET 89 7.785 -9.751 1.273 652 2HE MET 89 2HE MET 89 7.276 -8.664 2.565 653 3HE MET 89 3HE MET 89 6.640 -10.308 2.494 654 H VAL 90 H VAL 90 5.927 -3.808 1.945 655 HA VAL 90 HA VAL 90 8.210 -3.211 3.656 656 HB VAL 90 HB VAL 90 6.542 -1.002 2.445 657 1HG1 VAL 90 1HG1 VAL 90 8.784 -1.033 4.445 658 2HG1 VAL 90 2HG1 VAL 90 8.356 0.414 3.529 659 3HG1 VAL 90 3HG1 VAL 90 7.176 -0.329 4.609 660 1HG2 VAL 90 1HG2 VAL 90 7.950 -1.663 0.710 661 2HG2 VAL 90 2HG2 VAL 90 8.842 -0.355 1.488 662 3HG2 VAL 90 3HG2 VAL 90 9.283 -2.033 1.804 663 H ALA 91 H ALA 91 7.435 -3.932 5.539 664 HA ALA 91 HA ALA 91 4.835 -2.890 6.441 665 1HB ALA 91 1HB ALA 91 4.058 -4.918 7.106 666 2HB ALA 91 2HB ALA 91 5.070 -5.449 5.762 667 3HB ALA 91 3HB ALA 91 5.672 -5.560 7.416 668 HA PRO 92 HA PRO 92 6.912 -1.557 10.074 669 1HB PRO 92 1HB PRO 92 4.923 -1.762 11.910 670 2HB PRO 92 2HB PRO 92 4.953 -0.511 10.661 671 1HG PRO 92 1HG PRO 92 3.439 -3.094 10.721 672 2HG PRO 92 2HG PRO 92 2.890 -1.487 10.210 673 1HD PRO 92 1HD PRO 92 3.634 -3.402 8.446 674 2HD PRO 92 2HD PRO 92 3.878 -1.671 8.136 675 H ASP 93 H ASP 93 8.266 -2.483 11.483 676 HA ASP 93 HA ASP 93 7.653 -5.214 12.407 677 1HB ASP 93 1HB ASP 93 9.834 -4.373 10.938 678 2HB ASP 93 2HB ASP 93 10.456 -4.392 12.586 679 H LYS 94 H LYS 94 9.538 -5.508 14.354 680 HA LYS 94 HA LYS 94 8.360 -4.462 16.613 681 1HB LYS 94 1HB LYS 94 10.697 -5.995 16.002 682 2HB LYS 94 2HB LYS 94 11.122 -4.775 17.195 683 1HG LYS 94 1HG LYS 94 8.859 -6.745 17.451 684 2HG LYS 94 2HG LYS 94 10.440 -6.888 18.225 685 1HD LYS 94 1HD LYS 94 9.995 -4.687 19.337 686 2HD LYS 94 2HD LYS 94 8.353 -4.762 18.694 687 1HE LYS 94 1HE LYS 94 7.743 -6.008 20.426 688 2HE LYS 94 2HE LYS 94 8.895 -7.248 19.932 689 1HZ LYS 94 1HZ LYS 94 9.045 -5.383 22.103 690 2HZ LYS 94 2HZ LYS 94 10.444 -5.380 21.154 691 3HZ LYS 94 3HZ LYS 94 9.902 -6.820 21.855 692 H ASP 95 H ASP 95 11.309 -3.270 15.007 693 HA ASP 95 HA ASP 95 10.656 -0.561 15.805 694 1HB ASP 95 1HB ASP 95 12.848 -0.162 16.868 695 2HB ASP 95 2HB ASP 95 11.894 -1.349 17.754 696 H TYR 96 H TYR 96 11.213 -2.364 13.391 697 HA TYR 96 HA TYR 96 12.819 -0.387 11.964 698 1HB TYR 96 1HB TYR 96 14.062 -2.257 10.806 699 2HB TYR 96 2HB TYR 96 14.498 -1.997 12.491 700 HD1 TYR 96 HD1 TYR 96 13.655 -3.573 14.235 701 HD2 TYR 96 HD2 TYR 96 13.146 -4.324 10.078 702 HE1 TYR 96 HE1 TYR 96 13.197 -5.939 14.725 703 HE2 TYR 96 HE2 TYR 96 12.685 -6.692 10.557 704 HH TYR 96 HH TYR 96 13.349 -8.134 13.505 705 H PHE 97 H PHE 97 12.839 -1.038 9.520 706 HA PHE 97 HA PHE 97 10.150 -2.008 8.808 707 1HB PHE 97 1HB PHE 97 11.685 0.364 7.774 708 2HB PHE 97 2HB PHE 97 10.418 -0.390 6.811 709 HD1 PHE 97 HD1 PHE 97 8.137 -0.738 8.082 710 HD2 PHE 97 HD2 PHE 97 11.121 2.096 9.169 711 HE1 PHE 97 HE1 PHE 97 6.440 0.585 9.277 712 HE2 PHE 97 HE2 PHE 97 9.430 3.423 10.366 713 HZ PHE 97 HZ PHE 97 7.086 2.667 10.422 714 H LEU 98 H LEU 98 10.314 -3.878 7.775 715 HA LEU 98 HA LEU 98 12.731 -4.677 6.444 716 1HB LEU 98 1HB LEU 98 10.825 -6.056 7.708 717 2HB LEU 98 2HB LEU 98 10.221 -6.202 6.059 718 HG LEU 98 HG LEU 98 13.022 -6.842 6.144 719 1HD1 LEU 98 1HD1 LEU 98 11.291 -8.550 7.920 720 2HD1 LEU 98 2HD1 LEU 98 12.480 -7.391 8.512 721 3HD1 LEU 98 3HD1 LEU 98 13.001 -8.774 7.550 722 1HD2 LEU 98 1HD2 LEU 98 11.148 -7.467 4.500 723 2HD2 LEU 98 2HD2 LEU 98 10.756 -8.743 5.653 724 3HD2 LEU 98 3HD2 LEU 98 12.350 -8.694 4.899 725 H ILE 99 H ILE 99 13.212 -4.541 4.343 726 HA ILE 99 HA ILE 99 11.058 -3.790 2.475 727 HB ILE 99 HB ILE 99 13.934 -2.919 2.220 728 1HG1 ILE 99 1HG1 ILE 99 12.940 -1.924 4.238 729 2HG1 ILE 99 2HG1 ILE 99 13.201 -0.709 2.991 730 1HG2 ILE 99 1HG2 ILE 99 12.529 -3.064 0.161 731 2HG2 ILE 99 2HG2 ILE 99 11.459 -1.857 0.872 732 3HG2 ILE 99 3HG2 ILE 99 13.136 -1.446 0.515 733 1HD1 ILE 99 1HD1 ILE 99 10.900 -0.600 2.487 734 2HD1 ILE 99 2HD1 ILE 99 10.553 -2.051 3.428 735 3HD1 ILE 99 3HD1 ILE 99 11.031 -0.563 4.245 736 H VAL 100 H VAL 100 10.661 -5.493 1.223 737 HA VAL 100 HA VAL 100 12.951 -7.051 0.211 738 HB VAL 100 HB VAL 100 10.106 -8.000 0.577 739 1HG1 VAL 100 1HG1 VAL 100 10.914 -9.279 -1.168 740 2HG1 VAL 100 2HG1 VAL 100 12.570 -9.251 -0.560 741 3HG1 VAL 100 3HG1 VAL 100 11.356 -10.255 0.232 742 1HG2 VAL 100 1HG2 VAL 100 12.341 -7.862 2.403 743 2HG2 VAL 100 2HG2 VAL 100 10.664 -8.311 2.711 744 3HG2 VAL 100 3HG2 VAL 100 11.814 -9.527 2.156 745 H ILE 101 H ILE 101 13.380 -6.539 -1.828 746 HA ILE 101 HA ILE 101 11.157 -5.807 -3.609 747 HB ILE 101 HB ILE 101 14.111 -5.259 -3.914 748 1HG1 ILE 101 1HG1 ILE 101 12.530 -2.899 -3.856 749 2HG1 ILE 101 2HG1 ILE 101 12.040 -3.893 -2.488 750 1HG2 ILE 101 1HG2 ILE 101 13.038 -3.660 -5.723 751 2HG2 ILE 101 2HG2 ILE 101 13.456 -5.331 -6.099 752 3HG2 ILE 101 3HG2 ILE 101 11.786 -4.902 -5.729 753 1HD1 ILE 101 1HD1 ILE 101 13.806 -3.179 -1.375 754 2HD1 ILE 101 2HD1 ILE 101 14.857 -3.928 -2.577 755 3HD1 ILE 101 3HD1 ILE 101 14.341 -2.254 -2.778 756 H GLN 102 H GLN 102 10.754 -6.929 -5.445 757 HA GLN 102 HA GLN 102 12.606 -8.690 -6.678 758 1HB GLN 102 1HB GLN 102 11.527 -10.816 -6.195 759 2HB GLN 102 2HB GLN 102 12.073 -10.061 -4.704 760 1HG GLN 102 1HG GLN 102 9.791 -9.283 -4.272 761 2HG GLN 102 2HG GLN 102 9.252 -10.076 -5.752 762 1HE2 GLN 102 1HE2 GLN 102 8.983 -10.400 -2.643 763 2HE2 GLN 102 2HE2 GLN 102 9.073 -12.114 -2.448 764 H ASN 103 H ASN 103 11.407 -10.133 -8.336 765 HA ASN 103 HA ASN 103 10.033 -8.534 -10.114 766 1HB ASN 103 1HB ASN 103 10.452 -11.454 -9.816 767 2HB ASN 103 2HB ASN 103 9.133 -10.959 -10.873 768 1HD2 ASN 103 1HD2 ASN 103 12.381 -11.599 -10.692 769 2HD2 ASN 103 2HD2 ASN 103 12.892 -10.840 -12.158 770 HA PRO 104 HA PRO 104 5.835 -8.297 -8.862 771 1HB PRO 104 1HB PRO 104 4.503 -8.551 -11.214 772 2HB PRO 104 2HB PRO 104 5.426 -7.106 -10.784 773 1HG PRO 104 1HG PRO 104 6.212 -9.404 -12.533 774 2HG PRO 104 2HG PRO 104 6.463 -7.667 -12.788 775 1HD PRO 104 1HD PRO 104 8.420 -9.304 -11.880 776 2HD PRO 104 2HD PRO 104 8.299 -7.600 -11.396 777 H THR 105 H THR 105 4.036 -9.516 -8.326 778 HA THR 105 HA THR 105 4.195 -12.373 -9.024 779 HB THR 105 HB THR 105 2.861 -12.743 -6.923 780 HG1 THR 105 HG1 THR 105 2.114 -11.007 -5.988 781 1HG2 THR 105 1HG2 THR 105 5.399 -12.912 -7.138 782 2HG2 THR 105 2HG2 THR 105 4.748 -12.727 -5.509 783 3HG2 THR 105 3HG2 THR 105 5.458 -11.342 -6.339 784 H GLU 106 H GLU 106 2.063 -9.598 -8.717 785 HA GLU 106 HA GLU 106 -0.401 -10.832 -9.105 786 1HB GLU 106 1HB GLU 106 0.013 -8.417 -8.511 787 2HB GLU 106 2HB GLU 106 0.383 -8.132 -10.206 788 1HG GLU 106 1HG GLU 106 -1.904 -9.011 -10.748 789 2HG GLU 106 2HG GLU 106 -2.239 -8.991 -9.017 790 H MET 11 H MET 11 -18.609 4.430 -15.239 791 HA MET 11 HA MET 11 -18.889 3.824 -12.636 792 1HB MET 11 1HB MET 11 -20.656 5.091 -14.624 793 2HB MET 11 2HB MET 11 -21.470 4.511 -13.177 794 1HG MET 11 1HG MET 11 -19.299 5.798 -12.136 795 2HG MET 11 2HG MET 11 -19.682 6.784 -13.545 796 1HE MET 11 1HE MET 11 -21.167 6.211 -9.642 797 2HE MET 11 2HE MET 11 -22.615 5.507 -10.363 798 3HE MET 11 3HE MET 11 -21.028 4.830 -10.731 799 H ALA 12 H ALA 12 -20.916 2.423 -15.207 800 HA ALA 12 HA ALA 12 -22.538 0.802 -13.673 801 1HB ALA 12 1HB ALA 12 -23.312 0.255 -15.677 802 2HB ALA 12 2HB ALA 12 -21.950 1.101 -16.413 803 3HB ALA 12 3HB ALA 12 -21.824 -0.619 -16.045 804 H GLU 13 H GLU 13 -19.263 0.173 -14.845 805 HA GLU 13 HA GLU 13 -19.010 -2.504 -14.201 806 1HB GLU 13 1HB GLU 13 -17.142 -0.227 -14.491 807 2HB GLU 13 2HB GLU 13 -16.531 -1.614 -13.600 808 1HG GLU 13 1HG GLU 13 -16.142 -2.695 -15.484 809 2HG GLU 13 2HG GLU 13 -17.832 -2.539 -15.958 810 H VAL 14 H VAL 14 -18.276 0.297 -12.126 811 HA VAL 14 HA VAL 14 -17.595 -1.198 -9.838 812 HB VAL 14 HB VAL 14 -18.762 1.586 -9.848 813 1HG1 VAL 14 1HG1 VAL 14 -18.499 1.384 -7.646 814 2HG1 VAL 14 2HG1 VAL 14 -17.637 -0.146 -7.819 815 3HG1 VAL 14 3HG1 VAL 14 -16.761 1.381 -7.938 816 1HG2 VAL 14 1HG2 VAL 14 -16.158 2.078 -9.762 817 2HG2 VAL 14 2HG2 VAL 14 -16.096 0.574 -10.681 818 3HG2 VAL 14 3HG2 VAL 14 -17.029 1.941 -11.290 819 H GLU 15 H GLU 15 -20.663 0.085 -11.005 820 HA GLU 15 HA GLU 15 -22.183 -0.397 -8.686 821 1HB GLU 15 1HB GLU 15 -22.917 -0.162 -11.598 822 2HB GLU 15 2HB GLU 15 -24.127 -0.458 -10.358 823 1HG GLU 15 1HG GLU 15 -23.594 1.616 -9.267 824 2HG GLU 15 2HG GLU 15 -22.254 1.896 -10.378 825 H GLU 16 H GLU 16 -21.410 -2.423 -11.471 826 HA GLU 16 HA GLU 16 -23.138 -4.560 -10.847 827 1HB GLU 16 1HB GLU 16 -21.493 -3.967 -12.937 828 2HB GLU 16 2HB GLU 16 -20.594 -5.260 -12.156 829 1HG GLU 16 1HG GLU 16 -23.425 -5.390 -13.164 830 2HG GLU 16 2HG GLU 16 -22.012 -6.174 -13.867 831 H THR 17 H THR 17 -19.850 -3.794 -9.861 832 HA THR 17 HA THR 17 -19.457 -6.300 -8.500 833 HB THR 17 HB THR 17 -17.847 -3.741 -8.408 834 HG1 THR 17 HG1 THR 17 -17.378 -4.518 -10.344 835 1HG2 THR 17 1HG2 THR 17 -17.218 -4.803 -6.446 836 2HG2 THR 17 2HG2 THR 17 -16.066 -5.468 -7.604 837 3HG2 THR 17 3HG2 THR 17 -17.471 -6.414 -7.115 838 H LEU 18 H LEU 18 -20.725 -3.179 -7.713 839 HA LEU 18 HA LEU 18 -20.398 -3.367 -4.884 840 1HB LEU 18 1HB LEU 18 -21.493 -1.497 -6.787 841 2HB LEU 18 2HB LEU 18 -22.567 -1.684 -5.402 842 HG LEU 18 HG LEU 18 -20.216 -1.329 -4.130 843 1HD1 LEU 18 1HD1 LEU 18 -19.157 0.641 -5.339 844 2HD1 LEU 18 2HD1 LEU 18 -20.003 0.073 -6.777 845 3HD1 LEU 18 3HD1 LEU 18 -18.821 -0.966 -5.982 846 1HD2 LEU 18 1HD2 LEU 18 -22.181 -0.098 -3.589 847 2HD2 LEU 18 2HD2 LEU 18 -22.159 0.739 -5.142 848 3HD2 LEU 18 3HD2 LEU 18 -20.909 1.073 -3.941 849 H LYS 19 H LYS 19 -23.081 -3.997 -7.114 850 HA LYS 19 HA LYS 19 -25.059 -4.596 -5.255 851 1HB LYS 19 1HB LYS 19 -24.583 -5.707 -8.023 852 2HB LYS 19 2HB LYS 19 -26.042 -6.016 -7.091 853 1HG LYS 19 1HG LYS 19 -25.373 -3.185 -7.301 854 2HG LYS 19 2HG LYS 19 -25.684 -3.962 -8.855 855 1HD LYS 19 1HD LYS 19 -27.621 -4.784 -6.878 856 2HD LYS 19 2HD LYS 19 -27.575 -3.025 -7.027 857 1HE LYS 19 1HE LYS 19 -28.034 -3.126 -9.353 858 2HE LYS 19 2HE LYS 19 -27.762 -4.868 -9.400 859 1HZ LYS 19 1HZ LYS 19 -30.163 -3.935 -9.343 860 2HZ LYS 19 2HZ LYS 19 -29.886 -3.781 -7.682 861 3HZ LYS 19 3HZ LYS 19 -29.777 -5.299 -8.419 862 H ARG 20 H ARG 20 -22.777 -6.818 -6.849 863 HA ARG 20 HA ARG 20 -23.632 -9.134 -5.493 864 1HB ARG 20 1HB ARG 20 -22.177 -8.952 -7.597 865 2HB ARG 20 2HB ARG 20 -20.828 -8.692 -6.498 866 1HG ARG 20 1HG ARG 20 -20.598 -10.903 -6.506 867 2HG ARG 20 2HG ARG 20 -22.026 -10.938 -5.470 868 1HD ARG 20 1HD ARG 20 -23.273 -10.834 -7.798 869 2HD ARG 20 2HD ARG 20 -21.760 -11.533 -8.372 870 HE ARG 20 HE ARG 20 -22.472 -13.053 -6.206 871 1HH1 ARG 20 1HH1 ARG 20 -23.949 -12.182 -9.236 872 2HH1 ARG 20 2HH1 ARG 20 -24.854 -13.654 -9.367 873 1HH2 ARG 20 1HH2 ARG 20 -23.658 -14.994 -6.367 874 2HH2 ARG 20 2HH2 ARG 20 -24.688 -15.253 -7.734 875 H LEU 21 H LEU 21 -21.398 -6.591 -4.645 876 HA LEU 21 HA LEU 21 -20.132 -7.968 -2.496 877 1HB LEU 21 1HB LEU 21 -20.105 -5.289 -3.653 878 2HB LEU 21 2HB LEU 21 -19.903 -5.296 -1.902 879 HG LEU 21 HG LEU 21 -17.929 -6.649 -2.075 880 1HD1 LEU 21 1HD1 LEU 21 -19.022 -7.305 -4.656 881 2HD1 LEU 21 2HD1 LEU 21 -17.760 -8.117 -3.731 882 3HD1 LEU 21 3HD1 LEU 21 -17.345 -6.777 -4.800 883 1HD2 LEU 21 1HD2 LEU 21 -17.120 -4.550 -2.279 884 2HD2 LEU 21 2HD2 LEU 21 -18.164 -4.160 -3.646 885 3HD2 LEU 21 3HD2 LEU 21 -16.699 -5.110 -3.898 886 H GLN 22 H GLN 22 -22.481 -5.279 -2.479 887 HA GLN 22 HA GLN 22 -23.019 -5.352 0.260 888 1HB GLN 22 1HB GLN 22 -23.894 -3.867 -1.941 889 2HB GLN 22 2HB GLN 22 -25.353 -4.595 -1.281 890 1HG GLN 22 1HG GLN 22 -25.408 -3.055 0.297 891 2HG GLN 22 2HG GLN 22 -23.842 -3.604 0.892 892 1HE2 GLN 22 1HE2 GLN 22 -22.028 -2.847 -0.777 893 2HE2 GLN 22 2HE2 GLN 22 -22.055 -1.148 -1.089 894 H SER 23 H SER 23 -24.046 -7.432 -2.278 895 HA SER 23 HA SER 23 -26.359 -8.459 -0.905 896 1HB SER 23 1HB SER 23 -26.127 -8.425 -3.406 897 2HB SER 23 2HB SER 23 -24.891 -9.675 -3.256 898 HG SER 23 HG SER 23 -26.502 -11.013 -3.272 899 H GLN 24 H GLN 24 -22.989 -9.054 -0.865 900 HA GLN 24 HA GLN 24 -23.391 -11.634 0.489 901 1HB GLN 24 1HB GLN 24 -21.079 -12.136 -0.015 902 2HB GLN 24 2HB GLN 24 -21.906 -11.658 -1.491 903 1HG GLN 24 1HG GLN 24 -20.852 -9.556 -1.525 904 2HG GLN 24 2HG GLN 24 -20.289 -9.726 0.137 905 1HE2 GLN 24 1HE2 GLN 24 -18.331 -9.040 -1.273 906 2HE2 GLN 24 2HE2 GLN 24 -17.320 -10.339 -1.797 907 H LYS 25 H LYS 25 -22.191 -12.079 2.415 908 HA LYS 25 HA LYS 25 -22.078 -9.823 4.186 909 1HB LYS 25 1HB LYS 25 -22.550 -12.512 4.512 910 2HB LYS 25 2HB LYS 25 -20.927 -12.336 5.165 911 1HG LYS 25 1HG LYS 25 -22.052 -10.284 6.406 912 2HG LYS 25 2HG LYS 25 -23.503 -11.257 6.156 913 1HD LYS 25 1HD LYS 25 -22.930 -12.406 7.977 914 2HD LYS 25 2HD LYS 25 -21.580 -13.064 7.049 915 1HE LYS 25 1HE LYS 25 -20.075 -11.501 7.910 916 2HE LYS 25 2HE LYS 25 -21.360 -10.414 8.434 917 1HZ LYS 25 1HZ LYS 25 -21.484 -11.432 10.388 918 2HZ LYS 25 2HZ LYS 25 -20.049 -12.235 9.991 919 3HZ LYS 25 3HZ LYS 25 -21.542 -12.972 9.689 920 H GLY 26 H GLY 26 -20.217 -9.279 5.514 921 1HA GLY 26 1HA GLY 26 -17.852 -9.386 5.935 922 2HA GLY 26 2HA GLY 26 -17.629 -9.974 4.293 923 H VAL 27 H VAL 27 -19.027 -8.162 2.807 924 HA VAL 27 HA VAL 27 -17.251 -6.085 2.437 925 HB VAL 27 HB VAL 27 -20.194 -6.143 1.760 926 1HG1 VAL 27 1HG1 VAL 27 -18.078 -4.138 1.262 927 2HG1 VAL 27 2HG1 VAL 27 -19.147 -4.518 -0.089 928 3HG1 VAL 27 3HG1 VAL 27 -19.822 -3.932 1.432 929 1HG2 VAL 27 1HG2 VAL 27 -18.809 -7.958 0.790 930 2HG2 VAL 27 2HG2 VAL 27 -19.491 -6.876 -0.425 931 3HG2 VAL 27 3HG2 VAL 27 -17.793 -6.732 0.031 932 H GLN 28 H GLN 28 -16.888 -4.167 3.365 933 HA GLN 28 HA GLN 28 -18.604 -3.382 5.601 934 1HB GLN 28 1HB GLN 28 -15.786 -2.701 4.809 935 2HB GLN 28 2HB GLN 28 -16.653 -1.734 5.994 936 1HG GLN 28 1HG GLN 28 -16.969 -4.438 6.735 937 2HG GLN 28 2HG GLN 28 -15.266 -4.191 6.353 938 1HE2 GLN 28 1HE2 GLN 28 -14.541 -4.329 8.436 939 2HE2 GLN 28 2HE2 GLN 28 -14.889 -3.142 9.642 940 H GLY 29 H GLY 29 -17.447 -2.264 2.489 941 1HA GLY 29 1HA GLY 29 -19.566 -0.624 1.897 942 2HA GLY 29 2HA GLY 29 -18.443 0.408 2.770 943 H ILE 30 H ILE 30 -19.224 0.825 0.095 944 HA ILE 30 HA ILE 30 -16.604 0.616 -1.197 945 HB ILE 30 HB ILE 30 -19.138 0.066 -2.731 946 1HG1 ILE 30 1HG1 ILE 30 -17.939 -2.328 -2.728 947 2HG1 ILE 30 2HG1 ILE 30 -17.397 -1.759 -1.153 948 1HG2 ILE 30 1HG2 ILE 30 -16.205 -0.158 -3.354 949 2HG2 ILE 30 2HG2 ILE 30 -17.456 -0.911 -4.343 950 3HG2 ILE 30 3HG2 ILE 30 -17.418 0.842 -4.154 951 1HD1 ILE 30 1HD1 ILE 30 -20.281 -1.526 -1.806 952 2HD1 ILE 30 2HD1 ILE 30 -19.625 -3.123 -1.442 953 3HD1 ILE 30 3HD1 ILE 30 -19.487 -1.822 -0.260 954 H ILE 31 H ILE 31 -15.969 2.497 -2.027 955 HA ILE 31 HA ILE 31 -18.012 4.484 -2.759 956 HB ILE 31 HB ILE 31 -15.470 5.062 -1.231 957 1HG1 ILE 31 1HG1 ILE 31 -18.113 5.843 -0.162 958 2HG1 ILE 31 2HG1 ILE 31 -17.794 4.112 -0.198 959 1HG2 ILE 31 1HG2 ILE 31 -16.275 7.381 -1.184 960 2HG2 ILE 31 2HG2 ILE 31 -15.967 6.822 -2.827 961 3HG2 ILE 31 3HG2 ILE 31 -17.622 6.925 -2.227 962 1HD1 ILE 31 1HD1 ILE 31 -15.747 5.942 0.949 963 2HD1 ILE 31 2HD1 ILE 31 -17.179 5.532 1.894 964 3HD1 ILE 31 3HD1 ILE 31 -16.097 4.257 1.333 965 H VAL 32 H VAL 32 -17.534 5.800 -4.497 966 HA VAL 32 HA VAL 32 -15.030 5.198 -5.932 967 HB VAL 32 HB VAL 32 -17.614 5.850 -7.330 968 1HG1 VAL 32 1HG1 VAL 32 -15.095 4.481 -8.269 969 2HG1 VAL 32 2HG1 VAL 32 -16.501 4.882 -9.258 970 3HG1 VAL 32 3HG1 VAL 32 -15.512 6.168 -8.566 971 1HG2 VAL 32 1HG2 VAL 32 -16.529 3.114 -6.667 972 2HG2 VAL 32 2HG2 VAL 32 -18.014 3.832 -6.041 973 3HG2 VAL 32 3HG2 VAL 32 -17.878 3.441 -7.755 974 H VAL 33 H VAL 33 -13.798 6.925 -6.220 975 HA VAL 33 HA VAL 33 -15.085 9.577 -6.307 976 HB VAL 33 HB VAL 33 -12.246 9.078 -5.432 977 1HG1 VAL 33 1HG1 VAL 33 -12.392 11.296 -4.501 978 2HG1 VAL 33 2HG1 VAL 33 -12.870 11.350 -6.199 979 3HG1 VAL 33 3HG1 VAL 33 -14.098 11.405 -4.934 980 1HG2 VAL 33 1HG2 VAL 33 -14.720 8.583 -3.987 981 2HG2 VAL 33 2HG2 VAL 33 -13.065 8.127 -3.584 982 3HG2 VAL 33 3HG2 VAL 33 -13.666 9.730 -3.160 983 H ASN 34 H ASN 34 -14.510 10.989 -7.901 984 HA ASN 34 HA ASN 34 -13.308 9.892 -10.251 985 1HB ASN 34 1HB ASN 34 -14.091 12.755 -9.656 986 2HB ASN 34 2HB ASN 34 -13.735 12.088 -11.246 987 1HD2 ASN 34 1HD2 ASN 34 -16.094 13.348 -10.811 988 2HD2 ASN 34 2HD2 ASN 34 -17.390 12.207 -10.820 989 H THR 35 H THR 35 -11.811 11.824 -11.378 990 HA THR 35 HA THR 35 -9.303 11.517 -10.040 991 HB THR 35 HB THR 35 -9.033 13.462 -12.078 992 HG1 THR 35 HG1 THR 35 -10.090 12.388 -13.807 993 1HG2 THR 35 1HG2 THR 35 -7.909 11.582 -13.270 994 2HG2 THR 35 2HG2 THR 35 -8.498 10.492 -12.015 995 3HG2 THR 35 3HG2 THR 35 -7.372 11.785 -11.603 996 H GLU 36 H GLU 36 -11.733 13.976 -10.157 997 HA GLU 36 HA GLU 36 -10.002 16.086 -9.218 998 1HB GLU 36 1HB GLU 36 -12.826 15.827 -10.030 999 2HB GLU 36 2HB GLU 36 -12.516 17.018 -8.775 1000 1HG GLU 36 1HG GLU 36 -10.546 17.578 -10.569 1001 2HG GLU 36 2HG GLU 36 -11.866 17.070 -11.621 1002 H GLY 37 H GLY 37 -12.439 13.925 -7.849 1003 1HA GLY 37 1HA GLY 37 -11.821 13.210 -5.513 1004 2HA GLY 37 2HA GLY 37 -11.710 14.929 -5.168 1005 H ILE 38 H ILE 38 -14.168 13.484 -7.214 1006 HA ILE 38 HA ILE 38 -16.184 14.308 -5.234 1007 HB ILE 38 HB ILE 38 -16.659 13.815 -8.171 1008 1HG1 ILE 38 1HG1 ILE 38 -16.111 16.430 -6.749 1009 2HG1 ILE 38 2HG1 ILE 38 -15.047 15.643 -7.910 1010 1HG2 ILE 38 1HG2 ILE 38 -18.406 15.683 -6.825 1011 2HG2 ILE 38 2HG2 ILE 38 -18.802 14.233 -7.746 1012 3HG2 ILE 38 3HG2 ILE 38 -18.408 14.108 -6.032 1013 1HD1 ILE 38 1HD1 ILE 38 -16.020 17.055 -9.351 1014 2HD1 ILE 38 2HD1 ILE 38 -17.302 15.842 -9.371 1015 3HD1 ILE 38 3HD1 ILE 38 -17.451 17.267 -8.342 1016 HA PRO 39 HA PRO 39 -16.897 9.938 -4.697 1017 1HB PRO 39 1HB PRO 39 -18.890 10.216 -2.874 1018 2HB PRO 39 2HB PRO 39 -17.182 10.414 -2.467 1019 1HG PRO 39 1HG PRO 39 -19.247 12.503 -3.043 1020 2HG PRO 39 2HG PRO 39 -18.006 12.476 -1.777 1021 1HD PRO 39 1HD PRO 39 -17.725 13.901 -4.062 1022 2HD PRO 39 2HD PRO 39 -16.345 13.174 -3.215 1023 H ILE 40 H ILE 40 -17.737 10.023 -6.983 1024 HA ILE 40 HA ILE 40 -20.313 10.642 -7.733 1025 HB ILE 40 HB ILE 40 -20.050 8.688 -9.391 1026 1HG1 ILE 40 1HG1 ILE 40 -17.166 8.766 -8.580 1027 2HG1 ILE 40 2HG1 ILE 40 -18.269 7.666 -7.761 1028 1HG2 ILE 40 1HG2 ILE 40 -18.222 9.963 -10.618 1029 2HG2 ILE 40 2HG2 ILE 40 -19.661 10.873 -10.161 1030 3HG2 ILE 40 3HG2 ILE 40 -18.180 11.032 -9.216 1031 1HD1 ILE 40 1HD1 ILE 40 -18.435 7.574 -10.676 1032 2HD1 ILE 40 2HD1 ILE 40 -16.872 7.092 -10.015 1033 3HD1 ILE 40 3HD1 ILE 40 -18.342 6.266 -9.497 1034 H LYS 41 H LYS 41 -19.143 7.800 -6.036 1035 HA LYS 41 HA LYS 41 -21.896 7.109 -5.364 1036 1HB LYS 41 1HB LYS 41 -20.340 5.646 -7.265 1037 2HB LYS 41 2HB LYS 41 -20.558 4.646 -5.835 1038 1HG LYS 41 1HG LYS 41 -23.010 5.969 -6.664 1039 2HG LYS 41 2HG LYS 41 -22.335 4.918 -7.912 1040 1HD LYS 41 1HD LYS 41 -22.096 3.199 -5.987 1041 2HD LYS 41 2HD LYS 41 -23.264 4.223 -5.149 1042 1HE LYS 41 1HE LYS 41 -23.870 3.418 -7.943 1043 2HE LYS 41 2HE LYS 41 -24.009 2.190 -6.685 1044 1HZ LYS 41 1HZ LYS 41 -25.942 3.943 -7.350 1045 2HZ LYS 41 2HZ LYS 41 -25.240 4.709 -6.015 1046 3HZ LYS 41 3HZ LYS 41 -25.843 3.136 -5.866 1047 H SER 42 H SER 42 -22.105 5.874 -3.457 1048 HA SER 42 HA SER 42 -19.844 4.946 -1.988 1049 1HB SER 42 1HB SER 42 -20.088 6.550 -0.081 1050 2HB SER 42 2HB SER 42 -19.468 7.294 -1.555 1051 HG SER 42 HG SER 42 -21.775 7.792 -0.190 1052 H THR 43 H THR 43 -20.424 3.709 -0.209 1053 HA THR 43 HA THR 43 -23.324 3.385 0.212 1054 HB THR 43 HB THR 43 -23.064 1.041 0.492 1055 HG1 THR 43 HG1 THR 43 -21.183 0.763 1.576 1056 1HG2 THR 43 1HG2 THR 43 -22.887 0.601 -1.694 1057 2HG2 THR 43 2HG2 THR 43 -21.192 1.085 -1.730 1058 3HG2 THR 43 3HG2 THR 43 -22.460 2.299 -1.901 1059 H MET 44 H MET 44 -20.480 4.347 1.615 1060 HA MET 44 HA MET 44 -20.965 3.295 4.263 1061 1HB MET 44 1HB MET 44 -18.971 5.317 3.231 1062 2HB MET 44 2HB MET 44 -19.035 4.754 4.896 1063 1HG MET 44 1HG MET 44 -18.902 2.622 2.894 1064 2HG MET 44 2HG MET 44 -17.492 3.677 2.946 1065 1HE MET 44 1HE MET 44 -19.866 1.410 5.239 1066 2HE MET 44 2HE MET 44 -19.051 1.660 6.783 1067 3HE MET 44 3HE MET 44 -19.809 3.021 5.954 1068 H ASP 45 H ASP 45 -20.551 5.255 6.004 1069 HA ASP 45 HA ASP 45 -23.027 6.629 6.073 1070 1HB ASP 45 1HB ASP 45 -20.885 6.105 7.869 1071 2HB ASP 45 2HB ASP 45 -21.161 7.845 7.862 1072 H ASN 46 H ASN 46 -23.253 8.996 6.335 1073 HA ASN 46 HA ASN 46 -22.382 10.380 4.089 1074 1HB ASN 46 1HB ASN 46 -24.076 10.892 6.275 1075 2HB ASN 46 2HB ASN 46 -22.906 12.208 6.261 1076 1HD2 ASN 46 1HD2 ASN 46 -22.432 12.440 3.557 1077 2HD2 ASN 46 2HD2 ASN 46 -23.870 12.987 2.772 1078 HA PRO 47 HA PRO 47 -19.093 12.591 6.858 1079 1HB PRO 47 1HB PRO 47 -18.622 11.528 9.311 1080 2HB PRO 47 2HB PRO 47 -19.841 12.775 9.023 1081 1HG PRO 47 1HG PRO 47 -20.188 9.814 9.293 1082 2HG PRO 47 2HG PRO 47 -21.170 11.122 9.977 1083 1HD PRO 47 1HD PRO 47 -21.908 9.752 7.761 1084 2HD PRO 47 2HD PRO 47 -22.315 11.463 8.006 1085 H THR 48 H THR 48 -19.451 9.118 6.948 1086 HA THR 48 HA THR 48 -16.656 8.546 7.216 1087 HB THR 48 HB THR 48 -18.932 6.771 6.313 1088 HG1 THR 48 HG1 THR 48 -19.136 7.424 8.477 1089 1HG2 THR 48 1HG2 THR 48 -17.174 5.541 5.548 1090 2HG2 THR 48 2HG2 THR 48 -17.109 5.053 7.242 1091 3HG2 THR 48 3HG2 THR 48 -16.022 6.306 6.642 1092 H THR 49 H THR 49 -18.915 8.892 4.547 1093 HA THR 49 HA THR 49 -17.187 7.881 2.531 1094 HB THR 49 HB THR 49 -19.570 9.729 2.311 1095 HG1 THR 49 HG1 THR 49 -19.221 6.917 2.071 1096 1HG2 THR 49 1HG2 THR 49 -18.124 9.973 0.361 1097 2HG2 THR 49 2HG2 THR 49 -19.595 9.100 -0.068 1098 3HG2 THR 49 3HG2 THR 49 -18.083 8.222 0.156 1099 H THR 50 H THR 50 -18.072 11.198 3.480 1100 HA THR 50 HA THR 50 -16.457 12.559 1.665 1101 HB THR 50 HB THR 50 -16.604 13.853 4.290 1102 HG1 THR 50 HG1 THR 50 -18.942 14.043 4.123 1103 1HG2 THR 50 1HG2 THR 50 -18.088 15.350 2.600 1104 2HG2 THR 50 2HG2 THR 50 -17.101 14.456 1.444 1105 3HG2 THR 50 3HG2 THR 50 -16.329 15.433 2.693 1106 H GLN 51 H GLN 51 -15.728 11.624 5.025 1107 HA GLN 51 HA GLN 51 -13.162 12.650 5.196 1108 1HB GLN 51 1HB GLN 51 -14.251 11.798 7.156 1109 2HB GLN 51 2HB GLN 51 -14.361 10.186 6.462 1110 1HG GLN 51 1HG GLN 51 -11.639 11.251 6.662 1111 2HG GLN 51 2HG GLN 51 -12.454 10.997 8.204 1112 1HE2 GLN 51 1HE2 GLN 51 -10.996 9.525 5.469 1113 2HE2 GLN 51 2HE2 GLN 51 -11.127 7.887 6.002 1114 H TYR 52 H TYR 52 -14.185 9.440 4.070 1115 HA TYR 52 HA TYR 52 -11.601 8.454 3.539 1116 1HB TYR 52 1HB TYR 52 -14.366 7.696 2.699 1117 2HB TYR 52 2HB TYR 52 -13.001 6.976 1.852 1118 HD1 TYR 52 HD1 TYR 52 -13.665 7.782 5.446 1119 HD2 TYR 52 HD2 TYR 52 -12.654 4.814 2.569 1120 HE1 TYR 52 HE1 TYR 52 -13.431 6.124 7.247 1121 HE2 TYR 52 HE2 TYR 52 -12.419 3.148 4.363 1122 HH TYR 52 HH TYR 52 -13.324 3.863 7.666 1123 H ALA 53 H ALA 53 -14.039 9.827 1.331 1124 HA ALA 53 HA ALA 53 -12.465 9.763 -0.985 1125 1HB ALA 53 1HB ALA 53 -14.850 11.368 -0.158 1126 2HB ALA 53 2HB ALA 53 -14.041 11.687 -1.692 1127 3HB ALA 53 3HB ALA 53 -14.726 10.094 -1.371 1128 H SER 54 H SER 54 -12.317 11.806 1.762 1129 HA SER 54 HA SER 54 -11.068 14.041 0.466 1130 1HB SER 54 1HB SER 54 -12.383 14.103 2.655 1131 2HB SER 54 2HB SER 54 -10.953 13.406 3.415 1132 HG SER 54 HG SER 54 -11.249 15.839 3.289 1133 H LEU 55 H LEU 55 -9.919 11.420 2.581 1134 HA LEU 55 HA LEU 55 -7.160 12.171 2.185 1135 1HB LEU 55 1HB LEU 55 -6.652 10.705 3.850 1136 2HB LEU 55 2HB LEU 55 -8.335 11.046 4.250 1137 HG LEU 55 HG LEU 55 -8.720 8.895 2.730 1138 1HD1 LEU 55 1HD1 LEU 55 -5.944 8.967 2.870 1139 2HD1 LEU 55 2HD1 LEU 55 -6.947 7.615 2.347 1140 3HD1 LEU 55 3HD1 LEU 55 -6.424 7.725 4.027 1141 1HD2 LEU 55 1HD2 LEU 55 -9.305 7.870 4.659 1142 2HD2 LEU 55 2HD2 LEU 55 -9.025 9.479 5.327 1143 3HD2 LEU 55 3HD2 LEU 55 -7.773 8.242 5.451 1144 H MET 56 H MET 56 -9.414 10.408 0.446 1145 HA MET 56 HA MET 56 -7.853 8.279 -0.548 1146 1HB MET 56 1HB MET 56 -10.463 9.321 -0.963 1147 2HB MET 56 2HB MET 56 -9.700 9.171 -2.540 1148 1HG MET 56 1HG MET 56 -10.935 7.165 -1.980 1149 2HG MET 56 2HG MET 56 -9.209 6.830 -2.092 1150 1HE MET 56 1HE MET 56 -8.491 4.853 0.611 1151 2HE MET 56 2HE MET 56 -7.974 5.802 -0.783 1152 3HE MET 56 3HE MET 56 -7.740 6.431 0.849 1153 H HIS 57 H HIS 57 -8.793 11.276 -2.248 1154 HA HIS 57 HA HIS 57 -6.997 10.997 -4.365 1155 1HB HIS 57 1HB HIS 57 -8.895 12.561 -4.397 1156 2HB HIS 57 2HB HIS 57 -8.102 13.552 -3.176 1157 HD1 HIS 57 HD1 HIS 57 -6.441 15.257 -3.982 1158 HD2 HIS 57 HD2 HIS 57 -7.569 12.588 -6.960 1159 HE1 HIS 57 HE1 HIS 57 -5.460 16.170 -6.110 1160 H SER 58 H SER 58 -6.559 12.289 -1.149 1161 HA SER 58 HA SER 58 -4.024 13.514 -1.704 1162 1HB SER 58 1HB SER 58 -5.135 14.506 0.101 1163 2HB SER 58 2HB SER 58 -5.598 12.952 0.794 1164 HG SER 58 HG SER 58 -3.561 12.672 1.550 1165 H PHE 59 H PHE 59 -5.125 10.364 -0.798 1166 HA PHE 59 HA PHE 59 -2.699 9.401 0.320 1167 1HB PHE 59 1HB PHE 59 -4.731 8.228 0.817 1168 2HB PHE 59 2HB PHE 59 -5.072 7.980 -0.893 1169 HD1 PHE 59 HD1 PHE 59 -5.069 5.700 -1.240 1170 HD2 PHE 59 HD2 PHE 59 -1.943 7.457 1.054 1171 HE1 PHE 59 HE1 PHE 59 -3.915 3.528 -1.155 1172 HE2 PHE 59 HE2 PHE 59 -0.784 5.288 1.142 1173 HZ PHE 59 HZ PHE 59 -1.770 3.320 0.036 1174 H ILE 60 H ILE 60 -4.196 8.818 -2.865 1175 HA ILE 60 HA ILE 60 -2.086 7.414 -4.008 1176 HB ILE 60 HB ILE 60 -4.024 9.264 -5.402 1177 1HG1 ILE 60 1HG1 ILE 60 -5.186 7.545 -4.132 1178 2HG1 ILE 60 2HG1 ILE 60 -5.291 7.180 -5.851 1179 1HG2 ILE 60 1HG2 ILE 60 -2.421 8.888 -7.011 1180 2HG2 ILE 60 2HG2 ILE 60 -2.020 7.287 -6.391 1181 3HG2 ILE 60 3HG2 ILE 60 -3.516 7.535 -7.291 1182 1HD1 ILE 60 1HD1 ILE 60 -4.152 5.632 -3.693 1183 2HD1 ILE 60 2HD1 ILE 60 -4.607 5.140 -5.325 1184 3HD1 ILE 60 3HD1 ILE 60 -3.019 5.845 -5.027 1185 H LEU 61 H LEU 61 -2.758 10.906 -4.117 1186 HA LEU 61 HA LEU 61 -0.568 11.644 -5.693 1187 1HB LEU 61 1HB LEU 61 -2.613 12.941 -4.198 1188 2HB LEU 61 2HB LEU 61 -1.072 13.697 -3.801 1189 HG LEU 61 HG LEU 61 -0.692 14.214 -6.142 1190 1HD1 LEU 61 1HD1 LEU 61 -3.241 12.680 -6.550 1191 2HD1 LEU 61 2HD1 LEU 61 -1.669 12.426 -7.309 1192 3HD1 LEU 61 3HD1 LEU 61 -2.636 13.839 -7.734 1193 1HD2 LEU 61 1HD2 LEU 61 -2.695 15.723 -6.497 1194 2HD2 LEU 61 2HD2 LEU 61 -1.826 15.921 -4.975 1195 3HD2 LEU 61 3HD2 LEU 61 -3.353 15.038 -5.010 1196 H LYS 62 H LYS 62 -0.772 10.742 -2.363 1197 HA LYS 62 HA LYS 62 1.678 11.947 -1.521 1198 1HB LYS 62 1HB LYS 62 -0.462 10.552 -0.302 1199 2HB LYS 62 2HB LYS 62 1.004 9.652 0.064 1200 1HG LYS 62 1HG LYS 62 0.514 11.282 1.797 1201 2HG LYS 62 2HG LYS 62 2.028 11.666 0.975 1202 1HD LYS 62 1HD LYS 62 0.978 13.403 -0.292 1203 2HD LYS 62 2HD LYS 62 -0.622 12.924 0.278 1204 1HE LYS 62 1HE LYS 62 -0.316 13.863 2.344 1205 2HE LYS 62 2HE LYS 62 1.434 13.654 2.300 1206 1HZ LYS 62 1HZ LYS 62 1.728 15.572 1.122 1207 2HZ LYS 62 2HZ LYS 62 0.366 16.002 2.028 1208 3HZ LYS 62 3HZ LYS 62 0.192 15.526 0.414 1209 H ALA 63 H ALA 63 0.757 8.586 -2.269 1210 HA ALA 63 HA ALA 63 3.415 7.591 -2.079 1211 1HB ALA 63 1HB ALA 63 1.687 6.031 -1.721 1212 2HB ALA 63 2HB ALA 63 0.882 6.456 -3.232 1213 3HB ALA 63 3HB ALA 63 2.414 5.584 -3.264 1214 H ARG 64 H ARG 64 1.504 8.964 -4.655 1215 HA ARG 64 HA ARG 64 2.992 8.040 -6.853 1216 1HB ARG 64 1HB ARG 64 0.717 9.240 -6.819 1217 2HB ARG 64 2HB ARG 64 1.648 10.730 -6.754 1218 1HG ARG 64 1HG ARG 64 2.761 9.242 -8.843 1219 2HG ARG 64 2HG ARG 64 1.012 9.072 -9.007 1220 1HD ARG 64 1HD ARG 64 2.241 11.758 -8.520 1221 2HD ARG 64 2HD ARG 64 2.211 11.071 -10.144 1222 HE ARG 64 HE ARG 64 -0.352 11.026 -8.868 1223 1HH1 ARG 64 1HH1 ARG 64 1.880 12.992 -10.677 1224 2HH1 ARG 64 2HH1 ARG 64 0.650 14.032 -11.315 1225 1HH2 ARG 64 1HH2 ARG 64 -1.981 12.389 -9.702 1226 2HH2 ARG 64 2HH2 ARG 64 -1.545 13.688 -10.759 1227 H SER 65 H SER 65 3.498 10.680 -4.617 1228 HA SER 65 HA SER 65 5.554 11.944 -6.167 1229 1HB SER 65 1HB SER 65 4.003 12.678 -3.982 1230 2HB SER 65 2HB SER 65 5.625 12.519 -3.308 1231 HG SER 65 HG SER 65 5.243 14.618 -4.134 1232 H THR 66 H THR 66 5.407 9.431 -3.775 1233 HA THR 66 HA THR 66 8.242 9.483 -3.215 1234 HB THR 66 HB THR 66 7.142 7.016 -2.371 1235 HG1 THR 66 HG1 THR 66 5.480 9.197 -1.609 1236 1HG2 THR 66 1HG2 THR 66 8.863 8.474 -1.263 1237 2HG2 THR 66 2HG2 THR 66 7.627 7.836 -0.179 1238 3HG2 THR 66 3HG2 THR 66 7.543 9.511 -0.725 1239 H VAL 67 H VAL 67 5.987 7.359 -4.954 1240 HA VAL 67 HA VAL 67 7.732 5.359 -5.728 1241 HB VAL 67 HB VAL 67 5.450 6.509 -7.340 1242 1HG1 VAL 67 1HG1 VAL 67 7.301 4.287 -7.810 1243 2HG1 VAL 67 2HG1 VAL 67 5.595 3.862 -7.968 1244 3HG1 VAL 67 3HG1 VAL 67 6.273 5.169 -8.940 1245 1HG2 VAL 67 1HG2 VAL 67 4.093 5.590 -5.842 1246 2HG2 VAL 67 2HG2 VAL 67 4.834 4.015 -6.127 1247 3HG2 VAL 67 3HG2 VAL 67 5.484 5.084 -4.884 1248 H ARG 68 H ARG 68 6.989 8.392 -7.434 1249 HA ARG 68 HA ARG 68 8.593 8.017 -9.667 1250 1HB ARG 68 1HB ARG 68 8.615 10.474 -9.865 1251 2HB ARG 68 2HB ARG 68 7.009 9.855 -9.504 1252 1HG ARG 68 1HG ARG 68 7.225 10.512 -7.195 1253 2HG ARG 68 2HG ARG 68 8.892 11.024 -7.467 1254 1HD ARG 68 1HD ARG 68 7.243 12.892 -7.427 1255 2HD ARG 68 2HD ARG 68 8.186 12.791 -8.913 1256 HE ARG 68 HE ARG 68 5.740 11.377 -9.167 1257 1HH1 ARG 68 1HH1 ARG 68 7.079 14.591 -9.115 1258 2HH1 ARG 68 2HH1 ARG 68 5.822 15.271 -10.095 1259 1HH2 ARG 68 1HH2 ARG 68 4.080 12.261 -10.458 1260 2HH2 ARG 68 2HH2 ARG 68 4.117 13.945 -10.858 1261 H ASP 69 H ASP 69 9.469 8.787 -6.404 1262 HA ASP 69 HA ASP 69 12.089 9.775 -6.994 1263 1HB ASP 69 1HB ASP 69 10.441 9.630 -4.723 1264 2HB ASP 69 2HB ASP 69 11.862 8.663 -4.338 1265 H ILE 70 H ILE 70 10.691 6.639 -6.320 1266 HA ILE 70 HA ILE 70 13.010 5.203 -5.716 1267 HB ILE 70 HB ILE 70 10.585 4.194 -7.206 1268 1HG1 ILE 70 1HG1 ILE 70 11.136 4.064 -4.238 1269 2HG1 ILE 70 2HG1 ILE 70 10.156 5.325 -4.981 1270 1HG2 ILE 70 1HG2 ILE 70 11.850 2.292 -5.468 1271 2HG2 ILE 70 2HG2 ILE 70 11.525 2.183 -7.197 1272 3HG2 ILE 70 3HG2 ILE 70 13.017 2.930 -6.626 1273 1HD1 ILE 70 1HD1 ILE 70 9.535 2.491 -4.470 1274 2HD1 ILE 70 2HD1 ILE 70 8.492 3.912 -4.433 1275 3HD1 ILE 70 3HD1 ILE 70 8.923 3.175 -5.976 1276 H ASP 71 H ASP 71 11.459 5.810 -8.853 1277 HA ASP 71 HA ASP 71 14.030 5.507 -10.169 1278 1HB ASP 71 1HB ASP 71 11.816 3.552 -10.413 1279 2HB ASP 71 2HB ASP 71 12.590 4.041 -11.918 1280 HA PRO 72 HA PRO 72 12.521 8.642 -12.838 1281 1HB PRO 72 1HB PRO 72 13.629 7.969 -15.223 1282 2HB PRO 72 2HB PRO 72 14.571 8.616 -13.875 1283 1HG PRO 72 1HG PRO 72 14.235 5.776 -14.760 1284 2HG PRO 72 2HG PRO 72 15.706 6.620 -14.240 1285 1HD PRO 72 1HD PRO 72 14.320 4.967 -12.604 1286 2HD PRO 72 2HD PRO 72 15.201 6.386 -12.004 1287 H GLN 73 H GLN 73 11.776 5.345 -13.515 1288 HA GLN 73 HA GLN 73 9.372 6.192 -14.948 1289 1HB GLN 73 1HB GLN 73 11.330 4.121 -15.944 1290 2HB GLN 73 2HB GLN 73 9.694 4.291 -16.565 1291 1HG GLN 73 1HG GLN 73 10.452 6.785 -16.924 1292 2HG GLN 73 2HG GLN 73 12.055 6.053 -16.924 1293 1HE2 GLN 73 1HE2 GLN 73 12.211 6.748 -19.123 1294 2HE2 GLN 73 2HE2 GLN 73 11.473 5.823 -20.381 1295 H ASN 74 H ASN 74 7.591 5.105 -14.347 1296 HA ASN 74 HA ASN 74 7.463 2.430 -13.550 1297 1HB ASN 74 1HB ASN 74 8.364 4.240 -11.480 1298 2HB ASN 74 2HB ASN 74 6.832 3.495 -11.031 1299 1HD2 ASN 74 1HD2 ASN 74 9.487 3.119 -9.903 1300 2HD2 ASN 74 2HD2 ASN 74 9.833 1.432 -10.041 1301 H ASP 75 H ASP 75 5.356 2.139 -12.063 1302 HA ASP 75 HA ASP 75 3.317 4.102 -12.374 1303 1HB ASP 75 1HB ASP 75 3.776 2.622 -14.667 1304 2HB ASP 75 2HB ASP 75 2.435 1.774 -13.902 1305 H LEU 76 H LEU 76 2.067 3.825 -10.659 1306 HA LEU 76 HA LEU 76 2.187 1.554 -9.001 1307 1HB LEU 76 1HB LEU 76 0.385 3.939 -9.145 1308 2HB LEU 76 2HB LEU 76 0.039 2.627 -8.020 1309 HG LEU 76 HG LEU 76 1.192 4.413 -6.877 1310 1HD1 LEU 76 1HD1 LEU 76 1.827 1.803 -6.710 1311 2HD1 LEU 76 2HD1 LEU 76 2.519 3.049 -5.672 1312 3HD1 LEU 76 3HD1 LEU 76 3.410 2.485 -7.086 1313 1HD2 LEU 76 1HD2 LEU 76 2.392 5.043 -9.140 1314 2HD2 LEU 76 2HD2 LEU 76 3.669 4.021 -8.478 1315 3HD2 LEU 76 3HD2 LEU 76 3.113 5.433 -7.578 1316 H THR 77 H THR 77 0.704 -0.091 -8.605 1317 HA THR 77 HA THR 77 -1.207 -0.576 -10.795 1318 HB THR 77 HB THR 77 -0.951 -2.956 -10.401 1319 HG1 THR 77 HG1 THR 77 0.137 -3.742 -8.708 1320 1HG2 THR 77 1HG2 THR 77 1.553 -3.160 -10.867 1321 2HG2 THR 77 2HG2 THR 77 1.603 -1.402 -10.733 1322 3HG2 THR 77 3HG2 THR 77 0.611 -2.164 -11.976 1323 H PHE 78 H PHE 78 -0.704 -0.762 -7.310 1324 HA PHE 78 HA PHE 78 -3.404 -0.195 -6.721 1325 1HB PHE 78 1HB PHE 78 -4.196 -2.280 -5.861 1326 2HB PHE 78 2HB PHE 78 -3.601 -2.589 -7.489 1327 HD1 PHE 78 HD1 PHE 78 -2.977 -3.086 -3.913 1328 HD2 PHE 78 HD2 PHE 78 -1.669 -3.959 -7.868 1329 HE1 PHE 78 HE1 PHE 78 -1.515 -4.860 -3.034 1330 HE2 PHE 78 HE2 PHE 78 -0.206 -5.734 -6.996 1331 HZ PHE 78 HZ PHE 78 -0.128 -6.187 -4.577 1332 H LEU 79 H LEU 79 -3.597 0.518 -4.661 1333 HA LEU 79 HA LEU 79 -1.268 0.129 -2.900 1334 1HB LEU 79 1HB LEU 79 -2.930 2.478 -3.556 1335 2HB LEU 79 2HB LEU 79 -2.469 2.305 -1.864 1336 HG LEU 79 HG LEU 79 -0.143 2.422 -2.417 1337 1HD1 LEU 79 1HD1 LEU 79 -1.028 2.437 -5.299 1338 2HD1 LEU 79 2HD1 LEU 79 -0.148 1.150 -4.475 1339 3HD1 LEU 79 3HD1 LEU 79 0.621 2.715 -4.736 1340 1HD2 LEU 79 1HD2 LEU 79 -2.017 4.497 -3.223 1341 2HD2 LEU 79 2HD2 LEU 79 -0.457 4.627 -4.035 1342 3HD2 LEU 79 3HD2 LEU 79 -0.536 4.613 -2.273 1343 H ARG 80 H ARG 80 -1.847 -1.517 -1.591 1344 HA ARG 80 HA ARG 80 -4.443 -1.320 -0.215 1345 1HB ARG 80 1HB ARG 80 -3.019 -3.546 -1.417 1346 2HB ARG 80 2HB ARG 80 -3.414 -3.867 0.266 1347 1HG ARG 80 1HG ARG 80 -5.780 -2.960 -0.500 1348 2HG ARG 80 2HG ARG 80 -5.199 -3.515 -2.072 1349 1HD ARG 80 1HD ARG 80 -4.644 -5.469 -0.031 1350 2HD ARG 80 2HD ARG 80 -6.357 -5.052 -0.041 1351 HE ARG 80 HE ARG 80 -6.568 -6.070 -2.089 1352 1HH1 ARG 80 1HH1 ARG 80 -3.195 -5.680 -1.319 1353 2HH1 ARG 80 2HH1 ARG 80 -2.646 -6.665 -2.635 1354 1HH2 ARG 80 1HH2 ARG 80 -5.858 -7.369 -3.825 1355 2HH2 ARG 80 2HH2 ARG 80 -4.162 -7.624 -4.060 1356 H ILE 81 H ILE 81 -4.425 -0.858 1.881 1357 HA ILE 81 HA ILE 81 -1.885 -1.124 3.346 1358 HB ILE 81 HB ILE 81 -4.210 0.625 4.133 1359 1HG1 ILE 81 1HG1 ILE 81 -1.737 1.384 2.562 1360 2HG1 ILE 81 2HG1 ILE 81 -3.376 1.315 1.923 1361 1HG2 ILE 81 1HG2 ILE 81 -2.480 1.781 5.467 1362 2HG2 ILE 81 2HG2 ILE 81 -2.707 0.098 5.943 1363 3HG2 ILE 81 3HG2 ILE 81 -1.314 0.558 4.965 1364 1HD1 ILE 81 1HD1 ILE 81 -3.496 3.476 2.406 1365 2HD1 ILE 81 2HD1 ILE 81 -3.607 2.987 4.097 1366 3HD1 ILE 81 3HD1 ILE 81 -2.043 3.415 3.404 1367 H ARG 82 H ARG 82 -2.137 -3.251 4.030 1368 HA ARG 82 HA ARG 82 -4.465 -4.311 5.198 1369 1HB ARG 82 1HB ARG 82 -2.332 -5.506 4.323 1370 2HB ARG 82 2HB ARG 82 -1.710 -5.239 5.947 1371 1HG ARG 82 1HG ARG 82 -3.024 -6.821 6.853 1372 2HG ARG 82 2HG ARG 82 -4.393 -6.430 5.811 1373 1HD ARG 82 1HD ARG 82 -1.933 -7.877 4.851 1374 2HD ARG 82 2HD ARG 82 -3.371 -8.701 5.453 1375 HE ARG 82 HE ARG 82 -4.323 -7.039 3.521 1376 1HH1 ARG 82 1HH1 ARG 82 -1.859 -9.496 3.628 1377 2HH1 ARG 82 2HH1 ARG 82 -2.055 -9.949 1.968 1378 1HH2 ARG 82 1HH2 ARG 82 -4.590 -7.626 1.333 1379 2HH2 ARG 82 2HH2 ARG 82 -3.607 -8.884 0.663 1380 H SER 83 H SER 83 -5.412 -3.397 6.910 1381 HA SER 83 HA SER 83 -3.716 -2.693 9.216 1382 1HB SER 83 1HB SER 83 -6.258 -1.414 9.414 1383 2HB SER 83 2HB SER 83 -4.671 -0.669 9.225 1384 HG SER 83 HG SER 83 -6.642 -1.155 7.346 1385 H LYS 84 H LYS 84 -5.223 -2.576 11.280 1386 HA LYS 84 HA LYS 84 -6.099 -5.252 11.743 1387 1HB LYS 84 1HB LYS 84 -5.994 -2.743 13.379 1388 2HB LYS 84 2HB LYS 84 -6.897 -4.132 13.970 1389 1HG LYS 84 1HG LYS 84 -4.467 -5.201 13.192 1390 2HG LYS 84 2HG LYS 84 -4.044 -3.655 13.932 1391 1HD LYS 84 1HD LYS 84 -4.084 -4.940 15.810 1392 2HD LYS 84 2HD LYS 84 -5.791 -4.497 15.754 1393 1HE LYS 84 1HE LYS 84 -6.255 -6.601 14.540 1394 2HE LYS 84 2HE LYS 84 -4.558 -7.045 14.711 1395 1HZ LYS 84 1HZ LYS 84 -4.792 -7.123 17.067 1396 2HZ LYS 84 2HZ LYS 84 -6.042 -8.047 16.401 1397 3HZ LYS 84 3HZ LYS 84 -6.363 -6.498 17.002 1398 H LYS 85 H LYS 85 -7.776 -2.115 11.641 1399 HA LYS 85 HA LYS 85 -10.351 -2.962 12.168 1400 1HB LYS 85 1HB LYS 85 -9.242 -0.724 10.509 1401 2HB LYS 85 2HB LYS 85 -10.977 -1.006 10.554 1402 1HG LYS 85 1HG LYS 85 -9.778 -0.964 13.202 1403 2HG LYS 85 2HG LYS 85 -9.536 0.540 12.310 1404 1HD LYS 85 1HD LYS 85 -11.568 0.976 13.264 1405 2HD LYS 85 2HD LYS 85 -12.102 0.214 11.764 1406 1HE LYS 85 1HE LYS 85 -12.310 -1.928 12.930 1407 2HE LYS 85 2HE LYS 85 -11.771 -1.168 14.426 1408 1HZ LYS 85 1HZ LYS 85 -14.103 -1.249 14.530 1409 2HZ LYS 85 2HZ LYS 85 -14.290 -0.682 12.948 1410 3HZ LYS 85 3HZ LYS 85 -13.733 0.360 14.159 1411 H ASN 86 H ASN 86 -9.333 -2.149 8.857 1412 HA ASN 86 HA ASN 86 -10.308 -4.667 7.832 1413 1HB ASN 86 1HB ASN 86 -11.868 -3.426 6.211 1414 2HB ASN 86 2HB ASN 86 -12.428 -3.642 7.867 1415 1HD2 ASN 86 1HD2 ASN 86 -13.047 -1.910 8.965 1416 2HD2 ASN 86 2HD2 ASN 86 -12.788 -0.272 8.482 1417 H GLU 87 H GLU 87 -10.122 -4.710 5.384 1418 HA GLU 87 HA GLU 87 -7.574 -3.509 4.671 1419 1HB GLU 87 1HB GLU 87 -7.914 -5.882 4.211 1420 2HB GLU 87 2HB GLU 87 -9.309 -5.506 3.209 1421 1HG GLU 87 1HG GLU 87 -8.021 -5.236 1.436 1422 2HG GLU 87 2HG GLU 87 -7.051 -4.027 2.276 1423 H ILE 88 H ILE 88 -7.381 -1.724 3.500 1424 HA ILE 88 HA ILE 88 -9.737 -0.744 2.039 1425 HB ILE 88 HB ILE 88 -7.310 0.827 2.908 1426 1HG1 ILE 88 1HG1 ILE 88 -9.696 1.626 4.249 1427 2HG1 ILE 88 2HG1 ILE 88 -9.524 -0.116 4.437 1428 1HG2 ILE 88 1HG2 ILE 88 -9.028 2.728 2.515 1429 2HG2 ILE 88 2HG2 ILE 88 -8.211 2.004 1.131 1430 3HG2 ILE 88 3HG2 ILE 88 -9.864 1.533 1.524 1431 1HD1 ILE 88 1HD1 ILE 88 -7.243 1.739 4.991 1432 2HD1 ILE 88 2HD1 ILE 88 -8.479 1.401 6.204 1433 3HD1 ILE 88 3HD1 ILE 88 -7.496 0.088 5.556 1434 H MET 89 H MET 89 -9.564 -1.624 0.034 1435 HA MET 89 HA MET 89 -7.026 -1.640 -1.364 1436 1HB MET 89 1HB MET 89 -9.785 -2.471 -2.280 1437 2HB MET 89 2HB MET 89 -8.295 -2.728 -3.178 1438 1HG MET 89 1HG MET 89 -7.647 -4.458 -1.883 1439 2HG MET 89 2HG MET 89 -8.359 -3.776 -0.423 1440 1HE MET 89 1HE MET 89 -10.575 -3.881 -3.598 1441 2HE MET 89 2HE MET 89 -9.412 -5.154 -3.967 1442 3HE MET 89 3HE MET 89 -11.101 -5.563 -3.661 1443 H VAL 90 H VAL 90 -6.308 0.045 -2.473 1444 HA VAL 90 HA VAL 90 -8.232 1.739 -3.903 1445 HB VAL 90 HB VAL 90 -5.969 2.788 -2.197 1446 1HG1 VAL 90 1HG1 VAL 90 -7.002 5.019 -2.838 1447 2HG1 VAL 90 2HG1 VAL 90 -6.080 4.186 -4.091 1448 3HG1 VAL 90 3HG1 VAL 90 -7.843 4.144 -4.117 1449 1HG2 VAL 90 1HG2 VAL 90 -7.451 2.914 -0.549 1450 2HG2 VAL 90 2HG2 VAL 90 -8.477 3.939 -1.552 1451 3HG2 VAL 90 3HG2 VAL 90 -8.683 2.188 -1.583 1452 H ALA 91 H ALA 91 -7.717 1.417 -5.970 1453 HA ALA 91 HA ALA 91 -4.890 1.686 -6.747 1454 1HB ALA 91 1HB ALA 91 -5.370 0.026 -8.575 1455 2HB ALA 91 2HB ALA 91 -5.337 -0.635 -6.940 1456 3HB ALA 91 3HB ALA 91 -6.880 -0.340 -7.741 1457 HA PRO 92 HA PRO 92 -6.206 4.694 -9.662 1458 1HB PRO 92 1HB PRO 92 -4.422 4.304 -11.671 1459 2HB PRO 92 2HB PRO 92 -3.983 5.044 -10.127 1460 1HG PRO 92 1HG PRO 92 -3.597 2.223 -11.052 1461 2HG PRO 92 2HG PRO 92 -2.474 3.276 -10.171 1462 1HD PRO 92 1HD PRO 92 -3.937 1.356 -8.944 1463 2HD PRO 92 2HD PRO 92 -3.493 2.877 -8.143 1464 H ASP 93 H ASP 93 -7.801 4.798 -11.115 1465 HA ASP 93 HA ASP 93 -8.280 2.447 -12.826 1466 1HB ASP 93 1HB ASP 93 -9.987 3.602 -10.971 1467 2HB ASP 93 2HB ASP 93 -10.549 4.252 -12.509 1468 H LYS 94 H LYS 94 -10.094 3.464 -14.581 1469 HA LYS 94 HA LYS 94 -8.564 4.620 -16.560 1470 1HB LYS 94 1HB LYS 94 -11.320 3.947 -16.181 1471 2HB LYS 94 2HB LYS 94 -11.227 5.532 -16.937 1472 1HG LYS 94 1HG LYS 94 -9.827 3.070 -17.957 1473 2HG LYS 94 2HG LYS 94 -11.378 3.668 -18.552 1474 1HD LYS 94 1HD LYS 94 -9.931 5.910 -18.782 1475 2HD LYS 94 2HD LYS 94 -8.642 4.720 -18.972 1476 1HE LYS 94 1HE LYS 94 -9.529 3.872 -20.918 1477 2HE LYS 94 2HE LYS 94 -11.170 4.374 -20.514 1478 1HZ LYS 94 1HZ LYS 94 -10.178 5.685 -22.321 1479 2HZ LYS 94 2HZ LYS 94 -8.977 6.230 -21.263 1480 3HZ LYS 94 3HZ LYS 94 -10.594 6.642 -20.989 1481 H ASP 95 H ASP 95 -10.869 6.279 -14.407 1482 HA ASP 95 HA ASP 95 -9.223 8.665 -14.477 1483 1HB ASP 95 1HB ASP 95 -10.848 10.145 -15.350 1484 2HB ASP 95 2HB ASP 95 -10.839 8.770 -16.450 1485 H TYR 96 H TYR 96 -10.455 6.563 -12.618 1486 HA TYR 96 HA TYR 96 -11.194 8.470 -10.537 1487 1HB TYR 96 1HB TYR 96 -13.086 6.941 -9.834 1488 2HB TYR 96 2HB TYR 96 -13.361 7.859 -11.311 1489 HD1 TYR 96 HD1 TYR 96 -13.217 6.718 -13.516 1490 HD2 TYR 96 HD2 TYR 96 -13.026 4.560 -9.854 1491 HE1 TYR 96 HE1 TYR 96 -13.717 4.635 -14.725 1492 HE2 TYR 96 HE2 TYR 96 -13.525 2.471 -11.052 1493 HH TYR 96 HH TYR 96 -14.871 2.074 -13.574 1494 H PHE 97 H PHE 97 -11.572 7.104 -8.403 1495 HA PHE 97 HA PHE 97 -9.448 5.067 -8.267 1496 1HB PHE 97 1HB PHE 97 -10.051 7.318 -6.351 1497 2HB PHE 97 2HB PHE 97 -9.068 5.929 -5.901 1498 HD1 PHE 97 HD1 PHE 97 -7.416 5.438 -8.197 1499 HD2 PHE 97 HD2 PHE 97 -8.678 9.150 -6.539 1500 HE1 PHE 97 HE1 PHE 97 -5.429 6.535 -9.149 1501 HE2 PHE 97 HE2 PHE 97 -6.694 10.253 -7.489 1502 HZ PHE 97 HZ PHE 97 -5.067 8.945 -8.797 1503 H LEU 98 H LEU 98 -10.315 3.158 -7.825 1504 HA LEU 98 HA LEU 98 -12.897 2.915 -6.581 1505 1HB LEU 98 1HB LEU 98 -11.610 1.417 -8.384 1506 2HB LEU 98 2HB LEU 98 -11.160 0.541 -6.923 1507 HG LEU 98 HG LEU 98 -14.002 1.061 -6.991 1508 1HD1 LEU 98 1HD1 LEU 98 -13.350 0.954 -9.486 1509 2HD1 LEU 98 2HD1 LEU 98 -14.675 -0.055 -8.908 1510 3HD1 LEU 98 3HD1 LEU 98 -13.082 -0.762 -9.179 1511 1HD2 LEU 98 1HD2 LEU 98 -13.966 -1.488 -6.848 1512 2HD2 LEU 98 2HD2 LEU 98 -13.197 -0.591 -5.539 1513 3HD2 LEU 98 3HD2 LEU 98 -12.210 -1.340 -6.795 1514 H ILE 99 H ILE 99 -13.359 2.450 -4.514 1515 HA ILE 99 HA ILE 99 -11.125 1.756 -2.723 1516 HB ILE 99 HB ILE 99 -13.465 3.497 -1.951 1517 1HG1 ILE 99 1HG1 ILE 99 -11.150 5.038 -1.852 1518 2HG1 ILE 99 2HG1 ILE 99 -11.002 4.147 -3.363 1519 1HG2 ILE 99 1HG2 ILE 99 -12.643 3.512 0.137 1520 2HG2 ILE 99 2HG2 ILE 99 -11.814 2.037 -0.360 1521 3HG2 ILE 99 3HG2 ILE 99 -10.970 3.585 -0.415 1522 1HD1 ILE 99 1HD1 ILE 99 -13.438 5.730 -2.598 1523 2HD1 ILE 99 2HD1 ILE 99 -12.100 6.375 -3.550 1524 3HD1 ILE 99 3HD1 ILE 99 -13.055 5.028 -4.170 1525 H VAL 100 H VAL 100 -11.482 -0.355 -2.338 1526 HA VAL 100 HA VAL 100 -14.201 -1.269 -1.751 1527 HB VAL 100 HB VAL 100 -11.711 -2.951 -2.039 1528 1HG1 VAL 100 1HG1 VAL 100 -13.131 -4.434 -1.107 1529 2HG1 VAL 100 2HG1 VAL 100 -14.563 -3.499 -1.542 1530 3HG1 VAL 100 3HG1 VAL 100 -13.782 -4.528 -2.743 1531 1HG2 VAL 100 1HG2 VAL 100 -12.066 -1.754 -4.107 1532 2HG2 VAL 100 2HG2 VAL 100 -12.530 -3.442 -4.320 1533 3HG2 VAL 100 3HG2 VAL 100 -13.771 -2.206 -4.113 1534 H ILE 101 H ILE 101 -14.810 -1.166 0.304 1535 HA ILE 101 HA ILE 101 -12.798 -1.612 2.404 1536 HB ILE 101 HB ILE 101 -15.515 -0.372 2.799 1537 1HG1 ILE 101 1HG1 ILE 101 -12.881 1.030 2.292 1538 2HG1 ILE 101 2HG1 ILE 101 -14.239 0.968 1.173 1539 1HG2 ILE 101 1HG2 ILE 101 -13.332 0.424 4.545 1540 2HG2 ILE 101 2HG2 ILE 101 -14.946 -0.160 4.945 1541 3HG2 ILE 101 3HG2 ILE 101 -13.654 -1.309 4.599 1542 1HD1 ILE 101 1HD1 ILE 101 -15.597 2.256 2.676 1543 2HD1 ILE 101 2HD1 ILE 101 -14.334 2.216 3.908 1544 3HD1 ILE 101 3HD1 ILE 101 -14.070 3.095 2.402 1545 H GLN 102 H GLN 102 -12.881 -3.446 3.511 1546 HA GLN 102 HA GLN 102 -15.297 -4.652 4.382 1547 1HB GLN 102 1HB GLN 102 -15.278 -6.684 3.105 1548 2HB GLN 102 2HB GLN 102 -15.297 -5.334 1.978 1549 1HG GLN 102 1HG GLN 102 -13.017 -5.630 1.438 1550 2HG GLN 102 2HG GLN 102 -12.773 -6.749 2.778 1551 1HE2 GLN 102 1HE2 GLN 102 -12.738 -6.748 -0.358 1552 2HE2 GLN 102 2HE2 GLN 102 -13.475 -8.265 -0.730 1553 H ASN 103 H ASN 103 -14.936 -6.512 5.731 1554 HA ASN 103 HA ASN 103 -12.740 -6.327 7.397 1555 1HB ASN 103 1HB ASN 103 -13.478 -8.345 8.422 1556 2HB ASN 103 2HB ASN 103 -14.928 -7.531 7.843 1557 1HD2 ASN 103 1HD2 ASN 103 -14.812 -10.250 8.435 1558 2HD2 ASN 103 2HD2 ASN 103 -15.040 -11.142 6.973 1559 HA PRO 104 HA PRO 104 -9.376 -8.344 5.427 1560 1HB PRO 104 1HB PRO 104 -8.130 -9.499 7.544 1561 2HB PRO 104 2HB PRO 104 -8.107 -7.756 7.250 1562 1HG PRO 104 1HG PRO 104 -9.826 -9.339 9.121 1563 2HG PRO 104 2HG PRO 104 -9.001 -7.793 9.396 1564 1HD PRO 104 1HD PRO 104 -11.642 -7.953 8.819 1565 2HD PRO 104 2HD PRO 104 -10.634 -6.585 8.307 1566 H THR 105 H THR 105 -8.736 -10.303 4.584 1567 HA THR 105 HA THR 105 -10.455 -12.589 5.251 1568 HB THR 105 HB THR 105 -10.027 -13.466 3.080 1569 HG1 THR 105 HG1 THR 105 -8.536 -12.000 1.719 1570 1HG2 THR 105 1HG2 THR 105 -11.623 -11.571 3.189 1571 2HG2 THR 105 2HG2 THR 105 -10.831 -11.712 1.620 1572 3HG2 THR 105 3HG2 THR 105 -10.308 -10.476 2.765 1573 H GLU 106 H GLU 106 -7.066 -11.769 4.558 1574 HA GLU 106 HA GLU 106 -6.256 -14.314 5.785 1575 1HB GLU 106 1HB GLU 106 -5.340 -12.879 3.491 1576 2HB GLU 106 2HB GLU 106 -4.028 -12.954 4.659 1577 1HG GLU 106 1HG GLU 106 -4.004 -15.295 4.653 1578 2HG GLU 106 2HG GLU 106 -5.580 -15.393 3.870 Start of MODEL 14 1 H MET 11 H MET 11 18.219 -8.388 14.706 2 HA MET 11 HA MET 11 18.530 -7.954 11.937 3 1HB MET 11 1HB MET 11 20.272 -7.251 13.418 4 2HB MET 11 2HB MET 11 20.464 -8.876 14.063 5 1HG MET 11 1HG MET 11 21.827 -9.500 12.412 6 2HG MET 11 2HG MET 11 20.853 -8.706 11.177 7 1HE MET 11 1HE MET 11 21.395 -5.237 11.532 8 2HE MET 11 2HE MET 11 22.351 -5.804 10.163 9 3HE MET 11 3HE MET 11 20.813 -6.579 10.547 10 H ALA 12 H ALA 12 19.345 -10.848 13.864 11 HA ALA 12 HA ALA 12 19.973 -12.553 11.786 12 1HB ALA 12 1HB ALA 12 18.934 -14.321 13.483 13 2HB ALA 12 2HB ALA 12 20.478 -13.519 13.778 14 3HB ALA 12 3HB ALA 12 19.013 -12.929 14.563 15 H GLU 13 H GLU 13 16.796 -11.795 13.142 16 HA GLU 13 HA GLU 13 15.248 -13.699 11.868 17 1HB GLU 13 1HB GLU 13 14.285 -12.252 13.531 18 2HB GLU 13 2HB GLU 13 14.603 -10.829 12.549 19 1HG GLU 13 1HG GLU 13 12.907 -11.342 11.037 20 2HG GLU 13 2HG GLU 13 12.817 -13.020 11.567 21 H VAL 14 H VAL 14 16.091 -10.447 10.684 22 HA VAL 14 HA VAL 14 14.805 -10.696 8.190 23 HB VAL 14 HB VAL 14 17.215 -8.979 8.786 24 1HG1 VAL 14 1HG1 VAL 14 15.416 -7.656 7.112 25 2HG1 VAL 14 2HG1 VAL 14 16.972 -8.358 6.664 26 3HG1 VAL 14 3HG1 VAL 14 15.494 -9.307 6.498 27 1HG2 VAL 14 1HG2 VAL 14 15.861 -8.204 10.436 28 2HG2 VAL 14 2HG2 VAL 14 15.183 -7.279 9.096 29 3HG2 VAL 14 3HG2 VAL 14 14.387 -8.756 9.640 30 H GLU 15 H GLU 15 18.055 -11.505 9.276 31 HA GLU 15 HA GLU 15 19.191 -11.986 6.743 32 1HB GLU 15 1HB GLU 15 19.855 -12.960 9.512 33 2HB GLU 15 2HB GLU 15 20.774 -13.486 8.108 34 1HG GLU 15 1HG GLU 15 21.380 -11.193 7.611 35 2HG GLU 15 2HG GLU 15 20.407 -10.625 8.967 36 H GLU 16 H GLU 16 17.482 -14.094 9.013 37 HA GLU 16 HA GLU 16 17.886 -16.519 7.671 38 1HB GLU 16 1HB GLU 16 16.684 -15.812 9.995 39 2HB GLU 16 2HB GLU 16 15.273 -16.151 9.003 40 1HG GLU 16 1HG GLU 16 17.141 -18.246 8.609 41 2HG GLU 16 2HG GLU 16 16.979 -17.971 10.343 42 H THR 17 H THR 17 15.416 -14.029 7.283 43 HA THR 17 HA THR 17 13.948 -15.528 5.312 44 HB THR 17 HB THR 17 13.739 -12.618 6.109 45 HG1 THR 17 HG1 THR 17 13.152 -14.546 7.579 46 1HG2 THR 17 1HG2 THR 17 12.246 -14.298 4.149 47 2HG2 THR 17 2HG2 THR 17 12.707 -12.598 4.055 48 3HG2 THR 17 3HG2 THR 17 11.358 -13.091 5.078 49 H LEU 18 H LEU 18 16.568 -13.266 5.320 50 HA LEU 18 HA LEU 18 16.319 -12.388 2.625 51 1HB LEU 18 1HB LEU 18 18.020 -11.888 4.843 52 2HB LEU 18 2HB LEU 18 19.034 -12.309 3.465 53 HG LEU 18 HG LEU 18 17.322 -10.488 2.364 54 1HD1 LEU 18 1HD1 LEU 18 16.333 -9.985 4.545 55 2HD1 LEU 18 2HD1 LEU 18 17.199 -8.597 3.887 56 3HD1 LEU 18 3HD1 LEU 18 17.928 -9.563 5.169 57 1HD2 LEU 18 1HD2 LEU 18 19.888 -10.737 2.367 58 2HD2 LEU 18 2HD2 LEU 18 19.843 -9.619 3.730 59 3HD2 LEU 18 3HD2 LEU 18 19.196 -9.127 2.164 60 H LYS 19 H LYS 19 18.020 -15.032 4.208 61 HA LYS 19 HA LYS 19 19.614 -15.856 2.055 62 1HB LYS 19 1HB LYS 19 18.391 -17.563 4.231 63 2HB LYS 19 2HB LYS 19 19.748 -18.016 3.208 64 1HG LYS 19 1HG LYS 19 20.203 -15.494 4.558 65 2HG LYS 19 2HG LYS 19 19.880 -16.810 5.689 66 1HD LYS 19 1HD LYS 19 21.770 -17.322 3.451 67 2HD LYS 19 2HD LYS 19 22.321 -16.306 4.785 68 1HE LYS 19 1HE LYS 19 21.057 -18.469 6.002 69 2HE LYS 19 2HE LYS 19 21.968 -19.173 4.667 70 1HZ LYS 19 1HZ LYS 19 22.918 -18.150 7.136 71 2HZ LYS 19 2HZ LYS 19 23.658 -17.344 5.847 72 3HZ LYS 19 3HZ LYS 19 23.750 -19.030 5.955 73 H ARG 20 H ARG 20 16.399 -17.000 3.077 74 HA ARG 20 HA ARG 20 16.062 -18.803 0.928 75 1HB ARG 20 1HB ARG 20 14.777 -18.700 3.146 76 2HB ARG 20 2HB ARG 20 13.807 -17.444 2.389 77 1HG ARG 20 1HG ARG 20 12.497 -19.137 1.754 78 2HG ARG 20 2HG ARG 20 13.715 -19.396 0.503 79 1HD ARG 20 1HD ARG 20 14.217 -20.645 3.137 80 2HD ARG 20 2HD ARG 20 12.901 -21.320 2.177 81 HE ARG 20 HE ARG 20 15.697 -21.599 1.687 82 1HH1 ARG 20 1HH1 ARG 20 12.585 -21.406 0.140 83 2HH1 ARG 20 2HH1 ARG 20 13.080 -22.297 -1.260 84 1HH2 ARG 20 1HH2 ARG 20 16.361 -22.774 -0.151 85 2HH2 ARG 20 2HH2 ARG 20 15.228 -23.076 -1.424 86 H LEU 21 H LEU 21 15.456 -15.385 1.292 87 HA LEU 21 HA LEU 21 13.789 -15.092 -0.995 88 1HB LEU 21 1HB LEU 21 15.100 -13.350 0.956 89 2HB LEU 21 2HB LEU 21 14.962 -12.644 -0.653 90 HG LEU 21 HG LEU 21 12.567 -12.845 -0.596 91 1HD1 LEU 21 1HD1 LEU 21 11.632 -14.496 0.551 92 2HD1 LEU 21 2HD1 LEU 21 11.965 -13.594 2.029 93 3HD1 LEU 21 3HD1 LEU 21 13.124 -14.789 1.446 94 1HD2 LEU 21 1HD2 LEU 21 13.796 -11.645 1.873 95 2HD2 LEU 21 2HD2 LEU 21 12.087 -11.465 1.474 96 3HD2 LEU 21 3HD2 LEU 21 13.319 -10.834 0.381 97 H GLN 22 H GLN 22 17.225 -14.333 -0.427 98 HA GLN 22 HA GLN 22 17.763 -13.655 -3.125 99 1HB GLN 22 1HB GLN 22 19.144 -13.551 -0.696 100 2HB GLN 22 2HB GLN 22 20.091 -14.635 -1.706 101 1HG GLN 22 1HG GLN 22 20.832 -12.974 -2.987 102 2HG GLN 22 2HG GLN 22 19.235 -12.238 -3.111 103 1HE2 GLN 22 1HE2 GLN 22 18.521 -11.290 -0.881 104 2HE2 GLN 22 2HE2 GLN 22 19.692 -10.267 -0.130 105 H SER 23 H SER 23 17.351 -16.639 -1.545 106 HA SER 23 HA SER 23 18.973 -18.158 -3.407 107 1HB SER 23 1HB SER 23 18.736 -18.820 -1.005 108 2HB SER 23 2HB SER 23 17.038 -19.181 -1.317 109 HG SER 23 HG SER 23 19.341 -20.503 -2.231 110 H GLN 24 H GLN 24 15.788 -16.968 -3.220 111 HA GLN 24 HA GLN 24 14.822 -18.918 -5.191 112 1HB GLN 24 1HB GLN 24 12.586 -18.147 -4.657 113 2HB GLN 24 2HB GLN 24 13.432 -18.580 -3.177 114 1HG GLN 24 1HG GLN 24 13.702 -16.344 -2.543 115 2HG GLN 24 2HG GLN 24 13.320 -15.751 -4.159 116 1HE2 GLN 24 1HE2 GLN 24 12.031 -14.601 -2.146 117 2HE2 GLN 24 2HE2 GLN 24 10.385 -15.119 -2.070 118 H LYS 25 H LYS 25 13.764 -18.200 -7.098 119 HA LYS 25 HA LYS 25 14.993 -15.869 -8.255 120 1HB LYS 25 1HB LYS 25 14.717 -17.884 -9.595 121 2HB LYS 25 2HB LYS 25 12.974 -17.824 -9.371 122 1HG LYS 25 1HG LYS 25 12.707 -16.383 -11.045 123 2HG LYS 25 2HG LYS 25 14.035 -15.362 -10.488 124 1HD LYS 25 1HD LYS 25 15.487 -17.368 -11.425 125 2HD LYS 25 2HD LYS 25 14.051 -17.628 -12.417 126 1HE LYS 25 1HE LYS 25 14.181 -15.346 -13.239 127 2HE LYS 25 2HE LYS 25 15.564 -15.027 -12.194 128 1HZ LYS 25 1HZ LYS 25 16.886 -15.780 -13.781 129 2HZ LYS 25 2HZ LYS 25 15.558 -16.098 -14.779 130 3HZ LYS 25 3HZ LYS 25 16.133 -17.294 -13.730 131 H GLY 26 H GLY 26 14.106 -13.913 -8.634 132 1HA GLY 26 1HA GLY 26 11.951 -12.751 -9.214 133 2HA GLY 26 2HA GLY 26 11.300 -13.544 -7.786 134 H VAL 27 H VAL 27 13.554 -13.188 -6.095 135 HA VAL 27 HA VAL 27 13.003 -10.621 -5.067 136 HB VAL 27 HB VAL 27 15.323 -12.459 -4.457 137 1HG1 VAL 27 1HG1 VAL 27 14.854 -10.979 -2.205 138 2HG1 VAL 27 2HG1 VAL 27 16.135 -10.671 -3.379 139 3HG1 VAL 27 3HG1 VAL 27 14.608 -9.795 -3.488 140 1HG2 VAL 27 1HG2 VAL 27 12.648 -12.099 -3.110 141 2HG2 VAL 27 2HG2 VAL 27 13.192 -13.515 -4.008 142 3HG2 VAL 27 3HG2 VAL 27 13.971 -13.083 -2.486 143 H GLN 28 H GLN 28 13.919 -8.685 -5.393 144 HA GLN 28 HA GLN 28 16.119 -8.534 -7.327 145 1HB GLN 28 1HB GLN 28 13.855 -6.750 -6.600 146 2HB GLN 28 2HB GLN 28 15.348 -5.982 -7.122 147 1HG GLN 28 1HG GLN 28 13.695 -6.358 -8.935 148 2HG GLN 28 2HG GLN 28 15.274 -7.086 -9.227 149 1HE2 GLN 28 1HE2 GLN 28 11.979 -7.593 -9.208 150 2HE2 GLN 28 2HE2 GLN 28 11.974 -9.319 -9.279 151 H GLY 29 H GLY 29 15.218 -7.712 -4.056 152 1HA GLY 29 1HA GLY 29 17.706 -7.656 -2.957 153 2HA GLY 29 2HA GLY 29 17.509 -6.029 -3.590 154 H ILE 30 H ILE 30 17.467 -7.544 -0.821 155 HA ILE 30 HA ILE 30 14.999 -6.358 0.225 156 HB ILE 30 HB ILE 30 16.942 -8.123 1.709 157 1HG1 ILE 30 1HG1 ILE 30 14.864 -9.757 1.244 158 2HG1 ILE 30 2HG1 ILE 30 14.773 -8.776 -0.215 159 1HG2 ILE 30 1HG2 ILE 30 14.028 -7.608 2.256 160 2HG2 ILE 30 2HG2 ILE 30 15.201 -8.413 3.297 161 3HG2 ILE 30 3HG2 ILE 30 15.334 -6.681 2.996 162 1HD1 ILE 30 1HD1 ILE 30 16.597 -9.715 -1.101 163 2HD1 ILE 30 2HD1 ILE 30 17.457 -9.743 0.438 164 3HD1 ILE 30 3HD1 ILE 30 16.282 -11.002 0.061 165 H ILE 31 H ILE 31 14.981 -4.744 1.720 166 HA ILE 31 HA ILE 31 17.590 -3.658 2.554 167 HB ILE 31 HB ILE 31 15.144 -2.073 1.762 168 1HG1 ILE 31 1HG1 ILE 31 17.780 -1.722 0.438 169 2HG1 ILE 31 2HG1 ILE 31 16.889 -3.192 0.057 170 1HG2 ILE 31 1HG2 ILE 31 16.838 -0.150 2.021 171 2HG2 ILE 31 2HG2 ILE 31 16.109 -0.831 3.474 172 3HG2 ILE 31 3HG2 ILE 31 17.748 -1.288 3.014 173 1HD1 ILE 31 1HD1 ILE 31 15.699 -2.052 -1.409 174 2HD1 ILE 31 2HD1 ILE 31 15.064 -1.052 -0.103 175 3HD1 ILE 31 3HD1 ILE 31 16.527 -0.563 -0.957 176 H VAL 32 H VAL 32 17.751 -2.859 4.626 177 HA VAL 32 HA VAL 32 15.366 -3.062 6.334 178 HB VAL 32 HB VAL 32 18.092 -4.013 7.208 179 1HG1 VAL 32 1HG1 VAL 32 16.579 -3.255 8.985 180 2HG1 VAL 32 2HG1 VAL 32 15.353 -4.391 8.417 181 3HG1 VAL 32 3HG1 VAL 32 16.877 -4.991 9.074 182 1HG2 VAL 32 1HG2 VAL 32 17.258 -6.291 6.953 183 2HG2 VAL 32 2HG2 VAL 32 15.748 -5.675 6.282 184 3HG2 VAL 32 3HG2 VAL 32 17.261 -5.447 5.404 185 H VAL 33 H VAL 33 15.138 -1.476 7.823 186 HA VAL 33 HA VAL 33 17.404 0.278 8.410 187 HB VAL 33 HB VAL 33 14.748 1.473 7.651 188 1HG1 VAL 33 1HG1 VAL 33 15.887 3.528 7.617 189 2HG1 VAL 33 2HG1 VAL 33 16.473 2.705 9.063 190 3HG1 VAL 33 3HG1 VAL 33 17.468 2.748 7.607 191 1HG2 VAL 33 1HG2 VAL 33 15.332 0.507 5.621 192 2HG2 VAL 33 2HG2 VAL 33 16.040 2.119 5.505 193 3HG2 VAL 33 3HG2 VAL 33 17.060 0.734 5.896 194 H ASN 34 H ASN 34 17.344 1.212 10.418 195 HA ASN 34 HA ASN 34 15.583 0.029 12.335 196 1HB ASN 34 1HB ASN 34 17.311 2.390 12.979 197 2HB ASN 34 2HB ASN 34 16.946 0.974 13.961 198 1HD2 ASN 34 1HD2 ASN 34 19.292 2.464 12.240 199 2HD2 ASN 34 2HD2 ASN 34 20.304 1.109 11.885 200 H THR 35 H THR 35 15.017 1.974 14.148 201 HA THR 35 HA THR 35 12.736 3.237 12.952 202 HB THR 35 HB THR 35 12.439 4.220 15.280 203 HG1 THR 35 HG1 THR 35 13.781 2.913 16.842 204 1HG2 THR 35 1HG2 THR 35 12.497 1.481 16.020 205 2HG2 THR 35 2HG2 THR 35 12.072 1.566 14.310 206 3HG2 THR 35 3HG2 THR 35 11.115 2.444 15.502 207 H GLU 36 H GLU 36 15.974 4.171 13.673 208 HA GLU 36 HA GLU 36 15.511 6.989 13.807 209 1HB GLU 36 1HB GLU 36 17.914 5.226 13.627 210 2HB GLU 36 2HB GLU 36 18.094 6.931 13.240 211 1HG GLU 36 1HG GLU 36 16.684 6.973 15.600 212 2HG GLU 36 2HG GLU 36 17.795 5.622 15.814 213 H GLY 37 H GLY 37 16.557 4.745 11.274 214 1HA GLY 37 1HA GLY 37 15.553 5.382 9.040 215 2HA GLY 37 2HA GLY 37 16.296 6.949 9.326 216 H ILE 38 H ILE 38 18.325 4.686 10.602 217 HA ILE 38 HA ILE 38 20.084 4.858 8.282 218 HB ILE 38 HB ILE 38 20.708 3.755 11.021 219 1HG1 ILE 38 1HG1 ILE 38 21.300 6.511 9.924 220 2HG1 ILE 38 2HG1 ILE 38 20.006 6.150 11.061 221 1HG2 ILE 38 1HG2 ILE 38 22.212 2.987 9.264 222 2HG2 ILE 38 2HG2 ILE 38 22.503 4.654 8.772 223 3HG2 ILE 38 3HG2 ILE 38 23.038 4.097 10.357 224 1HD1 ILE 38 1HD1 ILE 38 22.786 6.647 11.554 225 2HD1 ILE 38 2HD1 ILE 38 21.445 6.528 12.694 226 3HD1 ILE 38 3HD1 ILE 38 22.314 5.075 12.199 227 HA PRO 39 HA PRO 39 19.149 0.715 7.034 228 1HB PRO 39 1HB PRO 39 21.193 0.424 5.271 229 2HB PRO 39 2HB PRO 39 19.754 1.389 4.923 230 1HG PRO 39 1HG PRO 39 22.458 2.285 5.841 231 2HG PRO 39 2HG PRO 39 21.406 2.994 4.603 232 1HD PRO 39 1HD PRO 39 21.594 4.004 7.109 233 2HD PRO 39 2HD PRO 39 20.096 4.078 6.159 234 H ILE 40 H ILE 40 19.758 -1.306 7.635 235 HA ILE 40 HA ILE 40 22.362 -1.575 8.991 236 HB ILE 40 HB ILE 40 21.160 -3.518 10.204 237 1HG1 ILE 40 1HG1 ILE 40 18.787 -1.855 9.331 238 2HG1 ILE 40 2HG1 ILE 40 19.137 -3.500 8.811 239 1HG2 ILE 40 1HG2 ILE 40 21.930 -1.340 11.178 240 2HG2 ILE 40 2HG2 ILE 40 20.303 -0.719 10.903 241 3HG2 ILE 40 3HG2 ILE 40 20.554 -2.077 11.999 242 1HD1 ILE 40 1HD1 ILE 40 18.048 -4.304 10.554 243 2HD1 ILE 40 2HD1 ILE 40 19.096 -3.413 11.658 244 3HD1 ILE 40 3HD1 ILE 40 17.633 -2.657 11.028 245 H LYS 41 H LYS 41 20.003 -3.086 6.870 246 HA LYS 41 HA LYS 41 22.110 -4.881 5.902 247 1HB LYS 41 1HB LYS 41 19.446 -5.649 7.001 248 2HB LYS 41 2HB LYS 41 20.065 -6.557 5.628 249 1HG LYS 41 1HG LYS 41 22.230 -6.517 7.277 250 2HG LYS 41 2HG LYS 41 20.896 -6.580 8.431 251 1HD LYS 41 1HD LYS 41 21.035 -8.803 8.075 252 2HD LYS 41 2HD LYS 41 20.082 -8.430 6.637 253 1HE LYS 41 1HE LYS 41 21.893 -9.798 5.936 254 2HE LYS 41 2HE LYS 41 22.249 -8.158 5.396 255 1HZ LYS 41 1HZ LYS 41 23.322 -8.518 7.963 256 2HZ LYS 41 2HZ LYS 41 24.142 -8.229 6.513 257 3HZ LYS 41 3HZ LYS 41 23.817 -9.816 6.999 258 H SER 42 H SER 42 22.231 -4.984 3.742 259 HA SER 42 HA SER 42 19.988 -4.682 2.014 260 1HB SER 42 1HB SER 42 20.916 -2.272 2.898 261 2HB SER 42 2HB SER 42 21.873 -2.490 1.432 262 HG SER 42 HG SER 42 19.573 -3.135 0.618 263 H THR 43 H THR 43 20.455 -5.254 -0.101 264 HA THR 43 HA THR 43 23.193 -6.247 -0.535 265 HB THR 43 HB THR 43 22.325 -7.930 -1.974 266 HG1 THR 43 HG1 THR 43 19.905 -6.450 -1.817 267 1HG2 THR 43 1HG2 THR 43 20.118 -8.283 -0.144 268 2HG2 THR 43 2HG2 THR 43 21.565 -7.743 0.707 269 3HG2 THR 43 3HG2 THR 43 21.616 -9.202 -0.283 270 H MET 44 H MET 44 20.904 -3.965 -1.571 271 HA MET 44 HA MET 44 21.652 -3.757 -4.305 272 1HB MET 44 1HB MET 44 20.550 -1.483 -2.677 273 2HB MET 44 2HB MET 44 20.304 -1.830 -4.383 274 1HG MET 44 1HG MET 44 19.287 -4.059 -3.130 275 2HG MET 44 2HG MET 44 18.822 -2.737 -2.062 276 1HE MET 44 1HE MET 44 18.504 -4.551 -5.275 277 2HE MET 44 2HE MET 44 17.297 -3.692 -6.232 278 3HE MET 44 3HE MET 44 18.959 -3.105 -6.177 279 H ASP 45 H ASP 45 22.207 -1.114 -4.746 280 HA ASP 45 HA ASP 45 24.991 -0.988 -3.917 281 1HB ASP 45 1HB ASP 45 23.885 -0.515 -6.306 282 2HB ASP 45 2HB ASP 45 23.806 1.119 -5.651 283 H ASN 46 H ASN 46 25.688 1.544 -3.778 284 HA ASN 46 HA ASN 46 24.818 2.382 -1.236 285 1HB ASN 46 1HB ASN 46 26.927 3.005 -2.914 286 2HB ASN 46 2HB ASN 46 26.002 4.503 -2.863 287 1HD2 ASN 46 1HD2 ASN 46 26.537 2.015 -0.404 288 2HD2 ASN 46 2HD2 ASN 46 27.252 3.073 0.760 289 HA PRO 47 HA PRO 47 22.422 5.878 -3.575 290 1HB PRO 47 1HB PRO 47 22.059 5.541 -6.245 291 2HB PRO 47 2HB PRO 47 23.455 6.385 -5.564 292 1HG PRO 47 1HG PRO 47 23.241 3.565 -6.546 293 2HG PRO 47 2HG PRO 47 24.539 4.745 -6.805 294 1HD PRO 47 1HD PRO 47 24.711 2.772 -4.958 295 2HD PRO 47 2HD PRO 47 25.475 4.359 -4.734 296 H THR 48 H THR 48 22.097 2.525 -4.484 297 HA THR 48 HA THR 48 19.271 2.700 -5.033 298 HB THR 48 HB THR 48 20.710 0.120 -4.494 299 HG1 THR 48 HG1 THR 48 21.251 0.202 -6.795 300 1HG2 THR 48 1HG2 THR 48 18.270 0.118 -4.900 301 2HG2 THR 48 2HG2 THR 48 19.164 -0.750 -6.148 302 3HG2 THR 48 3HG2 THR 48 18.553 0.873 -6.469 303 H THR 49 H THR 49 21.320 1.532 -2.395 304 HA THR 49 HA THR 49 19.081 0.669 -0.805 305 HB THR 49 HB THR 49 22.029 0.920 -0.229 306 HG1 THR 49 HG1 THR 49 20.207 -1.179 -0.736 307 1HG2 THR 49 1HG2 THR 49 19.808 0.107 1.644 308 2HG2 THR 49 2HG2 THR 49 20.956 1.429 1.854 309 3HG2 THR 49 3HG2 THR 49 21.512 -0.243 1.927 310 H THR 50 H THR 50 21.462 3.308 -0.573 311 HA THR 50 HA THR 50 20.464 4.538 1.714 312 HB THR 50 HB THR 50 21.734 5.934 -0.649 313 HG1 THR 50 HG1 THR 50 23.376 4.713 -0.086 314 1HG2 THR 50 1HG2 THR 50 21.122 6.725 2.160 315 2HG2 THR 50 2HG2 THR 50 21.039 7.676 0.677 316 3HG2 THR 50 3HG2 THR 50 22.602 7.329 1.415 317 H GLN 51 H GLN 51 19.338 4.656 -1.588 318 HA GLN 51 HA GLN 51 17.645 6.929 -1.258 319 1HB GLN 51 1HB GLN 51 18.424 6.303 -3.467 320 2HB GLN 51 2HB GLN 51 17.648 4.730 -3.331 321 1HG GLN 51 1HG GLN 51 15.619 6.590 -2.886 322 2HG GLN 51 2HG GLN 51 16.567 7.239 -4.223 323 1HE2 GLN 51 1HE2 GLN 51 14.288 4.917 -3.239 324 2HE2 GLN 51 2HE2 GLN 51 14.118 4.096 -4.749 325 H TYR 52 H TYR 52 17.000 3.431 -1.452 326 HA TYR 52 HA TYR 52 14.246 3.568 -0.986 327 1HB TYR 52 1HB TYR 52 16.309 1.422 -0.627 328 2HB TYR 52 2HB TYR 52 14.663 1.158 -0.060 329 HD1 TYR 52 HD1 TYR 52 16.132 2.718 -3.130 330 HD2 TYR 52 HD2 TYR 52 13.494 -0.199 -1.506 331 HE1 TYR 52 HE1 TYR 52 15.459 2.068 -5.405 332 HE2 TYR 52 HE2 TYR 52 12.815 -0.858 -3.776 333 HH TYR 52 HH TYR 52 12.834 0.530 -6.177 334 H ALA 53 H ALA 53 16.967 3.411 1.245 335 HA ALA 53 HA ALA 53 15.690 2.870 3.627 336 1HB ALA 53 1HB ALA 53 17.898 4.896 3.362 337 2HB ALA 53 2HB ALA 53 17.540 3.849 4.736 338 3HB ALA 53 3HB ALA 53 18.163 3.157 3.238 339 H SER 54 H SER 54 16.256 6.086 2.196 340 HA SER 54 HA SER 54 14.640 7.391 4.183 341 1HB SER 54 1HB SER 54 16.276 8.224 1.856 342 2HB SER 54 2HB SER 54 14.935 9.286 2.282 343 HG SER 54 HG SER 54 16.742 8.356 4.238 344 H LEU 55 H LEU 55 14.293 6.632 0.733 345 HA LEU 55 HA LEU 55 11.874 7.834 0.204 346 1HB LEU 55 1HB LEU 55 13.463 6.479 -1.318 347 2HB LEU 55 2HB LEU 55 12.490 5.092 -0.833 348 HG LEU 55 HG LEU 55 11.822 6.016 -3.015 349 1HD1 LEU 55 1HD1 LEU 55 9.578 5.702 -2.673 350 2HD1 LEU 55 2HD1 LEU 55 9.565 6.619 -1.167 351 3HD1 LEU 55 3HD1 LEU 55 10.237 4.989 -1.200 352 1HD2 LEU 55 1HD2 LEU 55 12.391 8.379 -2.468 353 2HD2 LEU 55 2HD2 LEU 55 10.940 8.447 -1.467 354 3HD2 LEU 55 3HD2 LEU 55 10.801 8.173 -3.204 355 H MET 56 H MET 56 12.487 4.729 1.770 356 HA MET 56 HA MET 56 9.689 4.080 1.976 357 1HB MET 56 1HB MET 56 12.144 2.837 3.224 358 2HB MET 56 2HB MET 56 10.516 2.198 3.404 359 1HG MET 56 1HG MET 56 11.953 2.540 0.782 360 2HG MET 56 2HG MET 56 11.836 1.032 1.687 361 1HE MET 56 1HE MET 56 10.060 1.069 -1.639 362 2HE MET 56 2HE MET 56 9.499 2.727 -1.423 363 3HE MET 56 3HE MET 56 11.187 2.319 -1.112 364 H HIS 57 H HIS 57 12.229 5.180 4.197 365 HA HIS 57 HA HIS 57 10.837 5.140 6.579 366 1HB HIS 57 1HB HIS 57 13.189 5.661 6.544 367 2HB HIS 57 2HB HIS 57 12.901 7.119 5.600 368 HD1 HIS 57 HD1 HIS 57 11.677 9.105 6.882 369 HD2 HIS 57 HD2 HIS 57 13.014 5.974 9.264 370 HE1 HIS 57 HE1 HIS 57 11.662 9.995 9.234 371 H SER 58 H SER 58 10.832 7.627 4.063 372 HA SER 58 HA SER 58 9.088 9.377 5.525 373 1HB SER 58 1HB SER 58 10.683 10.274 3.891 374 2HB SER 58 2HB SER 58 9.873 9.388 2.599 375 HG SER 58 HG SER 58 9.329 11.774 3.230 376 H PHE 59 H PHE 59 8.702 6.739 3.318 377 HA PHE 59 HA PHE 59 6.103 7.310 2.383 378 1HB PHE 59 1HB PHE 59 7.713 5.598 1.441 379 2HB PHE 59 2HB PHE 59 7.271 4.555 2.789 380 HD1 PHE 59 HD1 PHE 59 6.514 5.494 -0.524 381 HD2 PHE 59 HD2 PHE 59 4.733 4.082 3.075 382 HE1 PHE 59 HE1 PHE 59 4.585 4.665 -1.808 383 HE2 PHE 59 HE2 PHE 59 2.802 3.250 1.797 384 HZ PHE 59 HZ PHE 59 2.727 3.540 -0.648 385 H ILE 60 H ILE 60 7.162 5.071 4.950 386 HA ILE 60 HA ILE 60 4.672 4.305 5.873 387 HB ILE 60 HB ILE 60 7.165 4.723 7.527 388 1HG1 ILE 60 1HG1 ILE 60 7.563 3.218 5.652 389 2HG1 ILE 60 2HG1 ILE 60 7.518 2.303 7.155 390 1HG2 ILE 60 1HG2 ILE 60 4.523 4.002 8.287 391 2HG2 ILE 60 2HG2 ILE 60 5.561 2.589 8.474 392 3HG2 ILE 60 3HG2 ILE 60 5.972 4.098 9.289 393 1HD1 ILE 60 1HD1 ILE 60 5.902 2.036 4.793 394 2HD1 ILE 60 2HD1 ILE 60 6.062 0.955 6.178 395 3HD1 ILE 60 3HD1 ILE 60 4.898 2.279 6.223 396 H LEU 61 H LEU 61 6.592 7.140 6.764 397 HA LEU 61 HA LEU 61 4.886 8.061 8.817 398 1HB LEU 61 1HB LEU 61 7.235 8.976 7.425 399 2HB LEU 61 2HB LEU 61 6.097 10.302 7.658 400 HG LEU 61 HG LEU 61 6.093 9.801 10.090 401 1HD1 LEU 61 1HD1 LEU 61 6.717 7.465 10.020 402 2HD1 LEU 61 2HD1 LEU 61 7.883 8.371 10.982 403 3HD1 LEU 61 3HD1 LEU 61 8.291 7.879 9.339 404 1HD2 LEU 61 1HD2 LEU 61 8.938 10.191 9.677 405 2HD2 LEU 61 2HD2 LEU 61 7.727 11.297 10.326 406 3HD2 LEU 61 3HD2 LEU 61 7.962 11.169 8.582 407 H LYS 62 H LYS 62 4.726 8.253 5.368 408 HA LYS 62 HA LYS 62 2.906 10.460 5.243 409 1HB LYS 62 1HB LYS 62 4.367 8.859 3.397 410 2HB LYS 62 2HB LYS 62 2.670 8.792 2.939 411 1HG LYS 62 1HG LYS 62 3.597 10.596 1.750 412 2HG LYS 62 2HG LYS 62 2.663 11.313 3.066 413 1HD LYS 62 1HD LYS 62 4.718 11.598 4.366 414 2HD LYS 62 2HD LYS 62 5.651 10.876 3.053 415 1HE LYS 62 1HE LYS 62 3.932 13.305 2.640 416 2HE LYS 62 2HE LYS 62 5.598 13.427 3.205 417 1HZ LYS 62 1HZ LYS 62 5.093 13.563 0.690 418 2HZ LYS 62 2HZ LYS 62 4.985 11.878 0.778 419 3HZ LYS 62 3HZ LYS 62 6.422 12.657 1.215 420 H ALA 63 H ALA 63 2.525 6.946 4.778 421 HA ALA 63 HA ALA 63 -0.309 7.055 4.595 422 1HB ALA 63 1HB ALA 63 1.754 5.016 4.524 423 2HB ALA 63 2HB ALA 63 0.307 4.477 5.378 424 3HB ALA 63 3HB ALA 63 0.185 5.066 3.720 425 H ARG 64 H ARG 64 1.924 6.196 7.222 426 HA ARG 64 HA ARG 64 0.018 5.476 9.131 427 1HB ARG 64 1HB ARG 64 2.570 5.228 9.218 428 2HB ARG 64 2HB ARG 64 2.591 6.886 9.805 429 1HG ARG 64 1HG ARG 64 0.716 5.649 11.411 430 2HG ARG 64 2HG ARG 64 1.973 4.427 11.203 431 1HD ARG 64 1HD ARG 64 2.381 5.857 13.160 432 2HD ARG 64 2HD ARG 64 3.661 5.993 11.955 433 HE ARG 64 HE ARG 64 2.034 8.036 11.309 434 1HH1 ARG 64 1HH1 ARG 64 3.444 7.012 14.323 435 2HH1 ARG 64 2HH1 ARG 64 3.525 8.614 14.979 436 1HH2 ARG 64 1HH2 ARG 64 2.136 10.149 12.162 437 2HH2 ARG 64 2HH2 ARG 64 2.780 10.397 13.749 438 H SER 65 H SER 65 1.043 8.598 8.002 439 HA SER 65 HA SER 65 -0.083 10.059 10.210 440 1HB SER 65 1HB SER 65 1.813 10.981 8.961 441 2HB SER 65 2HB SER 65 0.845 11.007 7.487 442 HG SER 65 HG SER 65 1.063 12.984 9.005 443 H THR 66 H THR 66 -1.170 8.895 7.127 444 HA THR 66 HA THR 66 -3.521 10.577 7.065 445 HB THR 66 HB THR 66 -3.325 8.153 5.345 446 HG1 THR 66 HG1 THR 66 -1.850 9.279 3.974 447 1HG2 THR 66 1HG2 THR 66 -4.164 9.757 3.654 448 2HG2 THR 66 2HG2 THR 66 -4.119 11.029 4.874 449 3HG2 THR 66 3HG2 THR 66 -5.206 9.655 5.073 450 H VAL 67 H VAL 67 -2.663 7.347 8.079 451 HA VAL 67 HA VAL 67 -5.106 6.076 8.165 452 HB VAL 67 HB VAL 67 -2.896 5.905 10.219 453 1HG1 VAL 67 1HG1 VAL 67 -5.385 4.315 9.783 454 2HG1 VAL 67 2HG1 VAL 67 -3.938 3.520 10.407 455 3HG1 VAL 67 3HG1 VAL 67 -4.654 4.869 11.290 456 1HG2 VAL 67 1HG2 VAL 67 -3.198 3.731 8.299 457 2HG2 VAL 67 2HG2 VAL 67 -2.792 5.274 7.547 458 3HG2 VAL 67 3HG2 VAL 67 -1.751 4.604 8.803 459 H ARG 68 H ARG 68 -3.757 8.398 10.460 460 HA ARG 68 HA ARG 68 -5.571 8.189 12.529 461 1HB ARG 68 1HB ARG 68 -4.880 10.331 13.222 462 2HB ARG 68 2HB ARG 68 -3.495 9.666 12.365 463 1HG ARG 68 1HG ARG 68 -4.287 10.925 10.335 464 2HG ARG 68 2HG ARG 68 -5.443 11.735 11.394 465 1HD ARG 68 1HD ARG 68 -3.359 13.027 11.041 466 2HD ARG 68 2HD ARG 68 -3.664 12.639 12.734 467 HE ARG 68 HE ARG 68 -2.016 10.662 11.579 468 1HH1 ARG 68 1HH1 ARG 68 -1.944 13.975 12.648 469 2HH1 ARG 68 2HH1 ARG 68 -0.252 13.955 13.018 470 1HH2 ARG 68 1HH2 ARG 68 0.212 10.624 12.062 471 2HH2 ARG 68 2HH2 ARG 68 0.974 12.049 12.684 472 H ASP 69 H ASP 69 -5.983 9.610 9.376 473 HA ASP 69 HA ASP 69 -8.428 10.978 10.041 474 1HB ASP 69 1HB ASP 69 -6.584 11.076 7.927 475 2HB ASP 69 2HB ASP 69 -8.087 10.504 7.210 476 H ILE 70 H ILE 70 -7.508 7.900 8.637 477 HA ILE 70 HA ILE 70 -10.112 7.187 7.726 478 HB ILE 70 HB ILE 70 -7.829 5.333 8.409 479 1HG1 ILE 70 1HG1 ILE 70 -8.500 6.570 5.733 480 2HG1 ILE 70 2HG1 ILE 70 -7.220 7.149 6.793 481 1HG2 ILE 70 1HG2 ILE 70 -9.944 4.183 8.164 482 2HG2 ILE 70 2HG2 ILE 70 -10.235 4.994 6.625 483 3HG2 ILE 70 3HG2 ILE 70 -8.911 3.839 6.776 484 1HD1 ILE 70 1HD1 ILE 70 -7.089 5.135 4.835 485 2HD1 ILE 70 2HD1 ILE 70 -5.822 5.670 5.939 486 3HD1 ILE 70 3HD1 ILE 70 -6.894 4.349 6.401 487 H ASP 71 H ASP 71 -8.286 6.605 10.689 488 HA ASP 71 HA ASP 71 -10.777 5.886 12.031 489 1HB ASP 71 1HB ASP 71 -8.673 4.003 11.397 490 2HB ASP 71 2HB ASP 71 -8.885 4.139 13.141 491 HA PRO 72 HA PRO 72 -9.212 8.248 15.378 492 1HB PRO 72 1HB PRO 72 -10.109 6.876 17.542 493 2HB PRO 72 2HB PRO 72 -11.176 7.810 16.487 494 1HG PRO 72 1HG PRO 72 -10.651 4.863 16.522 495 2HG PRO 72 2HG PRO 72 -12.192 5.723 16.347 496 1HD PRO 72 1HD PRO 72 -10.861 4.674 14.235 497 2HD PRO 72 2HD PRO 72 -11.846 6.146 14.108 498 H GLN 73 H GLN 73 -8.391 4.863 15.242 499 HA GLN 73 HA GLN 73 -5.827 5.456 16.505 500 1HB GLN 73 1HB GLN 73 -7.722 3.294 17.423 501 2HB GLN 73 2HB GLN 73 -6.010 3.305 17.824 502 1HG GLN 73 1HG GLN 73 -6.604 5.749 18.653 503 2HG GLN 73 2HG GLN 73 -8.205 5.028 18.813 504 1HE2 GLN 73 1HE2 GLN 73 -8.314 4.985 21.000 505 2HE2 GLN 73 2HE2 GLN 73 -7.274 4.033 21.999 506 H ASN 74 H ASN 74 -7.442 2.413 15.633 507 HA ASN 74 HA ASN 74 -6.862 0.742 14.204 508 1HB ASN 74 1HB ASN 74 -7.179 2.852 12.652 509 2HB ASN 74 2HB ASN 74 -5.440 2.685 12.429 510 1HD2 ASN 74 1HD2 ASN 74 -8.087 0.345 12.740 511 2HD2 ASN 74 2HD2 ASN 74 -7.751 -0.488 11.265 512 H ASP 75 H ASP 75 -4.876 -0.162 12.887 513 HA ASP 75 HA ASP 75 -2.308 0.554 14.008 514 1HB ASP 75 1HB ASP 75 -3.788 -1.313 15.398 515 2HB ASP 75 2HB ASP 75 -2.768 -2.314 14.369 516 H LEU 76 H LEU 76 -0.992 0.534 12.320 517 HA LEU 76 HA LEU 76 -1.605 -0.884 9.917 518 1HB LEU 76 1HB LEU 76 0.146 1.204 10.731 519 2HB LEU 76 2HB LEU 76 1.104 -0.037 9.926 520 HG LEU 76 HG LEU 76 0.479 1.615 8.312 521 1HD1 LEU 76 1HD1 LEU 76 -0.343 0.232 6.655 522 2HD1 LEU 76 2HD1 LEU 76 -1.441 -0.606 7.752 523 3HD1 LEU 76 3HD1 LEU 76 0.292 -0.924 7.826 524 1HD2 LEU 76 1HD2 LEU 76 -1.486 2.469 9.595 525 2HD2 LEU 76 2HD2 LEU 76 -2.406 1.084 9.004 526 3HD2 LEU 76 3HD2 LEU 76 -1.773 2.275 7.866 527 H THR 77 H THR 77 -0.744 -2.731 9.104 528 HA THR 77 HA THR 77 1.424 -4.057 10.546 529 HB THR 77 HB THR 77 -0.622 -4.941 11.573 530 HG1 THR 77 HG1 THR 77 -0.026 -7.069 11.347 531 1HG2 THR 77 1HG2 THR 77 -2.091 -6.407 10.120 532 2HG2 THR 77 2HG2 THR 77 -1.335 -5.630 8.728 533 3HG2 THR 77 3HG2 THR 77 -2.261 -4.668 9.881 534 H PHE 78 H PHE 78 0.623 -2.845 7.792 535 HA PHE 78 HA PHE 78 2.334 -4.395 6.220 536 1HB PHE 78 1HB PHE 78 -0.188 -5.593 6.471 537 2HB PHE 78 2HB PHE 78 -0.189 -4.843 4.878 538 HD1 PHE 78 HD1 PHE 78 2.240 -5.199 3.660 539 HD2 PHE 78 HD2 PHE 78 0.398 -7.799 6.482 540 HE1 PHE 78 HE1 PHE 78 3.545 -7.086 2.769 541 HE2 PHE 78 HE2 PHE 78 1.700 -9.689 5.596 542 HZ PHE 78 HZ PHE 78 3.277 -9.334 3.738 543 H LEU 79 H LEU 79 2.776 -3.423 4.258 544 HA LEU 79 HA LEU 79 1.040 -1.414 3.151 545 1HB LEU 79 1HB LEU 79 2.337 -0.351 5.098 546 2HB LEU 79 2HB LEU 79 3.744 -0.474 4.045 547 HG LEU 79 HG LEU 79 2.594 0.952 2.391 548 1HD1 LEU 79 1HD1 LEU 79 0.608 2.154 3.965 549 2HD1 LEU 79 2HD1 LEU 79 0.343 0.414 4.079 550 3HD1 LEU 79 3HD1 LEU 79 0.394 1.196 2.499 551 1HD2 LEU 79 1HD2 LEU 79 4.039 2.195 3.682 552 2HD2 LEU 79 2HD2 LEU 79 3.143 1.892 5.171 553 3HD2 LEU 79 3HD2 LEU 79 2.511 3.026 3.976 554 H ARG 80 H ARG 80 1.133 -2.322 1.166 555 HA ARG 80 HA ARG 80 3.797 -2.572 -0.071 556 1HB ARG 80 1HB ARG 80 1.307 -4.130 -0.786 557 2HB ARG 80 2HB ARG 80 2.910 -4.343 -1.476 558 1HG ARG 80 1HG ARG 80 3.556 -5.675 0.183 559 2HG ARG 80 2HG ARG 80 2.910 -4.588 1.415 560 1HD ARG 80 1HD ARG 80 1.086 -6.300 -0.232 561 2HD ARG 80 2HD ARG 80 1.909 -6.961 1.180 562 HE ARG 80 HE ARG 80 0.772 -4.732 2.164 563 1HH1 ARG 80 1HH1 ARG 80 -0.478 -7.360 0.254 564 2HH1 ARG 80 2HH1 ARG 80 -2.079 -7.245 0.905 565 1HH2 ARG 80 1HH2 ARG 80 -1.332 -4.570 3.030 566 2HH2 ARG 80 2HH2 ARG 80 -2.564 -5.657 2.484 567 H ILE 81 H ILE 81 3.719 -2.360 -2.502 568 HA ILE 81 HA ILE 81 1.599 -0.633 -3.502 569 HB ILE 81 HB ILE 81 3.425 0.920 -4.453 570 1HG1 ILE 81 1HG1 ILE 81 4.895 -0.264 -2.088 571 2HG1 ILE 81 2HG1 ILE 81 5.348 -0.445 -3.780 572 1HG2 ILE 81 1HG2 ILE 81 2.645 2.392 -2.973 573 2HG2 ILE 81 2HG2 ILE 81 1.791 1.041 -2.231 574 3HG2 ILE 81 3HG2 ILE 81 3.370 1.529 -1.617 575 1HD1 ILE 81 1HD1 ILE 81 5.220 2.271 -3.487 576 2HD1 ILE 81 2HD1 ILE 81 5.854 1.738 -1.929 577 3HD1 ILE 81 3HD1 ILE 81 6.685 1.292 -3.420 578 H ARG 82 H ARG 82 1.090 -2.243 -4.976 579 HA ARG 82 HA ARG 82 2.938 -3.608 -6.595 580 1HB ARG 82 1HB ARG 82 0.252 -3.799 -6.147 581 2HB ARG 82 2HB ARG 82 0.284 -3.133 -7.775 582 1HG ARG 82 1HG ARG 82 2.182 -5.242 -7.641 583 2HG ARG 82 2HG ARG 82 0.659 -5.813 -6.956 584 1HD ARG 82 1HD ARG 82 0.129 -6.223 -9.104 585 2HD ARG 82 2HD ARG 82 -0.235 -4.499 -9.144 586 HE ARG 82 HE ARG 82 2.379 -4.560 -9.782 587 1HH1 ARG 82 1HH1 ARG 82 -0.384 -6.299 -10.990 588 2HH1 ARG 82 2HH1 ARG 82 0.259 -6.470 -12.590 589 1HH2 ARG 82 1HH2 ARG 82 3.236 -4.778 -11.884 590 2HH2 ARG 82 2HH2 ARG 82 2.319 -5.605 -13.097 591 H SER 83 H SER 83 4.211 -2.819 -8.124 592 HA SER 83 HA SER 83 3.284 -0.482 -9.663 593 1HB SER 83 1HB SER 83 6.171 -0.934 -9.697 594 2HB SER 83 2HB SER 83 5.267 0.540 -9.350 595 HG SER 83 HG SER 83 6.398 -1.241 -7.636 596 H LYS 84 H LYS 84 5.120 -0.437 -11.662 597 HA LYS 84 HA LYS 84 4.354 -2.789 -13.208 598 1HB LYS 84 1HB LYS 84 5.501 -0.105 -13.963 599 2HB LYS 84 2HB LYS 84 5.350 -1.421 -15.120 600 1HG LYS 84 1HG LYS 84 2.845 -1.362 -14.117 601 2HG LYS 84 2HG LYS 84 3.295 0.339 -13.972 602 1HD LYS 84 1HD LYS 84 4.196 -0.321 -16.485 603 2HD LYS 84 2HD LYS 84 2.701 -1.250 -16.349 604 1HE LYS 84 1HE LYS 84 1.528 0.821 -15.670 605 2HE LYS 84 2HE LYS 84 3.022 1.720 -15.928 606 1HZ LYS 84 1HZ LYS 84 2.729 1.714 -18.128 607 2HZ LYS 84 2HZ LYS 84 1.118 1.322 -17.791 608 3HZ LYS 84 3HZ LYS 84 2.224 0.100 -18.173 609 H LYS 85 H LYS 85 7.122 -1.361 -11.715 610 HA LYS 85 HA LYS 85 9.038 -2.909 -13.230 611 1HB LYS 85 1HB LYS 85 9.172 -0.892 -11.036 612 2HB LYS 85 2HB LYS 85 10.536 -1.982 -11.245 613 1HG LYS 85 1HG LYS 85 10.149 -1.161 -13.794 614 2HG LYS 85 2HG LYS 85 9.648 0.273 -12.896 615 1HD LYS 85 1HD LYS 85 12.275 -1.178 -12.573 616 2HD LYS 85 2HD LYS 85 12.037 0.334 -13.453 617 1HE LYS 85 1HE LYS 85 10.903 0.795 -10.960 618 2HE LYS 85 2HE LYS 85 12.363 -0.130 -10.611 619 1HZ LYS 85 1HZ LYS 85 12.087 2.572 -11.567 620 2HZ LYS 85 2HZ LYS 85 13.224 1.665 -12.429 621 3HZ LYS 85 3HZ LYS 85 13.376 1.839 -10.753 622 H ASN 86 H ASN 86 7.884 -2.836 -9.862 623 HA ASN 86 HA ASN 86 7.827 -5.627 -9.578 624 1HB ASN 86 1HB ASN 86 9.765 -5.750 -7.888 625 2HB ASN 86 2HB ASN 86 10.176 -5.737 -9.600 626 1HD2 ASN 86 1HD2 ASN 86 9.673 -3.517 -6.884 627 2HD2 ASN 86 2HD2 ASN 86 10.953 -2.436 -7.308 628 H GLU 87 H GLU 87 7.475 -6.295 -7.290 629 HA GLU 87 HA GLU 87 5.933 -4.233 -5.926 630 1HB GLU 87 1HB GLU 87 4.859 -6.389 -6.303 631 2HB GLU 87 2HB GLU 87 6.151 -7.208 -5.436 632 1HG GLU 87 1HG GLU 87 5.495 -6.226 -3.371 633 2HG GLU 87 2HG GLU 87 4.355 -5.151 -4.179 634 H ILE 88 H ILE 88 6.274 -3.577 -3.819 635 HA ILE 88 HA ILE 88 8.749 -4.511 -2.530 636 HB ILE 88 HB ILE 88 7.835 -1.637 -2.704 637 1HG1 ILE 88 1HG1 ILE 88 10.480 -2.046 -3.676 638 2HG1 ILE 88 2HG1 ILE 88 9.436 -3.232 -4.453 639 1HG2 ILE 88 1HG2 ILE 88 10.012 -1.175 -1.576 640 2HG2 ILE 88 2HG2 ILE 88 8.840 -2.023 -0.569 641 3HG2 ILE 88 3HG2 ILE 88 10.178 -2.908 -1.300 642 1HD1 ILE 88 1HD1 ILE 88 8.102 -0.734 -4.497 643 2HD1 ILE 88 2HD1 ILE 88 9.757 -0.490 -5.059 644 3HD1 ILE 88 3HD1 ILE 88 8.724 -1.680 -5.849 645 H MET 89 H MET 89 7.830 -5.696 -0.925 646 HA MET 89 HA MET 89 5.545 -4.785 0.549 647 1HB MET 89 1HB MET 89 7.437 -7.106 0.877 648 2HB MET 89 2HB MET 89 6.160 -6.773 2.040 649 1HG MET 89 1HG MET 89 4.499 -7.387 0.607 650 2HG MET 89 2HG MET 89 5.424 -6.952 -0.828 651 1HE MET 89 1HE MET 89 7.389 -9.296 1.795 652 2HE MET 89 2HE MET 89 5.704 -9.121 2.285 653 3HE MET 89 3HE MET 89 6.297 -10.679 1.708 654 H VAL 90 H VAL 90 5.515 -3.494 2.267 655 HA VAL 90 HA VAL 90 7.883 -3.306 3.979 656 HB VAL 90 HB VAL 90 6.492 -0.912 2.771 657 1HG1 VAL 90 1HG1 VAL 90 8.667 -1.070 4.854 658 2HG1 VAL 90 2HG1 VAL 90 8.159 0.410 4.037 659 3HG1 VAL 90 3HG1 VAL 90 7.029 -0.457 5.078 660 1HG2 VAL 90 1HG2 VAL 90 7.973 -1.343 1.131 661 2HG2 VAL 90 2HG2 VAL 90 9.130 -0.611 2.242 662 3HG2 VAL 90 3HG2 VAL 90 8.975 -2.366 2.161 663 H ALA 91 H ALA 91 7.404 -3.186 6.093 664 HA ALA 91 HA ALA 91 4.877 -2.125 7.012 665 1HB ALA 91 1HB ALA 91 4.772 -4.721 6.352 666 2HB ALA 91 2HB ALA 91 5.345 -4.863 8.014 667 3HB ALA 91 3HB ALA 91 3.835 -4.020 7.672 668 HA PRO 92 HA PRO 92 7.227 -1.119 10.580 669 1HB PRO 92 1HB PRO 92 5.337 -1.203 12.526 670 2HB PRO 92 2HB PRO 92 5.405 0.076 11.308 671 1HG PRO 92 1HG PRO 92 3.675 -2.365 11.397 672 2HG PRO 92 2HG PRO 92 3.242 -0.703 10.958 673 1HD PRO 92 1HD PRO 92 3.710 -2.623 9.107 674 2HD PRO 92 2HD PRO 92 4.089 -0.911 8.825 675 H ASP 93 H ASP 93 8.673 -2.781 10.916 676 HA ASP 93 HA ASP 93 7.886 -5.306 12.019 677 1HB ASP 93 1HB ASP 93 10.126 -4.338 10.682 678 2HB ASP 93 2HB ASP 93 10.711 -4.672 12.310 679 H LYS 94 H LYS 94 9.780 -5.875 13.910 680 HA LYS 94 HA LYS 94 8.635 -5.077 16.281 681 1HB LYS 94 1HB LYS 94 10.942 -6.567 15.482 682 2HB LYS 94 2HB LYS 94 11.397 -5.496 16.800 683 1HG LYS 94 1HG LYS 94 9.940 -6.498 18.292 684 2HG LYS 94 2HG LYS 94 8.936 -7.178 17.010 685 1HD LYS 94 1HD LYS 94 10.492 -8.867 16.535 686 2HD LYS 94 2HD LYS 94 11.789 -8.034 17.396 687 1HE LYS 94 1HE LYS 94 11.221 -8.965 19.344 688 2HE LYS 94 2HE LYS 94 9.512 -8.604 19.106 689 1HZ LYS 94 1HZ LYS 94 10.493 -10.722 17.424 690 2HZ LYS 94 2HZ LYS 94 9.106 -10.663 18.390 691 3HZ LYS 94 3HZ LYS 94 10.597 -11.075 19.076 692 H ASP 95 H ASP 95 11.593 -3.750 14.804 693 HA ASP 95 HA ASP 95 10.989 -1.149 15.942 694 1HB ASP 95 1HB ASP 95 13.061 -0.884 17.115 695 2HB ASP 95 2HB ASP 95 12.326 -2.382 17.680 696 H TYR 96 H TYR 96 11.466 -2.651 13.307 697 HA TYR 96 HA TYR 96 13.037 -0.516 12.086 698 1HB TYR 96 1HB TYR 96 14.153 -2.351 10.641 699 2HB TYR 96 2HB TYR 96 14.777 -2.066 12.262 700 HD1 TYR 96 HD1 TYR 96 13.093 -4.423 10.062 701 HD2 TYR 96 HD2 TYR 96 14.306 -3.675 14.071 702 HE1 TYR 96 HE1 TYR 96 12.757 -6.799 10.601 703 HE2 TYR 96 HE2 TYR 96 13.974 -6.049 14.621 704 HH TYR 96 HH TYR 96 13.956 -8.248 13.350 705 H PHE 97 H PHE 97 12.991 -0.860 9.585 706 HA PHE 97 HA PHE 97 10.234 -1.607 8.863 707 1HB PHE 97 1HB PHE 97 12.033 0.586 7.855 708 2HB PHE 97 2HB PHE 97 10.654 0.028 6.915 709 HD1 PHE 97 HD1 PHE 97 11.600 2.604 8.840 710 HD2 PHE 97 HD2 PHE 97 8.520 -0.331 8.719 711 HE1 PHE 97 HE1 PHE 97 10.127 4.101 10.122 712 HE2 PHE 97 HE2 PHE 97 7.042 1.162 10.000 713 HZ PHE 97 HZ PHE 97 7.845 3.382 10.702 714 H LEU 98 H LEU 98 10.385 -3.617 8.043 715 HA LEU 98 HA LEU 98 12.610 -4.513 6.492 716 1HB LEU 98 1HB LEU 98 10.771 -5.791 7.944 717 2HB LEU 98 2HB LEU 98 10.019 -5.944 6.357 718 HG LEU 98 HG LEU 98 12.869 -6.722 6.554 719 1HD1 LEU 98 1HD1 LEU 98 11.630 -7.582 8.640 720 2HD1 LEU 98 2HD1 LEU 98 12.541 -8.735 7.665 721 3HD1 LEU 98 3HD1 LEU 98 10.786 -8.647 7.515 722 1HD2 LEU 98 1HD2 LEU 98 10.746 -7.000 4.742 723 2HD2 LEU 98 2HD2 LEU 98 11.071 -8.617 5.367 724 3HD2 LEU 98 3HD2 LEU 98 12.367 -7.683 4.618 725 H ILE 99 H ILE 99 12.815 -4.744 4.311 726 HA ILE 99 HA ILE 99 10.572 -3.866 2.625 727 HB ILE 99 HB ILE 99 13.446 -3.015 2.249 728 1HG1 ILE 99 1HG1 ILE 99 11.575 -0.853 2.492 729 2HG1 ILE 99 2HG1 ILE 99 11.404 -1.922 3.880 730 1HG2 ILE 99 1HG2 ILE 99 10.974 -2.301 0.675 731 2HG2 ILE 99 2HG2 ILE 99 12.597 -1.669 0.403 732 3HG2 ILE 99 3HG2 ILE 99 12.263 -3.380 0.139 733 1HD1 ILE 99 1HD1 ILE 99 13.494 -0.033 3.242 734 2HD1 ILE 99 2HD1 ILE 99 13.108 -0.823 4.771 735 3HD1 ILE 99 3HD1 ILE 99 14.136 -1.637 3.592 736 H VAL 100 H VAL 100 10.042 -5.545 1.400 737 HA VAL 100 HA VAL 100 12.179 -7.316 0.416 738 HB VAL 100 HB VAL 100 9.226 -7.930 0.534 739 1HG1 VAL 100 1HG1 VAL 100 11.655 -9.656 0.068 740 2HG1 VAL 100 2HG1 VAL 100 10.011 -10.264 0.279 741 3HG1 VAL 100 3HG1 VAL 100 10.405 -9.247 -1.107 742 1HG2 VAL 100 1HG2 VAL 100 9.848 -9.371 2.483 743 2HG2 VAL 100 2HG2 VAL 100 11.421 -8.573 2.498 744 3HG2 VAL 100 3HG2 VAL 100 9.955 -7.638 2.792 745 H ILE 101 H ILE 101 12.775 -6.869 -1.596 746 HA ILE 101 HA ILE 101 10.776 -5.827 -3.480 747 HB ILE 101 HB ILE 101 13.769 -5.849 -3.848 748 1HG1 ILE 101 1HG1 ILE 101 12.022 -3.598 -2.831 749 2HG1 ILE 101 2HG1 ILE 101 13.132 -4.542 -1.843 750 1HG2 ILE 101 1HG2 ILE 101 12.123 -5.619 -5.813 751 2HG2 ILE 101 2HG2 ILE 101 11.798 -4.014 -5.160 752 3HG2 ILE 101 3HG2 ILE 101 13.430 -4.443 -5.673 753 1HD1 ILE 101 1HD1 ILE 101 15.014 -3.694 -3.084 754 2HD1 ILE 101 2HD1 ILE 101 13.937 -2.830 -4.181 755 3HD1 ILE 101 3HD1 ILE 101 14.037 -2.353 -2.487 756 H GLN 102 H GLN 102 10.091 -7.029 -5.131 757 HA GLN 102 HA GLN 102 11.689 -8.953 -6.471 758 1HB GLN 102 1HB GLN 102 10.677 -10.988 -5.801 759 2HB GLN 102 2HB GLN 102 11.103 -10.148 -4.316 760 1HG GLN 102 1HG GLN 102 8.770 -9.371 -4.127 761 2HG GLN 102 2HG GLN 102 8.369 -10.312 -5.562 762 1HE2 GLN 102 1HE2 GLN 102 8.549 -10.322 -2.231 763 2HE2 GLN 102 2HE2 GLN 102 8.409 -12.023 -1.962 764 H ASN 103 H ASN 103 10.227 -10.341 -7.971 765 HA ASN 103 HA ASN 103 8.850 -8.674 -9.683 766 1HB ASN 103 1HB ASN 103 9.108 -11.591 -9.340 767 2HB ASN 103 2HB ASN 103 7.664 -11.074 -10.206 768 1HD2 ASN 103 1HD2 ASN 103 10.756 -12.022 -10.593 769 2HD2 ASN 103 2HD2 ASN 103 11.111 -11.279 -12.112 770 HA PRO 104 HA PRO 104 4.814 -8.017 -8.095 771 1HB PRO 104 1HB PRO 104 3.263 -8.223 -10.314 772 2HB PRO 104 2HB PRO 104 4.344 -6.855 -10.020 773 1HG PRO 104 1HG PRO 104 4.769 -9.270 -11.737 774 2HG PRO 104 2HG PRO 104 5.148 -7.573 -12.081 775 1HD PRO 104 1HD PRO 104 7.025 -9.351 -11.277 776 2HD PRO 104 2HD PRO 104 7.098 -7.629 -10.852 777 H THR 105 H THR 105 2.976 -9.051 -7.352 778 HA THR 105 HA THR 105 2.814 -11.930 -7.956 779 HB THR 105 HB THR 105 1.710 -12.166 -5.739 780 HG1 THR 105 HG1 THR 105 0.998 -10.326 -4.956 781 1HG2 THR 105 1HG2 THR 105 4.323 -12.153 -6.266 782 2HG2 THR 105 2HG2 THR 105 3.695 -12.386 -4.634 783 3HG2 THR 105 3HG2 THR 105 4.276 -10.799 -5.138 784 H GLU 106 H GLU 106 0.949 -8.979 -7.480 785 HA GLU 106 HA GLU 106 -1.219 -8.437 -7.933 786 1HB GLU 106 1HB GLU 106 -0.534 -8.649 -10.210 787 2HB GLU 106 2HB GLU 106 -0.618 -10.403 -10.139 788 1HG GLU 106 1HG GLU 106 -2.935 -10.425 -10.216 789 2HG GLU 106 2HG GLU 106 -3.065 -8.746 -9.696 790 H MET 11 H MET 11 -19.381 4.272 -15.708 791 HA MET 11 HA MET 11 -19.396 3.837 -12.957 792 1HB MET 11 1HB MET 11 -21.418 4.782 -14.938 793 2HB MET 11 2HB MET 11 -21.962 4.390 -13.313 794 1HG MET 11 1HG MET 11 -19.876 5.928 -12.691 795 2HG MET 11 2HG MET 11 -20.268 6.613 -14.266 796 1HE MET 11 1HE MET 11 -22.420 6.898 -10.337 797 2HE MET 11 2HE MET 11 -22.941 5.433 -11.169 798 3HE MET 11 3HE MET 11 -21.228 5.701 -10.844 799 H ALA 12 H ALA 12 -21.380 2.261 -15.463 800 HA ALA 12 HA ALA 12 -22.820 0.531 -13.869 801 1HB ALA 12 1HB ALA 12 -21.737 -0.067 -16.620 802 2HB ALA 12 2HB ALA 12 -23.106 -0.858 -15.837 803 3HB ALA 12 3HB ALA 12 -23.206 0.847 -16.276 804 H GLU 13 H GLU 13 -19.549 0.142 -15.152 805 HA GLU 13 HA GLU 13 -19.074 -2.503 -14.507 806 1HB GLU 13 1HB GLU 13 -17.424 -0.110 -14.952 807 2HB GLU 13 2HB GLU 13 -16.657 -1.345 -13.963 808 1HG GLU 13 1HG GLU 13 -16.462 -2.798 -15.676 809 2HG GLU 13 2HG GLU 13 -17.968 -2.281 -16.433 810 H VAL 14 H VAL 14 -18.483 0.358 -12.469 811 HA VAL 14 HA VAL 14 -17.613 -1.066 -10.201 812 HB VAL 14 HB VAL 14 -18.986 1.622 -10.183 813 1HG1 VAL 14 1HG1 VAL 14 -16.977 1.668 -8.328 814 2HG1 VAL 14 2HG1 VAL 14 -18.678 1.351 -7.980 815 3HG1 VAL 14 3HG1 VAL 14 -17.557 0.008 -8.208 816 1HG2 VAL 14 1HG2 VAL 14 -16.402 2.279 -10.175 817 2HG2 VAL 14 2HG2 VAL 14 -16.301 0.803 -11.135 818 3HG2 VAL 14 3HG2 VAL 14 -17.337 2.130 -11.663 819 H GLU 15 H GLU 15 -20.806 -0.060 -11.288 820 HA GLU 15 HA GLU 15 -22.202 -0.639 -8.905 821 1HB GLU 15 1HB GLU 15 -23.057 -0.449 -11.786 822 2HB GLU 15 2HB GLU 15 -24.196 -0.835 -10.503 823 1HG GLU 15 1HG GLU 15 -23.746 1.271 -9.415 824 2HG GLU 15 2HG GLU 15 -22.505 1.652 -10.608 825 H GLU 16 H GLU 16 -21.289 -2.602 -11.676 826 HA GLU 16 HA GLU 16 -22.863 -4.865 -11.016 827 1HB GLU 16 1HB GLU 16 -21.328 -4.136 -13.161 828 2HB GLU 16 2HB GLU 16 -20.338 -5.390 -12.427 829 1HG GLU 16 1HG GLU 16 -22.510 -6.778 -12.409 830 2HG GLU 16 2HG GLU 16 -23.087 -5.594 -13.581 831 H THR 17 H THR 17 -19.627 -3.823 -10.132 832 HA THR 17 HA THR 17 -18.972 -6.300 -8.813 833 HB THR 17 HB THR 17 -17.577 -3.617 -8.752 834 HG1 THR 17 HG1 THR 17 -17.443 -4.537 -10.790 835 1HG2 THR 17 1HG2 THR 17 -16.530 -4.488 -6.961 836 2HG2 THR 17 2HG2 THR 17 -15.698 -5.504 -8.138 837 3HG2 THR 17 3HG2 THR 17 -17.118 -6.117 -7.291 838 H LEU 18 H LEU 18 -20.422 -3.270 -7.948 839 HA LEU 18 HA LEU 18 -19.991 -3.457 -5.138 840 1HB LEU 18 1HB LEU 18 -21.305 -1.670 -6.984 841 2HB LEU 18 2HB LEU 18 -22.298 -1.942 -5.554 842 HG LEU 18 HG LEU 18 -19.972 -1.401 -4.352 843 1HD1 LEU 18 1HD1 LEU 18 -18.931 0.512 -5.569 844 2HD1 LEU 18 2HD1 LEU 18 -19.867 0.048 -6.990 845 3HD1 LEU 18 3HD1 LEU 18 -18.669 -1.061 -6.322 846 1HD2 LEU 18 1HD2 LEU 18 -20.799 0.837 -4.003 847 2HD2 LEU 18 2HD2 LEU 18 -22.155 -0.291 -4.018 848 3HD2 LEU 18 3HD2 LEU 18 -21.828 0.716 -5.430 849 H LYS 19 H LYS 19 -22.663 -4.331 -7.289 850 HA LYS 19 HA LYS 19 -24.521 -5.086 -5.342 851 1HB LYS 19 1HB LYS 19 -24.227 -5.334 -8.199 852 2HB LYS 19 2HB LYS 19 -24.866 -6.828 -7.527 853 1HG LYS 19 1HG LYS 19 -26.823 -5.749 -7.845 854 2HG LYS 19 2HG LYS 19 -26.441 -5.104 -6.247 855 1HD LYS 19 1HD LYS 19 -26.488 -3.049 -7.092 856 2HD LYS 19 2HD LYS 19 -25.131 -3.466 -8.141 857 1HE LYS 19 1HE LYS 19 -26.488 -3.909 -9.943 858 2HE LYS 19 2HE LYS 19 -27.879 -4.303 -8.935 859 1HZ LYS 19 1HZ LYS 19 -27.359 -1.669 -8.406 860 2HZ LYS 19 2HZ LYS 19 -28.600 -2.267 -9.387 861 3HZ LYS 19 3HZ LYS 19 -27.128 -1.801 -10.077 862 H ARG 20 H ARG 20 -22.158 -7.089 -7.101 863 HA ARG 20 HA ARG 20 -22.763 -9.504 -5.804 864 1HB ARG 20 1HB ARG 20 -21.352 -9.096 -7.919 865 2HB ARG 20 2HB ARG 20 -20.018 -8.800 -6.812 866 1HG ARG 20 1HG ARG 20 -19.641 -10.991 -7.002 867 2HG ARG 20 2HG ARG 20 -20.992 -11.165 -5.879 868 1HD ARG 20 1HD ARG 20 -22.520 -11.583 -7.637 869 2HD ARG 20 2HD ARG 20 -21.361 -11.065 -8.861 870 HE ARG 20 HE ARG 20 -20.321 -13.260 -7.432 871 1HH1 ARG 20 1HH1 ARG 20 -22.756 -12.464 -9.789 872 2HH1 ARG 20 2HH1 ARG 20 -22.739 -14.031 -10.528 873 1HH2 ARG 20 1HH2 ARG 20 -20.290 -15.327 -8.396 874 2HH2 ARG 20 2HH2 ARG 20 -21.337 -15.659 -9.734 875 H LEU 21 H LEU 21 -20.463 -6.938 -5.026 876 HA LEU 21 HA LEU 21 -19.178 -8.259 -2.892 877 1HB LEU 21 1HB LEU 21 -19.325 -5.529 -3.955 878 2HB LEU 21 2HB LEU 21 -18.993 -5.625 -2.227 879 HG LEU 21 HG LEU 21 -16.995 -6.902 -2.626 880 1HD1 LEU 21 1HD1 LEU 21 -18.242 -7.385 -5.188 881 2HD1 LEU 21 2HD1 LEU 21 -16.939 -8.260 -4.384 882 3HD1 LEU 21 3HD1 LEU 21 -16.574 -6.843 -5.368 883 1HD2 LEU 21 1HD2 LEU 21 -15.804 -5.248 -4.216 884 2HD2 LEU 21 2HD2 LEU 21 -16.487 -4.641 -2.707 885 3HD2 LEU 21 3HD2 LEU 21 -17.349 -4.398 -4.227 886 H GLN 22 H GLN 22 -21.698 -5.733 -2.817 887 HA GLN 22 HA GLN 22 -22.152 -5.880 -0.047 888 1HB GLN 22 1HB GLN 22 -23.212 -4.443 -2.270 889 2HB GLN 22 2HB GLN 22 -24.559 -5.109 -1.356 890 1HG GLN 22 1HG GLN 22 -24.037 -2.889 -0.577 891 2HG GLN 22 2HG GLN 22 -23.680 -4.072 0.680 892 1HE2 GLN 22 1HE2 GLN 22 -22.541 -1.430 -0.973 893 2HE2 GLN 22 2HE2 GLN 22 -20.865 -1.557 -0.572 894 H SER 23 H SER 23 -23.099 -7.938 -2.613 895 HA SER 23 HA SER 23 -25.384 -9.066 -1.257 896 1HB SER 23 1HB SER 23 -25.367 -9.008 -3.694 897 2HB SER 23 2HB SER 23 -23.889 -9.968 -3.731 898 HG SER 23 HG SER 23 -25.019 -11.707 -2.918 899 H GLN 24 H GLN 24 -21.982 -9.641 -1.419 900 HA GLN 24 HA GLN 24 -22.266 -12.275 -0.172 901 1HB GLN 24 1HB GLN 24 -19.886 -12.552 -0.598 902 2HB GLN 24 2HB GLN 24 -20.718 -12.079 -2.073 903 1HG GLN 24 1HG GLN 24 -19.860 -9.891 -1.979 904 2HG GLN 24 2HG GLN 24 -19.321 -10.092 -0.313 905 1HE2 GLN 24 1HE2 GLN 24 -17.433 -9.149 -1.735 906 2HE2 GLN 24 2HE2 GLN 24 -16.285 -10.331 -2.254 907 H LYS 25 H LYS 25 -20.714 -12.764 1.633 908 HA LYS 25 HA LYS 25 -20.981 -10.702 3.653 909 1HB LYS 25 1HB LYS 25 -21.524 -13.092 4.117 910 2HB LYS 25 2HB LYS 25 -19.824 -13.484 3.903 911 1HG LYS 25 1HG LYS 25 -19.200 -12.282 5.832 912 2HG LYS 25 2HG LYS 25 -20.775 -11.493 5.940 913 1HD LYS 25 1HD LYS 25 -20.502 -14.476 6.133 914 2HD LYS 25 2HD LYS 25 -20.280 -13.439 7.545 915 1HE LYS 25 1HE LYS 25 -22.481 -13.384 7.821 916 2HE LYS 25 2HE LYS 25 -22.642 -12.589 6.256 917 1HZ LYS 25 1HZ LYS 25 -23.198 -14.520 5.226 918 2HZ LYS 25 2HZ LYS 25 -23.810 -14.870 6.763 919 3HZ LYS 25 3HZ LYS 25 -22.312 -15.496 6.286 920 H GLY 26 H GLY 26 -19.200 -10.055 5.031 921 1HA GLY 26 1HA GLY 26 -16.848 -9.901 5.475 922 2HA GLY 26 2HA GLY 26 -16.542 -10.356 3.805 923 H VAL 27 H VAL 27 -18.102 -8.632 2.395 924 HA VAL 27 HA VAL 27 -16.575 -6.333 2.222 925 HB VAL 27 HB VAL 27 -19.467 -6.657 1.410 926 1HG1 VAL 27 1HG1 VAL 27 -18.949 -4.859 -0.217 927 2HG1 VAL 27 2HG1 VAL 27 -18.874 -4.322 1.462 928 3HG1 VAL 27 3HG1 VAL 27 -17.386 -4.643 0.570 929 1HG2 VAL 27 1HG2 VAL 27 -17.934 -6.800 -0.858 930 2HG2 VAL 27 2HG2 VAL 27 -16.955 -7.673 0.321 931 3HG2 VAL 27 3HG2 VAL 27 -18.614 -8.179 0.006 932 H GLN 28 H GLN 28 -16.691 -4.287 3.039 933 HA GLN 28 HA GLN 28 -18.591 -3.883 5.251 934 1HB GLN 28 1HB GLN 28 -15.740 -3.508 5.048 935 2HB GLN 28 2HB GLN 28 -16.524 -1.987 5.455 936 1HG GLN 28 1HG GLN 28 -17.485 -2.901 7.413 937 2HG GLN 28 2HG GLN 28 -17.049 -4.542 6.942 938 1HE2 GLN 28 1HE2 GLN 28 -15.151 -5.341 7.583 939 2HE2 GLN 28 2HE2 GLN 28 -13.918 -4.443 8.394 940 H GLY 29 H GLY 29 -17.295 -2.560 2.302 941 1HA GLY 29 1HA GLY 29 -19.452 -1.002 1.641 942 2HA GLY 29 2HA GLY 29 -18.437 0.049 2.617 943 H ILE 30 H ILE 30 -19.195 0.091 -0.276 944 HA ILE 30 HA ILE 30 -16.460 0.143 -1.374 945 HB ILE 30 HB ILE 30 -18.959 -0.348 -2.989 946 1HG1 ILE 30 1HG1 ILE 30 -17.329 -2.647 -2.977 947 2HG1 ILE 30 2HG1 ILE 30 -17.479 -2.152 -1.295 948 1HG2 ILE 30 1HG2 ILE 30 -17.213 0.595 -4.312 949 2HG2 ILE 30 2HG2 ILE 30 -16.020 -0.504 -3.622 950 3HG2 ILE 30 3HG2 ILE 30 -17.286 -1.128 -4.678 951 1HD1 ILE 30 1HD1 ILE 30 -20.051 -1.964 -2.372 952 2HD1 ILE 30 2HD1 ILE 30 -19.376 -3.478 -2.977 953 3HD1 ILE 30 3HD1 ILE 30 -19.437 -3.170 -1.242 954 H ILE 31 H ILE 31 -15.790 2.131 -1.791 955 HA ILE 31 HA ILE 31 -17.795 4.198 -2.410 956 HB ILE 31 HB ILE 31 -15.021 4.545 -1.266 957 1HG1 ILE 31 1HG1 ILE 31 -17.588 5.236 0.126 958 2HG1 ILE 31 2HG1 ILE 31 -16.979 3.586 0.169 959 1HG2 ILE 31 1HG2 ILE 31 -17.078 6.464 -2.243 960 2HG2 ILE 31 2HG2 ILE 31 -16.078 6.914 -0.863 961 3HG2 ILE 31 3HG2 ILE 31 -15.323 6.512 -2.405 962 1HD1 ILE 31 1HD1 ILE 31 -16.371 5.066 2.116 963 2HD1 ILE 31 2HD1 ILE 31 -15.034 4.232 1.323 964 3HD1 ILE 31 3HD1 ILE 31 -15.321 5.943 1.003 965 H VAL 32 H VAL 32 -17.493 5.568 -4.145 966 HA VAL 32 HA VAL 32 -15.230 4.965 -5.929 967 HB VAL 32 HB VAL 32 -17.906 5.658 -7.075 968 1HG1 VAL 32 1HG1 VAL 32 -15.792 3.841 -8.189 969 2HG1 VAL 32 2HG1 VAL 32 -17.065 4.712 -9.047 970 3HG1 VAL 32 3HG1 VAL 32 -15.698 5.593 -8.363 971 1HG2 VAL 32 1HG2 VAL 32 -18.378 3.236 -7.314 972 2HG2 VAL 32 2HG2 VAL 32 -17.016 2.897 -6.246 973 3HG2 VAL 32 3HG2 VAL 32 -18.412 3.789 -5.640 974 H VAL 33 H VAL 33 -14.034 6.743 -6.052 975 HA VAL 33 HA VAL 33 -15.400 9.353 -6.171 976 HB VAL 33 HB VAL 33 -12.537 8.983 -5.326 977 1HG1 VAL 33 1HG1 VAL 33 -14.310 11.160 -4.359 978 2HG1 VAL 33 2HG1 VAL 33 -12.583 11.181 -4.720 979 3HG1 VAL 33 3HG1 VAL 33 -13.760 11.225 -6.033 980 1HG2 VAL 33 1HG2 VAL 33 -15.026 8.814 -3.647 981 2HG2 VAL 33 2HG2 VAL 33 -13.686 7.670 -3.738 982 3HG2 VAL 33 3HG2 VAL 33 -13.454 9.241 -2.971 983 H ASN 34 H ASN 34 -14.970 10.697 -7.837 984 HA ASN 34 HA ASN 34 -13.612 9.629 -10.124 985 1HB ASN 34 1HB ASN 34 -14.203 11.840 -11.158 986 2HB ASN 34 2HB ASN 34 -15.579 10.953 -10.507 987 1HD2 ASN 34 1HD2 ASN 34 -16.680 12.982 -10.486 988 2HD2 ASN 34 2HD2 ASN 34 -16.422 14.096 -9.191 989 H THR 35 H THR 35 -12.251 11.503 -11.355 990 HA THR 35 HA THR 35 -9.861 11.767 -9.753 991 HB THR 35 HB THR 35 -9.555 11.077 -12.036 992 HG1 THR 35 HG1 THR 35 -7.825 12.282 -11.572 993 1HG2 THR 35 1HG2 THR 35 -10.074 13.193 -13.689 994 2HG2 THR 35 2HG2 THR 35 -11.435 13.262 -12.570 995 3HG2 THR 35 3HG2 THR 35 -11.120 11.788 -13.486 996 H GLU 36 H GLU 36 -12.562 13.560 -9.907 997 HA GLU 36 HA GLU 36 -11.270 16.173 -9.967 998 1HB GLU 36 1HB GLU 36 -13.980 15.166 -10.344 999 2HB GLU 36 2HB GLU 36 -13.929 16.573 -9.292 1000 1HG GLU 36 1HG GLU 36 -12.252 17.015 -11.567 1001 2HG GLU 36 2HG GLU 36 -13.855 16.505 -12.094 1002 H GLY 37 H GLY 37 -12.917 14.008 -7.724 1003 1HA GLY 37 1HA GLY 37 -11.880 14.130 -5.427 1004 2HA GLY 37 2HA GLY 37 -12.207 15.853 -5.529 1005 H ILE 38 H ILE 38 -14.672 14.262 -7.066 1006 HA ILE 38 HA ILE 38 -16.347 14.403 -4.650 1007 HB ILE 38 HB ILE 38 -17.317 14.476 -7.504 1008 1HG1 ILE 38 1HG1 ILE 38 -16.738 16.789 -5.640 1009 2HG1 ILE 38 2HG1 ILE 38 -15.838 16.391 -7.100 1010 1HG2 ILE 38 1HG2 ILE 38 -18.702 15.480 -5.035 1011 2HG2 ILE 38 2HG2 ILE 38 -19.392 15.146 -6.622 1012 3HG2 ILE 38 3HG2 ILE 38 -18.860 13.815 -5.595 1013 1HD1 ILE 38 1HD1 ILE 38 -17.345 18.232 -7.505 1014 2HD1 ILE 38 2HD1 ILE 38 -17.850 16.819 -8.433 1015 3HD1 ILE 38 3HD1 ILE 38 -18.714 17.263 -6.961 1016 HA PRO 39 HA PRO 39 -16.783 10.004 -4.892 1017 1HB PRO 39 1HB PRO 39 -18.817 9.770 -3.110 1018 2HB PRO 39 2HB PRO 39 -17.146 10.080 -2.624 1019 1HG PRO 39 1HG PRO 39 -19.420 12.004 -2.921 1020 2HG PRO 39 2HG PRO 39 -18.199 11.904 -1.639 1021 1HD PRO 39 1HD PRO 39 -18.047 13.702 -3.658 1022 2HD PRO 39 2HD PRO 39 -16.607 12.997 -2.897 1023 H ILE 40 H ILE 40 -17.556 9.923 -7.065 1024 HA ILE 40 HA ILE 40 -20.054 10.585 -8.009 1025 HB ILE 40 HB ILE 40 -19.734 8.576 -9.591 1026 1HG1 ILE 40 1HG1 ILE 40 -16.974 8.608 -8.362 1027 2HG1 ILE 40 2HG1 ILE 40 -18.193 7.403 -7.959 1028 1HG2 ILE 40 1HG2 ILE 40 -19.136 10.990 -10.004 1029 2HG2 ILE 40 2HG2 ILE 40 -17.490 10.577 -9.526 1030 3HG2 ILE 40 3HG2 ILE 40 -18.219 9.805 -10.934 1031 1HD1 ILE 40 1HD1 ILE 40 -18.000 6.342 -9.956 1032 2HD1 ILE 40 2HD1 ILE 40 -17.544 7.810 -10.821 1033 3HD1 ILE 40 3HD1 ILE 40 -16.363 6.981 -9.807 1034 H LYS 41 H LYS 41 -19.077 7.701 -6.237 1035 HA LYS 41 HA LYS 41 -21.871 7.157 -5.630 1036 1HB LYS 41 1HB LYS 41 -20.284 5.566 -7.475 1037 2HB LYS 41 2HB LYS 41 -20.861 4.607 -6.119 1038 1HG LYS 41 1HG LYS 41 -23.085 6.053 -6.859 1039 2HG LYS 41 2HG LYS 41 -22.308 5.673 -8.398 1040 1HD LYS 41 1HD LYS 41 -23.354 3.700 -8.239 1041 2HD LYS 41 2HD LYS 41 -22.127 3.299 -7.035 1042 1HE LYS 41 1HE LYS 41 -23.551 3.729 -5.256 1043 2HE LYS 41 2HE LYS 41 -24.616 4.747 -6.225 1044 1HZ LYS 41 1HZ LYS 41 -25.895 2.994 -6.574 1045 2HZ LYS 41 2HZ LYS 41 -24.853 2.008 -5.678 1046 3HZ LYS 41 3HZ LYS 41 -24.621 2.189 -7.344 1047 H SER 42 H SER 42 -22.173 5.858 -3.770 1048 HA SER 42 HA SER 42 -19.995 4.742 -2.316 1049 1HB SER 42 1HB SER 42 -19.693 7.247 -1.970 1050 2HB SER 42 2HB SER 42 -21.204 7.209 -1.061 1051 HG SER 42 HG SER 42 -20.262 6.058 0.501 1052 H THR 43 H THR 43 -20.668 3.550 -0.518 1053 HA THR 43 HA THR 43 -23.593 3.361 -0.190 1054 HB THR 43 HB THR 43 -23.425 1.015 0.164 1055 HG1 THR 43 HG1 THR 43 -20.649 1.537 0.337 1056 1HG2 THR 43 1HG2 THR 43 -23.159 0.474 -1.998 1057 2HG2 THR 43 2HG2 THR 43 -21.476 1.003 -2.014 1058 3HG2 THR 43 3HG2 THR 43 -22.772 2.177 -2.239 1059 H MET 44 H MET 44 -20.602 3.920 1.333 1060 HA MET 44 HA MET 44 -21.276 3.045 3.959 1061 1HB MET 44 1HB MET 44 -18.987 4.004 2.683 1062 2HB MET 44 2HB MET 44 -19.360 5.224 3.894 1063 1HG MET 44 1HG MET 44 -19.282 3.599 5.648 1064 2HG MET 44 2HG MET 44 -19.121 2.286 4.484 1065 1HE MET 44 1HE MET 44 -15.649 3.034 2.907 1066 2HE MET 44 2HE MET 44 -16.538 1.596 3.409 1067 3HE MET 44 3HE MET 44 -17.350 2.854 2.477 1068 H ASP 45 H ASP 45 -20.698 5.160 5.608 1069 HA ASP 45 HA ASP 45 -23.197 6.507 5.713 1070 1HB ASP 45 1HB ASP 45 -20.786 7.408 7.259 1071 2HB ASP 45 2HB ASP 45 -22.477 7.394 7.752 1072 H ASN 46 H ASN 46 -23.380 8.909 5.914 1073 HA ASN 46 HA ASN 46 -22.480 10.145 3.537 1074 1HB ASN 46 1HB ASN 46 -24.393 10.686 5.526 1075 2HB ASN 46 2HB ASN 46 -23.308 12.073 5.522 1076 1HD2 ASN 46 1HD2 ASN 46 -22.602 12.173 2.866 1077 2HD2 ASN 46 2HD2 ASN 46 -23.993 12.569 1.920 1078 HA PRO 47 HA PRO 47 -19.594 12.751 6.412 1079 1HB PRO 47 1HB PRO 47 -19.284 11.887 8.967 1080 2HB PRO 47 2HB PRO 47 -20.545 13.028 8.485 1081 1HG PRO 47 1HG PRO 47 -20.735 10.075 8.938 1082 2HG PRO 47 2HG PRO 47 -21.852 11.358 9.439 1083 1HD PRO 47 1HD PRO 47 -22.302 9.797 7.272 1084 2HD PRO 47 2HD PRO 47 -22.833 11.489 7.357 1085 H THR 48 H THR 48 -19.748 9.274 6.733 1086 HA THR 48 HA THR 48 -16.953 8.916 7.268 1087 HB THR 48 HB THR 48 -19.036 6.929 6.343 1088 HG1 THR 48 HG1 THR 48 -18.611 6.302 8.688 1089 1HG2 THR 48 1HG2 THR 48 -16.814 6.148 5.755 1090 2HG2 THR 48 2HG2 THR 48 -17.429 5.221 7.124 1091 3HG2 THR 48 3HG2 THR 48 -16.236 6.493 7.385 1092 H THR 49 H THR 49 -19.004 8.893 4.413 1093 HA THR 49 HA THR 49 -17.052 7.856 2.626 1094 HB THR 49 HB THR 49 -19.529 9.500 2.077 1095 HG1 THR 49 HG1 THR 49 -20.518 7.632 2.183 1096 1HG2 THR 49 1HG2 THR 49 -17.775 7.958 0.160 1097 2HG2 THR 49 2HG2 THR 49 -17.939 9.713 0.235 1098 3HG2 THR 49 3HG2 THR 49 -19.315 8.718 -0.241 1099 H THR 50 H THR 50 -18.117 11.146 3.421 1100 HA THR 50 HA THR 50 -16.584 12.545 1.566 1101 HB THR 50 HB THR 50 -16.759 13.876 4.170 1102 HG1 THR 50 HG1 THR 50 -18.612 12.817 4.569 1103 1HG2 THR 50 1HG2 THR 50 -18.045 14.520 1.516 1104 2HG2 THR 50 2HG2 THR 50 -16.401 14.978 1.959 1105 3HG2 THR 50 3HG2 THR 50 -17.770 15.623 2.863 1106 H GLN 51 H GLN 51 -15.778 11.706 4.933 1107 HA GLN 51 HA GLN 51 -13.237 12.837 5.010 1108 1HB GLN 51 1HB GLN 51 -14.274 12.088 7.038 1109 2HB GLN 51 2HB GLN 51 -14.361 10.433 6.448 1110 1HG GLN 51 1HG GLN 51 -11.656 11.545 6.520 1111 2HG GLN 51 2HG GLN 51 -12.436 11.413 8.095 1112 1HE2 GLN 51 1HE2 GLN 51 -11.037 9.727 5.450 1113 2HE2 GLN 51 2HE2 GLN 51 -11.131 8.140 6.125 1114 H TYR 52 H TYR 52 -14.125 9.465 4.274 1115 HA TYR 52 HA TYR 52 -11.553 8.541 3.712 1116 1HB TYR 52 1HB TYR 52 -14.300 7.654 2.909 1117 2HB TYR 52 2HB TYR 52 -12.892 6.881 2.188 1118 HD1 TYR 52 HD1 TYR 52 -12.420 4.845 3.147 1119 HD2 TYR 52 HD2 TYR 52 -13.816 7.998 5.641 1120 HE1 TYR 52 HE1 TYR 52 -12.218 3.375 5.109 1121 HE2 TYR 52 HE2 TYR 52 -13.617 6.537 7.609 1122 HH TYR 52 HH TYR 52 -12.746 4.583 8.372 1123 H ALA 53 H ALA 53 -14.051 9.687 1.444 1124 HA ALA 53 HA ALA 53 -12.494 9.498 -0.879 1125 1HB ALA 53 1HB ALA 53 -14.881 11.190 -0.190 1126 2HB ALA 53 2HB ALA 53 -14.135 11.204 -1.788 1127 3HB ALA 53 3HB ALA 53 -14.825 9.712 -1.150 1128 H SER 54 H SER 54 -12.369 11.721 1.716 1129 HA SER 54 HA SER 54 -11.238 13.915 0.256 1130 1HB SER 54 1HB SER 54 -12.120 13.407 2.955 1131 2HB SER 54 2HB SER 54 -10.525 14.160 2.971 1132 HG SER 54 HG SER 54 -11.673 15.916 2.718 1133 H LEU 55 H LEU 55 -9.930 11.483 2.501 1134 HA LEU 55 HA LEU 55 -7.213 12.296 1.928 1135 1HB LEU 55 1HB LEU 55 -6.572 10.989 3.692 1136 2HB LEU 55 2HB LEU 55 -8.225 11.390 4.156 1137 HG LEU 55 HG LEU 55 -8.714 9.088 2.911 1138 1HD1 LEU 55 1HD1 LEU 55 -5.920 9.152 2.905 1139 2HD1 LEU 55 2HD1 LEU 55 -6.963 7.780 2.534 1140 3HD1 LEU 55 3HD1 LEU 55 -6.367 8.014 4.177 1141 1HD2 LEU 55 1HD2 LEU 55 -7.600 8.726 5.622 1142 2HD2 LEU 55 2HD2 LEU 55 -9.182 8.291 4.975 1143 3HD2 LEU 55 3HD2 LEU 55 -8.848 9.959 5.442 1144 H MET 56 H MET 56 -9.463 10.342 0.438 1145 HA MET 56 HA MET 56 -7.954 8.117 -0.367 1146 1HB MET 56 1HB MET 56 -10.529 9.145 -0.864 1147 2HB MET 56 2HB MET 56 -9.771 8.953 -2.440 1148 1HG MET 56 1HG MET 56 -10.992 6.962 -1.865 1149 2HG MET 56 2HG MET 56 -9.264 6.618 -1.899 1150 1HE MET 56 1HE MET 56 -7.982 5.852 -0.450 1151 2HE MET 56 2HE MET 56 -7.994 6.189 1.281 1152 3HE MET 56 3HE MET 56 -8.659 4.671 0.673 1153 H HIS 57 H HIS 57 -8.817 10.907 -2.417 1154 HA HIS 57 HA HIS 57 -6.927 10.378 -4.408 1155 1HB HIS 57 1HB HIS 57 -8.849 11.877 -4.734 1156 2HB HIS 57 2HB HIS 57 -8.131 13.042 -3.626 1157 HD1 HIS 57 HD1 HIS 57 -6.146 11.252 -6.276 1158 HD2 HIS 57 HD2 HIS 57 -7.730 15.017 -5.517 1159 HE1 HIS 57 HE1 HIS 57 -5.165 12.760 -8.033 1160 H SER 58 H SER 58 -6.657 12.077 -1.373 1161 HA SER 58 HA SER 58 -4.165 13.347 -1.950 1162 1HB SER 58 1HB SER 58 -5.918 13.955 -0.135 1163 2HB SER 58 2HB SER 58 -5.120 12.715 0.832 1164 HG SER 58 HG SER 58 -4.263 14.851 1.142 1165 H PHE 59 H PHE 59 -5.111 10.205 -0.878 1166 HA PHE 59 HA PHE 59 -2.700 9.438 0.393 1167 1HB PHE 59 1HB PHE 59 -4.775 8.202 0.743 1168 2HB PHE 59 2HB PHE 59 -4.815 7.748 -0.957 1169 HD1 PHE 59 HD1 PHE 59 -4.750 5.407 -0.758 1170 HD2 PHE 59 HD2 PHE 59 -1.825 7.789 1.214 1171 HE1 PHE 59 HE1 PHE 59 -3.450 3.381 -0.246 1172 HE2 PHE 59 HE2 PHE 59 -0.521 5.768 1.729 1173 HZ PHE 59 HZ PHE 59 -1.332 3.560 0.998 1174 H ILE 60 H ILE 60 -3.953 8.640 -2.850 1175 HA ILE 60 HA ILE 60 -1.603 7.401 -3.766 1176 HB ILE 60 HB ILE 60 -3.788 8.761 -5.346 1177 1HG1 ILE 60 1HG1 ILE 60 -3.713 5.891 -5.527 1178 2HG1 ILE 60 2HG1 ILE 60 -3.764 6.373 -3.835 1179 1HG2 ILE 60 1HG2 ILE 60 -1.546 6.959 -6.237 1180 2HG2 ILE 60 2HG2 ILE 60 -2.958 7.336 -7.223 1181 3HG2 ILE 60 3HG2 ILE 60 -1.852 8.622 -6.738 1182 1HD1 ILE 60 1HD1 ILE 60 -5.888 7.029 -3.974 1183 2HD1 ILE 60 2HD1 ILE 60 -5.643 7.823 -5.530 1184 3HD1 ILE 60 3HD1 ILE 60 -5.924 6.084 -5.462 1185 H LEU 61 H LEU 61 -2.666 10.752 -3.813 1186 HA LEU 61 HA LEU 61 -0.750 11.775 -5.587 1187 1HB LEU 61 1HB LEU 61 -2.774 12.789 -3.878 1188 2HB LEU 61 2HB LEU 61 -1.294 13.689 -3.550 1189 HG LEU 61 HG LEU 61 -1.153 14.391 -5.850 1190 1HD1 LEU 61 1HD1 LEU 61 -3.391 12.444 -6.228 1191 2HD1 LEU 61 2HD1 LEU 61 -1.902 12.630 -7.153 1192 3HD1 LEU 61 3HD1 LEU 61 -3.198 13.814 -7.323 1193 1HD2 LEU 61 1HD2 LEU 61 -3.472 14.929 -4.177 1194 2HD2 LEU 61 2HD2 LEU 61 -3.772 15.239 -5.888 1195 3HD2 LEU 61 3HD2 LEU 61 -2.433 16.043 -5.067 1196 H LYS 62 H LYS 62 -0.573 10.927 -2.209 1197 HA LYS 62 HA LYS 62 1.912 12.279 -1.722 1198 1HB LYS 62 1HB LYS 62 -0.065 11.009 -0.159 1199 2HB LYS 62 2HB LYS 62 1.428 10.124 0.123 1200 1HG LYS 62 1HG LYS 62 1.198 11.867 1.762 1201 2HG LYS 62 2HG LYS 62 2.548 12.244 0.688 1202 1HD LYS 62 1HD LYS 62 1.616 14.231 0.321 1203 2HD LYS 62 2HD LYS 62 0.288 13.403 -0.496 1204 1HE LYS 62 1HE LYS 62 -0.917 14.504 1.083 1205 2HE LYS 62 2HE LYS 62 -0.518 13.062 2.015 1206 1HZ LYS 62 1HZ LYS 62 1.217 15.450 2.078 1207 2HZ LYS 62 2HZ LYS 62 1.117 14.187 3.198 1208 3HZ LYS 62 3HZ LYS 62 -0.131 15.323 3.092 1209 H ALA 63 H ALA 63 0.986 8.853 -2.056 1210 HA ALA 63 HA ALA 63 3.591 7.813 -1.957 1211 1HB ALA 63 1HB ALA 63 2.186 6.079 -1.708 1212 2HB ALA 63 2HB ALA 63 0.931 6.820 -2.700 1213 3HB ALA 63 3HB ALA 63 2.280 5.982 -3.466 1214 H ARG 64 H ARG 64 1.576 8.799 -4.703 1215 HA ARG 64 HA ARG 64 3.159 7.954 -6.799 1216 1HB ARG 64 1HB ARG 64 0.876 9.061 -6.905 1217 2HB ARG 64 2HB ARG 64 1.714 10.601 -6.768 1218 1HG ARG 64 1HG ARG 64 3.014 9.224 -8.823 1219 2HG ARG 64 2HG ARG 64 1.289 8.951 -9.077 1220 1HD ARG 64 1HD ARG 64 2.316 11.698 -8.481 1221 2HD ARG 64 2HD ARG 64 2.425 11.044 -10.114 1222 HE ARG 64 HE ARG 64 -0.189 10.671 -9.260 1223 1HH1 ARG 64 1HH1 ARG 64 1.973 13.321 -9.910 1224 2HH1 ARG 64 2HH1 ARG 64 0.708 14.412 -10.367 1225 1HH2 ARG 64 1HH2 ARG 64 -1.864 12.098 -9.860 1226 2HH2 ARG 64 2HH2 ARG 64 -1.475 13.716 -10.337 1227 H SER 65 H SER 65 3.367 11.006 -4.995 1228 HA SER 65 HA SER 65 5.469 12.139 -6.468 1229 1HB SER 65 1HB SER 65 3.891 12.984 -4.405 1230 2HB SER 65 2HB SER 65 5.439 12.768 -3.589 1231 HG SER 65 HG SER 65 6.376 14.185 -5.045 1232 H THR 66 H THR 66 5.430 9.682 -4.033 1233 HA THR 66 HA THR 66 8.242 9.877 -3.420 1234 HB THR 66 HB THR 66 7.099 7.333 -2.686 1235 HG1 THR 66 HG1 THR 66 5.618 9.669 -1.995 1236 1HG2 THR 66 1HG2 THR 66 7.963 7.847 -0.600 1237 2HG2 THR 66 2HG2 THR 66 7.654 9.574 -0.783 1238 3HG2 THR 66 3HG2 THR 66 8.983 8.818 -1.661 1239 H VAL 67 H VAL 67 6.157 7.644 -5.232 1240 HA VAL 67 HA VAL 67 8.075 5.780 -5.985 1241 HB VAL 67 HB VAL 67 5.702 6.708 -7.609 1242 1HG1 VAL 67 1HG1 VAL 67 7.513 4.325 -7.819 1243 2HG1 VAL 67 2HG1 VAL 67 5.869 4.298 -8.460 1244 3HG1 VAL 67 3HG1 VAL 67 7.038 5.468 -9.075 1245 1HG2 VAL 67 1HG2 VAL 67 5.844 4.330 -5.774 1246 2HG2 VAL 67 2HG2 VAL 67 5.268 5.909 -5.242 1247 3HG2 VAL 67 3HG2 VAL 67 4.418 5.048 -6.525 1248 H ARG 68 H ARG 68 7.547 9.009 -7.115 1249 HA ARG 68 HA ARG 68 8.930 8.751 -9.596 1250 1HB ARG 68 1HB ARG 68 8.091 11.100 -7.912 1251 2HB ARG 68 2HB ARG 68 9.052 11.313 -9.369 1252 1HG ARG 68 1HG ARG 68 6.879 9.633 -10.034 1253 2HG ARG 68 2HG ARG 68 6.240 10.997 -9.114 1254 1HD ARG 68 1HD ARG 68 6.255 12.047 -11.101 1255 2HD ARG 68 2HD ARG 68 7.974 12.259 -10.770 1256 HE ARG 68 HE ARG 68 7.367 9.798 -12.116 1257 1HH1 ARG 68 1HH1 ARG 68 8.017 13.192 -12.531 1258 2HH1 ARG 68 2HH1 ARG 68 8.586 13.018 -14.158 1259 1HH2 ARG 68 1HH2 ARG 68 8.114 9.555 -14.257 1260 2HH2 ARG 68 2HH2 ARG 68 8.640 10.948 -15.139 1261 H ASP 69 H ASP 69 9.845 9.785 -6.343 1262 HA ASP 69 HA ASP 69 12.394 10.750 -6.850 1263 1HB ASP 69 1HB ASP 69 10.864 10.137 -4.576 1264 2HB ASP 69 2HB ASP 69 12.360 9.225 -4.396 1265 H ILE 70 H ILE 70 11.346 7.418 -6.254 1266 HA ILE 70 HA ILE 70 13.788 6.145 -6.118 1267 HB ILE 70 HB ILE 70 11.291 5.114 -7.469 1268 1HG1 ILE 70 1HG1 ILE 70 12.194 4.476 -4.674 1269 2HG1 ILE 70 2HG1 ILE 70 11.232 5.914 -5.001 1270 1HG2 ILE 70 1HG2 ILE 70 12.469 3.305 -7.980 1271 2HG2 ILE 70 2HG2 ILE 70 13.903 3.986 -7.214 1272 3HG2 ILE 70 3HG2 ILE 70 12.761 3.038 -6.261 1273 1HD1 ILE 70 1HD1 ILE 70 10.448 3.101 -4.911 1274 2HD1 ILE 70 2HD1 ILE 70 9.496 4.561 -4.635 1275 3HD1 ILE 70 3HD1 ILE 70 9.793 3.999 -6.280 1276 H ASP 71 H ASP 71 11.913 6.958 -9.023 1277 HA ASP 71 HA ASP 71 14.145 7.471 -10.624 1278 1HB ASP 71 1HB ASP 71 13.388 4.650 -10.434 1279 2HB ASP 71 2HB ASP 71 13.426 5.248 -12.091 1280 HA PRO 72 HA PRO 72 11.054 9.110 -13.267 1281 1HB PRO 72 1HB PRO 72 12.186 8.868 -15.723 1282 2HB PRO 72 2HB PRO 72 12.745 10.035 -14.519 1283 1HG PRO 72 1HG PRO 72 13.871 7.351 -15.221 1284 2HG PRO 72 2HG PRO 72 14.722 8.875 -14.907 1285 1HD PRO 72 1HD PRO 72 14.509 6.916 -13.050 1286 2HD PRO 72 2HD PRO 72 14.565 8.637 -12.620 1287 H GLN 73 H GLN 73 11.989 5.839 -13.555 1288 HA GLN 73 HA GLN 73 9.922 5.238 -15.532 1289 1HB GLN 73 1HB GLN 73 11.808 3.289 -14.212 1290 2HB GLN 73 2HB GLN 73 10.881 3.056 -15.688 1291 1HG GLN 73 1HG GLN 73 12.610 3.762 -16.862 1292 2HG GLN 73 2HG GLN 73 12.479 5.338 -16.085 1293 1HE2 GLN 73 1HE2 GLN 73 14.695 5.659 -16.107 1294 2HE2 GLN 73 2HE2 GLN 73 15.765 4.798 -15.058 1295 H ASN 74 H ASN 74 9.120 2.740 -14.804 1296 HA ASN 74 HA ASN 74 7.620 1.611 -13.520 1297 1HB ASN 74 1HB ASN 74 9.553 2.004 -11.828 1298 2HB ASN 74 2HB ASN 74 8.476 3.205 -11.121 1299 1HD2 ASN 74 1HD2 ASN 74 8.986 1.477 -9.372 1300 2HD2 ASN 74 2HD2 ASN 74 7.787 0.245 -9.202 1301 H ASP 75 H ASP 75 5.660 1.914 -12.101 1302 HA ASP 75 HA ASP 75 4.585 4.527 -11.741 1303 1HB ASP 75 1HB ASP 75 4.364 3.623 -14.332 1304 2HB ASP 75 2HB ASP 75 2.823 3.141 -13.629 1305 H LEU 76 H LEU 76 3.485 4.293 -9.921 1306 HA LEU 76 HA LEU 76 2.647 1.818 -8.881 1307 1HB LEU 76 1HB LEU 76 2.849 4.454 -7.977 1308 2HB LEU 76 2HB LEU 76 1.148 4.032 -7.798 1309 HG LEU 76 HG LEU 76 2.334 3.616 -5.734 1310 1HD1 LEU 76 1HD1 LEU 76 1.694 1.007 -7.098 1311 2HD1 LEU 76 2HD1 LEU 76 0.500 2.102 -6.403 1312 3HD1 LEU 76 3HD1 LEU 76 1.694 1.325 -5.363 1313 1HD2 LEU 76 1HD2 LEU 76 3.945 1.382 -6.696 1314 2HD2 LEU 76 2HD2 LEU 76 4.361 2.687 -5.584 1315 3HD2 LEU 76 3HD2 LEU 76 4.463 2.946 -7.326 1316 H THR 77 H THR 77 0.657 0.837 -8.740 1317 HA THR 77 HA THR 77 -1.668 2.078 -9.958 1318 HB THR 77 HB THR 77 -0.471 0.989 -11.859 1319 HG1 THR 77 HG1 THR 77 -2.374 -0.158 -12.561 1320 1HG2 THR 77 1HG2 THR 77 -0.229 -1.361 -12.000 1321 2HG2 THR 77 2HG2 THR 77 -1.209 -1.625 -10.558 1322 3HG2 THR 77 3HG2 THR 77 0.398 -0.914 -10.414 1323 H PHE 78 H PHE 78 -0.662 0.866 -7.352 1324 HA PHE 78 HA PHE 78 -3.131 -0.265 -6.539 1325 1HB PHE 78 1HB PHE 78 -1.466 -2.111 -7.753 1326 2HB PHE 78 2HB PHE 78 -1.136 -2.338 -6.039 1327 HD1 PHE 78 HD1 PHE 78 -3.325 -2.419 -4.533 1328 HD2 PHE 78 HD2 PHE 78 -3.161 -3.335 -8.686 1329 HE1 PHE 78 HE1 PHE 78 -5.376 -3.760 -4.315 1330 HE2 PHE 78 HE2 PHE 78 -5.212 -4.677 -8.475 1331 HZ PHE 78 HZ PHE 78 -6.323 -4.890 -6.287 1332 H LEU 79 H LEU 79 -3.379 0.217 -4.457 1333 HA LEU 79 HA LEU 79 -0.992 0.393 -2.749 1334 1HB LEU 79 1HB LEU 79 -2.761 2.519 -3.546 1335 2HB LEU 79 2HB LEU 79 -2.819 2.293 -1.799 1336 HG LEU 79 HG LEU 79 -0.472 2.721 -1.599 1337 1HD1 LEU 79 1HD1 LEU 79 0.875 3.310 -3.611 1338 2HD1 LEU 79 2HD1 LEU 79 -0.458 2.732 -4.610 1339 3HD1 LEU 79 3HD1 LEU 79 0.386 1.617 -3.536 1340 1HD2 LEU 79 1HD2 LEU 79 -0.755 4.927 -1.709 1341 2HD2 LEU 79 2HD2 LEU 79 -2.329 4.592 -2.431 1342 3HD2 LEU 79 3HD2 LEU 79 -0.931 4.896 -3.463 1343 H ARG 80 H ARG 80 -1.321 -1.372 -1.508 1344 HA ARG 80 HA ARG 80 -3.960 -1.730 -0.267 1345 1HB ARG 80 1HB ARG 80 -2.243 -3.554 -1.491 1346 2HB ARG 80 2HB ARG 80 -2.053 -3.862 0.230 1347 1HG ARG 80 1HG ARG 80 -4.040 -4.848 0.372 1348 2HG ARG 80 2HG ARG 80 -4.835 -3.559 -0.533 1349 1HD ARG 80 1HD ARG 80 -4.965 -5.782 -1.634 1350 2HD ARG 80 2HD ARG 80 -4.188 -4.545 -2.621 1351 HE ARG 80 HE ARG 80 -2.244 -5.973 -1.156 1352 1HH1 ARG 80 1HH1 ARG 80 -4.418 -6.320 -3.852 1353 2HH1 ARG 80 2HH1 ARG 80 -3.430 -7.488 -4.666 1354 1HH2 ARG 80 1HH2 ARG 80 -0.935 -7.510 -2.217 1355 2HH2 ARG 80 2HH2 ARG 80 -1.450 -8.165 -3.735 1356 H ILE 81 H ILE 81 -4.181 -1.944 1.956 1357 HA ILE 81 HA ILE 81 -1.814 -1.567 3.626 1358 HB ILE 81 HB ILE 81 -4.231 0.187 4.013 1359 1HG1 ILE 81 1HG1 ILE 81 -1.625 0.873 2.636 1360 2HG1 ILE 81 2HG1 ILE 81 -3.197 0.739 1.856 1361 1HG2 ILE 81 1HG2 ILE 81 -1.632 1.054 5.016 1362 2HG2 ILE 81 2HG2 ILE 81 -3.194 0.978 5.829 1363 3HG2 ILE 81 3HG2 ILE 81 -2.188 -0.466 5.716 1364 1HD1 ILE 81 1HD1 ILE 81 -2.014 3.007 3.027 1365 2HD1 ILE 81 2HD1 ILE 81 -3.613 2.861 2.296 1366 3HD1 ILE 81 3HD1 ILE 81 -3.402 2.572 4.023 1367 H ARG 82 H ARG 82 -2.097 -3.607 4.487 1368 HA ARG 82 HA ARG 82 -4.560 -4.627 5.421 1369 1HB ARG 82 1HB ARG 82 -2.044 -5.654 5.032 1370 2HB ARG 82 2HB ARG 82 -2.163 -5.627 6.786 1371 1HG ARG 82 1HG ARG 82 -4.225 -6.930 6.671 1372 2HG ARG 82 2HG ARG 82 -4.108 -6.954 4.910 1373 1HD ARG 82 1HD ARG 82 -1.849 -7.955 6.600 1374 2HD ARG 82 2HD ARG 82 -3.243 -8.984 6.271 1375 HE ARG 82 HE ARG 82 -1.126 -8.375 4.484 1376 1HH1 ARG 82 1HH1 ARG 82 -4.558 -8.943 4.605 1377 2HH1 ARG 82 2HH1 ARG 82 -4.652 -9.524 2.976 1378 1HH2 ARG 82 1HH2 ARG 82 -1.236 -9.138 2.337 1379 2HH2 ARG 82 2HH2 ARG 82 -2.761 -9.635 1.687 1380 H SER 83 H SER 83 -5.699 -3.600 6.941 1381 HA SER 83 HA SER 83 -4.287 -2.487 9.264 1382 1HB SER 83 1HB SER 83 -7.130 -1.896 9.151 1383 2HB SER 83 2HB SER 83 -5.758 -0.790 9.215 1384 HG SER 83 HG SER 83 -7.243 -1.628 7.066 1385 H LYS 84 H LYS 84 -6.044 -2.464 11.224 1386 HA LYS 84 HA LYS 84 -6.269 -5.249 11.950 1387 1HB LYS 84 1HB LYS 84 -6.895 -2.697 13.439 1388 2HB LYS 84 2HB LYS 84 -7.101 -4.300 14.131 1389 1HG LYS 84 1HG LYS 84 -4.569 -4.533 13.362 1390 2HG LYS 84 2HG LYS 84 -4.626 -2.780 13.558 1391 1HD LYS 84 1HD LYS 84 -3.962 -3.549 15.658 1392 2HD LYS 84 2HD LYS 84 -5.696 -3.279 15.844 1393 1HE LYS 84 1HE LYS 84 -5.993 -5.732 15.280 1394 2HE LYS 84 2HE LYS 84 -4.248 -5.891 15.472 1395 1HZ LYS 84 1HZ LYS 84 -5.726 -4.602 17.636 1396 2HZ LYS 84 2HZ LYS 84 -4.375 -5.617 17.705 1397 3HZ LYS 84 3HZ LYS 84 -5.915 -6.274 17.462 1398 H LYS 85 H LYS 85 -8.532 -2.506 11.714 1399 HA LYS 85 HA LYS 85 -10.868 -3.981 12.209 1400 1HB LYS 85 1HB LYS 85 -12.045 -2.068 11.135 1401 2HB LYS 85 2HB LYS 85 -10.892 -1.578 12.369 1402 1HG LYS 85 1HG LYS 85 -9.264 -1.316 10.355 1403 2HG LYS 85 2HG LYS 85 -10.753 -1.247 9.409 1404 1HD LYS 85 1HD LYS 85 -10.712 0.436 11.825 1405 2HD LYS 85 2HD LYS 85 -9.573 0.903 10.559 1406 1HE LYS 85 1HE LYS 85 -11.290 1.978 9.619 1407 2HE LYS 85 2HE LYS 85 -11.888 0.384 9.161 1408 1HZ LYS 85 1HZ LYS 85 -12.836 2.199 11.223 1409 2HZ LYS 85 2HZ LYS 85 -12.832 0.559 11.634 1410 3HZ LYS 85 3HZ LYS 85 -13.695 1.088 10.279 1411 H ASN 86 H ASN 86 -9.150 -3.251 9.213 1412 HA ASN 86 HA ASN 86 -10.016 -5.550 7.884 1413 1HB ASN 86 1HB ASN 86 -11.431 -4.191 6.123 1414 2HB ASN 86 2HB ASN 86 -12.188 -4.827 7.580 1415 1HD2 ASN 86 1HD2 ASN 86 -11.107 -1.995 5.912 1416 2HD2 ASN 86 2HD2 ASN 86 -11.862 -0.841 6.952 1417 H GLU 87 H GLU 87 -9.791 -5.134 5.333 1418 HA GLU 87 HA GLU 87 -7.171 -3.881 5.042 1419 1HB GLU 87 1HB GLU 87 -7.518 -6.204 4.247 1420 2HB GLU 87 2HB GLU 87 -8.706 -5.610 3.095 1421 1HG GLU 87 1HG GLU 87 -6.993 -4.294 1.980 1422 2HG GLU 87 2HG GLU 87 -5.795 -4.847 3.150 1423 H ILE 88 H ILE 88 -6.688 -2.408 3.366 1424 HA ILE 88 HA ILE 88 -9.034 -1.030 2.230 1425 HB ILE 88 HB ILE 88 -6.480 0.333 3.079 1426 1HG1 ILE 88 1HG1 ILE 88 -9.147 0.229 4.506 1427 2HG1 ILE 88 2HG1 ILE 88 -7.667 -0.559 5.041 1428 1HG2 ILE 88 1HG2 ILE 88 -7.272 2.117 2.023 1429 2HG2 ILE 88 2HG2 ILE 88 -8.592 1.127 1.405 1430 3HG2 ILE 88 3HG2 ILE 88 -8.790 2.016 2.915 1431 1HD1 ILE 88 1HD1 ILE 88 -7.478 1.284 6.304 1432 2HD1 ILE 88 2HD1 ILE 88 -6.805 1.978 4.829 1433 3HD1 ILE 88 3HD1 ILE 88 -8.498 2.251 5.239 1434 H MET 89 H MET 89 -9.054 -1.270 0.101 1435 HA MET 89 HA MET 89 -6.482 -1.371 -1.331 1436 1HB MET 89 1HB MET 89 -9.165 -2.509 -2.136 1437 2HB MET 89 2HB MET 89 -7.703 -2.578 -3.111 1438 1HG MET 89 1HG MET 89 -6.781 -4.223 -1.867 1439 2HG MET 89 2HG MET 89 -7.516 -3.655 -0.370 1440 1HE MET 89 1HE MET 89 -8.548 -4.468 -3.805 1441 2HE MET 89 2HE MET 89 -9.208 -6.101 -3.715 1442 3HE MET 89 3HE MET 89 -10.268 -4.707 -3.498 1443 H VAL 90 H VAL 90 -6.008 0.469 -2.324 1444 HA VAL 90 HA VAL 90 -8.136 1.885 -3.768 1445 HB VAL 90 HB VAL 90 -6.112 3.200 -1.952 1446 1HG1 VAL 90 1HG1 VAL 90 -7.607 5.247 -2.666 1447 2HG1 VAL 90 2HG1 VAL 90 -6.228 4.740 -3.644 1448 3HG1 VAL 90 3HG1 VAL 90 -7.863 4.268 -4.110 1449 1HG2 VAL 90 1HG2 VAL 90 -7.696 3.210 -0.394 1450 2HG2 VAL 90 2HG2 VAL 90 -8.840 3.959 -1.508 1451 3HG2 VAL 90 3HG2 VAL 90 -8.692 2.202 -1.445 1452 H ALA 91 H ALA 91 -7.512 1.601 -5.820 1453 HA ALA 91 HA ALA 91 -4.739 2.312 -6.519 1454 1HB ALA 91 1HB ALA 91 -5.116 -0.112 -6.717 1455 2HB ALA 91 2HB ALA 91 -6.420 0.199 -7.863 1456 3HB ALA 91 3HB ALA 91 -4.762 0.642 -8.272 1457 HA PRO 92 HA PRO 92 -6.383 5.259 -9.330 1458 1HB PRO 92 1HB PRO 92 -4.473 5.244 -11.260 1459 2HB PRO 92 2HB PRO 92 -4.220 5.960 -9.664 1460 1HG PRO 92 1HG PRO 92 -3.372 3.280 -10.695 1461 2HG PRO 92 2HG PRO 92 -2.460 4.440 -9.711 1462 1HD PRO 92 1HD PRO 92 -3.670 2.263 -8.649 1463 2HD PRO 92 2HD PRO 92 -3.496 3.788 -7.758 1464 H ASP 93 H ASP 93 -8.168 4.795 -10.460 1465 HA ASP 93 HA ASP 93 -8.194 2.576 -12.342 1466 1HB ASP 93 1HB ASP 93 -10.107 3.694 -10.656 1467 2HB ASP 93 2HB ASP 93 -10.612 4.191 -12.268 1468 H LYS 94 H LYS 94 -9.960 3.398 -14.247 1469 HA LYS 94 HA LYS 94 -8.388 4.594 -16.168 1470 1HB LYS 94 1HB LYS 94 -11.105 3.730 -15.941 1471 2HB LYS 94 2HB LYS 94 -11.082 5.295 -16.743 1472 1HG LYS 94 1HG LYS 94 -10.914 3.835 -18.513 1473 2HG LYS 94 2HG LYS 94 -9.223 4.239 -18.207 1474 1HD LYS 94 1HD LYS 94 -8.716 2.149 -17.521 1475 2HD LYS 94 2HD LYS 94 -10.260 1.937 -16.693 1476 1HE LYS 94 1HE LYS 94 -10.579 2.085 -19.571 1477 2HE LYS 94 2HE LYS 94 -9.490 0.782 -19.095 1478 1HZ LYS 94 1HZ LYS 94 -11.752 0.820 -17.403 1479 2HZ LYS 94 2HZ LYS 94 -11.210 -0.415 -18.424 1480 3HZ LYS 94 3HZ LYS 94 -12.257 0.774 -19.017 1481 H ASP 95 H ASP 95 -10.940 6.153 -14.230 1482 HA ASP 95 HA ASP 95 -9.473 8.663 -14.358 1483 1HB ASP 95 1HB ASP 95 -11.447 8.253 -16.207 1484 2HB ASP 95 2HB ASP 95 -12.341 9.030 -14.904 1485 H TYR 96 H TYR 96 -10.592 6.512 -12.438 1486 HA TYR 96 HA TYR 96 -11.427 8.431 -10.406 1487 1HB TYR 96 1HB TYR 96 -13.235 6.796 -9.671 1488 2HB TYR 96 2HB TYR 96 -13.564 7.715 -11.136 1489 HD1 TYR 96 HD1 TYR 96 -13.398 6.604 -13.351 1490 HD2 TYR 96 HD2 TYR 96 -13.049 4.420 -9.717 1491 HE1 TYR 96 HE1 TYR 96 -13.810 4.512 -14.577 1492 HE2 TYR 96 HE2 TYR 96 -13.459 2.321 -10.932 1493 HH TYR 96 HH TYR 96 -14.403 2.303 -14.300 1494 H PHE 97 H PHE 97 -11.872 6.932 -8.283 1495 HA PHE 97 HA PHE 97 -9.581 5.094 -8.074 1496 1HB PHE 97 1HB PHE 97 -10.428 7.237 -6.119 1497 2HB PHE 97 2HB PHE 97 -9.283 5.959 -5.726 1498 HD1 PHE 97 HD1 PHE 97 -7.281 5.731 -7.434 1499 HD2 PHE 97 HD2 PHE 97 -9.606 9.248 -6.854 1500 HE1 PHE 97 HE1 PHE 97 -5.446 7.090 -8.351 1501 HE2 PHE 97 HE2 PHE 97 -7.777 10.613 -7.771 1502 HZ PHE 97 HZ PHE 97 -5.693 9.535 -8.522 1503 H LEU 98 H LEU 98 -10.272 3.123 -7.607 1504 HA LEU 98 HA LEU 98 -12.878 2.702 -6.426 1505 1HB LEU 98 1HB LEU 98 -11.500 1.334 -8.275 1506 2HB LEU 98 2HB LEU 98 -11.032 0.429 -6.837 1507 HG LEU 98 HG LEU 98 -13.928 0.917 -7.222 1508 1HD1 LEU 98 1HD1 LEU 98 -14.043 -1.086 -8.726 1509 2HD1 LEU 98 2HD1 LEU 98 -12.305 -0.915 -8.974 1510 3HD1 LEU 98 3HD1 LEU 98 -13.397 0.376 -9.474 1511 1HD2 LEU 98 1HD2 LEU 98 -13.589 -1.701 -6.655 1512 2HD2 LEU 98 2HD2 LEU 98 -13.709 -0.434 -5.434 1513 3HD2 LEU 98 3HD2 LEU 98 -12.125 -1.024 -5.940 1514 H ILE 99 H ILE 99 -13.316 1.941 -4.411 1515 HA ILE 99 HA ILE 99 -11.026 1.431 -2.630 1516 HB ILE 99 HB ILE 99 -13.531 2.939 -1.872 1517 1HG1 ILE 99 1HG1 ILE 99 -11.105 4.426 -1.521 1518 2HG1 ILE 99 2HG1 ILE 99 -11.178 3.838 -3.178 1519 1HG2 ILE 99 1HG2 ILE 99 -12.315 3.363 0.240 1520 2HG2 ILE 99 2HG2 ILE 99 -12.677 1.657 -0.020 1521 3HG2 ILE 99 3HG2 ILE 99 -11.046 2.266 -0.304 1522 1HD1 ILE 99 1HD1 ILE 99 -13.714 4.789 -2.758 1523 2HD1 ILE 99 2HD1 ILE 99 -12.705 5.930 -1.869 1524 3HD1 ILE 99 3HD1 ILE 99 -12.408 5.641 -3.583 1525 H VAL 100 H VAL 100 -11.155 -0.718 -2.338 1526 HA VAL 100 HA VAL 100 -13.774 -1.919 -1.773 1527 HB VAL 100 HB VAL 100 -11.142 -3.254 -2.425 1528 1HG1 VAL 100 1HG1 VAL 100 -12.052 -5.077 -1.531 1529 2HG1 VAL 100 2HG1 VAL 100 -13.603 -4.269 -1.298 1530 3HG1 VAL 100 3HG1 VAL 100 -13.232 -5.041 -2.840 1531 1HG2 VAL 100 1HG2 VAL 100 -12.773 -3.917 -4.447 1532 2HG2 VAL 100 2HG2 VAL 100 -13.424 -2.325 -4.058 1533 3HG2 VAL 100 3HG2 VAL 100 -11.722 -2.501 -4.482 1534 H ILE 101 H ILE 101 -14.288 -2.034 0.307 1535 HA ILE 101 HA ILE 101 -12.148 -2.581 2.258 1536 HB ILE 101 HB ILE 101 -14.775 -1.162 2.716 1537 1HG1 ILE 101 1HG1 ILE 101 -12.274 0.248 3.299 1538 2HG1 ILE 101 2HG1 ILE 101 -12.464 -0.157 1.597 1539 1HG2 ILE 101 1HG2 ILE 101 -14.519 -1.664 4.862 1540 2HG2 ILE 101 2HG2 ILE 101 -13.003 -2.497 4.523 1541 3HG2 ILE 101 3HG2 ILE 101 -13.001 -0.767 4.861 1542 1HD1 ILE 101 1HD1 ILE 101 -14.263 1.519 3.314 1543 2HD1 ILE 101 2HD1 ILE 101 -13.366 1.995 1.872 1544 3HD1 ILE 101 3HD1 ILE 101 -14.746 0.906 1.732 1545 H GLN 102 H GLN 102 -12.245 -4.429 3.354 1546 HA GLN 102 HA GLN 102 -14.684 -5.656 4.160 1547 1HB GLN 102 1HB GLN 102 -14.700 -7.604 2.814 1548 2HB GLN 102 2HB GLN 102 -14.533 -6.253 1.700 1549 1HG GLN 102 1HG GLN 102 -12.058 -6.681 1.719 1550 2HG GLN 102 2HG GLN 102 -12.402 -8.168 2.601 1551 1HE2 GLN 102 1HE2 GLN 102 -11.890 -6.886 -0.385 1552 2HE2 GLN 102 2HE2 GLN 102 -12.622 -8.114 -1.355 1553 H ASN 103 H ASN 103 -14.175 -7.981 5.010 1554 HA ASN 103 HA ASN 103 -12.323 -7.773 7.059 1555 1HB ASN 103 1HB ASN 103 -13.977 -9.906 5.908 1556 2HB ASN 103 2HB ASN 103 -12.511 -10.491 6.688 1557 1HD2 ASN 103 1HD2 ASN 103 -15.533 -10.375 7.307 1558 2HD2 ASN 103 2HD2 ASN 103 -15.570 -9.883 8.962 1559 HA PRO 104 HA PRO 104 -8.360 -8.728 5.436 1560 1HB PRO 104 1HB PRO 104 -7.296 -10.313 7.366 1561 2HB PRO 104 2HB PRO 104 -7.546 -8.577 7.579 1562 1HG PRO 104 1HG PRO 104 -9.233 -10.863 8.522 1563 2HG PRO 104 2HG PRO 104 -8.766 -9.387 9.386 1564 1HD PRO 104 1HD PRO 104 -11.197 -9.693 8.232 1565 2HD PRO 104 2HD PRO 104 -10.387 -8.117 8.349 1566 H THR 105 H THR 105 -7.208 -10.250 4.273 1567 HA THR 105 HA THR 105 -8.515 -12.873 3.977 1568 HB THR 105 HB THR 105 -7.487 -12.944 1.712 1569 HG1 THR 105 HG1 THR 105 -5.831 -11.316 2.296 1570 1HG2 THR 105 1HG2 THR 105 -8.998 -11.289 0.684 1571 2HG2 THR 105 2HG2 THR 105 -9.251 -10.555 2.267 1572 3HG2 THR 105 3HG2 THR 105 -9.793 -12.205 1.964 1573 H GLU 106 H GLU 106 -5.418 -11.216 4.260 1574 HA GLU 106 HA GLU 106 -4.199 -13.779 5.018 1575 1HB GLU 106 1HB GLU 106 -3.553 -12.208 2.714 1576 2HB GLU 106 2HB GLU 106 -2.188 -12.177 3.821 1577 1HG GLU 106 1HG GLU 106 -1.709 -14.353 3.510 1578 2HG GLU 106 2HG GLU 106 -3.403 -14.818 3.362 Start of MODEL 15 1 H MET 11 H MET 11 18.111 -10.167 14.973 2 HA MET 11 HA MET 11 18.040 -8.899 12.337 3 1HB MET 11 1HB MET 11 19.982 -9.057 14.401 4 2HB MET 11 2HB MET 11 20.634 -9.902 13.004 5 1HG MET 11 1HG MET 11 19.729 -7.712 11.781 6 2HG MET 11 2HG MET 11 20.029 -7.038 13.381 7 1HE MET 11 1HE MET 11 21.624 -6.413 10.364 8 2HE MET 11 2HE MET 11 22.983 -7.514 10.134 9 3HE MET 11 3HE MET 11 21.331 -8.130 10.084 10 H ALA 12 H ALA 12 19.076 -11.942 13.862 11 HA ALA 12 HA ALA 12 19.876 -13.336 11.619 12 1HB ALA 12 1HB ALA 12 20.028 -15.095 12.999 13 2HB ALA 12 2HB ALA 12 19.588 -13.940 14.258 14 3HB ALA 12 3HB ALA 12 18.349 -14.956 13.521 15 H GLU 13 H GLU 13 16.606 -12.889 12.890 16 HA GLU 13 HA GLU 13 15.209 -14.666 11.299 17 1HB GLU 13 1HB GLU 13 14.434 -12.992 13.182 18 2HB GLU 13 2HB GLU 13 14.055 -11.956 11.813 19 1HG GLU 13 1HG GLU 13 12.545 -13.589 10.920 20 2HG GLU 13 2HG GLU 13 13.018 -14.760 12.149 21 H VAL 14 H VAL 14 15.943 -11.252 10.593 22 HA VAL 14 HA VAL 14 14.804 -11.243 8.013 23 HB VAL 14 HB VAL 14 17.064 -9.481 8.961 24 1HG1 VAL 14 1HG1 VAL 14 15.350 -9.554 6.603 25 2HG1 VAL 14 2HG1 VAL 14 15.364 -7.985 7.410 26 3HG1 VAL 14 3HG1 VAL 14 16.877 -8.713 6.869 27 1HG2 VAL 14 1HG2 VAL 14 14.146 -9.449 9.593 28 2HG2 VAL 14 2HG2 VAL 14 15.526 -9.144 10.647 29 3HG2 VAL 14 3HG2 VAL 14 15.029 -7.928 9.471 30 H GLU 15 H GLU 15 18.052 -11.960 9.182 31 HA GLU 15 HA GLU 15 19.337 -12.054 6.678 32 1HB GLU 15 1HB GLU 15 19.956 -13.395 9.309 33 2HB GLU 15 2HB GLU 15 21.003 -13.524 7.902 34 1HG GLU 15 1HG GLU 15 21.493 -11.219 7.930 35 2HG GLU 15 2HG GLU 15 20.196 -10.882 9.074 36 H GLU 16 H GLU 16 17.617 -14.499 8.553 37 HA GLU 16 HA GLU 16 18.281 -16.714 6.940 38 1HB GLU 16 1HB GLU 16 16.928 -16.365 9.293 39 2HB GLU 16 2HB GLU 16 15.622 -16.780 8.192 40 1HG GLU 16 1HG GLU 16 18.119 -18.409 8.600 41 2HG GLU 16 2HG GLU 16 16.558 -18.732 9.353 42 H THR 17 H THR 17 15.742 -14.298 6.738 43 HA THR 17 HA THR 17 14.349 -15.645 4.604 44 HB THR 17 HB THR 17 14.038 -12.836 5.679 45 HG1 THR 17 HG1 THR 17 13.281 -14.136 7.242 46 1HG2 THR 17 1HG2 THR 17 12.386 -14.412 3.707 47 2HG2 THR 17 2HG2 THR 17 13.199 -12.870 3.439 48 3HG2 THR 17 3HG2 THR 17 11.812 -12.959 4.524 49 H LEU 18 H LEU 18 16.905 -13.331 4.892 50 HA LEU 18 HA LEU 18 16.678 -12.265 2.244 51 1HB LEU 18 1HB LEU 18 18.367 -11.887 4.569 52 2HB LEU 18 2HB LEU 18 19.299 -11.884 3.074 53 HG LEU 18 HG LEU 18 17.341 -10.184 2.380 54 1HD1 LEU 18 1HD1 LEU 18 16.997 -8.661 4.335 55 2HD1 LEU 18 2HD1 LEU 18 17.635 -9.941 5.366 56 3HD1 LEU 18 3HD1 LEU 18 16.155 -10.207 4.444 57 1HD2 LEU 18 1HD2 LEU 18 18.912 -8.443 2.683 58 2HD2 LEU 18 2HD2 LEU 18 19.851 -9.903 2.369 59 3HD2 LEU 18 3HD2 LEU 18 19.701 -9.287 4.015 60 H LYS 19 H LYS 19 18.378 -14.929 3.743 61 HA LYS 19 HA LYS 19 20.183 -15.463 1.630 62 1HB LYS 19 1HB LYS 19 19.078 -17.171 3.856 63 2HB LYS 19 2HB LYS 19 20.242 -17.784 2.689 64 1HG LYS 19 1HG LYS 19 20.780 -15.317 4.307 65 2HG LYS 19 2HG LYS 19 21.134 -16.935 4.917 66 1HD LYS 19 1HD LYS 19 22.294 -17.102 2.502 67 2HD LYS 19 2HD LYS 19 22.464 -15.369 2.791 68 1HE LYS 19 1HE LYS 19 23.576 -15.813 4.906 69 2HE LYS 19 2HE LYS 19 23.353 -17.547 4.681 70 1HZ LYS 19 1HZ LYS 19 25.202 -15.719 3.324 71 2HZ LYS 19 2HZ LYS 19 24.633 -17.067 2.475 72 3HZ LYS 19 3HZ LYS 19 25.476 -17.276 3.926 73 H ARG 20 H ARG 20 17.055 -16.937 2.489 74 HA ARG 20 HA ARG 20 16.948 -18.657 0.250 75 1HB ARG 20 1HB ARG 20 14.736 -19.153 0.909 76 2HB ARG 20 2HB ARG 20 15.599 -18.817 2.404 77 1HG ARG 20 1HG ARG 20 14.697 -16.427 2.153 78 2HG ARG 20 2HG ARG 20 13.577 -17.129 0.983 79 1HD ARG 20 1HD ARG 20 12.997 -18.817 2.801 80 2HD ARG 20 2HD ARG 20 13.855 -17.750 3.910 81 HE ARG 20 HE ARG 20 12.040 -16.165 2.563 82 1HH1 ARG 20 1HH1 ARG 20 11.941 -18.939 4.664 83 2HH1 ARG 20 2HH1 ARG 20 10.390 -18.543 5.328 84 1HH2 ARG 20 1HH2 ARG 20 9.999 -15.633 3.430 85 2HH2 ARG 20 2HH2 ARG 20 9.286 -16.663 4.625 86 H LEU 21 H LEU 21 16.006 -15.332 0.754 87 HA LEU 21 HA LEU 21 14.401 -15.084 -1.584 88 1HB LEU 21 1HB LEU 21 15.474 -13.317 0.494 89 2HB LEU 21 2HB LEU 21 15.289 -12.553 -1.084 90 HG LEU 21 HG LEU 21 12.932 -13.000 -1.090 91 1HD1 LEU 21 1HD1 LEU 21 12.317 -13.967 1.439 92 2HD1 LEU 21 2HD1 LEU 21 13.656 -14.974 0.890 93 3HD1 LEU 21 3HD1 LEU 21 12.195 -14.840 -0.089 94 1HD2 LEU 21 1HD2 LEU 21 13.291 -10.991 -0.003 95 2HD2 LEU 21 2HD2 LEU 21 14.072 -11.758 1.380 96 3HD2 LEU 21 3HD2 LEU 21 12.325 -11.883 1.172 97 H GLN 22 H GLN 22 17.687 -13.905 -0.842 98 HA GLN 22 HA GLN 22 18.276 -13.040 -3.446 99 1HB GLN 22 1HB GLN 22 19.574 -13.059 -0.966 100 2HB GLN 22 2HB GLN 22 20.631 -13.964 -2.041 101 1HG GLN 22 1HG GLN 22 21.130 -11.538 -1.920 102 2HG GLN 22 2HG GLN 22 20.797 -12.128 -3.548 103 1HE2 GLN 22 1HE2 GLN 22 18.872 -10.976 -0.792 104 2HE2 GLN 22 2HE2 GLN 22 17.920 -9.861 -1.706 105 H SER 23 H SER 23 18.067 -16.175 -2.130 106 HA SER 23 HA SER 23 19.866 -17.412 -4.025 107 1HB SER 23 1HB SER 23 18.278 -18.283 -1.694 108 2HB SER 23 2HB SER 23 18.449 -19.486 -2.972 109 HG SER 23 HG SER 23 20.745 -19.080 -2.847 110 H GLN 24 H GLN 24 16.444 -16.799 -3.707 111 HA GLN 24 HA GLN 24 15.792 -18.489 -5.981 112 1HB GLN 24 1HB GLN 24 13.471 -17.840 -5.536 113 2HB GLN 24 2HB GLN 24 14.254 -18.447 -4.083 114 1HG GLN 24 1HG GLN 24 14.471 -16.267 -3.182 115 2HG GLN 24 2HG GLN 24 14.004 -15.520 -4.709 116 1HE2 GLN 24 1HE2 GLN 24 12.685 -14.695 -2.574 117 2HE2 GLN 24 2HE2 GLN 24 11.084 -15.342 -2.521 118 H LYS 25 H LYS 25 14.776 -17.694 -7.885 119 HA LYS 25 HA LYS 25 15.910 -15.217 -8.806 120 1HB LYS 25 1HB LYS 25 15.638 -17.344 -10.178 121 2HB LYS 25 2HB LYS 25 13.927 -16.950 -10.277 122 1HG LYS 25 1HG LYS 25 14.751 -14.673 -11.187 123 2HG LYS 25 2HG LYS 25 16.264 -15.532 -11.482 124 1HD LYS 25 1HD LYS 25 15.423 -16.521 -13.292 125 2HD LYS 25 2HD LYS 25 14.010 -17.083 -12.395 126 1HE LYS 25 1HE LYS 25 12.990 -15.733 -13.930 127 2HE LYS 25 2HE LYS 25 13.279 -14.562 -12.643 128 1HZ LYS 25 1HZ LYS 25 13.916 -13.769 -14.880 129 2HZ LYS 25 2HZ LYS 25 15.095 -14.979 -14.954 130 3HZ LYS 25 3HZ LYS 25 15.204 -13.763 -13.782 131 H GLY 26 H GLY 26 14.887 -13.313 -9.249 132 1HA GLY 26 1HA GLY 26 12.743 -12.194 -9.780 133 2HA GLY 26 2HA GLY 26 12.033 -13.160 -8.495 134 H VAL 27 H VAL 27 13.990 -12.888 -6.532 135 HA VAL 27 HA VAL 27 13.253 -10.484 -5.315 136 HB VAL 27 HB VAL 27 15.665 -12.210 -4.740 137 1HG1 VAL 27 1HG1 VAL 27 14.728 -10.904 -2.422 138 2HG1 VAL 27 2HG1 VAL 27 16.271 -10.682 -3.249 139 3HG1 VAL 27 3HG1 VAL 27 14.887 -9.676 -3.678 140 1HG2 VAL 27 1HG2 VAL 27 13.600 -13.458 -4.562 141 2HG2 VAL 27 2HG2 VAL 27 14.245 -13.148 -2.950 142 3HG2 VAL 27 3HG2 VAL 27 12.890 -12.196 -3.556 143 H GLN 28 H GLN 28 13.745 -8.506 -5.989 144 HA GLN 28 HA GLN 28 16.071 -7.963 -7.580 145 1HB GLN 28 1HB GLN 28 13.624 -6.585 -6.841 146 2HB GLN 28 2HB GLN 28 15.018 -5.516 -6.765 147 1HG GLN 28 1HG GLN 28 14.882 -5.249 -8.951 148 2HG GLN 28 2HG GLN 28 15.276 -6.956 -9.155 149 1HE2 GLN 28 1HE2 GLN 28 13.092 -8.245 -8.319 150 2HE2 GLN 28 2HE2 GLN 28 11.717 -7.827 -9.278 151 H GLY 29 H GLY 29 15.154 -7.592 -4.225 152 1HA GLY 29 1HA GLY 29 17.609 -7.598 -3.093 153 2HA GLY 29 2HA GLY 29 17.423 -5.920 -3.582 154 H ILE 30 H ILE 30 17.526 -7.368 -0.910 155 HA ILE 30 HA ILE 30 14.995 -6.336 0.189 156 HB ILE 30 HB ILE 30 16.844 -8.341 1.482 157 1HG1 ILE 30 1HG1 ILE 30 14.321 -9.462 0.759 158 2HG1 ILE 30 2HG1 ILE 30 15.012 -8.703 -0.670 159 1HG2 ILE 30 1HG2 ILE 30 15.324 -6.890 2.910 160 2HG2 ILE 30 2HG2 ILE 30 13.979 -7.753 2.165 161 3HG2 ILE 30 3HG2 ILE 30 15.175 -8.636 3.114 162 1HD1 ILE 30 1HD1 ILE 30 15.865 -11.092 0.805 163 2HD1 ILE 30 2HD1 ILE 30 16.018 -10.690 -0.906 164 3HD1 ILE 30 3HD1 ILE 30 17.162 -10.028 0.261 165 H ILE 31 H ILE 31 15.035 -4.757 1.682 166 HA ILE 31 HA ILE 31 17.644 -3.982 2.807 167 HB ILE 31 HB ILE 31 15.497 -2.088 1.845 168 1HG1 ILE 31 1HG1 ILE 31 18.185 -1.878 0.702 169 2HG1 ILE 31 2HG1 ILE 31 17.393 -3.407 0.337 170 1HG2 ILE 31 1HG2 ILE 31 18.098 -1.662 3.279 171 2HG2 ILE 31 2HG2 ILE 31 17.353 -0.393 2.308 172 3HG2 ILE 31 3HG2 ILE 31 16.494 -1.059 3.697 173 1HD1 ILE 31 1HD1 ILE 31 15.894 -2.449 -1.033 174 2HD1 ILE 31 2HD1 ILE 31 15.753 -0.996 -0.042 175 3HD1 ILE 31 3HD1 ILE 31 17.120 -1.186 -1.139 176 H VAL 32 H VAL 32 17.649 -3.202 4.905 177 HA VAL 32 HA VAL 32 15.080 -3.283 6.341 178 HB VAL 32 HB VAL 32 17.623 -4.226 7.629 179 1HG1 VAL 32 1HG1 VAL 32 16.076 -5.391 9.116 180 2HG1 VAL 32 2HG1 VAL 32 15.728 -3.662 9.068 181 3HG1 VAL 32 3HG1 VAL 32 14.710 -4.793 8.175 182 1HG2 VAL 32 1HG2 VAL 32 16.934 -6.542 7.115 183 2HG2 VAL 32 2HG2 VAL 32 15.672 -5.909 6.058 184 3HG2 VAL 32 3HG2 VAL 32 17.370 -5.625 5.673 185 H VAL 33 H VAL 33 14.667 -1.417 7.307 186 HA VAL 33 HA VAL 33 16.935 0.285 8.116 187 HB VAL 33 HB VAL 33 14.161 1.293 7.513 188 1HG1 VAL 33 1HG1 VAL 33 15.191 2.990 8.638 189 2HG1 VAL 33 2HG1 VAL 33 16.807 2.503 8.121 190 3HG1 VAL 33 3HG1 VAL 33 15.740 3.353 7.002 191 1HG2 VAL 33 1HG2 VAL 33 16.432 0.723 5.658 192 2HG2 VAL 33 2HG2 VAL 33 14.704 0.457 5.429 193 3HG2 VAL 33 3HG2 VAL 33 15.364 2.090 5.341 194 H ASN 34 H ASN 34 16.977 1.124 10.151 195 HA ASN 34 HA ASN 34 15.138 -0.051 12.070 196 1HB ASN 34 1HB ASN 34 16.686 0.930 13.762 197 2HB ASN 34 2HB ASN 34 17.489 -0.149 12.624 198 1HD2 ASN 34 1HD2 ASN 34 19.463 0.865 13.166 199 2HD2 ASN 34 2HD2 ASN 34 19.884 2.401 12.496 200 H THR 35 H THR 35 14.927 1.687 14.074 201 HA THR 35 HA THR 35 12.896 3.441 13.258 202 HB THR 35 HB THR 35 13.903 4.422 15.705 203 HG1 THR 35 HG1 THR 35 14.085 2.419 16.868 204 1HG2 THR 35 1HG2 THR 35 11.833 2.315 15.771 205 2HG2 THR 35 2HG2 THR 35 11.514 3.682 14.703 206 3HG2 THR 35 3HG2 THR 35 11.805 3.954 16.420 207 H GLU 36 H GLU 36 16.313 4.001 13.982 208 HA GLU 36 HA GLU 36 16.273 6.804 13.844 209 1HB GLU 36 1HB GLU 36 18.346 4.692 13.682 210 2HB GLU 36 2HB GLU 36 18.775 6.260 13.012 211 1HG GLU 36 1HG GLU 36 17.694 6.986 15.389 212 2HG GLU 36 2HG GLU 36 18.415 5.430 15.797 213 H GLY 37 H GLY 37 16.259 4.363 11.373 214 1HA GLY 37 1HA GLY 37 15.443 4.898 9.179 215 2HA GLY 37 2HA GLY 37 16.148 6.499 9.350 216 H ILE 38 H ILE 38 18.203 4.079 10.494 217 HA ILE 38 HA ILE 38 19.910 4.397 8.148 218 HB ILE 38 HB ILE 38 20.542 3.094 10.798 219 1HG1 ILE 38 1HG1 ILE 38 21.196 5.867 9.775 220 2HG1 ILE 38 2HG1 ILE 38 20.041 5.486 11.048 221 1HG2 ILE 38 1HG2 ILE 38 21.923 2.329 8.903 222 2HG2 ILE 38 2HG2 ILE 38 22.385 4.002 8.592 223 3HG2 ILE 38 3HG2 ILE 38 22.854 3.224 10.104 224 1HD1 ILE 38 1HD1 ILE 38 21.674 5.704 12.517 225 2HD1 ILE 38 2HD1 ILE 38 22.464 4.296 11.805 226 3HD1 ILE 38 3HD1 ILE 38 22.858 5.915 11.227 227 HA PRO 39 HA PRO 39 18.820 0.402 6.589 228 1HB PRO 39 1HB PRO 39 20.830 0.180 4.778 229 2HB PRO 39 2HB PRO 39 19.424 1.222 4.530 230 1HG PRO 39 1HG PRO 39 22.172 1.941 5.476 231 2HG PRO 39 2HG PRO 39 21.131 2.786 4.315 232 1HD PRO 39 1HD PRO 39 21.387 3.583 6.890 233 2HD PRO 39 2HD PRO 39 19.882 3.788 5.972 234 H ILE 40 H ILE 40 19.396 -0.573 8.693 235 HA ILE 40 HA ILE 40 21.901 -1.337 9.532 236 HB ILE 40 HB ILE 40 20.697 -3.407 10.487 237 1HG1 ILE 40 1HG1 ILE 40 18.204 -1.888 9.790 238 2HG1 ILE 40 2HG1 ILE 40 18.848 -3.086 8.674 239 1HG2 ILE 40 1HG2 ILE 40 19.957 -0.565 11.117 240 2HG2 ILE 40 2HG2 ILE 40 19.413 -1.921 12.104 241 3HG2 ILE 40 3HG2 ILE 40 21.137 -1.598 11.923 242 1HD1 ILE 40 1HD1 ILE 40 17.102 -3.569 10.724 243 2HD1 ILE 40 2HD1 ILE 40 18.083 -4.779 9.896 244 3HD1 ILE 40 3HD1 ILE 40 18.651 -4.064 11.405 245 H LYS 41 H LYS 41 19.884 -2.803 7.057 246 HA LYS 41 HA LYS 41 22.188 -4.278 6.076 247 1HB LYS 41 1HB LYS 41 20.249 -5.559 7.658 248 2HB LYS 41 2HB LYS 41 19.900 -6.036 6.001 249 1HG LYS 41 1HG LYS 41 22.734 -6.170 6.628 250 2HG LYS 41 2HG LYS 41 21.748 -7.196 7.673 251 1HD LYS 41 1HD LYS 41 20.822 -8.345 5.803 252 2HD LYS 41 2HD LYS 41 21.518 -7.185 4.668 253 1HE LYS 41 1HE LYS 41 23.322 -8.714 6.488 254 2HE LYS 41 2HE LYS 41 22.650 -9.517 5.071 255 1HZ LYS 41 1HZ LYS 41 24.117 -6.942 4.947 256 2HZ LYS 41 2HZ LYS 41 23.655 -7.925 3.650 257 3HZ LYS 41 3HZ LYS 41 24.855 -8.447 4.721 258 H SER 42 H SER 42 22.018 -4.893 3.889 259 HA SER 42 HA SER 42 19.647 -4.494 2.364 260 1HB SER 42 1HB SER 42 20.420 -2.575 1.023 261 2HB SER 42 2HB SER 42 20.215 -2.133 2.718 262 HG SER 42 HG SER 42 22.471 -2.151 1.180 263 H THR 43 H THR 43 19.888 -5.112 0.173 264 HA THR 43 HA THR 43 22.445 -6.460 -0.408 265 HB THR 43 HB THR 43 21.292 -8.187 -1.568 266 HG1 THR 43 HG1 THR 43 19.171 -6.365 -1.494 267 1HG2 THR 43 1HG2 THR 43 19.460 -7.796 0.766 268 2HG2 THR 43 2HG2 THR 43 21.183 -8.058 1.036 269 3HG2 THR 43 3HG2 THR 43 20.229 -9.270 0.181 270 H MET 44 H MET 44 20.439 -3.959 -1.307 271 HA MET 44 HA MET 44 20.866 -4.105 -4.156 272 1HB MET 44 1HB MET 44 19.829 -1.810 -2.485 273 2HB MET 44 2HB MET 44 19.728 -1.949 -4.235 274 1HG MET 44 1HG MET 44 18.565 -4.200 -2.769 275 2HG MET 44 2HG MET 44 17.770 -2.652 -2.495 276 1HE MET 44 1HE MET 44 19.626 -3.126 -5.856 277 2HE MET 44 2HE MET 44 19.315 -4.807 -5.422 278 3HE MET 44 3HE MET 44 18.495 -4.088 -6.808 279 H ASP 45 H ASP 45 21.507 -1.608 -4.942 280 HA ASP 45 HA ASP 45 24.324 -1.545 -4.577 281 1HB ASP 45 1HB ASP 45 22.634 -0.621 -6.503 282 2HB ASP 45 2HB ASP 45 23.048 0.877 -5.673 283 H ASN 46 H ASN 46 25.442 0.606 -4.055 284 HA ASN 46 HA ASN 46 24.924 1.238 -1.354 285 1HB ASN 46 1HB ASN 46 27.000 1.688 -3.206 286 2HB ASN 46 2HB ASN 46 26.500 3.279 -2.643 287 1HD2 ASN 46 1HD2 ASN 46 25.750 2.696 -0.058 288 2HD2 ASN 46 2HD2 ASN 46 27.144 2.216 0.844 289 HA PRO 47 HA PRO 47 23.342 5.500 -3.000 290 1HB PRO 47 1HB PRO 47 22.882 5.706 -5.667 291 2HB PRO 47 2HB PRO 47 24.442 6.087 -4.929 292 1HG PRO 47 1HG PRO 47 23.572 3.595 -6.340 293 2HG PRO 47 2HG PRO 47 25.105 4.477 -6.470 294 1HD PRO 47 1HD PRO 47 24.837 2.235 -4.975 295 2HD PRO 47 2HD PRO 47 25.949 3.547 -4.537 296 H THR 48 H THR 48 22.241 2.517 -4.447 297 HA THR 48 HA THR 48 19.540 3.392 -4.865 298 HB THR 48 HB THR 48 20.699 0.599 -4.809 299 HG1 THR 48 HG1 THR 48 21.450 2.011 -6.511 300 1HG2 THR 48 1HG2 THR 48 17.953 1.633 -5.211 301 2HG2 THR 48 2HG2 THR 48 18.498 0.077 -4.582 302 3HG2 THR 48 3HG2 THR 48 18.497 0.375 -6.320 303 H THR 49 H THR 49 21.275 1.626 -2.360 304 HA THR 49 HA THR 49 18.999 0.828 -0.874 305 HB THR 49 HB THR 49 21.867 1.217 0.002 306 HG1 THR 49 HG1 THR 49 22.129 -0.765 -0.716 307 1HG2 THR 49 1HG2 THR 49 19.576 -0.131 1.439 308 2HG2 THR 49 2HG2 THR 49 20.384 1.358 1.931 309 3HG2 THR 49 3HG2 THR 49 21.265 -0.170 1.945 310 H THR 50 H THR 50 21.291 3.519 -0.428 311 HA THR 50 HA THR 50 20.101 4.659 1.820 312 HB THR 50 HB THR 50 21.184 6.631 -0.058 313 HG1 THR 50 HG1 THR 50 22.627 5.237 -0.810 314 1HG2 THR 50 1HG2 THR 50 20.870 6.704 2.516 315 2HG2 THR 50 2HG2 THR 50 22.336 7.390 1.815 316 3HG2 THR 50 3HG2 THR 50 22.378 5.792 2.559 317 H GLN 51 H GLN 51 19.611 5.471 -1.615 318 HA GLN 51 HA GLN 51 17.732 7.486 -1.284 319 1HB GLN 51 1HB GLN 51 18.748 7.048 -3.436 320 2HB GLN 51 2HB GLN 51 17.998 5.459 -3.508 321 1HG GLN 51 1HG GLN 51 16.111 7.669 -3.168 322 2HG GLN 51 2HG GLN 51 17.022 7.706 -4.677 323 1HE2 GLN 51 1HE2 GLN 51 14.606 6.090 -2.830 324 2HE2 GLN 51 2HE2 GLN 51 14.104 4.979 -4.054 325 H TYR 52 H TYR 52 17.231 3.988 -1.583 326 HA TYR 52 HA TYR 52 14.410 4.076 -1.507 327 1HB TYR 52 1HB TYR 52 16.473 1.952 -1.095 328 2HB TYR 52 2HB TYR 52 14.809 1.618 -0.629 329 HD1 TYR 52 HD1 TYR 52 13.928 0.167 -2.205 330 HD2 TYR 52 HD2 TYR 52 16.218 3.499 -3.531 331 HE1 TYR 52 HE1 TYR 52 13.386 -0.396 -4.537 332 HE2 TYR 52 HE2 TYR 52 15.681 2.945 -5.867 333 HH TYR 52 HH TYR 52 14.754 0.199 -6.939 334 H ALA 53 H ALA 53 16.783 3.308 1.039 335 HA ALA 53 HA ALA 53 14.942 3.031 3.133 336 1HB ALA 53 1HB ALA 53 17.167 3.885 4.423 337 2HB ALA 53 2HB ALA 53 16.906 2.229 3.874 338 3HB ALA 53 3HB ALA 53 17.851 3.346 2.889 339 H SER 54 H SER 54 16.051 5.819 1.494 340 HA SER 54 HA SER 54 15.620 7.686 3.630 341 1HB SER 54 1HB SER 54 16.562 7.774 0.876 342 2HB SER 54 2HB SER 54 15.485 9.120 1.247 343 HG SER 54 HG SER 54 17.919 9.186 1.757 344 H LEU 55 H LEU 55 13.908 7.116 0.550 345 HA LEU 55 HA LEU 55 11.643 8.662 1.349 346 1HB LEU 55 1HB LEU 55 10.858 8.341 -0.760 347 2HB LEU 55 2HB LEU 55 12.571 8.022 -1.029 348 HG LEU 55 HG LEU 55 11.779 5.526 -0.551 349 1HD1 LEU 55 1HD1 LEU 55 9.315 7.033 -1.249 350 2HD1 LEU 55 2HD1 LEU 55 9.529 5.635 -0.196 351 3HD1 LEU 55 3HD1 LEU 55 9.543 5.429 -1.947 352 1HD2 LEU 55 1HD2 LEU 55 12.239 5.192 -2.729 353 2HD2 LEU 55 2HD2 LEU 55 12.671 6.902 -2.698 354 3HD2 LEU 55 3HD2 LEU 55 11.078 6.404 -3.271 355 H MET 56 H MET 56 12.636 5.433 1.863 356 HA MET 56 HA MET 56 10.136 4.149 2.065 357 1HB MET 56 1HB MET 56 12.904 3.590 2.983 358 2HB MET 56 2HB MET 56 11.608 2.723 3.796 359 1HG MET 56 1HG MET 56 12.011 2.766 0.816 360 2HG MET 56 2HG MET 56 12.611 1.503 1.888 361 1HE MET 56 1HE MET 56 10.214 2.766 -0.313 362 2HE MET 56 2HE MET 56 8.840 1.661 -0.269 363 3HE MET 56 3HE MET 56 8.846 3.102 0.749 364 H HIS 57 H HIS 57 12.269 5.208 4.727 365 HA HIS 57 HA HIS 57 10.455 4.878 6.792 366 1HB HIS 57 1HB HIS 57 12.919 5.390 6.994 367 2HB HIS 57 2HB HIS 57 12.524 7.076 6.671 368 HD1 HIS 57 HD1 HIS 57 11.900 4.374 9.240 369 HD2 HIS 57 HD2 HIS 57 11.667 8.504 8.848 370 HE1 HIS 57 HE1 HIS 57 11.426 5.243 11.552 371 H SER 58 H SER 58 10.813 7.533 4.532 372 HA SER 58 HA SER 58 9.022 9.287 5.930 373 1HB SER 58 1HB SER 58 10.510 10.489 4.619 374 2HB SER 58 2HB SER 58 10.425 9.340 3.284 375 HG SER 58 HG SER 58 8.472 10.176 2.690 376 H PHE 59 H PHE 59 8.719 6.772 3.573 377 HA PHE 59 HA PHE 59 6.191 7.519 2.518 378 1HB PHE 59 1HB PHE 59 7.661 5.968 1.331 379 2HB PHE 59 2HB PHE 59 7.527 4.808 2.648 380 HD1 PHE 59 HD1 PHE 59 6.354 2.969 1.939 381 HD2 PHE 59 HD2 PHE 59 5.008 6.842 0.796 382 HE1 PHE 59 HE1 PHE 59 4.390 1.962 0.851 383 HE2 PHE 59 HE2 PHE 59 3.042 5.841 -0.293 384 HZ PHE 59 HZ PHE 59 2.730 3.398 -0.266 385 H ILE 60 H ILE 60 7.082 4.975 4.856 386 HA ILE 60 HA ILE 60 4.527 4.176 5.560 387 HB ILE 60 HB ILE 60 6.959 4.297 7.347 388 1HG1 ILE 60 1HG1 ILE 60 7.285 3.013 5.254 389 2HG1 ILE 60 2HG1 ILE 60 7.326 1.985 6.682 390 1HG2 ILE 60 1HG2 ILE 60 5.657 3.550 8.980 391 2HG2 ILE 60 2HG2 ILE 60 4.258 3.578 7.908 392 3HG2 ILE 60 3HG2 ILE 60 5.267 2.135 8.001 393 1HD1 ILE 60 1HD1 ILE 60 5.732 0.718 5.831 394 2HD1 ILE 60 2HD1 ILE 60 4.652 2.109 5.718 395 3HD1 ILE 60 3HD1 ILE 60 5.732 1.719 4.379 396 H LEU 61 H LEU 61 6.500 6.779 6.938 397 HA LEU 61 HA LEU 61 4.667 7.500 8.969 398 1HB LEU 61 1HB LEU 61 7.164 8.497 7.878 399 2HB LEU 61 2HB LEU 61 6.073 9.802 8.339 400 HG LEU 61 HG LEU 61 5.956 8.894 10.613 401 1HD1 LEU 61 1HD1 LEU 61 7.486 6.699 9.358 402 2HD1 LEU 61 2HD1 LEU 61 6.302 6.659 10.664 403 3HD1 LEU 61 3HD1 LEU 61 7.959 7.168 10.991 404 1HD2 LEU 61 1HD2 LEU 61 8.582 9.111 11.002 405 2HD2 LEU 61 2HD2 LEU 61 7.560 10.500 10.630 406 3HD2 LEU 61 3HD2 LEU 61 8.503 9.730 9.352 407 H LYS 62 H LYS 62 4.847 8.196 5.587 408 HA LYS 62 HA LYS 62 3.170 10.516 5.637 409 1HB LYS 62 1HB LYS 62 4.708 9.097 3.703 410 2HB LYS 62 2HB LYS 62 3.062 9.227 3.095 411 1HG LYS 62 1HG LYS 62 4.379 11.089 2.320 412 2HG LYS 62 2HG LYS 62 3.142 11.657 3.444 413 1HD LYS 62 1HD LYS 62 4.878 11.596 5.248 414 2HD LYS 62 2HD LYS 62 6.078 11.250 4.000 415 1HE LYS 62 1HE LYS 62 6.203 13.397 3.429 416 2HE LYS 62 2HE LYS 62 4.451 13.513 3.264 417 1HZ LYS 62 1HZ LYS 62 4.214 14.088 5.504 418 2HZ LYS 62 2HZ LYS 62 5.542 14.993 4.980 419 3HZ LYS 62 3HZ LYS 62 5.783 13.597 5.904 420 H ALA 63 H ALA 63 2.646 7.140 4.619 421 HA ALA 63 HA ALA 63 -0.147 7.466 4.209 422 1HB ALA 63 1HB ALA 63 1.530 4.989 4.575 423 2HB ALA 63 2HB ALA 63 -0.176 4.980 4.126 424 3HB ALA 63 3HB ALA 63 1.014 5.716 3.053 425 H ARG 64 H ARG 64 1.824 6.533 6.951 426 HA ARG 64 HA ARG 64 -0.188 5.423 8.567 427 1HB ARG 64 1HB ARG 64 2.077 5.068 9.196 428 2HB ARG 64 2HB ARG 64 2.414 6.793 9.226 429 1HG ARG 64 1HG ARG 64 1.724 7.002 11.334 430 2HG ARG 64 2HG ARG 64 0.287 6.017 11.054 431 1HD ARG 64 1HD ARG 64 1.592 4.853 12.648 432 2HD ARG 64 2HD ARG 64 1.801 4.002 11.118 433 HE ARG 64 HE ARG 64 3.851 5.892 11.377 434 1HH1 ARG 64 1HH1 ARG 64 2.771 2.918 12.829 435 2HH1 ARG 64 2HH1 ARG 64 4.360 2.423 13.309 436 1HH2 ARG 64 1HH2 ARG 64 5.949 5.252 12.004 437 2HH2 ARG 64 2HH2 ARG 64 6.167 3.752 12.840 438 H SER 65 H SER 65 0.944 8.751 8.181 439 HA SER 65 HA SER 65 -0.677 9.845 10.239 440 1HB SER 65 1HB SER 65 1.410 10.837 8.973 441 2HB SER 65 2HB SER 65 0.182 11.482 7.884 442 HG SER 65 HG SER 65 -0.539 12.774 9.428 443 H THR 66 H THR 66 -1.269 8.940 6.963 444 HA THR 66 HA THR 66 -3.633 10.561 6.649 445 HB THR 66 HB THR 66 -3.506 8.330 4.813 446 HG1 THR 66 HG1 THR 66 -1.213 10.005 4.780 447 1HG2 THR 66 1HG2 THR 66 -3.742 9.996 3.191 448 2HG2 THR 66 2HG2 THR 66 -2.919 11.204 4.178 449 3HG2 THR 66 3HG2 THR 66 -4.548 10.679 4.603 450 H VAL 67 H VAL 67 -2.941 7.113 7.158 451 HA VAL 67 HA VAL 67 -5.579 6.187 7.140 452 HB VAL 67 HB VAL 67 -3.351 5.057 8.834 453 1HG1 VAL 67 1HG1 VAL 67 -5.798 4.259 9.030 454 2HG1 VAL 67 2HG1 VAL 67 -5.516 3.513 7.456 455 3HG1 VAL 67 3HG1 VAL 67 -4.526 3.052 8.841 456 1HG2 VAL 67 1HG2 VAL 67 -3.511 5.337 5.982 457 2HG2 VAL 67 2HG2 VAL 67 -2.216 4.655 6.965 458 3HG2 VAL 67 3HG2 VAL 67 -3.546 3.630 6.427 459 H ARG 68 H ARG 68 -3.661 7.643 9.699 460 HA ARG 68 HA ARG 68 -5.396 7.033 11.845 461 1HB ARG 68 1HB ARG 68 -3.100 8.835 11.385 462 2HB ARG 68 2HB ARG 68 -4.202 9.323 12.666 463 1HG ARG 68 1HG ARG 68 -2.470 8.033 13.653 464 2HG ARG 68 2HG ARG 68 -3.934 7.047 13.657 465 1HD ARG 68 1HD ARG 68 -3.004 6.163 11.388 466 2HD ARG 68 2HD ARG 68 -1.467 6.780 11.991 467 HE ARG 68 HE ARG 68 -2.802 4.415 12.834 468 1HH1 ARG 68 1HH1 ARG 68 -0.786 7.022 13.957 469 2HH1 ARG 68 2HH1 ARG 68 -0.091 6.101 15.250 470 1HH2 ARG 68 1HH2 ARG 68 -1.895 3.193 14.533 471 2HH2 ARG 68 2HH2 ARG 68 -0.722 3.923 15.576 472 H ASP 69 H ASP 69 -5.518 9.387 9.328 473 HA ASP 69 HA ASP 69 -7.266 11.227 10.642 474 1HB ASP 69 1HB ASP 69 -5.801 11.194 8.258 475 2HB ASP 69 2HB ASP 69 -7.487 11.262 7.753 476 H ILE 70 H ILE 70 -7.681 8.262 8.912 477 HA ILE 70 HA ILE 70 -10.385 8.587 8.144 478 HB ILE 70 HB ILE 70 -8.976 5.989 8.762 479 1HG1 ILE 70 1HG1 ILE 70 -9.166 7.415 6.102 480 2HG1 ILE 70 2HG1 ILE 70 -7.746 7.464 7.141 481 1HG2 ILE 70 1HG2 ILE 70 -11.487 6.000 8.498 482 2HG2 ILE 70 2HG2 ILE 70 -11.222 6.493 6.827 483 3HG2 ILE 70 3HG2 ILE 70 -10.603 4.944 7.397 484 1HD1 ILE 70 1HD1 ILE 70 -7.648 5.823 5.260 485 2HD1 ILE 70 2HD1 ILE 70 -7.365 5.141 6.862 486 3HD1 ILE 70 3HD1 ILE 70 -8.925 4.916 6.072 487 H ASP 71 H ASP 71 -8.838 7.338 11.056 488 HA ASP 71 HA ASP 71 -11.235 7.790 12.579 489 1HB ASP 71 1HB ASP 71 -10.556 5.104 11.634 490 2HB ASP 71 2HB ASP 71 -10.752 5.196 13.382 491 HA PRO 72 HA PRO 72 -8.383 8.392 15.855 492 1HB PRO 72 1HB PRO 72 -9.779 7.529 18.018 493 2HB PRO 72 2HB PRO 72 -10.162 9.028 17.163 494 1HG PRO 72 1HG PRO 72 -11.455 6.337 16.941 495 2HG PRO 72 2HG PRO 72 -12.211 7.940 17.012 496 1HD PRO 72 1HD PRO 72 -11.874 6.588 14.689 497 2HD PRO 72 2HD PRO 72 -11.820 8.361 14.779 498 H GLN 73 H GLN 73 -10.025 5.241 16.198 499 HA GLN 73 HA GLN 73 -7.561 4.103 17.287 500 1HB GLN 73 1HB GLN 73 -10.321 2.889 17.070 501 2HB GLN 73 2HB GLN 73 -8.942 2.175 17.896 502 1HG GLN 73 1HG GLN 73 -8.966 3.840 19.573 503 2HG GLN 73 2HG GLN 73 -10.101 4.836 18.664 504 1HE2 GLN 73 1HE2 GLN 73 -12.004 4.853 19.600 505 2HE2 GLN 73 2HE2 GLN 73 -12.793 3.506 20.340 506 H ASN 74 H ASN 74 -6.360 4.032 15.347 507 HA ASN 74 HA ASN 74 -7.127 1.801 13.600 508 1HB ASN 74 1HB ASN 74 -6.820 4.598 12.839 509 2HB ASN 74 2HB ASN 74 -5.762 3.537 11.914 510 1HD2 ASN 74 1HD2 ASN 74 -8.057 5.055 11.019 511 2HD2 ASN 74 2HD2 ASN 74 -9.173 3.913 10.361 512 H ASP 75 H ASP 75 -5.222 1.091 12.226 513 HA ASP 75 HA ASP 75 -2.578 1.730 12.862 514 1HB ASP 75 1HB ASP 75 -3.741 0.376 14.968 515 2HB ASP 75 2HB ASP 75 -2.925 -0.908 14.079 516 H LEU 76 H LEU 76 -1.509 1.110 11.114 517 HA LEU 76 HA LEU 76 -2.603 -0.898 9.357 518 1HB LEU 76 1HB LEU 76 -0.082 0.743 9.170 519 2HB LEU 76 2HB LEU 76 -0.699 -0.311 7.900 520 HG LEU 76 HG LEU 76 -1.322 1.834 7.229 521 1HD1 LEU 76 1HD1 LEU 76 -3.732 1.868 7.347 522 2HD1 LEU 76 2HD1 LEU 76 -3.710 0.787 8.740 523 3HD1 LEU 76 3HD1 LEU 76 -3.172 0.205 7.165 524 1HD2 LEU 76 1HD2 LEU 76 -1.676 3.595 8.574 525 2HD2 LEU 76 2HD2 LEU 76 -0.983 2.562 9.825 526 3HD2 LEU 76 3HD2 LEU 76 -2.734 2.687 9.654 527 H THR 77 H THR 77 -1.581 -2.811 8.703 528 HA THR 77 HA THR 77 0.434 -3.820 10.603 529 HB THR 77 HB THR 77 -0.445 -6.022 10.357 530 HG1 THR 77 HG1 THR 77 -1.268 -6.502 8.473 531 1HG2 THR 77 1HG2 THR 77 -2.689 -4.019 10.624 532 2HG2 THR 77 2HG2 THR 77 -1.704 -4.692 11.923 533 3HG2 THR 77 3HG2 THR 77 -2.824 -5.728 11.038 534 H PHE 78 H PHE 78 -0.524 -3.595 7.238 535 HA PHE 78 HA PHE 78 2.213 -4.218 6.449 536 1HB PHE 78 1HB PHE 78 1.717 -5.978 5.024 537 2HB PHE 78 2HB PHE 78 0.625 -6.298 6.367 538 HD1 PHE 78 HD1 PHE 78 0.888 -5.255 2.884 539 HD2 PHE 78 HD2 PHE 78 -1.766 -5.952 6.137 540 HE1 PHE 78 HE1 PHE 78 -1.018 -5.236 1.328 541 HE2 PHE 78 HE2 PHE 78 -3.676 -5.935 4.587 542 HZ PHE 78 HZ PHE 78 -3.304 -5.578 2.179 543 H LEU 79 H LEU 79 2.897 -3.091 4.692 544 HA LEU 79 HA LEU 79 0.890 -1.521 3.219 545 1HB LEU 79 1HB LEU 79 2.285 -0.278 4.998 546 2HB LEU 79 2HB LEU 79 3.615 -0.446 3.854 547 HG LEU 79 HG LEU 79 2.359 0.839 2.198 548 1HD1 LEU 79 1HD1 LEU 79 0.293 2.036 2.989 549 2HD1 LEU 79 2HD1 LEU 79 0.257 0.913 4.348 550 3HD1 LEU 79 3HD1 LEU 79 0.106 0.306 2.700 551 1HD2 LEU 79 1HD2 LEU 79 2.778 2.042 4.915 552 2HD2 LEU 79 2HD2 LEU 79 2.251 3.014 3.541 553 3HD2 LEU 79 3HD2 LEU 79 3.797 2.166 3.481 554 H ARG 80 H ARG 80 0.901 -2.602 1.320 555 HA ARG 80 HA ARG 80 3.504 -3.013 0.004 556 1HB ARG 80 1HB ARG 80 2.241 -5.087 0.421 557 2HB ARG 80 2HB ARG 80 0.886 -4.440 -0.494 558 1HG ARG 80 1HG ARG 80 2.328 -4.341 -2.495 559 2HG ARG 80 2HG ARG 80 3.624 -5.092 -1.561 560 1HD ARG 80 1HD ARG 80 2.794 -7.044 -2.257 561 2HD ARG 80 2HD ARG 80 1.482 -6.761 -1.113 562 HE ARG 80 HE ARG 80 0.901 -5.480 -3.552 563 1HH1 ARG 80 1HH1 ARG 80 1.126 -8.660 -2.154 564 2HH1 ARG 80 2HH1 ARG 80 -0.036 -9.359 -3.232 565 1HH2 ARG 80 1HH2 ARG 80 -0.631 -6.388 -4.978 566 2HH2 ARG 80 2HH2 ARG 80 -1.034 -8.066 -4.839 567 H ILE 81 H ILE 81 3.737 -2.452 -2.179 568 HA ILE 81 HA ILE 81 1.558 -1.024 -3.484 569 HB ILE 81 HB ILE 81 3.247 0.832 -4.076 570 1HG1 ILE 81 1HG1 ILE 81 4.485 -0.232 -1.528 571 2HG1 ILE 81 2HG1 ILE 81 5.225 -0.265 -3.125 572 1HG2 ILE 81 1HG2 ILE 81 2.002 2.085 -2.720 573 2HG2 ILE 81 2HG2 ILE 81 1.287 0.583 -2.137 574 3HG2 ILE 81 3HG2 ILE 81 2.652 1.300 -1.281 575 1HD1 ILE 81 1HD1 ILE 81 5.355 2.133 -3.163 576 2HD1 ILE 81 2HD1 ILE 81 4.478 2.238 -1.636 577 3HD1 ILE 81 3HD1 ILE 81 6.091 1.528 -1.679 578 H ARG 82 H ARG 82 1.569 -2.655 -5.035 579 HA ARG 82 HA ARG 82 3.951 -3.431 -6.416 580 1HB ARG 82 1HB ARG 82 2.420 -4.664 -7.902 581 2HB ARG 82 2HB ARG 82 2.090 -4.983 -6.205 582 1HG ARG 82 1HG ARG 82 0.258 -3.278 -6.336 583 2HG ARG 82 2HG ARG 82 0.523 -3.233 -8.080 584 1HD ARG 82 1HD ARG 82 0.319 -5.952 -7.277 585 2HD ARG 82 2HD ARG 82 -1.030 -5.066 -6.568 586 HE ARG 82 HE ARG 82 -0.781 -4.346 -9.269 587 1HH1 ARG 82 1HH1 ARG 82 -1.687 -7.064 -7.292 588 2HH1 ARG 82 2HH1 ARG 82 -2.775 -7.724 -8.469 589 1HH2 ARG 82 1HH2 ARG 82 -2.211 -5.204 -10.826 590 2HH2 ARG 82 2HH2 ARG 82 -3.071 -6.665 -10.479 591 H SER 83 H SER 83 4.953 -2.326 -7.950 592 HA SER 83 HA SER 83 3.500 -0.197 -9.348 593 1HB SER 83 1HB SER 83 6.429 -0.484 -9.719 594 2HB SER 83 2HB SER 83 5.459 0.968 -9.472 595 HG SER 83 HG SER 83 6.664 -0.705 -7.619 596 H LYS 84 H LYS 84 4.972 0.122 -11.604 597 HA LYS 84 HA LYS 84 4.044 -2.077 -13.220 598 1HB LYS 84 1HB LYS 84 5.241 0.613 -13.769 599 2HB LYS 84 2HB LYS 84 5.199 -0.591 -15.051 600 1HG LYS 84 1HG LYS 84 2.651 -0.727 -14.223 601 2HG LYS 84 2HG LYS 84 3.010 0.955 -13.827 602 1HD LYS 84 1HD LYS 84 2.378 1.276 -15.979 603 2HD LYS 84 2HD LYS 84 4.062 0.849 -16.290 604 1HE LYS 84 1HE LYS 84 3.352 -1.509 -16.591 605 2HE LYS 84 2HE LYS 84 1.676 -0.993 -16.405 606 1HZ LYS 84 1HZ LYS 84 1.652 -0.014 -18.437 607 2HZ LYS 84 2HZ LYS 84 2.803 -1.211 -18.757 608 3HZ LYS 84 3HZ LYS 84 3.300 0.370 -18.417 609 H LYS 85 H LYS 85 6.954 -1.216 -11.680 610 HA LYS 85 HA LYS 85 8.599 -2.816 -13.489 611 1HB LYS 85 1HB LYS 85 9.206 -0.948 -11.216 612 2HB LYS 85 2HB LYS 85 10.426 -2.070 -11.805 613 1HG LYS 85 1HG LYS 85 9.000 -0.106 -13.579 614 2HG LYS 85 2HG LYS 85 10.524 0.246 -12.761 615 1HD LYS 85 1HD LYS 85 11.610 -0.721 -14.443 616 2HD LYS 85 2HD LYS 85 10.840 -2.254 -14.027 617 1HE LYS 85 1HE LYS 85 9.297 -2.084 -15.686 618 2HE LYS 85 2HE LYS 85 9.229 -0.325 -15.592 619 1HZ LYS 85 1HZ LYS 85 11.692 -0.654 -16.510 620 2HZ LYS 85 2HZ LYS 85 10.347 -0.497 -17.524 621 3HZ LYS 85 3HZ LYS 85 10.969 -2.031 -17.177 622 H ASN 86 H ASN 86 7.768 -2.664 -10.031 623 HA ASN 86 HA ASN 86 7.553 -5.476 -9.788 624 1HB ASN 86 1HB ASN 86 9.534 -5.532 -8.050 625 2HB ASN 86 2HB ASN 86 9.841 -5.784 -9.765 626 1HD2 ASN 86 1HD2 ASN 86 10.040 -3.512 -7.123 627 2HD2 ASN 86 2HD2 ASN 86 11.199 -2.462 -7.857 628 H GLU 87 H GLU 87 7.279 -6.140 -7.464 629 HA GLU 87 HA GLU 87 5.832 -4.022 -6.063 630 1HB GLU 87 1HB GLU 87 5.871 -6.946 -5.336 631 2HB GLU 87 2HB GLU 87 4.674 -5.735 -4.899 632 1HG GLU 87 1HG GLU 87 4.239 -5.563 -7.429 633 2HG GLU 87 2HG GLU 87 5.094 -7.102 -7.525 634 H ILE 88 H ILE 88 6.125 -3.621 -3.832 635 HA ILE 88 HA ILE 88 8.571 -4.699 -2.625 636 HB ILE 88 HB ILE 88 7.911 -1.756 -2.561 637 1HG1 ILE 88 1HG1 ILE 88 10.000 -3.181 -4.223 638 2HG1 ILE 88 2HG1 ILE 88 8.513 -2.478 -4.849 639 1HG2 ILE 88 1HG2 ILE 88 9.372 -1.734 -0.889 640 2HG2 ILE 88 2HG2 ILE 88 9.731 -3.445 -1.116 641 3HG2 ILE 88 3HG2 ILE 88 10.618 -2.229 -2.034 642 1HD1 ILE 88 1HD1 ILE 88 9.397 -0.289 -3.799 643 2HD1 ILE 88 2HD1 ILE 88 10.954 -1.118 -3.810 644 3HD1 ILE 88 3HD1 ILE 88 10.081 -0.860 -5.320 645 H MET 89 H MET 89 7.692 -5.786 -0.961 646 HA MET 89 HA MET 89 5.412 -4.828 0.487 647 1HB MET 89 1HB MET 89 7.239 -7.185 0.706 648 2HB MET 89 2HB MET 89 6.200 -6.781 2.066 649 1HG MET 89 1HG MET 89 4.396 -6.703 0.085 650 2HG MET 89 2HG MET 89 5.522 -7.883 -0.580 651 1HE MET 89 1HE MET 89 6.458 -9.169 2.558 652 2HE MET 89 2HE MET 89 5.596 -10.644 2.123 653 3HE MET 89 3HE MET 89 6.516 -9.768 0.899 654 H VAL 90 H VAL 90 5.337 -3.667 2.318 655 HA VAL 90 HA VAL 90 7.729 -3.374 3.962 656 HB VAL 90 HB VAL 90 6.259 -0.942 2.945 657 1HG1 VAL 90 1HG1 VAL 90 7.242 -0.598 5.113 658 2HG1 VAL 90 2HG1 VAL 90 8.775 -1.283 4.571 659 3HG1 VAL 90 3HG1 VAL 90 8.210 0.251 3.908 660 1HG2 VAL 90 1HG2 VAL 90 8.190 -0.491 1.548 661 2HG2 VAL 90 2HG2 VAL 90 8.963 -1.978 2.096 662 3HG2 VAL 90 3HG2 VAL 90 7.492 -2.055 1.127 663 H ALA 91 H ALA 91 7.113 -3.749 5.977 664 HA ALA 91 HA ALA 91 4.574 -2.618 6.924 665 1HB ALA 91 1HB ALA 91 4.125 -4.699 8.187 666 2HB ALA 91 2HB ALA 91 4.081 -4.925 6.438 667 3HB ALA 91 3HB ALA 91 5.486 -5.458 7.361 668 HA PRO 92 HA PRO 92 6.939 -1.243 10.365 669 1HB PRO 92 1HB PRO 92 4.993 -1.090 12.251 670 2HB PRO 92 2HB PRO 92 5.127 0.059 10.915 671 1HG PRO 92 1HG PRO 92 3.335 -2.323 11.193 672 2HG PRO 92 2HG PRO 92 2.956 -0.704 10.578 673 1HD PRO 92 1HD PRO 92 3.429 -2.809 8.942 674 2HD PRO 92 2HD PRO 92 3.858 -1.144 8.502 675 H ASP 93 H ASP 93 8.359 -2.774 11.050 676 HA ASP 93 HA ASP 93 7.468 -5.197 12.338 677 1HB ASP 93 1HB ASP 93 9.772 -4.423 10.971 678 2HB ASP 93 2HB ASP 93 10.299 -4.613 12.642 679 H LYS 94 H LYS 94 9.300 -5.597 14.331 680 HA LYS 94 HA LYS 94 8.118 -4.514 16.568 681 1HB LYS 94 1HB LYS 94 10.407 -6.135 16.000 682 2HB LYS 94 2HB LYS 94 10.851 -4.939 17.211 683 1HG LYS 94 1HG LYS 94 9.213 -5.699 18.717 684 2HG LYS 94 2HG LYS 94 8.392 -6.641 17.469 685 1HD LYS 94 1HD LYS 94 10.410 -8.079 17.304 686 2HD LYS 94 2HD LYS 94 11.113 -7.185 18.654 687 1HE LYS 94 1HE LYS 94 8.812 -7.823 19.795 688 2HE LYS 94 2HE LYS 94 8.866 -9.134 18.619 689 1HZ LYS 94 1HZ LYS 94 10.850 -8.524 20.734 690 2HZ LYS 94 2HZ LYS 94 11.148 -9.620 19.481 691 3HZ LYS 94 3HZ LYS 94 9.897 -9.913 20.581 692 H ASP 95 H ASP 95 11.149 -3.432 15.039 693 HA ASP 95 HA ASP 95 10.589 -0.709 15.887 694 1HB ASP 95 1HB ASP 95 12.667 -0.375 17.038 695 2HB ASP 95 2HB ASP 95 11.881 -1.779 17.755 696 H TYR 96 H TYR 96 11.069 -2.504 13.429 697 HA TYR 96 HA TYR 96 12.702 -0.537 12.012 698 1HB TYR 96 1HB TYR 96 13.885 -2.398 10.803 699 2HB TYR 96 2HB TYR 96 14.326 -2.228 12.498 700 HD1 TYR 96 HD1 TYR 96 12.945 -4.407 9.978 701 HD2 TYR 96 HD2 TYR 96 13.372 -3.838 14.173 702 HE1 TYR 96 HE1 TYR 96 12.400 -6.777 10.348 703 HE2 TYR 96 HE2 TYR 96 12.830 -6.206 14.555 704 HH TYR 96 HH TYR 96 13.020 -8.506 12.417 705 H PHE 97 H PHE 97 12.644 -1.086 9.562 706 HA PHE 97 HA PHE 97 9.909 -1.945 8.878 707 1HB PHE 97 1HB PHE 97 11.556 0.344 7.831 708 2HB PHE 97 2HB PHE 97 10.229 -0.329 6.891 709 HD1 PHE 97 HD1 PHE 97 7.937 -0.476 8.090 710 HD2 PHE 97 HD2 PHE 97 11.142 2.018 9.364 711 HE1 PHE 97 HE1 PHE 97 6.344 0.933 9.327 712 HE2 PHE 97 HE2 PHE 97 9.555 3.431 10.604 713 HZ PHE 97 HZ PHE 97 7.153 2.889 10.588 714 H LEU 98 H LEU 98 10.104 -3.914 8.010 715 HA LEU 98 HA LEU 98 12.412 -4.733 6.522 716 1HB LEU 98 1HB LEU 98 10.813 -6.153 7.972 717 2HB LEU 98 2HB LEU 98 9.794 -6.189 6.535 718 HG LEU 98 HG LEU 98 12.613 -6.994 6.158 719 1HD1 LEU 98 1HD1 LEU 98 12.174 -9.260 7.005 720 2HD1 LEU 98 2HD1 LEU 98 10.643 -8.698 7.676 721 3HD1 LEU 98 3HD1 LEU 98 12.164 -8.050 8.288 722 1HD2 LEU 98 1HD2 LEU 98 10.010 -8.232 5.276 723 2HD2 LEU 98 2HD2 LEU 98 11.622 -8.579 4.650 724 3HD2 LEU 98 3HD2 LEU 98 10.888 -6.999 4.371 725 H ILE 99 H ILE 99 12.744 -4.688 4.386 726 HA ILE 99 HA ILE 99 10.459 -4.101 2.625 727 HB ILE 99 HB ILE 99 13.214 -2.935 2.237 728 1HG1 ILE 99 1HG1 ILE 99 11.418 -0.865 2.791 729 2HG1 ILE 99 2HG1 ILE 99 11.063 -2.098 3.996 730 1HG2 ILE 99 1HG2 ILE 99 11.648 -3.303 0.268 731 2HG2 ILE 99 2HG2 ILE 99 10.626 -2.060 0.989 732 3HG2 ILE 99 3HG2 ILE 99 12.272 -1.669 0.493 733 1HD1 ILE 99 1HD1 ILE 99 12.712 -0.457 4.768 734 2HD1 ILE 99 2HD1 ILE 99 13.365 -2.095 4.721 735 3HD1 ILE 99 3HD1 ILE 99 13.787 -0.941 3.456 736 H VAL 100 H VAL 100 10.236 -5.522 1.035 737 HA VAL 100 HA VAL 100 12.615 -6.966 0.075 738 HB VAL 100 HB VAL 100 9.895 -8.178 0.588 739 1HG1 VAL 100 1HG1 VAL 100 12.376 -9.267 -0.713 740 2HG1 VAL 100 2HG1 VAL 100 11.135 -10.313 -0.019 741 3HG1 VAL 100 3HG1 VAL 100 10.731 -9.225 -1.348 742 1HG2 VAL 100 1HG2 VAL 100 10.809 -9.313 2.395 743 2HG2 VAL 100 2HG2 VAL 100 12.467 -9.047 1.854 744 3HG2 VAL 100 3HG2 VAL 100 11.536 -7.712 2.534 745 H ILE 101 H ILE 101 12.924 -6.408 -1.973 746 HA ILE 101 HA ILE 101 10.601 -5.786 -3.655 747 HB ILE 101 HB ILE 101 13.521 -5.240 -4.201 748 1HG1 ILE 101 1HG1 ILE 101 11.937 -2.881 -3.842 749 2HG1 ILE 101 2HG1 ILE 101 11.717 -3.929 -2.445 750 1HG2 ILE 101 1HG2 ILE 101 11.067 -4.177 -5.590 751 2HG2 ILE 101 2HG2 ILE 101 12.748 -3.863 -6.018 752 3HG2 ILE 101 3HG2 ILE 101 12.081 -5.485 -6.201 753 1HD1 ILE 101 1HD1 ILE 101 13.664 -2.146 -2.590 754 2HD1 ILE 101 2HD1 ILE 101 13.863 -3.689 -1.758 755 3HD1 ILE 101 3HD1 ILE 101 14.484 -3.483 -3.396 756 H GLN 102 H GLN 102 10.164 -6.876 -5.521 757 HA GLN 102 HA GLN 102 11.971 -8.664 -6.781 758 1HB GLN 102 1HB GLN 102 10.949 -10.777 -6.254 759 2HB GLN 102 2HB GLN 102 11.401 -9.988 -4.748 760 1HG GLN 102 1HG GLN 102 9.055 -9.228 -4.503 761 2HG GLN 102 2HG GLN 102 8.644 -10.166 -5.938 762 1HE2 GLN 102 1HE2 GLN 102 8.319 -10.231 -2.781 763 2HE2 GLN 102 2HE2 GLN 102 8.441 -11.923 -2.458 764 H ASN 103 H ASN 103 10.888 -9.921 -8.540 765 HA ASN 103 HA ASN 103 9.364 -8.298 -10.170 766 1HB ASN 103 1HB ASN 103 10.101 -11.156 -10.142 767 2HB ASN 103 2HB ASN 103 8.667 -10.765 -11.086 768 1HD2 ASN 103 1HD2 ASN 103 12.059 -10.693 -10.937 769 2HD2 ASN 103 2HD2 ASN 103 12.345 -9.884 -12.437 770 HA PRO 104 HA PRO 104 5.171 -8.543 -8.905 771 1HB PRO 104 1HB PRO 104 3.847 -8.723 -11.268 772 2HB PRO 104 2HB PRO 104 4.641 -7.241 -10.722 773 1HG PRO 104 1HG PRO 104 5.614 -9.311 -12.654 774 2HG PRO 104 2HG PRO 104 5.707 -7.544 -12.766 775 1HD PRO 104 1HD PRO 104 7.809 -9.067 -11.997 776 2HD PRO 104 2HD PRO 104 7.541 -7.426 -11.375 777 H THR 105 H THR 105 3.507 -9.962 -8.449 778 HA THR 105 HA THR 105 3.948 -12.737 -9.319 779 HB THR 105 HB THR 105 2.650 -13.403 -7.328 780 HG1 THR 105 HG1 THR 105 1.786 -11.925 -6.003 781 1HG2 THR 105 1HG2 THR 105 5.195 -11.950 -7.247 782 2HG2 THR 105 2HG2 THR 105 4.772 -13.533 -6.594 783 3HG2 THR 105 3HG2 THR 105 4.382 -12.071 -5.687 784 H GLU 106 H GLU 106 1.474 -10.254 -8.901 785 HA GLU 106 HA GLU 106 -0.673 -10.081 -9.651 786 1HB GLU 106 1HB GLU 106 0.358 -9.877 -11.795 787 2HB GLU 106 2HB GLU 106 0.628 -11.611 -11.901 788 1HG GLU 106 1HG GLU 106 -1.501 -12.049 -12.538 789 2HG GLU 106 2HG GLU 106 -2.172 -10.699 -11.625 790 H MET 11 H MET 11 -18.348 3.795 -15.778 791 HA MET 11 HA MET 11 -18.634 3.524 -13.002 792 1HB MET 11 1HB MET 11 -19.971 5.078 -14.365 793 2HB MET 11 2HB MET 11 -20.797 3.714 -15.106 794 1HG MET 11 1HG MET 11 -22.333 4.186 -13.532 795 2HG MET 11 2HG MET 11 -21.294 3.157 -12.549 796 1HE MET 11 1HE MET 11 -21.861 5.385 -9.682 797 2HE MET 11 2HE MET 11 -23.204 5.384 -10.825 798 3HE MET 11 3HE MET 11 -22.275 3.909 -10.555 799 H ALA 12 H ALA 12 -20.036 1.566 -15.630 800 HA ALA 12 HA ALA 12 -21.396 -0.298 -14.118 801 1HB ALA 12 1HB ALA 12 -21.160 -1.818 -16.028 802 2HB ALA 12 2HB ALA 12 -21.581 -0.183 -16.538 803 3HB ALA 12 3HB ALA 12 -19.923 -0.760 -16.709 804 H GLU 13 H GLU 13 -17.969 -0.238 -14.988 805 HA GLU 13 HA GLU 13 -17.198 -2.754 -14.141 806 1HB GLU 13 1HB GLU 13 -15.908 -0.419 -14.966 807 2HB GLU 13 2HB GLU 13 -15.250 -0.748 -13.369 808 1HG GLU 13 1HG GLU 13 -14.289 -2.727 -14.018 809 2HG GLU 13 2HG GLU 13 -15.419 -2.964 -15.350 810 H VAL 14 H VAL 14 -17.293 0.241 -12.216 811 HA VAL 14 HA VAL 14 -16.511 -0.948 -9.784 812 HB VAL 14 HB VAL 14 -18.240 1.508 -10.083 813 1HG1 VAL 14 1HG1 VAL 14 -16.475 1.888 -8.006 814 2HG1 VAL 14 2HG1 VAL 14 -18.170 1.420 -7.852 815 3HG1 VAL 14 3HG1 VAL 14 -16.910 0.185 -7.856 816 1HG2 VAL 14 1HG2 VAL 14 -15.347 1.066 -10.603 817 2HG2 VAL 14 2HG2 VAL 14 -16.489 2.142 -11.409 818 3HG2 VAL 14 3HG2 VAL 14 -15.835 2.574 -9.829 819 H GLU 15 H GLU 15 -19.652 -0.477 -11.297 820 HA GLU 15 HA GLU 15 -21.234 -1.164 -9.059 821 1HB GLU 15 1HB GLU 15 -21.759 -1.208 -12.026 822 2HB GLU 15 2HB GLU 15 -22.979 -1.687 -10.854 823 1HG GLU 15 1HG GLU 15 -22.957 0.502 -9.861 824 2HG GLU 15 2HG GLU 15 -21.623 0.998 -10.900 825 H GLU 16 H GLU 16 -19.938 -3.075 -11.746 826 HA GLU 16 HA GLU 16 -21.182 -5.503 -11.156 827 1HB GLU 16 1HB GLU 16 -19.443 -4.635 -13.075 828 2HB GLU 16 2HB GLU 16 -18.417 -5.713 -12.139 829 1HG GLU 16 1HG GLU 16 -20.479 -7.332 -12.379 830 2HG GLU 16 2HG GLU 16 -20.810 -6.323 -13.786 831 H THR 17 H THR 17 -18.265 -4.038 -9.850 832 HA THR 17 HA THR 17 -17.549 -6.374 -8.318 833 HB THR 17 HB THR 17 -16.470 -3.551 -8.209 834 HG1 THR 17 HG1 THR 17 -14.788 -4.427 -9.443 835 1HG2 THR 17 1HG2 THR 17 -15.683 -6.075 -6.787 836 2HG2 THR 17 2HG2 THR 17 -15.916 -4.456 -6.127 837 3HG2 THR 17 3HG2 THR 17 -14.501 -4.810 -7.117 838 H LEU 18 H LEU 18 -19.431 -3.500 -7.847 839 HA LEU 18 HA LEU 18 -19.413 -3.568 -4.986 840 1HB LEU 18 1HB LEU 18 -20.559 -1.933 -7.083 841 2HB LEU 18 2HB LEU 18 -21.713 -2.224 -5.782 842 HG LEU 18 HG LEU 18 -19.554 -1.491 -4.343 843 1HD1 LEU 18 1HD1 LEU 18 -19.352 -0.049 -6.979 844 2HD1 LEU 18 2HD1 LEU 18 -18.120 -1.042 -6.200 845 3HD1 LEU 18 3HD1 LEU 18 -18.589 0.501 -5.487 846 1HD2 LEU 18 1HD2 LEU 18 -21.651 0.264 -5.607 847 2HD2 LEU 18 2HD2 LEU 18 -20.591 0.778 -4.294 848 3HD2 LEU 18 3HD2 LEU 18 -21.730 -0.547 -4.043 849 H LYS 19 H LYS 19 -21.549 -4.781 -7.516 850 HA LYS 19 HA LYS 19 -23.682 -5.589 -5.876 851 1HB LYS 19 1HB LYS 19 -22.712 -6.670 -8.525 852 2HB LYS 19 2HB LYS 19 -24.221 -7.156 -7.764 853 1HG LYS 19 1HG LYS 19 -23.646 -4.273 -8.320 854 2HG LYS 19 2HG LYS 19 -24.274 -5.338 -9.580 855 1HD LYS 19 1HD LYS 19 -25.847 -5.819 -7.308 856 2HD LYS 19 2HD LYS 19 -25.663 -4.066 -7.407 857 1HE LYS 19 1HE LYS 19 -26.538 -4.025 -9.622 858 2HE LYS 19 2HE LYS 19 -26.481 -5.783 -9.742 859 1HZ LYS 19 1HZ LYS 19 -28.091 -5.726 -7.777 860 2HZ LYS 19 2HZ LYS 19 -28.696 -5.320 -9.303 861 3HZ LYS 19 3HZ LYS 19 -28.341 -4.103 -8.183 862 H ARG 20 H ARG 20 -20.777 -7.312 -6.950 863 HA ARG 20 HA ARG 20 -21.472 -9.757 -5.649 864 1HB ARG 20 1HB ARG 20 -19.873 -9.440 -7.622 865 2HB ARG 20 2HB ARG 20 -18.688 -8.915 -6.434 866 1HG ARG 20 1HG ARG 20 -18.112 -11.068 -6.346 867 2HG ARG 20 2HG ARG 20 -19.558 -11.262 -5.354 868 1HD ARG 20 1HD ARG 20 -19.721 -11.421 -8.339 869 2HD ARG 20 2HD ARG 20 -19.201 -12.816 -7.395 870 HE ARG 20 HE ARG 20 -21.507 -12.056 -6.188 871 1HH1 ARG 20 1HH1 ARG 20 -20.635 -12.799 -9.476 872 2HH1 ARG 20 2HH1 ARG 20 -22.207 -13.394 -9.896 873 1HH2 ARG 20 1HH2 ARG 20 -23.581 -12.836 -6.730 874 2HH2 ARG 20 2HH2 ARG 20 -23.882 -13.413 -8.333 875 H LEU 21 H LEU 21 -19.690 -6.885 -4.749 876 HA LEU 21 HA LEU 21 -18.470 -7.980 -2.420 877 1HB LEU 21 1HB LEU 21 -18.707 -5.361 -3.703 878 2HB LEU 21 2HB LEU 21 -18.632 -5.289 -1.944 879 HG LEU 21 HG LEU 21 -16.491 -6.381 -1.935 880 1HD1 LEU 21 1HD1 LEU 21 -15.712 -6.477 -4.617 881 2HD1 LEU 21 2HD1 LEU 21 -17.302 -7.237 -4.557 882 3HD1 LEU 21 3HD1 LEU 21 -15.998 -7.839 -3.533 883 1HD2 LEU 21 1HD2 LEU 21 -15.279 -4.741 -3.601 884 2HD2 LEU 21 2HD2 LEU 21 -16.067 -4.143 -2.141 885 3HD2 LEU 21 3HD2 LEU 21 -16.884 -4.018 -3.699 886 H GLN 22 H GLN 22 -21.275 -5.831 -2.884 887 HA GLN 22 HA GLN 22 -22.029 -5.759 -0.171 888 1HB GLN 22 1HB GLN 22 -22.918 -4.605 -2.568 889 2HB GLN 22 2HB GLN 22 -24.297 -5.500 -1.944 890 1HG GLN 22 1HG GLN 22 -24.703 -3.917 -0.460 891 2HG GLN 22 2HG GLN 22 -23.073 -4.064 0.194 892 1HE2 GLN 22 1HE2 GLN 22 -21.364 -2.967 -1.172 893 2HE2 GLN 22 2HE2 GLN 22 -21.759 -1.401 -1.787 894 H SER 23 H SER 23 -22.400 -8.160 -2.589 895 HA SER 23 HA SER 23 -24.662 -9.466 -1.368 896 1HB SER 23 1HB SER 23 -23.015 -9.837 -3.779 897 2HB SER 23 2HB SER 23 -23.577 -11.339 -3.045 898 HG SER 23 HG SER 23 -25.635 -10.765 -3.400 899 H GLN 24 H GLN 24 -21.238 -9.526 -1.031 900 HA GLN 24 HA GLN 24 -21.334 -12.047 0.464 901 1HB GLN 24 1HB GLN 24 -18.908 -12.049 0.323 902 2HB GLN 24 2HB GLN 24 -19.604 -11.840 -1.278 903 1HG GLN 24 1HG GLN 24 -19.045 -9.549 -1.331 904 2HG GLN 24 2HG GLN 24 -18.661 -9.530 0.390 905 1HE2 GLN 24 1HE2 GLN 24 -16.796 -8.491 -1.089 906 2HE2 GLN 24 2HE2 GLN 24 -15.455 -9.556 -1.320 907 H LYS 25 H LYS 25 -20.458 -12.197 2.570 908 HA LYS 25 HA LYS 25 -20.995 -9.895 4.198 909 1HB LYS 25 1HB LYS 25 -21.300 -12.479 4.689 910 2HB LYS 25 2HB LYS 25 -19.655 -12.329 5.293 911 1HG LYS 25 1HG LYS 25 -20.845 -10.212 6.498 912 2HG LYS 25 2HG LYS 25 -22.180 -11.364 6.426 913 1HD LYS 25 1HD LYS 25 -20.233 -12.998 7.279 914 2HD LYS 25 2HD LYS 25 -19.648 -11.476 7.954 915 1HE LYS 25 1HE LYS 25 -22.494 -12.348 8.316 916 2HE LYS 25 2HE LYS 25 -21.219 -12.934 9.382 917 1HZ LYS 25 1HZ LYS 25 -20.672 -10.605 9.882 918 2HZ LYS 25 2HZ LYS 25 -22.250 -11.008 10.341 919 3HZ LYS 25 3HZ LYS 25 -21.983 -10.099 8.939 920 H GLY 26 H GLY 26 -19.544 -8.773 5.529 921 1HA GLY 26 1HA GLY 26 -17.278 -8.511 6.400 922 2HA GLY 26 2HA GLY 26 -16.690 -9.157 4.875 923 H VAL 27 H VAL 27 -18.199 -7.698 3.069 924 HA VAL 27 HA VAL 27 -16.716 -5.362 2.789 925 HB VAL 27 HB VAL 27 -19.458 -5.899 1.639 926 1HG1 VAL 27 1HG1 VAL 27 -17.547 -3.719 1.343 927 2HG1 VAL 27 2HG1 VAL 27 -18.018 -4.446 -0.195 928 3HG1 VAL 27 3HG1 VAL 27 -19.250 -3.803 0.892 929 1HG2 VAL 27 1HG2 VAL 27 -18.029 -7.724 1.064 930 2HG2 VAL 27 2HG2 VAL 27 -18.157 -6.680 -0.352 931 3HG2 VAL 27 3HG2 VAL 27 -16.707 -6.632 0.650 932 H GLN 28 H GLN 28 -16.693 -3.702 4.155 933 HA GLN 28 HA GLN 28 -18.983 -3.014 5.757 934 1HB GLN 28 1HB GLN 28 -16.167 -2.501 5.811 935 2HB GLN 28 2HB GLN 28 -17.025 -0.968 5.893 936 1HG GLN 28 1HG GLN 28 -18.151 -1.583 7.862 937 2HG GLN 28 2HG GLN 28 -17.707 -3.279 7.679 938 1HE2 GLN 28 1HE2 GLN 28 -15.761 -3.980 8.415 939 2HE2 GLN 28 2HE2 GLN 28 -14.650 -2.987 9.289 940 H GLY 29 H GLY 29 -17.543 -1.927 2.789 941 1HA GLY 29 1HA GLY 29 -19.678 -0.625 1.741 942 2HA GLY 29 2HA GLY 29 -18.931 0.603 2.753 943 H ILE 30 H ILE 30 -19.254 0.544 -0.151 944 HA ILE 30 HA ILE 30 -16.408 0.704 -0.900 945 HB ILE 30 HB ILE 30 -18.634 0.029 -2.818 946 1HG1 ILE 30 1HG1 ILE 30 -16.978 -2.209 -2.505 947 2HG1 ILE 30 2HG1 ILE 30 -17.306 -1.651 -0.868 948 1HG2 ILE 30 1HG2 ILE 30 -15.682 -0.421 -3.143 949 2HG2 ILE 30 2HG2 ILE 30 -16.937 -0.439 -4.380 950 3HG2 ILE 30 3HG2 ILE 30 -16.468 1.083 -3.622 951 1HD1 ILE 30 1HD1 ILE 30 -18.966 -3.157 -2.595 952 2HD1 ILE 30 2HD1 ILE 30 -19.284 -2.624 -0.943 953 3HD1 ILE 30 3HD1 ILE 30 -19.743 -1.601 -2.304 954 H ILE 31 H ILE 31 -15.749 2.633 -1.583 955 HA ILE 31 HA ILE 31 -17.795 4.627 -2.295 956 HB ILE 31 HB ILE 31 -15.008 5.100 -1.232 957 1HG1 ILE 31 1HG1 ILE 31 -17.262 6.054 0.355 958 2HG1 ILE 31 2HG1 ILE 31 -17.272 4.305 0.159 959 1HG2 ILE 31 1HG2 ILE 31 -17.238 7.002 -1.928 960 2HG2 ILE 31 2HG2 ILE 31 -15.805 7.451 -1.004 961 3HG2 ILE 31 3HG2 ILE 31 -15.642 6.902 -2.672 962 1HD1 ILE 31 1HD1 ILE 31 -14.693 5.526 0.898 963 2HD1 ILE 31 2HD1 ILE 31 -15.966 5.553 2.118 964 3HD1 ILE 31 3HD1 ILE 31 -15.435 4.018 1.430 965 H VAL 32 H VAL 32 -17.529 5.912 -4.105 966 HA VAL 32 HA VAL 32 -15.301 5.203 -5.898 967 HB VAL 32 HB VAL 32 -18.088 5.798 -6.877 968 1HG1 VAL 32 1HG1 VAL 32 -17.271 4.810 -8.955 969 2HG1 VAL 32 2HG1 VAL 32 -16.269 6.178 -8.466 970 3HG1 VAL 32 3HG1 VAL 32 -15.698 4.529 -8.210 971 1HG2 VAL 32 1HG2 VAL 32 -18.366 3.391 -7.229 972 2HG2 VAL 32 2HG2 VAL 32 -16.823 3.095 -6.428 973 3HG2 VAL 32 3HG2 VAL 32 -18.172 3.774 -5.518 974 H VAL 33 H VAL 33 -14.073 6.990 -5.858 975 HA VAL 33 HA VAL 33 -15.398 9.601 -6.181 976 HB VAL 33 HB VAL 33 -12.563 9.168 -5.256 977 1HG1 VAL 33 1HG1 VAL 33 -14.459 11.506 -5.182 978 2HG1 VAL 33 2HG1 VAL 33 -12.939 11.453 -4.287 979 3HG1 VAL 33 3HG1 VAL 33 -12.929 11.382 -6.049 980 1HG2 VAL 33 1HG2 VAL 33 -15.035 9.496 -3.558 981 2HG2 VAL 33 2HG2 VAL 33 -14.064 8.031 -3.702 982 3HG2 VAL 33 3HG2 VAL 33 -13.373 9.478 -2.968 983 H ASN 34 H ASN 34 -14.543 11.111 -7.662 984 HA ASN 34 HA ASN 34 -13.207 9.855 -9.939 985 1HB ASN 34 1HB ASN 34 -14.250 12.659 -10.003 986 2HB ASN 34 2HB ASN 34 -14.183 11.462 -11.294 987 1HD2 ASN 34 1HD2 ASN 34 -16.372 13.154 -10.130 988 2HD2 ASN 34 2HD2 ASN 34 -17.647 12.037 -9.794 989 H THR 35 H THR 35 -12.048 11.970 -11.189 990 HA THR 35 HA THR 35 -9.634 12.293 -9.673 991 HB THR 35 HB THR 35 -9.524 14.003 -11.908 992 HG1 THR 35 HG1 THR 35 -10.428 12.849 -13.542 993 1HG2 THR 35 1HG2 THR 35 -8.109 12.085 -12.825 994 2HG2 THR 35 2HG2 THR 35 -8.508 11.229 -11.335 995 3HG2 THR 35 3HG2 THR 35 -7.629 12.756 -11.266 996 H GLU 36 H GLU 36 -12.476 14.174 -10.231 997 HA GLU 36 HA GLU 36 -11.298 16.705 -9.547 998 1HB GLU 36 1HB GLU 36 -14.025 15.710 -10.189 999 2HB GLU 36 2HB GLU 36 -13.912 17.186 -9.242 1000 1HG GLU 36 1HG GLU 36 -12.144 17.728 -11.207 1001 2HG GLU 36 2HG GLU 36 -13.286 16.698 -12.068 1002 H GLY 37 H GLY 37 -13.103 14.188 -7.874 1003 1HA GLY 37 1HA GLY 37 -12.463 13.928 -5.487 1004 2HA GLY 37 2HA GLY 37 -12.667 15.669 -5.353 1005 H ILE 38 H ILE 38 -14.916 14.022 -7.349 1006 HA ILE 38 HA ILE 38 -16.978 14.403 -5.290 1007 HB ILE 38 HB ILE 38 -17.418 14.036 -8.252 1008 1HG1 ILE 38 1HG1 ILE 38 -17.257 16.599 -6.652 1009 2HG1 ILE 38 2HG1 ILE 38 -16.090 16.060 -7.853 1010 1HG2 ILE 38 1HG2 ILE 38 -19.269 15.295 -6.252 1011 2HG2 ILE 38 2HG2 ILE 38 -19.637 14.688 -7.866 1012 3HG2 ILE 38 3HG2 ILE 38 -19.268 13.559 -6.563 1013 1HD1 ILE 38 1HD1 ILE 38 -17.577 17.770 -8.739 1014 2HD1 ILE 38 2HD1 ILE 38 -17.782 16.237 -9.589 1015 3HD1 ILE 38 3HD1 ILE 38 -18.970 16.746 -8.389 1016 HA PRO 39 HA PRO 39 -17.010 9.932 -5.052 1017 1HB PRO 39 1HB PRO 39 -18.824 9.808 -3.036 1018 2HB PRO 39 2HB PRO 39 -17.119 10.196 -2.772 1019 1HG PRO 39 1HG PRO 39 -19.472 12.036 -2.967 1020 2HG PRO 39 2HG PRO 39 -18.113 12.075 -1.828 1021 1HD PRO 39 1HD PRO 39 -18.245 13.694 -3.994 1022 2HD PRO 39 2HD PRO 39 -16.707 13.090 -3.346 1023 H ILE 40 H ILE 40 -18.048 9.886 -7.189 1024 HA ILE 40 HA ILE 40 -20.707 10.312 -7.752 1025 HB ILE 40 HB ILE 40 -20.434 8.377 -9.421 1026 1HG1 ILE 40 1HG1 ILE 40 -17.547 8.615 -8.563 1027 2HG1 ILE 40 2HG1 ILE 40 -18.599 7.297 -8.061 1028 1HG2 ILE 40 1HG2 ILE 40 -18.365 9.927 -10.404 1029 2HG2 ILE 40 2HG2 ILE 40 -20.089 10.210 -10.638 1030 3HG2 ILE 40 3HG2 ILE 40 -19.235 11.014 -9.322 1031 1HD1 ILE 40 1HD1 ILE 40 -18.396 7.831 -10.961 1032 2HD1 ILE 40 2HD1 ILE 40 -16.991 7.126 -10.159 1033 3HD1 ILE 40 3HD1 ILE 40 -18.550 6.304 -10.092 1034 H LYS 41 H LYS 41 -19.217 7.535 -6.185 1035 HA LYS 41 HA LYS 41 -21.910 6.570 -5.496 1036 1HB LYS 41 1HB LYS 41 -19.991 5.228 -7.102 1037 2HB LYS 41 2HB LYS 41 -20.078 4.374 -5.567 1038 1HG LYS 41 1HG LYS 41 -22.656 5.095 -6.809 1039 2HG LYS 41 2HG LYS 41 -21.696 3.866 -7.636 1040 1HD LYS 41 1HD LYS 41 -21.532 2.632 -5.482 1041 2HD LYS 41 2HD LYS 41 -22.627 3.816 -4.767 1042 1HE LYS 41 1HE LYS 41 -23.236 1.996 -7.094 1043 2HE LYS 41 2HE LYS 41 -23.837 1.816 -5.447 1044 1HZ LYS 41 1HZ LYS 41 -25.511 3.149 -5.948 1045 2HZ LYS 41 2HZ LYS 41 -24.940 3.314 -7.532 1046 3HZ LYS 41 3HZ LYS 41 -24.442 4.402 -6.336 1047 H SER 42 H SER 42 -22.154 5.691 -3.447 1048 HA SER 42 HA SER 42 -19.927 5.269 -1.695 1049 1HB SER 42 1HB SER 42 -20.652 7.036 -0.042 1050 2HB SER 42 2HB SER 42 -19.910 7.661 -1.515 1051 HG SER 42 HG SER 42 -22.660 7.586 -0.843 1052 H THR 43 H THR 43 -20.662 3.374 -0.953 1053 HA THR 43 HA THR 43 -23.461 3.010 -0.288 1054 HB THR 43 HB THR 43 -22.988 0.707 -0.003 1055 HG1 THR 43 HG1 THR 43 -21.182 0.590 1.219 1056 1HG2 THR 43 1HG2 THR 43 -22.309 2.039 -2.343 1057 2HG2 THR 43 2HG2 THR 43 -22.610 0.310 -2.171 1058 3HG2 THR 43 3HG2 THR 43 -20.964 0.933 -2.070 1059 H MET 44 H MET 44 -20.856 4.295 1.278 1060 HA MET 44 HA MET 44 -21.553 3.240 3.912 1061 1HB MET 44 1HB MET 44 -19.140 3.955 2.788 1062 2HB MET 44 2HB MET 44 -19.516 5.339 3.806 1063 1HG MET 44 1HG MET 44 -19.786 3.846 5.726 1064 2HG MET 44 2HG MET 44 -19.385 2.469 4.702 1065 1HE MET 44 1HE MET 44 -17.342 1.865 3.802 1066 2HE MET 44 2HE MET 44 -16.638 3.283 3.025 1067 3HE MET 44 3HE MET 44 -15.742 2.430 4.282 1068 H ASP 45 H ASP 45 -20.982 5.372 5.534 1069 HA ASP 45 HA ASP 45 -23.411 6.818 5.485 1070 1HB ASP 45 1HB ASP 45 -21.288 6.409 7.308 1071 2HB ASP 45 2HB ASP 45 -21.441 8.151 7.095 1072 H ASN 46 H ASN 46 -23.814 9.008 5.094 1073 HA ASN 46 HA ASN 46 -22.615 10.127 2.849 1074 1HB ASN 46 1HB ASN 46 -24.773 10.753 4.531 1075 2HB ASN 46 2HB ASN 46 -23.740 12.179 4.549 1076 1HD2 ASN 46 1HD2 ASN 46 -22.701 12.060 1.988 1077 2HD2 ASN 46 2HD2 ASN 46 -23.973 12.341 0.853 1078 HA PRO 47 HA PRO 47 -20.178 13.098 5.786 1079 1HB PRO 47 1HB PRO 47 -20.132 12.464 8.425 1080 2HB PRO 47 2HB PRO 47 -21.370 13.503 7.708 1081 1HG PRO 47 1HG PRO 47 -21.504 10.592 8.394 1082 2HG PRO 47 2HG PRO 47 -22.717 11.859 8.653 1083 1HD PRO 47 1HD PRO 47 -22.859 10.105 6.595 1084 2HD PRO 47 2HD PRO 47 -23.456 11.772 6.471 1085 H THR 48 H THR 48 -20.241 9.656 6.378 1086 HA THR 48 HA THR 48 -17.524 9.464 7.267 1087 HB THR 48 HB THR 48 -19.424 7.337 6.263 1088 HG1 THR 48 HG1 THR 48 -19.548 6.869 8.526 1089 1HG2 THR 48 1HG2 THR 48 -16.677 7.123 7.488 1090 2HG2 THR 48 2HG2 THR 48 -17.215 6.504 5.927 1091 3HG2 THR 48 3HG2 THR 48 -17.815 5.779 7.418 1092 H THR 49 H THR 49 -19.209 9.026 4.197 1093 HA THR 49 HA THR 49 -16.991 8.012 2.755 1094 HB THR 49 HB THR 49 -19.469 9.434 1.766 1095 HG1 THR 49 HG1 THR 49 -19.496 7.242 2.879 1096 1HG2 THR 49 1HG2 THR 49 -17.070 8.713 0.373 1097 2HG2 THR 49 2HG2 THR 49 -18.529 9.480 -0.254 1098 3HG2 THR 49 3HG2 THR 49 -18.407 7.721 -0.206 1099 H THR 50 H THR 50 -18.234 11.266 3.309 1100 HA THR 50 HA THR 50 -16.726 12.688 1.467 1101 HB THR 50 HB THR 50 -16.946 14.043 4.055 1102 HG1 THR 50 HG1 THR 50 -19.359 14.067 3.710 1103 1HG2 THR 50 1HG2 THR 50 -17.341 15.802 2.724 1104 2HG2 THR 50 2HG2 THR 50 -18.613 14.955 1.844 1105 3HG2 THR 50 3HG2 THR 50 -16.925 14.732 1.386 1106 H GLN 51 H GLN 51 -15.899 11.915 4.845 1107 HA GLN 51 HA GLN 51 -13.393 13.125 4.906 1108 1HB GLN 51 1HB GLN 51 -14.369 12.396 6.954 1109 2HB GLN 51 2HB GLN 51 -14.484 10.736 6.386 1110 1HG GLN 51 1HG GLN 51 -11.761 11.764 6.373 1111 2HG GLN 51 2HG GLN 51 -12.503 11.763 7.973 1112 1HE2 GLN 51 1HE2 GLN 51 -11.272 9.852 5.386 1113 2HE2 GLN 51 2HE2 GLN 51 -11.391 8.319 6.174 1114 H TYR 52 H TYR 52 -14.206 9.738 4.166 1115 HA TYR 52 HA TYR 52 -11.613 8.846 3.654 1116 1HB TYR 52 1HB TYR 52 -14.280 7.838 3.350 1117 2HB TYR 52 2HB TYR 52 -13.359 7.472 1.896 1118 HD1 TYR 52 HD1 TYR 52 -10.791 6.711 2.591 1119 HD2 TYR 52 HD2 TYR 52 -14.332 6.122 4.876 1120 HE1 TYR 52 HE1 TYR 52 -9.727 4.814 3.739 1121 HE2 TYR 52 HE2 TYR 52 -13.277 4.224 6.031 1122 HH TYR 52 HH TYR 52 -11.445 2.999 6.266 1123 H ALA 53 H ALA 53 -14.061 10.061 1.373 1124 HA ALA 53 HA ALA 53 -12.414 9.894 -0.917 1125 1HB ALA 53 1HB ALA 53 -14.860 10.016 -1.034 1126 2HB ALA 53 2HB ALA 53 -14.800 11.678 -0.443 1127 3HB ALA 53 3HB ALA 53 -14.094 11.272 -2.008 1128 H SER 54 H SER 54 -12.499 12.102 1.689 1129 HA SER 54 HA SER 54 -11.447 14.372 0.294 1130 1HB SER 54 1HB SER 54 -12.748 14.495 2.445 1131 2HB SER 54 2HB SER 54 -11.341 13.821 3.267 1132 HG SER 54 HG SER 54 -10.835 15.870 3.422 1133 H LEU 55 H LEU 55 -10.033 12.072 2.624 1134 HA LEU 55 HA LEU 55 -7.362 13.007 2.065 1135 1HB LEU 55 1HB LEU 55 -6.697 11.787 3.865 1136 2HB LEU 55 2HB LEU 55 -8.400 12.005 4.267 1137 HG LEU 55 HG LEU 55 -8.600 9.678 2.998 1138 1HD1 LEU 55 1HD1 LEU 55 -6.136 8.931 4.336 1139 2HD1 LEU 55 2HD1 LEU 55 -5.862 10.017 2.974 1140 3HD1 LEU 55 3HD1 LEU 55 -6.730 8.501 2.732 1141 1HD2 LEU 55 1HD2 LEU 55 -7.704 8.928 5.547 1142 2HD2 LEU 55 2HD2 LEU 55 -9.362 9.245 5.037 1143 3HD2 LEU 55 3HD2 LEU 55 -8.387 10.544 5.724 1144 H MET 56 H MET 56 -9.487 10.773 0.678 1145 HA MET 56 HA MET 56 -7.839 8.690 -0.135 1146 1HB MET 56 1HB MET 56 -10.424 9.762 -0.889 1147 2HB MET 56 2HB MET 56 -9.552 9.161 -2.293 1148 1HG MET 56 1HG MET 56 -10.095 7.596 0.219 1149 2HG MET 56 2HG MET 56 -11.004 7.466 -1.285 1150 1HE MET 56 1HE MET 56 -8.433 5.191 0.514 1151 2HE MET 56 2HE MET 56 -6.947 5.837 -0.181 1152 3HE MET 56 3HE MET 56 -8.028 6.894 0.727 1153 H HIS 57 H HIS 57 -8.754 11.501 -2.139 1154 HA HIS 57 HA HIS 57 -6.927 11.062 -4.186 1155 1HB HIS 57 1HB HIS 57 -8.796 12.661 -4.336 1156 2HB HIS 57 2HB HIS 57 -7.977 13.721 -3.192 1157 HD1 HIS 57 HD1 HIS 57 -8.161 12.865 -6.758 1158 HD2 HIS 57 HD2 HIS 57 -5.576 14.926 -4.242 1159 HE1 HIS 57 HE1 HIS 57 -6.678 14.213 -8.277 1160 H SER 58 H SER 58 -6.494 12.560 -1.061 1161 HA SER 58 HA SER 58 -3.943 13.716 -1.656 1162 1HB SER 58 1HB SER 58 -5.740 14.179 0.294 1163 2HB SER 58 2HB SER 58 -4.646 13.103 1.163 1164 HG SER 58 HG SER 58 -3.641 15.275 -0.321 1165 H PHE 59 H PHE 59 -5.063 10.605 -0.698 1166 HA PHE 59 HA PHE 59 -2.617 9.685 0.463 1167 1HB PHE 59 1HB PHE 59 -4.705 8.613 1.069 1168 2HB PHE 59 2HB PHE 59 -5.011 8.181 -0.610 1169 HD1 PHE 59 HD1 PHE 59 -1.902 7.892 1.412 1170 HD2 PHE 59 HD2 PHE 59 -5.009 5.871 -0.682 1171 HE1 PHE 59 HE1 PHE 59 -0.737 5.752 1.755 1172 HE2 PHE 59 HE2 PHE 59 -3.849 3.728 -0.342 1173 HZ PHE 59 HZ PHE 59 -1.711 3.666 0.879 1174 H ILE 60 H ILE 60 -4.238 8.930 -2.625 1175 HA ILE 60 HA ILE 60 -2.178 7.430 -3.746 1176 HB ILE 60 HB ILE 60 -4.175 9.184 -5.181 1177 1HG1 ILE 60 1HG1 ILE 60 -5.260 7.534 -3.747 1178 2HG1 ILE 60 2HG1 ILE 60 -5.458 7.087 -5.438 1179 1HG2 ILE 60 1HG2 ILE 60 -3.757 7.451 -7.022 1180 2HG2 ILE 60 2HG2 ILE 60 -2.535 8.695 -6.768 1181 3HG2 ILE 60 3HG2 ILE 60 -2.280 7.067 -6.139 1182 1HD1 ILE 60 1HD1 ILE 60 -4.158 5.663 -3.270 1183 2HD1 ILE 60 2HD1 ILE 60 -4.772 5.070 -4.814 1184 3HD1 ILE 60 3HD1 ILE 60 -3.158 5.775 -4.719 1185 H LEU 61 H LEU 61 -2.807 10.916 -3.953 1186 HA LEU 61 HA LEU 61 -0.693 11.538 -5.701 1187 1HB LEU 61 1HB LEU 61 -2.593 12.970 -4.042 1188 2HB LEU 61 2HB LEU 61 -1.020 13.765 -4.083 1189 HG LEU 61 HG LEU 61 -1.145 13.841 -6.540 1190 1HD1 LEU 61 1HD1 LEU 61 -3.353 13.374 -7.598 1191 2HD1 LEU 61 2HD1 LEU 61 -3.857 12.610 -6.091 1192 3HD1 LEU 61 3HD1 LEU 61 -2.511 11.939 -7.012 1193 1HD2 LEU 61 1HD2 LEU 61 -3.277 15.102 -4.861 1194 2HD2 LEU 61 2HD2 LEU 61 -3.214 15.400 -6.599 1195 3HD2 LEU 61 3HD2 LEU 61 -1.840 15.831 -5.580 1196 H LYS 62 H LYS 62 -0.761 10.810 -2.332 1197 HA LYS 62 HA LYS 62 1.742 12.050 -1.681 1198 1HB LYS 62 1HB LYS 62 -0.106 11.563 -0.037 1199 2HB LYS 62 2HB LYS 62 0.318 9.861 -0.164 1200 1HG LYS 62 1HG LYS 62 1.479 10.472 1.711 1201 2HG LYS 62 2HG LYS 62 2.706 10.704 0.464 1202 1HD LYS 62 1HD LYS 62 2.878 12.670 1.661 1203 2HD LYS 62 2HD LYS 62 1.759 13.132 0.377 1204 1HE LYS 62 1HE LYS 62 -0.030 13.249 1.790 1205 2HE LYS 62 2HE LYS 62 0.612 12.022 2.881 1206 1HZ LYS 62 1HZ LYS 62 2.387 14.059 3.109 1207 2HZ LYS 62 2HZ LYS 62 1.130 13.729 4.191 1208 3HZ LYS 62 3HZ LYS 62 0.911 14.873 2.965 1209 H ALA 63 H ALA 63 0.700 8.666 -2.094 1210 HA ALA 63 HA ALA 63 3.323 7.596 -1.910 1211 1HB ALA 63 1HB ALA 63 2.328 5.511 -2.667 1212 2HB ALA 63 2HB ALA 63 1.314 6.271 -1.440 1213 3HB ALA 63 3HB ALA 63 0.859 6.366 -3.142 1214 H ARG 64 H ARG 64 1.224 8.422 -4.645 1215 HA ARG 64 HA ARG 64 2.820 7.437 -6.707 1216 1HB ARG 64 1HB ARG 64 0.435 8.417 -6.788 1217 2HB ARG 64 2HB ARG 64 1.230 9.977 -6.960 1218 1HG ARG 64 1HG ARG 64 2.483 8.390 -8.844 1219 2HG ARG 64 2HG ARG 64 0.791 7.892 -8.918 1220 1HD ARG 64 1HD ARG 64 1.768 10.741 -9.074 1221 2HD ARG 64 2HD ARG 64 1.326 9.748 -10.462 1222 HE ARG 64 HE ARG 64 -0.743 9.991 -8.472 1223 1HH1 ARG 64 1HH1 ARG 64 0.678 11.368 -11.336 1224 2HH1 ARG 64 2HH1 ARG 64 -0.766 12.201 -11.810 1225 1HH2 ARG 64 1HH2 ARG 64 -2.650 11.083 -9.085 1226 2HH2 ARG 64 2HH2 ARG 64 -2.658 12.039 -10.528 1227 H SER 65 H SER 65 3.070 10.378 -4.835 1228 HA SER 65 HA SER 65 4.950 11.668 -6.557 1229 1HB SER 65 1HB SER 65 3.435 12.796 -4.843 1230 2HB SER 65 2HB SER 65 4.567 12.229 -3.615 1231 HG SER 65 HG SER 65 5.319 14.197 -4.143 1232 H THR 66 H THR 66 5.195 9.739 -3.602 1233 HA THR 66 HA THR 66 8.002 10.011 -3.302 1234 HB THR 66 HB THR 66 7.215 7.533 -2.181 1235 HG1 THR 66 HG1 THR 66 5.310 8.034 -1.151 1236 1HG2 THR 66 1HG2 THR 66 7.721 8.582 -0.123 1237 2HG2 THR 66 2HG2 THR 66 7.317 10.180 -0.749 1238 3HG2 THR 66 3HG2 THR 66 8.768 9.352 -1.314 1239 H VAL 67 H VAL 67 5.960 7.527 -4.798 1240 HA VAL 67 HA VAL 67 7.855 5.618 -5.404 1241 HB VAL 67 HB VAL 67 5.517 6.467 -7.119 1242 1HG1 VAL 67 1HG1 VAL 67 6.672 5.142 -8.580 1243 2HG1 VAL 67 2HG1 VAL 67 7.444 4.208 -7.297 1244 3HG1 VAL 67 3HG1 VAL 67 5.756 3.908 -7.714 1245 1HG2 VAL 67 1HG2 VAL 67 5.366 5.567 -4.593 1246 2HG2 VAL 67 2HG2 VAL 67 4.154 5.208 -5.823 1247 3HG2 VAL 67 3HG2 VAL 67 5.413 4.029 -5.456 1248 H ARG 68 H ARG 68 7.123 8.618 -7.108 1249 HA ARG 68 HA ARG 68 8.553 8.237 -9.445 1250 1HB ARG 68 1HB ARG 68 8.046 10.715 -7.808 1251 2HB ARG 68 2HB ARG 68 8.898 10.771 -9.345 1252 1HG ARG 68 1HG ARG 68 7.015 10.177 -10.559 1253 2HG ARG 68 2HG ARG 68 6.207 9.484 -9.151 1254 1HD ARG 68 1HD ARG 68 6.089 11.797 -8.195 1255 2HD ARG 68 2HD ARG 68 6.686 12.399 -9.741 1256 HE ARG 68 HE ARG 68 4.342 10.736 -9.941 1257 1HH1 ARG 68 1HH1 ARG 68 5.555 13.970 -9.502 1258 2HH1 ARG 68 2HH1 ARG 68 4.105 14.730 -10.070 1259 1HH2 ARG 68 1HH2 ARG 68 2.428 11.726 -10.691 1260 2HH2 ARG 68 2HH2 ARG 68 2.327 13.453 -10.745 1261 H ASP 69 H ASP 69 9.706 8.857 -6.222 1262 HA ASP 69 HA ASP 69 12.374 9.562 -7.024 1263 1HB ASP 69 1HB ASP 69 10.905 9.835 -4.697 1264 2HB ASP 69 2HB ASP 69 12.075 8.585 -4.286 1265 H ILE 70 H ILE 70 10.682 6.644 -6.099 1266 HA ILE 70 HA ILE 70 12.849 4.978 -5.542 1267 HB ILE 70 HB ILE 70 10.232 4.222 -6.848 1268 1HG1 ILE 70 1HG1 ILE 70 11.027 4.142 -3.930 1269 2HG1 ILE 70 2HG1 ILE 70 10.035 5.403 -4.655 1270 1HG2 ILE 70 1HG2 ILE 70 10.679 1.978 -5.988 1271 2HG2 ILE 70 2HG2 ILE 70 11.933 2.496 -7.114 1272 3HG2 ILE 70 3HG2 ILE 70 12.242 2.521 -5.378 1273 1HD1 ILE 70 1HD1 ILE 70 8.493 3.981 -3.678 1274 2HD1 ILE 70 2HD1 ILE 70 8.493 3.477 -5.368 1275 3HD1 ILE 70 3HD1 ILE 70 9.371 2.532 -4.166 1276 H ASP 71 H ASP 71 11.475 6.005 -8.599 1277 HA ASP 71 HA ASP 71 13.798 5.502 -10.068 1278 1HB ASP 71 1HB ASP 71 12.000 3.210 -9.780 1279 2HB ASP 71 2HB ASP 71 12.339 3.620 -11.460 1280 HA PRO 72 HA PRO 72 11.697 7.999 -12.997 1281 1HB PRO 72 1HB PRO 72 12.759 7.166 -15.352 1282 2HB PRO 72 2HB PRO 72 13.668 8.118 -14.171 1283 1HG PRO 72 1HG PRO 72 13.708 5.164 -14.657 1284 2HG PRO 72 2HG PRO 72 15.064 6.268 -14.361 1285 1HD PRO 72 1HD PRO 72 14.030 4.678 -12.428 1286 2HD PRO 72 2HD PRO 72 14.724 6.275 -12.081 1287 H GLN 73 H GLN 73 11.902 4.627 -14.150 1288 HA GLN 73 HA GLN 73 9.281 4.921 -15.413 1289 1HB GLN 73 1HB GLN 73 11.233 2.616 -15.547 1290 2HB GLN 73 2HB GLN 73 9.770 2.794 -16.507 1291 1HG GLN 73 1HG GLN 73 10.691 4.727 -17.622 1292 2HG GLN 73 2HG GLN 73 12.128 4.661 -16.603 1293 1HE2 GLN 73 1HE2 GLN 73 13.784 4.009 -17.764 1294 2HE2 GLN 73 2HE2 GLN 73 13.781 2.715 -18.909 1295 H ASN 74 H ASN 74 7.795 4.790 -13.788 1296 HA ASN 74 HA ASN 74 7.157 2.210 -12.788 1297 1HB ASN 74 1HB ASN 74 9.066 3.428 -11.261 1298 2HB ASN 74 2HB ASN 74 7.590 3.963 -10.461 1299 1HD2 ASN 74 1HD2 ASN 74 8.104 2.744 -8.632 1300 2HD2 ASN 74 2HD2 ASN 74 7.920 1.026 -8.605 1301 H ASP 75 H ASP 75 5.191 2.228 -11.458 1302 HA ASP 75 HA ASP 75 3.707 4.591 -11.004 1303 1HB ASP 75 1HB ASP 75 3.671 3.791 -13.673 1304 2HB ASP 75 2HB ASP 75 2.157 3.176 -13.016 1305 H LEU 76 H LEU 76 2.608 4.047 -9.250 1306 HA LEU 76 HA LEU 76 2.133 1.402 -8.430 1307 1HB LEU 76 1HB LEU 76 1.745 4.030 -7.399 1308 2HB LEU 76 2HB LEU 76 0.257 3.113 -7.173 1309 HG LEU 76 HG LEU 76 1.571 2.926 -5.186 1310 1HD1 LEU 76 1HD1 LEU 76 1.312 0.701 -4.896 1311 2HD1 LEU 76 2HD1 LEU 76 2.200 0.292 -6.362 1312 3HD1 LEU 76 3HD1 LEU 76 0.521 0.822 -6.468 1313 1HD2 LEU 76 1HD2 LEU 76 3.800 2.760 -5.114 1314 2HD2 LEU 76 2HD2 LEU 76 3.748 3.190 -6.824 1315 3HD2 LEU 76 3HD2 LEU 76 3.840 1.495 -6.343 1316 H THR 77 H THR 77 0.465 0.032 -8.695 1317 HA THR 77 HA THR 77 -1.892 1.017 -10.167 1318 HB THR 77 HB THR 77 -0.743 -0.317 -11.739 1319 HG1 THR 77 HG1 THR 77 -2.308 -1.761 -12.142 1320 1HG2 THR 77 1HG2 THR 77 -0.415 -2.862 -10.675 1321 2HG2 THR 77 2HG2 THR 77 0.115 -1.781 -9.385 1322 3HG2 THR 77 3HG2 THR 77 0.858 -1.681 -10.981 1323 H PHE 78 H PHE 78 -0.771 -0.343 -7.338 1324 HA PHE 78 HA PHE 78 -3.468 -0.968 -6.482 1325 1HB PHE 78 1HB PHE 78 -1.932 -3.057 -7.406 1326 2HB PHE 78 2HB PHE 78 -1.625 -3.099 -5.673 1327 HD1 PHE 78 HD1 PHE 78 -2.893 -4.679 -4.614 1328 HD2 PHE 78 HD2 PHE 78 -4.631 -2.437 -7.788 1329 HE1 PHE 78 HE1 PHE 78 -5.031 -5.846 -4.263 1330 HE2 PHE 78 HE2 PHE 78 -6.771 -3.600 -7.442 1331 HZ PHE 78 HZ PHE 78 -6.974 -5.306 -5.677 1332 H LEU 79 H LEU 79 -3.785 -0.538 -4.360 1333 HA LEU 79 HA LEU 79 -1.425 -0.110 -2.663 1334 1HB LEU 79 1HB LEU 79 -3.264 1.875 -3.620 1335 2HB LEU 79 2HB LEU 79 -3.371 1.754 -1.865 1336 HG LEU 79 HG LEU 79 -1.048 2.295 -1.623 1337 1HD1 LEU 79 1HD1 LEU 79 -0.948 2.148 -4.630 1338 2HD1 LEU 79 2HD1 LEU 79 -0.086 1.132 -3.475 1339 3HD1 LEU 79 3HD1 LEU 79 0.329 2.839 -3.628 1340 1HD2 LEU 79 1HD2 LEU 79 -1.524 4.351 -3.601 1341 2HD2 LEU 79 2HD2 LEU 79 -1.455 4.472 -1.843 1342 3HD2 LEU 79 3HD2 LEU 79 -2.966 4.027 -2.638 1343 H ARG 80 H ARG 80 -1.683 -1.812 -1.318 1344 HA ARG 80 HA ARG 80 -4.314 -2.236 -0.087 1345 1HB ARG 80 1HB ARG 80 -1.886 -4.034 -0.007 1346 2HB ARG 80 2HB ARG 80 -3.505 -4.430 0.555 1347 1HG ARG 80 1HG ARG 80 -4.151 -3.893 -1.933 1348 2HG ARG 80 2HG ARG 80 -2.448 -4.255 -2.217 1349 1HD ARG 80 1HD ARG 80 -4.543 -6.046 -1.008 1350 2HD ARG 80 2HD ARG 80 -3.662 -6.279 -2.517 1351 HE ARG 80 HE ARG 80 -1.738 -6.186 -0.564 1352 1HH1 ARG 80 1HH1 ARG 80 -4.553 -8.129 -1.216 1353 2HH1 ARG 80 2HH1 ARG 80 -3.910 -9.547 -0.456 1354 1HH2 ARG 80 1HH2 ARG 80 -0.882 -8.047 0.439 1355 2HH2 ARG 80 2HH2 ARG 80 -1.822 -9.499 0.486 1356 H ILE 81 H ILE 81 -4.604 -1.205 1.772 1357 HA ILE 81 HA ILE 81 -2.442 -1.262 3.758 1358 HB ILE 81 HB ILE 81 -4.171 1.174 3.426 1359 1HG1 ILE 81 1HG1 ILE 81 -1.764 1.983 2.471 1360 2HG1 ILE 81 2HG1 ILE 81 -1.808 0.334 1.857 1361 1HG2 ILE 81 1HG2 ILE 81 -3.171 1.741 5.325 1362 2HG2 ILE 81 2HG2 ILE 81 -2.149 0.305 5.266 1363 3HG2 ILE 81 3HG2 ILE 81 -1.637 1.785 4.455 1364 1HD1 ILE 81 1HD1 ILE 81 -3.906 2.439 1.387 1365 2HD1 ILE 81 2HD1 ILE 81 -2.675 1.922 0.234 1366 3HD1 ILE 81 3HD1 ILE 81 -3.926 0.793 0.754 1367 H ARG 82 H ARG 82 -3.508 -2.882 4.898 1368 HA ARG 82 HA ARG 82 -6.246 -2.492 5.753 1369 1HB ARG 82 1HB ARG 82 -6.150 -4.673 6.621 1370 2HB ARG 82 2HB ARG 82 -5.160 -4.737 5.169 1371 1HG ARG 82 1HG ARG 82 -3.754 -5.814 6.568 1372 2HG ARG 82 2HG ARG 82 -3.251 -4.163 6.936 1373 1HD ARG 82 1HD ARG 82 -3.853 -4.429 9.056 1374 2HD ARG 82 2HD ARG 82 -5.500 -4.817 8.559 1375 HE ARG 82 HE ARG 82 -3.650 -7.014 8.338 1376 1HH1 ARG 82 1HH1 ARG 82 -5.869 -5.313 10.413 1377 2HH1 ARG 82 2HH1 ARG 82 -6.144 -6.673 11.452 1378 1HH2 ARG 82 1HH2 ARG 82 -4.003 -8.811 9.698 1379 2HH2 ARG 82 2HH2 ARG 82 -5.081 -8.661 11.045 1380 H SER 83 H SER 83 -6.920 -1.763 7.686 1381 HA SER 83 HA SER 83 -4.845 -1.007 9.635 1382 1HB SER 83 1HB SER 83 -6.959 0.486 10.399 1383 2HB SER 83 2HB SER 83 -5.775 1.031 9.210 1384 HG SER 83 HG SER 83 -8.415 0.367 8.884 1385 H LYS 84 H LYS 84 -6.036 -0.657 11.907 1386 HA LYS 84 HA LYS 84 -6.692 -3.260 12.812 1387 1HB LYS 84 1HB LYS 84 -6.325 -0.598 13.997 1388 2HB LYS 84 2HB LYS 84 -7.491 -1.604 14.847 1389 1HG LYS 84 1HG LYS 84 -5.254 -3.229 14.294 1390 2HG LYS 84 2HG LYS 84 -4.645 -1.696 14.925 1391 1HD LYS 84 1HD LYS 84 -5.052 -2.607 16.937 1392 2HD LYS 84 2HD LYS 84 -6.734 -2.189 16.604 1393 1HE LYS 84 1HE LYS 84 -7.219 -4.384 15.846 1394 2HE LYS 84 2HE LYS 84 -5.511 -4.819 15.799 1395 1HZ LYS 84 1HZ LYS 84 -6.947 -4.117 18.297 1396 2HZ LYS 84 2HZ LYS 84 -5.404 -4.793 18.154 1397 3HZ LYS 84 3HZ LYS 84 -6.768 -5.705 17.741 1398 H LYS 85 H LYS 85 -8.571 -0.650 11.592 1399 HA LYS 85 HA LYS 85 -11.055 -1.509 12.781 1400 1HB LYS 85 1HB LYS 85 -10.265 0.608 10.810 1401 2HB LYS 85 2HB LYS 85 -11.958 0.169 10.992 1402 1HG LYS 85 1HG LYS 85 -10.472 0.742 13.478 1403 2HG LYS 85 2HG LYS 85 -10.785 2.108 12.404 1404 1HD LYS 85 1HD LYS 85 -12.626 2.043 13.865 1405 2HD LYS 85 2HD LYS 85 -13.206 1.314 12.366 1406 1HE LYS 85 1HE LYS 85 -12.972 -0.890 13.275 1407 2HE LYS 85 2HE LYS 85 -12.162 -0.266 14.711 1408 1HZ LYS 85 1HZ LYS 85 -14.538 -0.834 15.044 1409 2HZ LYS 85 2HZ LYS 85 -14.956 0.403 13.969 1410 3HZ LYS 85 3HZ LYS 85 -14.168 0.774 15.419 1411 H ASN 86 H ASN 86 -9.614 -1.569 9.531 1412 HA ASN 86 HA ASN 86 -10.641 -4.075 8.848 1413 1HB ASN 86 1HB ASN 86 -12.271 -3.095 7.027 1414 2HB ASN 86 2HB ASN 86 -12.835 -3.370 8.673 1415 1HD2 ASN 86 1HD2 ASN 86 -11.522 -0.910 6.517 1416 2HD2 ASN 86 2HD2 ASN 86 -12.311 0.429 7.273 1417 H GLU 87 H GLU 87 -10.520 -4.446 6.401 1418 HA GLU 87 HA GLU 87 -8.012 -3.368 5.495 1419 1HB GLU 87 1HB GLU 87 -8.403 -5.688 5.079 1420 2HB GLU 87 2HB GLU 87 -9.945 -5.353 4.304 1421 1HG GLU 87 1HG GLU 87 -8.998 -4.814 2.332 1422 2HG GLU 87 2HG GLU 87 -7.582 -4.084 3.086 1423 H ILE 88 H ILE 88 -7.634 -1.999 3.803 1424 HA ILE 88 HA ILE 88 -9.977 -0.877 2.422 1425 HB ILE 88 HB ILE 88 -7.658 0.728 3.504 1426 1HG1 ILE 88 1HG1 ILE 88 -10.337 1.458 4.385 1427 2HG1 ILE 88 2HG1 ILE 88 -9.917 -0.189 4.843 1428 1HG2 ILE 88 1HG2 ILE 88 -9.757 1.294 1.535 1429 2HG2 ILE 88 2HG2 ILE 88 -9.567 2.519 2.788 1430 3HG2 ILE 88 3HG2 ILE 88 -8.192 2.067 1.782 1431 1HD1 ILE 88 1HD1 ILE 88 -8.527 2.361 5.583 1432 2HD1 ILE 88 2HD1 ILE 88 -9.264 1.158 6.642 1433 3HD1 ILE 88 3HD1 ILE 88 -7.772 0.779 5.781 1434 H MET 89 H MET 89 -9.693 -1.644 0.410 1435 HA MET 89 HA MET 89 -7.024 -1.588 -0.786 1436 1HB MET 89 1HB MET 89 -9.519 -3.099 -1.276 1437 2HB MET 89 2HB MET 89 -8.582 -2.684 -2.705 1438 1HG MET 89 1HG MET 89 -6.620 -3.633 -1.147 1439 2HG MET 89 2HG MET 89 -7.978 -4.564 -0.518 1440 1HE MET 89 1HE MET 89 -9.332 -6.125 -3.906 1441 2HE MET 89 2HE MET 89 -9.810 -5.424 -2.360 1442 3HE MET 89 3HE MET 89 -9.518 -4.378 -3.751 1443 H VAL 90 H VAL 90 -6.442 -0.191 -2.340 1444 HA VAL 90 HA VAL 90 -8.472 1.285 -3.821 1445 HB VAL 90 HB VAL 90 -6.344 2.682 -2.193 1446 1HG1 VAL 90 1HG1 VAL 90 -6.668 3.750 -4.360 1447 2HG1 VAL 90 2HG1 VAL 90 -8.409 3.815 -4.079 1448 3HG1 VAL 90 3HG1 VAL 90 -7.314 4.754 -3.063 1449 1HG2 VAL 90 1HG2 VAL 90 -9.351 2.768 -1.967 1450 2HG2 VAL 90 2HG2 VAL 90 -8.263 1.924 -0.865 1451 3HG2 VAL 90 3HG2 VAL 90 -8.206 3.683 -0.985 1452 H ALA 91 H ALA 91 -7.862 1.735 -5.864 1453 HA ALA 91 HA ALA 91 -5.047 1.801 -6.586 1454 1HB ALA 91 1HB ALA 91 -5.443 0.129 -8.434 1455 2HB ALA 91 2HB ALA 91 -5.389 -0.531 -6.799 1456 3HB ALA 91 3HB ALA 91 -6.940 -0.302 -7.607 1457 HA PRO 92 HA PRO 92 -6.405 4.761 -9.530 1458 1HB PRO 92 1HB PRO 92 -4.567 4.433 -11.502 1459 2HB PRO 92 2HB PRO 92 -4.186 5.187 -9.950 1460 1HG PRO 92 1HG PRO 92 -3.684 2.382 -10.866 1461 2HG PRO 92 2HG PRO 92 -2.616 3.472 -9.963 1462 1HD PRO 92 1HD PRO 92 -4.038 1.503 -8.765 1463 2HD PRO 92 2HD PRO 92 -3.662 3.037 -7.955 1464 H ASP 93 H ASP 93 -8.140 4.645 -10.794 1465 HA ASP 93 HA ASP 93 -8.448 2.333 -12.582 1466 1HB ASP 93 1HB ASP 93 -10.210 3.431 -10.751 1467 2HB ASP 93 2HB ASP 93 -10.781 4.065 -12.292 1468 H LYS 94 H LYS 94 -10.315 3.305 -14.338 1469 HA LYS 94 HA LYS 94 -8.827 4.452 -16.345 1470 1HB LYS 94 1HB LYS 94 -11.576 3.790 -15.913 1471 2HB LYS 94 2HB LYS 94 -11.494 5.370 -16.680 1472 1HG LYS 94 1HG LYS 94 -11.572 3.974 -18.498 1473 2HG LYS 94 2HG LYS 94 -9.832 4.195 -18.302 1474 1HD LYS 94 1HD LYS 94 -9.547 2.009 -18.007 1475 2HD LYS 94 2HD LYS 94 -10.711 2.002 -16.680 1476 1HE LYS 94 1HE LYS 94 -12.397 1.252 -17.989 1477 2HE LYS 94 2HE LYS 94 -11.847 2.156 -19.399 1478 1HZ LYS 94 1HZ LYS 94 -10.306 -0.165 -18.448 1479 2HZ LYS 94 2HZ LYS 94 -10.389 0.498 -20.002 1480 3HZ LYS 94 3HZ LYS 94 -11.686 -0.403 -19.397 1481 H ASP 95 H ASP 95 -11.087 6.137 -14.166 1482 HA ASP 95 HA ASP 95 -9.428 8.503 -14.235 1483 1HB ASP 95 1HB ASP 95 -11.645 8.277 -16.009 1484 2HB ASP 95 2HB ASP 95 -12.063 9.458 -14.770 1485 H TYR 96 H TYR 96 -10.694 6.451 -12.378 1486 HA TYR 96 HA TYR 96 -11.524 8.390 -10.359 1487 1HB TYR 96 1HB TYR 96 -13.374 6.751 -9.675 1488 2HB TYR 96 2HB TYR 96 -13.664 7.744 -11.098 1489 HD1 TYR 96 HD1 TYR 96 -13.205 4.370 -9.836 1490 HD2 TYR 96 HD2 TYR 96 -13.536 6.738 -13.356 1491 HE1 TYR 96 HE1 TYR 96 -13.651 2.341 -11.152 1492 HE2 TYR 96 HE2 TYR 96 -13.984 4.715 -14.681 1493 HH TYR 96 HH TYR 96 -13.262 1.865 -13.987 1494 H PHE 97 H PHE 97 -11.668 7.338 -8.166 1495 HA PHE 97 HA PHE 97 -9.577 5.277 -7.936 1496 1HB PHE 97 1HB PHE 97 -10.304 7.588 -6.146 1497 2HB PHE 97 2HB PHE 97 -9.341 6.234 -5.565 1498 HD1 PHE 97 HD1 PHE 97 -8.944 9.421 -6.383 1499 HD2 PHE 97 HD2 PHE 97 -7.548 5.626 -7.711 1500 HE1 PHE 97 HE1 PHE 97 -6.916 10.486 -7.282 1501 HE2 PHE 97 HE2 PHE 97 -5.517 6.684 -8.612 1502 HZ PHE 97 HZ PHE 97 -5.199 9.117 -8.397 1503 H LEU 98 H LEU 98 -10.530 3.363 -7.642 1504 HA LEU 98 HA LEU 98 -13.057 3.086 -6.309 1505 1HB LEU 98 1HB LEU 98 -11.960 1.658 -8.219 1506 2HB LEU 98 2HB LEU 98 -11.262 0.771 -6.866 1507 HG LEU 98 HG LEU 98 -14.224 1.210 -7.081 1508 1HD1 LEU 98 1HD1 LEU 98 -12.918 0.003 -9.094 1509 2HD1 LEU 98 2HD1 LEU 98 -14.528 -0.470 -8.554 1510 3HD1 LEU 98 3HD1 LEU 98 -13.114 -1.364 -7.997 1511 1HD2 LEU 98 1HD2 LEU 98 -13.571 -1.277 -5.983 1512 2HD2 LEU 98 2HD2 LEU 98 -14.161 0.150 -5.131 1513 3HD2 LEU 98 3HD2 LEU 98 -12.426 -0.134 -5.281 1514 H ILE 99 H ILE 99 -13.471 2.447 -4.263 1515 HA ILE 99 HA ILE 99 -11.176 1.739 -2.559 1516 HB ILE 99 HB ILE 99 -13.510 3.439 -1.679 1517 1HG1 ILE 99 1HG1 ILE 99 -11.239 4.995 -1.500 1518 2HG1 ILE 99 2HG1 ILE 99 -10.996 4.131 -3.014 1519 1HG2 ILE 99 1HG2 ILE 99 -10.889 3.003 -0.273 1520 2HG2 ILE 99 2HG2 ILE 99 -12.374 3.704 0.370 1521 3HG2 ILE 99 3HG2 ILE 99 -12.299 1.981 0.005 1522 1HD1 ILE 99 1HD1 ILE 99 -12.106 6.306 -3.301 1523 2HD1 ILE 99 2HD1 ILE 99 -13.089 4.955 -3.867 1524 3HD1 ILE 99 3HD1 ILE 99 -13.452 5.723 -2.322 1525 H VAL 100 H VAL 100 -11.425 -0.291 -1.916 1526 HA VAL 100 HA VAL 100 -14.144 -1.282 -1.367 1527 HB VAL 100 HB VAL 100 -11.645 -2.855 -2.008 1528 1HG1 VAL 100 1HG1 VAL 100 -14.269 -3.617 -0.938 1529 2HG1 VAL 100 2HG1 VAL 100 -13.727 -4.571 -2.320 1530 3HG1 VAL 100 3HG1 VAL 100 -12.725 -4.465 -0.872 1531 1HG2 VAL 100 1HG2 VAL 100 -13.992 -1.967 -3.630 1532 2HG2 VAL 100 2HG2 VAL 100 -12.278 -1.960 -4.043 1533 3HG2 VAL 100 3HG2 VAL 100 -13.173 -3.479 -4.023 1534 H ILE 101 H ILE 101 -14.623 -1.268 0.724 1535 HA ILE 101 HA ILE 101 -12.486 -1.826 2.670 1536 HB ILE 101 HB ILE 101 -15.109 -0.389 3.089 1537 1HG1 ILE 101 1HG1 ILE 101 -12.866 1.206 3.758 1538 2HG1 ILE 101 2HG1 ILE 101 -12.534 0.498 2.181 1539 1HG2 ILE 101 1HG2 ILE 101 -13.122 -1.504 4.946 1540 2HG2 ILE 101 2HG2 ILE 101 -13.623 0.152 5.283 1541 3HG2 ILE 101 3HG2 ILE 101 -14.828 -1.132 5.194 1542 1HD1 ILE 101 1HD1 ILE 101 -14.115 2.729 2.768 1543 2HD1 ILE 101 2HD1 ILE 101 -13.896 1.937 1.207 1544 3HD1 ILE 101 3HD1 ILE 101 -15.226 1.458 2.260 1545 H GLN 102 H GLN 102 -12.695 -3.459 4.121 1546 HA GLN 102 HA GLN 102 -15.152 -4.738 4.740 1547 1HB GLN 102 1HB GLN 102 -14.855 -6.851 3.648 1548 2HB GLN 102 2HB GLN 102 -14.762 -5.593 2.422 1549 1HG GLN 102 1HG GLN 102 -12.269 -5.733 2.598 1550 2HG GLN 102 2HG GLN 102 -12.490 -7.147 3.627 1551 1HE2 GLN 102 1HE2 GLN 102 -11.693 -6.316 0.643 1552 2HE2 GLN 102 2HE2 GLN 102 -12.321 -7.654 -0.253 1553 H ASN 103 H ASN 103 -14.748 -6.811 6.007 1554 HA ASN 103 HA ASN 103 -13.092 -6.321 8.157 1555 1HB ASN 103 1HB ASN 103 -14.644 -8.598 7.166 1556 2HB ASN 103 2HB ASN 103 -13.247 -9.075 8.126 1557 1HD2 ASN 103 1HD2 ASN 103 -16.239 -9.048 8.568 1558 2HD2 ASN 103 2HD2 ASN 103 -16.428 -8.290 10.109 1559 HA PRO 104 HA PRO 104 -8.988 -7.439 7.081 1560 1HB PRO 104 1HB PRO 104 -8.123 -8.729 9.308 1561 2HB PRO 104 2HB PRO 104 -8.392 -6.983 9.253 1562 1HG PRO 104 1HG PRO 104 -10.166 -9.140 10.331 1563 2HG PRO 104 2HG PRO 104 -9.786 -7.552 11.024 1564 1HD PRO 104 1HD PRO 104 -12.090 -8.046 9.691 1565 2HD PRO 104 2HD PRO 104 -11.295 -6.459 9.668 1566 H THR 105 H THR 105 -7.737 -9.087 6.246 1567 HA THR 105 HA THR 105 -9.008 -11.744 6.191 1568 HB THR 105 HB THR 105 -7.847 -12.126 4.062 1569 HG1 THR 105 HG1 THR 105 -6.857 -10.186 3.096 1570 1HG2 THR 105 1HG2 THR 105 -8.964 -9.924 2.924 1571 2HG2 THR 105 2HG2 THR 105 -9.798 -9.966 4.477 1572 3HG2 THR 105 3HG2 THR 105 -9.863 -11.362 3.403 1573 H GLU 106 H GLU 106 -5.916 -10.050 6.456 1574 HA GLU 106 HA GLU 106 -4.447 -12.488 6.929 1575 1HB GLU 106 1HB GLU 106 -3.749 -9.994 6.025 1576 2HB GLU 106 2HB GLU 106 -3.157 -9.960 7.681 1577 1HG GLU 106 1HG GLU 106 -2.355 -12.431 6.686 1578 2HG GLU 106 2HG GLU 106 -2.080 -11.294 5.368 Start of MODEL 16 1 H MET 11 H MET 11 17.474 -10.052 14.982 2 HA MET 11 HA MET 11 17.594 -8.830 12.352 3 1HB MET 11 1HB MET 11 19.744 -9.948 14.158 4 2HB MET 11 2HB MET 11 20.056 -9.205 12.595 5 1HG MET 11 1HG MET 11 18.628 -7.248 13.729 6 2HG MET 11 2HG MET 11 19.331 -7.973 15.173 7 1HE MET 11 1HE MET 11 21.592 -6.441 11.548 8 2HE MET 11 2HE MET 11 19.898 -6.916 11.674 9 3HE MET 11 3HE MET 11 20.405 -5.309 12.197 10 H ALA 12 H ALA 12 18.457 -11.961 13.814 11 HA ALA 12 HA ALA 12 19.296 -13.300 11.551 12 1HB ALA 12 1HB ALA 12 18.551 -13.992 14.207 13 2HB ALA 12 2HB ALA 12 17.806 -15.144 13.098 14 3HB ALA 12 3HB ALA 12 19.552 -14.895 13.069 15 H GLU 13 H GLU 13 15.998 -12.796 12.723 16 HA GLU 13 HA GLU 13 14.607 -14.478 11.027 17 1HB GLU 13 1HB GLU 13 13.798 -12.880 12.939 18 2HB GLU 13 2HB GLU 13 13.540 -11.744 11.622 19 1HG GLU 13 1HG GLU 13 12.328 -13.947 10.630 20 2HG GLU 13 2HG GLU 13 12.045 -14.158 12.357 21 H VAL 14 H VAL 14 15.473 -11.069 10.462 22 HA VAL 14 HA VAL 14 14.422 -10.935 7.848 23 HB VAL 14 HB VAL 14 16.706 -9.285 8.932 24 1HG1 VAL 14 1HG1 VAL 14 14.915 -9.118 6.579 25 2HG1 VAL 14 2HG1 VAL 14 15.306 -7.607 7.402 26 3HG1 VAL 14 3HG1 VAL 14 16.598 -8.624 6.762 27 1HG2 VAL 14 1HG2 VAL 14 14.561 -7.718 9.307 28 2HG2 VAL 14 2HG2 VAL 14 13.824 -9.296 9.587 29 3HG2 VAL 14 3HG2 VAL 14 15.207 -8.784 10.554 30 H GLU 15 H GLU 15 17.572 -11.867 9.104 31 HA GLU 15 HA GLU 15 18.938 -11.911 6.627 32 1HB GLU 15 1HB GLU 15 19.446 -13.308 9.251 33 2HB GLU 15 2HB GLU 15 20.521 -13.465 7.869 34 1HG GLU 15 1HG GLU 15 21.036 -11.139 7.910 35 2HG GLU 15 2HG GLU 15 19.790 -10.830 9.118 36 H GLU 16 H GLU 16 17.080 -14.330 8.398 37 HA GLU 16 HA GLU 16 17.728 -16.541 6.774 38 1HB GLU 16 1HB GLU 16 16.275 -16.161 9.075 39 2HB GLU 16 2HB GLU 16 15.024 -16.560 7.906 40 1HG GLU 16 1HG GLU 16 17.487 -18.238 8.217 41 2HG GLU 16 2HG GLU 16 16.063 -18.469 9.229 42 H THR 17 H THR 17 15.308 -14.019 6.501 43 HA THR 17 HA THR 17 13.939 -15.287 4.302 44 HB THR 17 HB THR 17 13.701 -12.477 5.395 45 HG1 THR 17 HG1 THR 17 12.992 -14.594 6.568 46 1HG2 THR 17 1HG2 THR 17 11.472 -12.582 4.172 47 2HG2 THR 17 2HG2 THR 17 12.132 -13.967 3.302 48 3HG2 THR 17 3HG2 THR 17 12.910 -12.390 3.170 49 H LEU 18 H LEU 18 16.561 -13.064 4.719 50 HA LEU 18 HA LEU 18 16.483 -11.975 2.072 51 1HB LEU 18 1HB LEU 18 18.084 -11.668 4.469 52 2HB LEU 18 2HB LEU 18 19.076 -11.681 3.013 53 HG LEU 18 HG LEU 18 17.249 -9.909 2.229 54 1HD1 LEU 18 1HD1 LEU 18 17.271 -9.725 5.234 55 2HD1 LEU 18 2HD1 LEU 18 15.877 -9.954 4.178 56 3HD1 LEU 18 3HD1 LEU 18 16.746 -8.420 4.169 57 1HD2 LEU 18 1HD2 LEU 18 18.848 -8.262 2.598 58 2HD2 LEU 18 2HD2 LEU 18 19.799 -9.747 2.567 59 3HD2 LEU 18 3HD2 LEU 18 19.393 -8.991 4.109 60 H LYS 19 H LYS 19 17.973 -14.731 3.604 61 HA LYS 19 HA LYS 19 19.860 -15.300 1.557 62 1HB LYS 19 1HB LYS 19 18.616 -17.088 3.654 63 2HB LYS 19 2HB LYS 19 19.958 -17.555 2.618 64 1HG LYS 19 1HG LYS 19 20.425 -15.048 4.021 65 2HG LYS 19 2HG LYS 19 20.158 -16.416 5.105 66 1HD LYS 19 1HD LYS 19 21.925 -17.034 2.863 67 2HD LYS 19 2HD LYS 19 22.543 -15.758 3.914 68 1HE LYS 19 1HE LYS 19 22.033 -17.304 5.855 69 2HE LYS 19 2HE LYS 19 21.775 -18.571 4.657 70 1HZ LYS 19 1HZ LYS 19 24.008 -18.708 5.434 71 2HZ LYS 19 2HZ LYS 19 24.283 -17.064 5.149 72 3HZ LYS 19 3HZ LYS 19 24.059 -18.122 3.848 73 H ARG 20 H ARG 20 16.666 -16.680 2.321 74 HA ARG 20 HA ARG 20 16.576 -18.404 0.085 75 1HB ARG 20 1HB ARG 20 14.315 -18.808 0.663 76 2HB ARG 20 2HB ARG 20 15.156 -18.535 2.183 77 1HG ARG 20 1HG ARG 20 14.367 -16.072 1.853 78 2HG ARG 20 2HG ARG 20 13.179 -16.807 0.774 79 1HD ARG 20 1HD ARG 20 13.588 -17.939 3.506 80 2HD ARG 20 2HD ARG 20 12.639 -16.465 3.311 81 HE ARG 20 HE ARG 20 11.735 -18.422 1.497 82 1HH1 ARG 20 1HH1 ARG 20 11.738 -17.677 4.898 83 2HH1 ARG 20 2HH1 ARG 20 10.258 -18.519 5.216 84 1HH2 ARG 20 1HH2 ARG 20 9.786 -19.534 1.904 85 2HH2 ARG 20 2HH2 ARG 20 9.149 -19.576 3.513 86 H LEU 21 H LEU 21 15.820 -15.037 0.518 87 HA LEU 21 HA LEU 21 14.271 -14.752 -1.868 88 1HB LEU 21 1HB LEU 21 15.319 -13.013 0.245 89 2HB LEU 21 2HB LEU 21 15.218 -12.250 -1.341 90 HG LEU 21 HG LEU 21 12.850 -12.626 -1.436 91 1HD1 LEU 21 1HD1 LEU 21 12.112 -13.555 1.075 92 2HD1 LEU 21 2HD1 LEU 21 13.437 -14.607 0.581 93 3HD1 LEU 21 3HD1 LEU 21 12.017 -14.434 -0.451 94 1HD2 LEU 21 1HD2 LEU 21 12.178 -11.457 0.763 95 2HD2 LEU 21 2HD2 LEU 21 13.266 -10.619 -0.343 96 3HD2 LEU 21 3HD2 LEU 21 13.910 -11.419 1.091 97 H GLN 22 H GLN 22 17.553 -13.646 -1.005 98 HA GLN 22 HA GLN 22 18.278 -12.807 -3.574 99 1HB GLN 22 1HB GLN 22 19.482 -12.896 -1.052 100 2HB GLN 22 2HB GLN 22 20.538 -13.844 -2.090 101 1HG GLN 22 1HG GLN 22 21.140 -11.443 -1.937 102 2HG GLN 22 2HG GLN 22 20.845 -12.013 -3.580 103 1HE2 GLN 22 1HE2 GLN 22 18.861 -10.790 -0.898 104 2HE2 GLN 22 2HE2 GLN 22 17.998 -9.629 -1.843 105 H SER 23 H SER 23 17.951 -15.950 -2.264 106 HA SER 23 HA SER 23 19.750 -17.241 -4.110 107 1HB SER 23 1HB SER 23 18.037 -18.059 -1.855 108 2HB SER 23 2HB SER 23 18.183 -19.256 -3.141 109 HG SER 23 HG SER 23 20.457 -19.086 -2.925 110 H GLN 24 H GLN 24 16.324 -16.548 -3.906 111 HA GLN 24 HA GLN 24 15.722 -18.160 -6.246 112 1HB GLN 24 1HB GLN 24 13.406 -17.452 -5.884 113 2HB GLN 24 2HB GLN 24 14.110 -18.099 -4.408 114 1HG GLN 24 1HG GLN 24 14.348 -15.938 -3.469 115 2HG GLN 24 2HG GLN 24 13.970 -15.159 -5.004 116 1HE2 GLN 24 1HE2 GLN 24 12.579 -14.308 -2.936 117 2HE2 GLN 24 2HE2 GLN 24 10.961 -14.915 -2.953 118 H LYS 25 H LYS 25 14.809 -17.299 -8.174 119 HA LYS 25 HA LYS 25 16.070 -14.862 -9.019 120 1HB LYS 25 1HB LYS 25 15.059 -17.174 -10.272 121 2HB LYS 25 2HB LYS 25 14.108 -15.832 -10.893 122 1HG LYS 25 1HG LYS 25 16.365 -14.685 -11.307 123 2HG LYS 25 2HG LYS 25 17.059 -16.294 -11.093 124 1HD LYS 25 1HD LYS 25 15.276 -17.018 -12.833 125 2HD LYS 25 2HD LYS 25 15.203 -15.298 -13.223 126 1HE LYS 25 1HE LYS 25 17.909 -15.821 -13.137 127 2HE LYS 25 2HE LYS 25 17.239 -17.280 -13.865 128 1HZ LYS 25 1HZ LYS 25 16.746 -16.200 -15.739 129 2HZ LYS 25 2HZ LYS 25 17.806 -15.000 -15.193 130 3HZ LYS 25 3HZ LYS 25 16.142 -14.842 -14.931 131 H GLY 26 H GLY 26 15.097 -12.939 -9.649 132 1HA GLY 26 1HA GLY 26 13.052 -11.692 -10.140 133 2HA GLY 26 2HA GLY 26 12.258 -12.638 -8.889 134 H VAL 27 H VAL 27 14.009 -12.494 -6.808 135 HA VAL 27 HA VAL 27 13.401 -10.091 -5.587 136 HB VAL 27 HB VAL 27 15.747 -11.902 -5.001 137 1HG1 VAL 27 1HG1 VAL 27 16.375 -10.426 -3.468 138 2HG1 VAL 27 2HG1 VAL 27 15.036 -9.363 -3.906 139 3HG1 VAL 27 3HG1 VAL 27 14.811 -10.608 -2.676 140 1HG2 VAL 27 1HG2 VAL 27 13.664 -13.102 -4.872 141 2HG2 VAL 27 2HG2 VAL 27 14.251 -12.802 -3.237 142 3HG2 VAL 27 3HG2 VAL 27 12.941 -11.823 -3.897 143 H GLN 28 H GLN 28 13.962 -8.115 -6.212 144 HA GLN 28 HA GLN 28 16.375 -7.623 -7.707 145 1HB GLN 28 1HB GLN 28 13.906 -6.203 -7.120 146 2HB GLN 28 2HB GLN 28 15.312 -5.154 -6.993 147 1HG GLN 28 1HG GLN 28 15.893 -5.454 -9.225 148 2HG GLN 28 2HG GLN 28 14.911 -6.909 -9.381 149 1HE2 GLN 28 1HE2 GLN 28 13.084 -6.668 -10.435 150 2HE2 GLN 28 2HE2 GLN 28 12.189 -5.200 -10.607 151 H GLY 29 H GLY 29 15.339 -7.383 -4.407 152 1HA GLY 29 1HA GLY 29 17.755 -7.303 -3.197 153 2HA GLY 29 2HA GLY 29 17.484 -5.617 -3.611 154 H ILE 30 H ILE 30 17.711 -6.852 -0.977 155 HA ILE 30 HA ILE 30 15.065 -6.099 0.081 156 HB ILE 30 HB ILE 30 16.924 -8.156 1.277 157 1HG1 ILE 30 1HG1 ILE 30 14.336 -9.151 0.484 158 2HG1 ILE 30 2HG1 ILE 30 15.147 -8.416 -0.895 159 1HG2 ILE 30 1HG2 ILE 30 14.174 -7.205 2.056 160 2HG2 ILE 30 2HG2 ILE 30 14.944 -8.648 2.715 161 3HG2 ILE 30 3HG2 ILE 30 15.664 -7.061 2.988 162 1HD1 ILE 30 1HD1 ILE 30 17.157 -9.892 0.140 163 2HD1 ILE 30 2HD1 ILE 30 15.759 -10.882 0.564 164 3HD1 ILE 30 3HD1 ILE 30 16.054 -10.448 -1.120 165 H ILE 31 H ILE 31 15.050 -4.514 1.545 166 HA ILE 31 HA ILE 31 17.633 -3.665 2.681 167 HB ILE 31 HB ILE 31 15.189 -1.964 2.180 168 1HG1 ILE 31 1HG1 ILE 31 17.589 -1.216 0.743 169 2HG1 ILE 31 2HG1 ILE 31 17.116 -2.866 0.356 170 1HG2 ILE 31 1HG2 ILE 31 16.200 -0.860 3.903 171 2HG2 ILE 31 2HG2 ILE 31 17.802 -1.480 3.507 172 3HG2 ILE 31 3HG2 ILE 31 17.099 -0.177 2.549 173 1HD1 ILE 31 1HD1 ILE 31 15.042 -2.188 -0.484 174 2HD1 ILE 31 2HD1 ILE 31 15.166 -0.594 0.260 175 3HD1 ILE 31 3HD1 ILE 31 16.198 -1.012 -1.108 176 H VAL 32 H VAL 32 17.752 -3.102 4.849 177 HA VAL 32 HA VAL 32 15.368 -3.633 6.487 178 HB VAL 32 HB VAL 32 18.111 -4.531 7.341 179 1HG1 VAL 32 1HG1 VAL 32 15.379 -5.438 8.233 180 2HG1 VAL 32 2HG1 VAL 32 16.934 -5.825 8.972 181 3HG1 VAL 32 3HG1 VAL 32 16.312 -4.176 9.038 182 1HG2 VAL 32 1HG2 VAL 32 17.607 -5.730 5.298 183 2HG2 VAL 32 2HG2 VAL 32 17.451 -6.814 6.681 184 3HG2 VAL 32 3HG2 VAL 32 16.008 -6.155 5.910 185 H VAL 33 H VAL 33 14.922 -1.681 7.306 186 HA VAL 33 HA VAL 33 17.141 -0.078 8.393 187 HB VAL 33 HB VAL 33 14.389 0.990 7.821 188 1HG1 VAL 33 1HG1 VAL 33 15.397 3.110 7.913 189 2HG1 VAL 33 2HG1 VAL 33 16.104 2.212 9.259 190 3HG1 VAL 33 3HG1 VAL 33 17.021 2.438 7.769 191 1HG2 VAL 33 1HG2 VAL 33 15.585 1.891 5.693 192 2HG2 VAL 33 2HG2 VAL 33 16.644 0.499 5.920 193 3HG2 VAL 33 3HG2 VAL 33 14.911 0.261 5.691 194 H ASN 34 H ASN 34 17.135 0.544 10.496 195 HA ASN 34 HA ASN 34 15.117 -0.687 12.214 196 1HB ASN 34 1HB ASN 34 16.673 -0.605 13.949 197 2HB ASN 34 2HB ASN 34 17.690 -0.877 12.537 198 1HD2 ASN 34 1HD2 ASN 34 18.605 1.093 11.527 199 2HD2 ASN 34 2HD2 ASN 34 19.110 2.372 12.573 200 H THR 35 H THR 35 15.236 0.898 14.441 201 HA THR 35 HA THR 35 13.364 2.902 13.883 202 HB THR 35 HB THR 35 13.837 3.715 16.212 203 HG1 THR 35 HG1 THR 35 15.307 2.410 17.436 204 1HG2 THR 35 1HG2 THR 35 12.333 1.708 15.512 205 2HG2 THR 35 2HG2 THR 35 12.722 1.945 17.216 206 3HG2 THR 35 3HG2 THR 35 13.588 0.732 16.273 207 H GLU 36 H GLU 36 16.823 3.187 14.684 208 HA GLU 36 HA GLU 36 17.048 5.946 14.589 209 1HB GLU 36 1HB GLU 36 18.911 3.670 14.236 210 2HB GLU 36 2HB GLU 36 19.457 5.222 13.619 211 1HG GLU 36 1HG GLU 36 18.434 5.772 16.149 212 2HG GLU 36 2HG GLU 36 19.331 4.265 16.328 213 H GLY 37 H GLY 37 16.724 3.656 11.996 214 1HA GLY 37 1HA GLY 37 15.890 4.361 9.864 215 2HA GLY 37 2HA GLY 37 16.702 5.902 10.096 216 H ILE 38 H ILE 38 18.759 3.497 11.087 217 HA ILE 38 HA ILE 38 20.357 3.778 8.682 218 HB ILE 38 HB ILE 38 20.990 2.309 11.244 219 1HG1 ILE 38 1HG1 ILE 38 21.855 5.057 10.316 220 2HG1 ILE 38 2HG1 ILE 38 20.644 4.743 11.554 221 1HG2 ILE 38 1HG2 ILE 38 23.285 2.319 10.477 222 2HG2 ILE 38 2HG2 ILE 38 22.258 1.529 9.281 223 3HG2 ILE 38 3HG2 ILE 38 22.818 3.179 9.010 224 1HD1 ILE 38 1HD1 ILE 38 22.274 4.809 13.045 225 2HD1 ILE 38 2HD1 ILE 38 22.900 3.313 12.351 226 3HD1 ILE 38 3HD1 ILE 38 23.501 4.869 11.779 227 HA PRO 39 HA PRO 39 19.010 -0.057 6.936 228 1HB PRO 39 1HB PRO 39 20.954 -0.282 5.054 229 2HB PRO 39 2HB PRO 39 19.602 0.847 4.908 230 1HG PRO 39 1HG PRO 39 22.409 1.362 5.809 231 2HG PRO 39 2HG PRO 39 21.386 2.327 4.729 232 1HD PRO 39 1HD PRO 39 21.755 2.959 7.336 233 2HD PRO 39 2HD PRO 39 20.239 3.297 6.478 234 H ILE 40 H ILE 40 19.628 -1.129 9.007 235 HA ILE 40 HA ILE 40 22.112 -2.093 9.680 236 HB ILE 40 HB ILE 40 20.834 -4.102 10.642 237 1HG1 ILE 40 1HG1 ILE 40 18.459 -2.400 9.866 238 2HG1 ILE 40 2HG1 ILE 40 18.932 -3.864 9.011 239 1HG2 ILE 40 1HG2 ILE 40 20.493 -2.899 12.525 240 2HG2 ILE 40 2HG2 ILE 40 21.340 -1.654 11.608 241 3HG2 ILE 40 3HG2 ILE 40 19.578 -1.644 11.689 242 1HD1 ILE 40 1HD1 ILE 40 18.506 -4.032 11.941 243 2HD1 ILE 40 2HD1 ILE 40 17.097 -3.891 10.890 244 3HD1 ILE 40 3HD1 ILE 40 18.222 -5.233 10.681 245 H LYS 41 H LYS 41 19.859 -3.347 7.289 246 HA LYS 41 HA LYS 41 22.000 -5.069 6.263 247 1HB LYS 41 1HB LYS 41 19.511 -5.956 7.442 248 2HB LYS 41 2HB LYS 41 19.621 -6.466 5.763 249 1HG LYS 41 1HG LYS 41 22.088 -7.124 6.628 250 2HG LYS 41 2HG LYS 41 21.158 -7.336 8.113 251 1HD LYS 41 1HD LYS 41 20.461 -9.305 7.355 252 2HD LYS 41 2HD LYS 41 19.637 -8.477 6.031 253 1HE LYS 41 1HE LYS 41 21.367 -8.847 4.550 254 2HE LYS 41 2HE LYS 41 22.566 -9.018 5.830 255 1HZ LYS 41 1HZ LYS 41 20.418 -11.006 5.630 256 2HZ LYS 41 2HZ LYS 41 22.000 -11.187 6.199 257 3HZ LYS 41 3HZ LYS 41 21.706 -11.091 4.536 258 H SER 42 H SER 42 21.954 -5.432 4.033 259 HA SER 42 HA SER 42 19.836 -4.520 2.362 260 1HB SER 42 1HB SER 42 21.117 -2.683 1.254 261 2HB SER 42 2HB SER 42 20.674 -2.317 2.922 262 HG SER 42 HG SER 42 23.170 -2.753 1.796 263 H THR 43 H THR 43 20.137 -5.077 0.189 264 HA THR 43 HA THR 43 22.583 -6.620 -0.381 265 HB THR 43 HB THR 43 21.354 -8.284 -1.536 266 HG1 THR 43 HG1 THR 43 19.158 -8.070 -1.996 267 1HG2 THR 43 1HG2 THR 43 19.380 -7.983 0.631 268 2HG2 THR 43 2HG2 THR 43 21.069 -7.934 1.136 269 3HG2 THR 43 3HG2 THR 43 20.452 -9.330 0.253 270 H MET 44 H MET 44 20.803 -3.966 -1.200 271 HA MET 44 HA MET 44 21.256 -4.113 -4.069 272 1HB MET 44 1HB MET 44 19.377 -2.821 -2.467 273 2HB MET 44 2HB MET 44 20.399 -1.524 -3.071 274 1HG MET 44 1HG MET 44 19.880 -1.988 -5.297 275 2HG MET 44 2HG MET 44 19.259 -3.591 -4.910 276 1HE MET 44 1HE MET 44 16.540 -2.470 -2.433 277 2HE MET 44 2HE MET 44 16.103 -3.552 -3.755 278 3HE MET 44 3HE MET 44 17.660 -3.732 -2.945 279 H ASP 45 H ASP 45 21.864 -1.534 -4.728 280 HA ASP 45 HA ASP 45 24.673 -1.465 -4.289 281 1HB ASP 45 1HB ASP 45 22.754 -0.134 -5.990 282 2HB ASP 45 2HB ASP 45 23.895 1.029 -5.320 283 H ASN 46 H ASN 46 25.830 0.503 -3.522 284 HA ASN 46 HA ASN 46 25.160 1.076 -0.861 285 1HB ASN 46 1HB ASN 46 27.342 1.558 -2.581 286 2HB ASN 46 2HB ASN 46 26.848 3.133 -1.965 287 1HD2 ASN 46 1HD2 ASN 46 25.955 2.454 0.545 288 2HD2 ASN 46 2HD2 ASN 46 27.287 1.892 1.492 289 HA PRO 47 HA PRO 47 23.765 5.443 -2.394 290 1HB PRO 47 1HB PRO 47 23.458 5.779 -5.070 291 2HB PRO 47 2HB PRO 47 24.983 6.088 -4.232 292 1HG PRO 47 1HG PRO 47 24.138 3.682 -5.800 293 2HG PRO 47 2HG PRO 47 25.695 4.532 -5.806 294 1HD PRO 47 1HD PRO 47 25.295 2.233 -4.432 295 2HD PRO 47 2HD PRO 47 26.409 3.497 -3.875 296 H THR 48 H THR 48 22.681 2.561 -4.051 297 HA THR 48 HA THR 48 20.025 3.521 -4.561 298 HB THR 48 HB THR 48 21.059 0.678 -4.562 299 HG1 THR 48 HG1 THR 48 20.998 1.132 -6.919 300 1HG2 THR 48 1HG2 THR 48 18.548 1.897 -5.715 301 2HG2 THR 48 2HG2 THR 48 18.644 0.738 -4.390 302 3HG2 THR 48 3HG2 THR 48 19.103 0.252 -6.021 303 H THR 49 H THR 49 21.620 1.727 -2.011 304 HA THR 49 HA THR 49 19.233 0.868 -0.703 305 HB THR 49 HB THR 49 22.056 1.124 0.350 306 HG1 THR 49 HG1 THR 49 22.310 -0.877 -0.376 307 1HG2 THR 49 1HG2 THR 49 20.428 1.166 2.178 308 2HG2 THR 49 2HG2 THR 49 21.320 -0.355 2.161 309 3HG2 THR 49 3HG2 THR 49 19.670 -0.294 1.543 310 H THR 50 H THR 50 21.554 3.493 -0.087 311 HA THR 50 HA THR 50 20.396 4.559 2.197 312 HB THR 50 HB THR 50 21.397 6.607 0.356 313 HG1 THR 50 HG1 THR 50 22.734 5.094 -0.489 314 1HG2 THR 50 1HG2 THR 50 22.671 7.270 2.222 315 2HG2 THR 50 2HG2 THR 50 22.597 5.665 2.949 316 3HG2 THR 50 3HG2 THR 50 21.155 6.679 2.900 317 H GLN 51 H GLN 51 19.746 5.377 -1.202 318 HA GLN 51 HA GLN 51 17.878 7.394 -0.776 319 1HB GLN 51 1HB GLN 51 18.758 7.045 -2.973 320 2HB GLN 51 2HB GLN 51 18.146 5.397 -3.021 321 1HG GLN 51 1HG GLN 51 16.089 7.434 -2.594 322 2HG GLN 51 2HG GLN 51 16.931 7.555 -4.138 323 1HE2 GLN 51 1HE2 GLN 51 14.704 5.769 -2.231 324 2HE2 GLN 51 2HE2 GLN 51 14.267 4.606 -3.432 325 H TYR 52 H TYR 52 17.355 3.901 -1.174 326 HA TYR 52 HA TYR 52 14.554 3.964 -0.953 327 1HB TYR 52 1HB TYR 52 16.647 1.853 -0.630 328 2HB TYR 52 2HB TYR 52 15.003 1.504 -0.107 329 HD1 TYR 52 HD1 TYR 52 16.527 3.224 -3.063 330 HD2 TYR 52 HD2 TYR 52 13.838 0.249 -1.642 331 HE1 TYR 52 HE1 TYR 52 15.912 2.681 -5.382 332 HE2 TYR 52 HE2 TYR 52 13.216 -0.302 -3.956 333 HH TYR 52 HH TYR 52 14.448 1.566 -6.686 334 H ALA 53 H ALA 53 17.023 3.196 1.501 335 HA ALA 53 HA ALA 53 15.251 2.900 3.656 336 1HB ALA 53 1HB ALA 53 18.175 3.408 3.403 337 2HB ALA 53 2HB ALA 53 17.412 3.572 4.984 338 3HB ALA 53 3HB ALA 53 17.325 2.038 4.118 339 H SER 54 H SER 54 16.321 5.697 2.004 340 HA SER 54 HA SER 54 15.997 7.555 4.158 341 1HB SER 54 1HB SER 54 17.434 7.947 2.127 342 2HB SER 54 2HB SER 54 15.953 8.152 1.193 343 HG SER 54 HG SER 54 17.064 9.799 3.166 344 H LEU 55 H LEU 55 14.071 6.832 1.248 345 HA LEU 55 HA LEU 55 11.864 8.431 2.159 346 1HB LEU 55 1HB LEU 55 10.936 8.082 0.108 347 2HB LEU 55 2HB LEU 55 12.635 7.805 -0.270 348 HG LEU 55 HG LEU 55 11.940 5.291 0.255 349 1HD1 LEU 55 1HD1 LEU 55 9.469 5.918 -1.162 350 2HD1 LEU 55 2HD1 LEU 55 9.496 6.501 0.502 351 3HD1 LEU 55 3HD1 LEU 55 9.766 4.792 0.162 352 1HD2 LEU 55 1HD2 LEU 55 12.629 6.707 -1.953 353 2HD2 LEU 55 2HD2 LEU 55 11.029 6.124 -2.411 354 3HD2 LEU 55 3HD2 LEU 55 12.285 4.977 -1.943 355 H MET 56 H MET 56 12.900 5.196 2.590 356 HA MET 56 HA MET 56 10.555 3.771 2.881 357 1HB MET 56 1HB MET 56 13.284 3.421 3.573 358 2HB MET 56 2HB MET 56 12.332 3.027 4.998 359 1HG MET 56 1HG MET 56 12.741 1.052 3.664 360 2HG MET 56 2HG MET 56 11.023 1.439 3.694 361 1HE MET 56 1HE MET 56 9.967 0.915 0.552 362 2HE MET 56 2HE MET 56 9.672 1.595 2.152 363 3HE MET 56 3HE MET 56 9.897 2.664 0.767 364 H HIS 57 H HIS 57 12.090 5.992 5.147 365 HA HIS 57 HA HIS 57 10.209 5.450 7.256 366 1HB HIS 57 1HB HIS 57 12.631 6.267 7.516 367 2HB HIS 57 2HB HIS 57 12.010 7.859 7.091 368 HD1 HIS 57 HD1 HIS 57 11.246 5.146 9.652 369 HD2 HIS 57 HD2 HIS 57 11.215 9.280 9.247 370 HE1 HIS 57 HE1 HIS 57 10.608 6.038 11.915 371 H SER 58 H SER 58 10.543 7.774 4.666 372 HA SER 58 HA SER 58 8.602 9.620 5.623 373 1HB SER 58 1HB SER 58 10.259 10.328 3.994 374 2HB SER 58 2HB SER 58 9.671 9.139 2.831 375 HG SER 58 HG SER 58 8.909 11.508 2.814 376 H PHE 59 H PHE 59 8.486 6.819 3.485 377 HA PHE 59 HA PHE 59 5.906 7.114 2.483 378 1HB PHE 59 1HB PHE 59 7.555 5.430 1.695 379 2HB PHE 59 2HB PHE 59 7.292 4.517 3.178 380 HD1 PHE 59 HD1 PHE 59 6.282 2.542 2.529 381 HD2 PHE 59 HD2 PHE 59 4.850 6.228 0.954 382 HE1 PHE 59 HE1 PHE 59 4.408 1.355 1.464 383 HE2 PHE 59 HE2 PHE 59 2.974 5.047 -0.113 384 HZ PHE 59 HZ PHE 59 2.750 2.608 0.142 385 H ILE 60 H ILE 60 6.931 5.158 5.285 386 HA ILE 60 HA ILE 60 4.366 4.448 6.140 387 HB ILE 60 HB ILE 60 6.848 4.808 7.823 388 1HG1 ILE 60 1HG1 ILE 60 7.216 3.232 6.007 389 2HG1 ILE 60 2HG1 ILE 60 7.092 2.360 7.531 390 1HG2 ILE 60 1HG2 ILE 60 4.137 3.746 8.397 391 2HG2 ILE 60 2HG2 ILE 60 5.518 2.916 9.113 392 3HG2 ILE 60 3HG2 ILE 60 5.252 4.628 9.440 393 1HD1 ILE 60 1HD1 ILE 60 5.533 2.092 5.138 394 2HD1 ILE 60 2HD1 ILE 60 5.585 1.062 6.569 395 3HD1 ILE 60 3HD1 ILE 60 4.497 2.449 6.520 396 H LEU 61 H LEU 61 6.374 7.243 6.943 397 HA LEU 61 HA LEU 61 4.661 8.287 8.944 398 1HB LEU 61 1HB LEU 61 7.076 9.091 7.552 399 2HB LEU 61 2HB LEU 61 5.997 10.453 7.847 400 HG LEU 61 HG LEU 61 6.057 10.036 10.227 401 1HD1 LEU 61 1HD1 LEU 61 7.680 8.292 11.079 402 2HD1 LEU 61 2HD1 LEU 61 7.663 7.618 9.450 403 3HD1 LEU 61 3HD1 LEU 61 6.173 7.688 10.390 404 1HD2 LEU 61 1HD2 LEU 61 8.745 10.120 8.876 405 2HD2 LEU 61 2HD2 LEU 61 8.528 10.354 10.611 406 3HD2 LEU 61 3HD2 LEU 61 7.781 11.473 9.469 407 H LYS 62 H LYS 62 4.631 8.403 5.488 408 HA LYS 62 HA LYS 62 2.902 10.684 5.271 409 1HB LYS 62 1HB LYS 62 4.400 9.031 3.496 410 2HB LYS 62 2HB LYS 62 2.728 9.037 2.952 411 1HG LYS 62 1HG LYS 62 3.896 10.796 1.840 412 2HG LYS 62 2HG LYS 62 2.778 11.518 3.000 413 1HD LYS 62 1HD LYS 62 4.554 11.960 4.540 414 2HD LYS 62 2HD LYS 62 5.698 11.029 3.571 415 1HE LYS 62 1HE LYS 62 4.297 13.328 2.302 416 2HE LYS 62 2HE LYS 62 5.599 13.664 3.442 417 1HZ LYS 62 1HZ LYS 62 6.120 11.671 1.376 418 2HZ LYS 62 2HZ LYS 62 7.157 12.822 2.054 419 3HZ LYS 62 3HZ LYS 62 6.034 13.285 0.877 420 H ALA 63 H ALA 63 2.444 7.182 4.783 421 HA ALA 63 HA ALA 63 -0.355 7.339 4.414 422 1HB ALA 63 1HB ALA 63 1.435 5.045 5.190 423 2HB ALA 63 2HB ALA 63 -0.290 4.873 4.865 424 3HB ALA 63 3HB ALA 63 0.797 5.425 3.590 425 H ARG 64 H ARG 64 1.620 6.485 7.247 426 HA ARG 64 HA ARG 64 -0.414 5.898 9.032 427 1HB ARG 64 1HB ARG 64 2.100 5.668 9.366 428 2HB ARG 64 2HB ARG 64 2.101 7.372 9.799 429 1HG ARG 64 1HG ARG 64 0.080 6.215 11.342 430 2HG ARG 64 2HG ARG 64 1.432 5.082 11.394 431 1HD ARG 64 1HD ARG 64 1.802 8.025 11.860 432 2HD ARG 64 2HD ARG 64 1.359 6.925 13.165 433 HE ARG 64 HE ARG 64 3.670 6.082 11.680 434 1HH1 ARG 64 1HH1 ARG 64 2.520 8.049 14.312 435 2HH1 ARG 64 2HH1 ARG 64 4.037 8.046 15.149 436 1HH2 ARG 64 1HH2 ARG 64 5.672 6.071 12.772 437 2HH2 ARG 64 2HH2 ARG 64 5.830 6.922 14.271 438 H SER 65 H SER 65 0.690 8.982 7.854 439 HA SER 65 HA SER 65 -0.663 10.525 9.870 440 1HB SER 65 1HB SER 65 1.407 11.233 8.520 441 2HB SER 65 2HB SER 65 0.282 11.572 7.205 442 HG SER 65 HG SER 65 0.677 13.420 8.494 443 H THR 66 H THR 66 -1.409 9.250 6.721 444 HA THR 66 HA THR 66 -3.766 10.885 6.371 445 HB THR 66 HB THR 66 -3.575 8.473 4.715 446 HG1 THR 66 HG1 THR 66 -1.727 9.345 3.562 447 1HG2 THR 66 1HG2 THR 66 -4.021 10.010 2.943 448 2HG2 THR 66 2HG2 THR 66 -3.543 11.386 3.937 449 3HG2 THR 66 3HG2 THR 66 -5.017 10.496 4.315 450 H VAL 67 H VAL 67 -3.007 7.580 7.340 451 HA VAL 67 HA VAL 67 -5.553 6.471 7.319 452 HB VAL 67 HB VAL 67 -3.427 5.898 9.386 453 1HG1 VAL 67 1HG1 VAL 67 -5.867 4.461 8.425 454 2HG1 VAL 67 2HG1 VAL 67 -4.496 3.554 9.067 455 3HG1 VAL 67 3HG1 VAL 67 -5.314 4.749 10.074 456 1HG2 VAL 67 1HG2 VAL 67 -3.371 3.994 7.306 457 2HG2 VAL 67 2HG2 VAL 67 -3.334 5.586 6.547 458 3HG2 VAL 67 3HG2 VAL 67 -2.120 5.155 7.751 459 H ARG 68 H ARG 68 -4.044 8.614 9.645 460 HA ARG 68 HA ARG 68 -5.702 8.304 11.835 461 1HB ARG 68 1HB ARG 68 -4.555 10.904 10.801 462 2HB ARG 68 2HB ARG 68 -5.105 10.595 12.443 463 1HG ARG 68 1HG ARG 68 -3.033 8.778 11.381 464 2HG ARG 68 2HG ARG 68 -2.547 10.444 11.702 465 1HD ARG 68 1HD ARG 68 -3.450 10.230 13.990 466 2HD ARG 68 2HD ARG 68 -3.839 8.543 13.655 467 HE ARG 68 HE ARG 68 -1.621 8.008 13.909 468 1HH1 ARG 68 1HH1 ARG 68 -1.965 11.464 13.668 469 2HH1 ARG 68 2HH1 ARG 68 -0.320 11.789 14.106 470 1HH2 ARG 68 1HH2 ARG 68 0.547 8.424 14.486 471 2HH2 ARG 68 2HH2 ARG 68 1.108 10.059 14.570 472 H ASP 69 H ASP 69 -6.295 9.974 8.817 473 HA ASP 69 HA ASP 69 -8.700 11.261 9.715 474 1HB ASP 69 1HB ASP 69 -6.998 11.622 7.579 475 2HB ASP 69 2HB ASP 69 -8.414 10.898 6.822 476 H ILE 70 H ILE 70 -7.870 8.235 8.201 477 HA ILE 70 HA ILE 70 -10.420 7.540 7.218 478 HB ILE 70 HB ILE 70 -8.272 5.650 8.183 479 1HG1 ILE 70 1HG1 ILE 70 -8.691 6.857 5.439 480 2HG1 ILE 70 2HG1 ILE 70 -7.389 7.268 6.550 481 1HG2 ILE 70 1HG2 ILE 70 -9.501 3.972 7.377 482 2HG2 ILE 70 2HG2 ILE 70 -10.845 5.112 7.364 483 3HG2 ILE 70 3HG2 ILE 70 -9.891 4.858 5.903 484 1HD1 ILE 70 1HD1 ILE 70 -6.372 5.802 5.096 485 2HD1 ILE 70 2HD1 ILE 70 -6.833 4.743 6.429 486 3HD1 ILE 70 3HD1 ILE 70 -7.803 4.781 4.957 487 H ASP 71 H ASP 71 -8.888 7.139 10.360 488 HA ASP 71 HA ASP 71 -11.455 6.758 11.607 489 1HB ASP 71 1HB ASP 71 -9.620 4.486 11.143 490 2HB ASP 71 2HB ASP 71 -10.268 4.620 12.776 491 HA PRO 72 HA PRO 72 -9.469 8.658 15.024 492 1HB PRO 72 1HB PRO 72 -10.702 7.492 17.144 493 2HB PRO 72 2HB PRO 72 -11.506 8.659 16.087 494 1HG PRO 72 1HG PRO 72 -11.662 5.669 16.073 495 2HG PRO 72 2HG PRO 72 -12.964 6.858 15.888 496 1HD PRO 72 1HD PRO 72 -11.858 5.569 13.780 497 2HD PRO 72 2HD PRO 72 -12.482 7.227 13.664 498 H GLN 73 H GLN 73 -9.844 5.153 15.589 499 HA GLN 73 HA GLN 73 -7.068 5.112 16.571 500 1HB GLN 73 1HB GLN 73 -9.431 3.552 17.628 501 2HB GLN 73 2HB GLN 73 -7.761 3.266 18.101 502 1HG GLN 73 1HG GLN 73 -7.742 5.738 18.783 503 2HG GLN 73 2HG GLN 73 -9.499 5.630 18.685 504 1HE2 GLN 73 1HE2 GLN 73 -10.197 5.608 20.707 505 2HE2 GLN 73 2HE2 GLN 73 -9.630 4.559 21.958 506 H ASN 74 H ASN 74 -5.769 3.829 15.447 507 HA ASN 74 HA ASN 74 -6.514 1.255 14.515 508 1HB ASN 74 1HB ASN 74 -7.328 3.286 12.818 509 2HB ASN 74 2HB ASN 74 -5.797 2.766 12.120 510 1HD2 ASN 74 1HD2 ASN 74 -8.769 2.441 11.459 511 2HD2 ASN 74 2HD2 ASN 74 -8.913 0.760 11.085 512 H ASP 75 H ASP 75 -4.714 0.746 12.578 513 HA ASP 75 HA ASP 75 -2.174 1.920 12.894 514 1HB ASP 75 1HB ASP 75 -2.880 0.191 15.011 515 2HB ASP 75 2HB ASP 75 -1.723 -0.689 14.017 516 H LEU 76 H LEU 76 -1.322 1.576 10.961 517 HA LEU 76 HA LEU 76 -2.217 -0.485 9.223 518 1HB LEU 76 1HB LEU 76 -0.612 1.867 9.056 519 2HB LEU 76 2HB LEU 76 0.266 0.529 8.317 520 HG LEU 76 HG LEU 76 -1.087 1.894 6.728 521 1HD1 LEU 76 1HD1 LEU 76 -1.467 0.097 5.405 522 2HD1 LEU 76 2HD1 LEU 76 -2.316 -0.796 6.667 523 3HD1 LEU 76 3HD1 LEU 76 -0.554 -0.719 6.674 524 1HD2 LEU 76 1HD2 LEU 76 -3.467 0.583 8.025 525 2HD2 LEU 76 2HD2 LEU 76 -3.460 1.769 6.719 526 3HD2 LEU 76 3HD2 LEU 76 -2.977 2.247 8.348 527 H THR 77 H THR 77 -1.257 -2.375 8.595 528 HA THR 77 HA THR 77 1.258 -3.139 9.906 529 HB THR 77 HB THR 77 0.428 -5.304 10.527 530 HG1 THR 77 HG1 THR 77 -1.523 -6.052 9.905 531 1HG2 THR 77 1HG2 THR 77 -1.463 -3.105 11.368 532 2HG2 THR 77 2HG2 THR 77 0.019 -3.604 12.182 533 3HG2 THR 77 3HG2 THR 77 -1.371 -4.687 12.140 534 H PHE 78 H PHE 78 0.421 -2.351 7.141 535 HA PHE 78 HA PHE 78 2.035 -4.131 5.701 536 1HB PHE 78 1HB PHE 78 -0.651 -5.041 6.036 537 2HB PHE 78 2HB PHE 78 -0.420 -4.609 4.345 538 HD1 PHE 78 HD1 PHE 78 2.103 -5.409 3.540 539 HD2 PHE 78 HD2 PHE 78 -0.380 -7.269 6.453 540 HE1 PHE 78 HE1 PHE 78 3.255 -7.548 3.150 541 HE2 PHE 78 HE2 PHE 78 0.767 -9.411 6.069 542 HZ PHE 78 HZ PHE 78 2.588 -9.552 4.416 543 H LEU 79 H LEU 79 2.779 -3.049 3.993 544 HA LEU 79 HA LEU 79 1.054 -1.082 2.674 545 1HB LEU 79 1HB LEU 79 3.261 -0.469 4.372 546 2HB LEU 79 2HB LEU 79 3.679 -0.021 2.719 547 HG LEU 79 HG LEU 79 1.789 1.462 2.587 548 1HD1 LEU 79 1HD1 LEU 79 0.142 0.256 3.830 549 2HD1 LEU 79 2HD1 LEU 79 0.357 1.831 4.592 550 3HD1 LEU 79 3HD1 LEU 79 1.083 0.396 5.315 551 1HD2 LEU 79 1HD2 LEU 79 3.980 2.051 3.872 552 2HD2 LEU 79 2HD2 LEU 79 2.922 2.067 5.283 553 3HD2 LEU 79 3HD2 LEU 79 2.601 3.150 3.928 554 H ARG 80 H ARG 80 0.886 -2.113 0.756 555 HA ARG 80 HA ARG 80 3.397 -2.785 -0.634 556 1HB ARG 80 1HB ARG 80 0.760 -4.180 -0.518 557 2HB ARG 80 2HB ARG 80 1.689 -4.273 -2.008 558 1HG ARG 80 1HG ARG 80 3.138 -5.727 -1.142 559 2HG ARG 80 2HG ARG 80 3.283 -4.821 0.366 560 1HD ARG 80 1HD ARG 80 2.275 -6.684 1.186 561 2HD ARG 80 2HD ARG 80 0.830 -5.787 0.718 562 HE ARG 80 HE ARG 80 1.484 -7.235 -1.501 563 1HH1 ARG 80 1HH1 ARG 80 0.836 -7.997 1.834 564 2HH1 ARG 80 2HH1 ARG 80 0.191 -9.566 1.486 565 1HH2 ARG 80 1HH2 ARG 80 0.636 -9.300 -1.972 566 2HH2 ARG 80 2HH2 ARG 80 0.079 -10.307 -0.679 567 H ILE 81 H ILE 81 3.785 -1.821 -2.533 568 HA ILE 81 HA ILE 81 1.570 -0.426 -3.877 569 HB ILE 81 HB ILE 81 3.350 1.325 -4.511 570 1HG1 ILE 81 1HG1 ILE 81 4.615 0.148 -2.026 571 2HG1 ILE 81 2HG1 ILE 81 5.290 0.093 -3.651 572 1HG2 ILE 81 1HG2 ILE 81 1.476 1.152 -2.454 573 2HG2 ILE 81 2HG2 ILE 81 2.919 1.836 -1.708 574 3HG2 ILE 81 3HG2 ILE 81 2.200 2.617 -3.116 575 1HD1 ILE 81 1HD1 ILE 81 5.315 2.603 -3.605 576 2HD1 ILE 81 2HD1 ILE 81 4.915 2.493 -1.890 577 3HD1 ILE 81 3HD1 ILE 81 6.423 1.803 -2.490 578 H ARG 82 H ARG 82 1.417 -2.026 -5.448 579 HA ARG 82 HA ARG 82 3.587 -3.120 -6.863 580 1HB ARG 82 1HB ARG 82 1.295 -4.088 -6.792 581 2HB ARG 82 2HB ARG 82 0.744 -2.778 -7.828 582 1HG ARG 82 1HG ARG 82 1.972 -3.561 -9.663 583 2HG ARG 82 2HG ARG 82 2.961 -4.619 -8.655 584 1HD ARG 82 1HD ARG 82 1.540 -6.283 -9.024 585 2HD ARG 82 2HD ARG 82 0.258 -5.349 -8.254 586 HE ARG 82 HE ARG 82 -0.622 -4.941 -10.321 587 1HH1 ARG 82 1HH1 ARG 82 2.686 -5.962 -10.690 588 2HH1 ARG 82 2HH1 ARG 82 2.605 -6.043 -12.419 589 1HH2 ARG 82 1HH2 ARG 82 -0.741 -5.044 -12.597 590 2HH2 ARG 82 2HH2 ARG 82 0.656 -5.520 -13.502 591 H SER 83 H SER 83 4.969 -2.068 -8.116 592 HA SER 83 HA SER 83 3.995 0.238 -9.669 593 1HB SER 83 1HB SER 83 6.886 0.038 -9.504 594 2HB SER 83 2HB SER 83 5.829 1.373 -9.045 595 HG SER 83 HG SER 83 7.156 -0.191 -7.437 596 H LYS 84 H LYS 84 4.808 0.528 -11.812 597 HA LYS 84 HA LYS 84 4.716 -1.742 -13.416 598 1HB LYS 84 1HB LYS 84 5.809 1.020 -13.939 599 2HB LYS 84 2HB LYS 84 5.729 -0.217 -15.187 600 1HG LYS 84 1HG LYS 84 3.196 -0.302 -14.313 601 2HG LYS 84 2HG LYS 84 3.579 1.385 -13.961 602 1HD LYS 84 1HD LYS 84 2.862 1.614 -16.114 603 2HD LYS 84 2HD LYS 84 4.569 1.281 -16.421 604 1HE LYS 84 1HE LYS 84 3.976 -1.131 -16.660 605 2HE LYS 84 2HE LYS 84 2.277 -0.676 -16.535 606 1HZ LYS 84 1HZ LYS 84 4.162 -0.242 -18.727 607 2HZ LYS 84 2HZ LYS 84 2.987 0.945 -18.465 608 3HZ LYS 84 3HZ LYS 84 2.521 -0.651 -18.778 609 H LYS 85 H LYS 85 7.372 -0.307 -11.726 610 HA LYS 85 HA LYS 85 9.415 -1.655 -13.251 611 1HB LYS 85 1HB LYS 85 9.342 0.152 -10.885 612 2HB LYS 85 2HB LYS 85 10.749 -0.886 -11.072 613 1HG LYS 85 1HG LYS 85 9.850 0.704 -13.416 614 2HG LYS 85 2HG LYS 85 10.676 1.535 -12.096 615 1HD LYS 85 1HD LYS 85 12.464 0.952 -13.412 616 2HD LYS 85 2HD LYS 85 12.381 -0.451 -12.343 617 1HE LYS 85 1HE LYS 85 11.775 -1.836 -14.008 618 2HE LYS 85 2HE LYS 85 10.710 -0.642 -14.748 619 1HZ LYS 85 1HZ LYS 85 13.615 -0.999 -15.121 620 2HZ LYS 85 2HZ LYS 85 12.872 0.479 -15.475 621 3HZ LYS 85 3HZ LYS 85 12.398 -0.924 -16.293 622 H ASN 86 H ASN 86 8.095 -1.964 -9.957 623 HA ASN 86 HA ASN 86 8.108 -4.764 -9.950 624 1HB ASN 86 1HB ASN 86 10.005 -4.903 -8.133 625 2HB ASN 86 2HB ASN 86 10.410 -4.950 -9.847 626 1HD2 ASN 86 1HD2 ASN 86 10.445 -3.048 -6.941 627 2HD2 ASN 86 2HD2 ASN 86 11.541 -1.838 -7.505 628 H GLU 87 H GLU 87 7.599 -5.672 -7.815 629 HA GLU 87 HA GLU 87 5.985 -3.800 -6.296 630 1HB GLU 87 1HB GLU 87 5.222 -5.859 -5.096 631 2HB GLU 87 2HB GLU 87 4.941 -5.888 -6.831 632 1HG GLU 87 1HG GLU 87 6.705 -7.404 -7.196 633 2HG GLU 87 2HG GLU 87 7.345 -7.167 -5.571 634 H ILE 88 H ILE 88 6.439 -3.025 -4.324 635 HA ILE 88 HA ILE 88 8.801 -4.108 -2.932 636 HB ILE 88 HB ILE 88 7.913 -1.221 -2.948 637 1HG1 ILE 88 1HG1 ILE 88 10.451 -1.369 -4.051 638 2HG1 ILE 88 2HG1 ILE 88 9.622 -2.754 -4.753 639 1HG2 ILE 88 1HG2 ILE 88 10.414 -1.139 -2.037 640 2HG2 ILE 88 2HG2 ILE 88 9.024 -1.345 -0.974 641 3HG2 ILE 88 3HG2 ILE 88 9.972 -2.748 -1.467 642 1HD1 ILE 88 1HD1 ILE 88 9.013 0.152 -5.028 643 2HD1 ILE 88 2HD1 ILE 88 9.197 -1.082 -6.275 644 3HD1 ILE 88 3HD1 ILE 88 7.747 -1.051 -5.273 645 H MET 89 H MET 89 7.822 -5.346 -1.405 646 HA MET 89 HA MET 89 5.506 -4.445 0.039 647 1HB MET 89 1HB MET 89 7.321 -6.835 0.359 648 2HB MET 89 2HB MET 89 5.946 -6.529 1.412 649 1HG MET 89 1HG MET 89 4.429 -7.100 -0.165 650 2HG MET 89 2HG MET 89 5.424 -6.510 -1.494 651 1HE MET 89 1HE MET 89 5.427 -9.091 1.369 652 2HE MET 89 2HE MET 89 6.310 -10.461 0.697 653 3HE MET 89 3HE MET 89 7.167 -8.974 1.103 654 H VAL 90 H VAL 90 5.432 -3.364 1.908 655 HA VAL 90 HA VAL 90 7.762 -3.316 3.664 656 HB VAL 90 HB VAL 90 6.495 -0.797 2.578 657 1HG1 VAL 90 1HG1 VAL 90 8.490 0.196 3.931 658 2HG1 VAL 90 2HG1 VAL 90 6.987 -0.219 4.757 659 3HG1 VAL 90 3HG1 VAL 90 8.372 -1.308 4.845 660 1HG2 VAL 90 1HG2 VAL 90 9.308 -1.845 2.286 661 2HG2 VAL 90 2HG2 VAL 90 8.069 -1.892 1.032 662 3HG2 VAL 90 3HG2 VAL 90 8.675 -0.342 1.616 663 H ALA 91 H ALA 91 7.152 -3.518 5.715 664 HA ALA 91 HA ALA 91 4.656 -2.344 6.640 665 1HB ALA 91 1HB ALA 91 4.949 -5.131 7.520 666 2HB ALA 91 2HB ALA 91 3.506 -4.231 7.050 667 3HB ALA 91 3HB ALA 91 4.554 -4.924 5.813 668 HA PRO 92 HA PRO 92 6.868 -1.698 10.374 669 1HB PRO 92 1HB PRO 92 4.921 -1.961 12.248 670 2HB PRO 92 2HB PRO 92 5.023 -0.575 11.156 671 1HG PRO 92 1HG PRO 92 3.295 -3.013 10.967 672 2HG PRO 92 2HG PRO 92 2.872 -1.316 10.672 673 1HD PRO 92 1HD PRO 92 3.399 -3.057 8.666 674 2HD PRO 92 2HD PRO 92 3.782 -1.327 8.554 675 H ASP 93 H ASP 93 8.316 -3.104 11.131 676 HA ASP 93 HA ASP 93 7.482 -5.813 11.845 677 1HB ASP 93 1HB ASP 93 9.744 -4.803 10.571 678 2HB ASP 93 2HB ASP 93 10.313 -5.242 12.180 679 H LYS 94 H LYS 94 9.335 -6.519 13.714 680 HA LYS 94 HA LYS 94 8.196 -5.799 16.116 681 1HB LYS 94 1HB LYS 94 10.452 -7.333 15.258 682 2HB LYS 94 2HB LYS 94 10.935 -6.347 16.632 683 1HG LYS 94 1HG LYS 94 8.358 -7.698 16.960 684 2HG LYS 94 2HG LYS 94 9.745 -8.779 16.802 685 1HD LYS 94 1HD LYS 94 10.874 -7.611 18.623 686 2HD LYS 94 2HD LYS 94 9.512 -6.497 18.766 687 1HE LYS 94 1HE LYS 94 8.232 -8.865 18.974 688 2HE LYS 94 2HE LYS 94 9.793 -9.288 19.677 689 1HZ LYS 94 1HZ LYS 94 9.538 -7.338 21.158 690 2HZ LYS 94 2HZ LYS 94 8.360 -8.526 21.405 691 3HZ LYS 94 3HZ LYS 94 7.972 -7.115 20.556 692 H ASP 95 H ASP 95 11.214 -4.515 14.725 693 HA ASP 95 HA ASP 95 10.698 -1.951 15.986 694 1HB ASP 95 1HB ASP 95 12.850 -1.830 17.112 695 2HB ASP 95 2HB ASP 95 11.950 -3.225 17.703 696 H TYR 96 H TYR 96 11.143 -3.346 13.283 697 HA TYR 96 HA TYR 96 12.790 -1.208 12.173 698 1HB TYR 96 1HB TYR 96 13.909 -2.955 10.672 699 2HB TYR 96 2HB TYR 96 14.461 -2.861 12.341 700 HD1 TYR 96 HD1 TYR 96 12.837 -4.917 9.829 701 HD2 TYR 96 HD2 TYR 96 13.788 -4.608 13.965 702 HE1 TYR 96 HE1 TYR 96 12.375 -7.317 10.109 703 HE2 TYR 96 HE2 TYR 96 13.330 -7.006 14.256 704 HH TYR 96 HH TYR 96 12.955 -9.138 11.631 705 H PHE 97 H PHE 97 12.793 -1.556 9.628 706 HA PHE 97 HA PHE 97 10.023 -2.193 8.851 707 1HB PHE 97 1HB PHE 97 11.798 0.100 8.066 708 2HB PHE 97 2HB PHE 97 10.495 -0.426 7.005 709 HD1 PHE 97 HD1 PHE 97 8.185 -0.802 8.352 710 HD2 PHE 97 HD2 PHE 97 11.327 1.848 9.459 711 HE1 PHE 97 HE1 PHE 97 6.586 0.548 9.645 712 HE2 PHE 97 HE2 PHE 97 9.733 3.202 10.754 713 HZ PHE 97 HZ PHE 97 7.359 2.552 10.850 714 H LEU 98 H LEU 98 10.060 -4.035 7.739 715 HA LEU 98 HA LEU 98 12.355 -4.877 6.233 716 1HB LEU 98 1HB LEU 98 10.378 -6.207 7.481 717 2HB LEU 98 2HB LEU 98 9.765 -6.236 5.829 718 HG LEU 98 HG LEU 98 12.576 -7.076 6.208 719 1HD1 LEU 98 1HD1 LEU 98 10.342 -8.950 6.935 720 2HD1 LEU 98 2HD1 LEU 98 11.276 -8.064 8.139 721 3HD1 LEU 98 3HD1 LEU 98 12.081 -9.213 7.071 722 1HD2 LEU 98 1HD2 LEU 98 10.583 -7.215 4.226 723 2HD2 LEU 98 2HD2 LEU 98 10.887 -8.870 4.754 724 3HD2 LEU 98 3HD2 LEU 98 12.219 -7.872 4.169 725 H ILE 99 H ILE 99 12.632 -4.932 4.045 726 HA ILE 99 HA ILE 99 10.473 -3.891 2.352 727 HB ILE 99 HB ILE 99 13.333 -2.959 2.112 728 1HG1 ILE 99 1HG1 ILE 99 11.760 -0.760 2.723 729 2HG1 ILE 99 2HG1 ILE 99 11.138 -2.015 3.789 730 1HG2 ILE 99 1HG2 ILE 99 12.432 -2.763 -0.003 731 2HG2 ILE 99 2HG2 ILE 99 10.812 -2.424 0.605 732 3HG2 ILE 99 3HG2 ILE 99 12.064 -1.185 0.692 733 1HD1 ILE 99 1HD1 ILE 99 14.014 -1.158 3.585 734 2HD1 ILE 99 2HD1 ILE 99 12.883 -0.702 4.860 735 3HD1 ILE 99 3HD1 ILE 99 13.369 -2.387 4.674 736 H VAL 100 H VAL 100 10.052 -5.638 1.139 737 HA VAL 100 HA VAL 100 12.310 -7.115 -0.033 738 HB VAL 100 HB VAL 100 9.417 -7.945 0.237 739 1HG1 VAL 100 1HG1 VAL 100 11.786 -9.209 -1.075 740 2HG1 VAL 100 2HG1 VAL 100 10.529 -10.221 -0.361 741 3HG1 VAL 100 3HG1 VAL 100 10.123 -9.082 -1.646 742 1HG2 VAL 100 1HG2 VAL 100 10.945 -9.740 1.636 743 2HG2 VAL 100 2HG2 VAL 100 11.748 -8.207 1.976 744 3HG2 VAL 100 3HG2 VAL 100 10.033 -8.404 2.340 745 H ILE 101 H ILE 101 12.825 -6.472 -2.014 746 HA ILE 101 HA ILE 101 10.684 -5.537 -3.804 747 HB ILE 101 HB ILE 101 13.657 -5.035 -3.993 748 1HG1 ILE 101 1HG1 ILE 101 11.896 -2.733 -3.662 749 2HG1 ILE 101 2HG1 ILE 101 11.807 -3.846 -2.301 750 1HG2 ILE 101 1HG2 ILE 101 12.273 -3.206 -5.571 751 2HG2 ILE 101 2HG2 ILE 101 13.249 -4.565 -6.126 752 3HG2 ILE 101 3HG2 ILE 101 11.511 -4.762 -5.901 753 1HD1 ILE 101 1HD1 ILE 101 14.181 -2.346 -3.338 754 2HD1 ILE 101 2HD1 ILE 101 13.470 -2.320 -1.724 755 3HD1 ILE 101 3HD1 ILE 101 14.351 -3.744 -2.276 756 H GLN 102 H GLN 102 10.220 -6.634 -5.609 757 HA GLN 102 HA GLN 102 12.114 -8.268 -6.983 758 1HB GLN 102 1HB GLN 102 11.189 -10.425 -6.599 759 2HB GLN 102 2HB GLN 102 11.458 -9.704 -5.017 760 1HG GLN 102 1HG GLN 102 9.068 -9.085 -4.937 761 2HG GLN 102 2HG GLN 102 8.832 -9.927 -6.468 762 1HE2 GLN 102 1HE2 GLN 102 8.558 -10.210 -3.215 763 2HE2 GLN 102 2HE2 GLN 102 8.607 -11.930 -3.064 764 H ASN 103 H ASN 103 10.903 -9.621 -8.725 765 HA ASN 103 HA ASN 103 9.548 -7.903 -10.410 766 1HB ASN 103 1HB ASN 103 10.056 -10.800 -10.314 767 2HB ASN 103 2HB ASN 103 8.631 -10.343 -11.241 768 1HD2 ASN 103 1HD2 ASN 103 12.089 -10.058 -10.970 769 2HD2 ASN 103 2HD2 ASN 103 12.368 -9.488 -12.577 770 HA PRO 104 HA PRO 104 5.346 -7.731 -9.163 771 1HB PRO 104 1HB PRO 104 4.023 -7.832 -11.532 772 2HB PRO 104 2HB PRO 104 4.948 -6.420 -11.008 773 1HG PRO 104 1HG PRO 104 5.735 -8.607 -12.895 774 2HG PRO 104 2HG PRO 104 5.993 -6.858 -13.039 775 1HD PRO 104 1HD PRO 104 7.940 -8.555 -12.227 776 2HD PRO 104 2HD PRO 104 7.823 -6.885 -11.637 777 H THR 105 H THR 105 3.536 -8.973 -8.718 778 HA THR 105 HA THR 105 3.676 -11.777 -9.615 779 HB THR 105 HB THR 105 2.375 -12.294 -7.522 780 HG1 THR 105 HG1 THR 105 2.282 -10.703 -5.936 781 1HG2 THR 105 1HG2 THR 105 5.171 -11.249 -7.537 782 2HG2 THR 105 2HG2 THR 105 4.587 -12.897 -7.303 783 3HG2 THR 105 3HG2 THR 105 4.441 -11.716 -6.002 784 H GLU 106 H GLU 106 1.574 -9.018 -9.060 785 HA GLU 106 HA GLU 106 -0.854 -10.366 -9.703 786 1HB GLU 106 1HB GLU 106 -0.150 -7.865 -8.680 787 2HB GLU 106 2HB GLU 106 -0.916 -7.514 -10.224 788 1HG GLU 106 1HG GLU 106 -2.835 -7.616 -9.110 789 2HG GLU 106 2HG GLU 106 -2.612 -9.364 -9.135 790 H MET 11 H MET 11 -20.285 3.479 -15.563 791 HA MET 11 HA MET 11 -20.101 3.172 -12.781 792 1HB MET 11 1HB MET 11 -21.644 4.712 -14.113 793 2HB MET 11 2HB MET 11 -22.695 3.316 -14.308 794 1HG MET 11 1HG MET 11 -23.655 3.939 -12.410 795 2HG MET 11 2HG MET 11 -22.200 3.358 -11.602 796 1HE MET 11 1HE MET 11 -20.089 6.656 -11.333 797 2HE MET 11 2HE MET 11 -20.229 5.016 -10.700 798 3HE MET 11 3HE MET 11 -20.014 5.278 -12.431 799 H ALA 12 H ALA 12 -21.900 1.258 -15.185 800 HA ALA 12 HA ALA 12 -23.087 -0.583 -13.508 801 1HB ALA 12 1HB ALA 12 -23.391 -1.961 -15.385 802 2HB ALA 12 2HB ALA 12 -23.351 -0.318 -16.025 803 3HB ALA 12 3HB ALA 12 -21.933 -1.356 -16.171 804 H GLU 13 H GLU 13 -19.800 -0.582 -14.812 805 HA GLU 13 HA GLU 13 -18.971 -3.113 -14.070 806 1HB GLU 13 1HB GLU 13 -17.673 -1.397 -15.394 807 2HB GLU 13 2HB GLU 13 -17.259 -0.636 -13.865 808 1HG GLU 13 1HG GLU 13 -15.586 -2.044 -13.569 809 2HG GLU 13 2HG GLU 13 -16.674 -3.424 -13.710 810 H VAL 14 H VAL 14 -18.756 -0.119 -12.152 811 HA VAL 14 HA VAL 14 -17.688 -1.321 -9.840 812 HB VAL 14 HB VAL 14 -19.414 1.154 -9.907 813 1HG1 VAL 14 1HG1 VAL 14 -19.008 1.174 -7.722 814 2HG1 VAL 14 2HG1 VAL 14 -17.919 -0.208 -7.856 815 3HG1 VAL 14 3HG1 VAL 14 -17.305 1.428 -8.098 816 1HG2 VAL 14 1HG2 VAL 14 -17.827 1.679 -11.504 817 2HG2 VAL 14 2HG2 VAL 14 -17.062 2.260 -10.025 818 3HG2 VAL 14 3HG2 VAL 14 -16.572 0.717 -10.724 819 H GLU 15 H GLU 15 -20.996 -0.795 -10.923 820 HA GLU 15 HA GLU 15 -22.287 -1.460 -8.507 821 1HB GLU 15 1HB GLU 15 -23.169 -1.509 -11.385 822 2HB GLU 15 2HB GLU 15 -24.240 -2.007 -10.083 823 1HG GLU 15 1HG GLU 15 -24.087 0.182 -9.072 824 2HG GLU 15 2HG GLU 15 -22.925 0.692 -10.296 825 H GLU 16 H GLU 16 -21.227 -3.407 -11.254 826 HA GLU 16 HA GLU 16 -22.440 -5.826 -10.469 827 1HB GLU 16 1HB GLU 16 -21.028 -4.996 -12.653 828 2HB GLU 16 2HB GLU 16 -19.861 -6.053 -11.871 829 1HG GLU 16 1HG GLU 16 -22.646 -7.024 -12.244 830 2HG GLU 16 2HG GLU 16 -21.564 -6.974 -13.634 831 H THR 17 H THR 17 -19.358 -4.341 -9.659 832 HA THR 17 HA THR 17 -18.397 -6.650 -8.228 833 HB THR 17 HB THR 17 -17.342 -3.816 -8.301 834 HG1 THR 17 HG1 THR 17 -16.730 -4.504 -10.213 835 1HG2 THR 17 1HG2 THR 17 -15.233 -5.390 -7.629 836 2HG2 THR 17 2HG2 THR 17 -16.545 -6.203 -6.776 837 3HG2 THR 17 3HG2 THR 17 -16.215 -4.498 -6.469 838 H LEU 18 H LEU 18 -20.116 -3.709 -7.479 839 HA LEU 18 HA LEU 18 -19.690 -3.772 -4.666 840 1HB LEU 18 1HB LEU 18 -21.088 -2.139 -6.568 841 2HB LEU 18 2HB LEU 18 -22.129 -2.477 -5.187 842 HG LEU 18 HG LEU 18 -19.941 -1.724 -3.863 843 1HD1 LEU 18 1HD1 LEU 18 -19.025 0.282 -5.100 844 2HD1 LEU 18 2HD1 LEU 18 -19.741 -0.406 -6.557 845 3HD1 LEU 18 3HD1 LEU 18 -18.499 -1.298 -5.679 846 1HD2 LEU 18 1HD2 LEU 18 -20.931 0.531 -3.753 847 2HD2 LEU 18 2HD2 LEU 18 -22.135 -0.746 -3.584 848 3HD2 LEU 18 3HD2 LEU 18 -21.975 0.119 -5.113 849 H LYS 19 H LYS 19 -22.229 -4.988 -6.801 850 HA LYS 19 HA LYS 19 -24.058 -5.799 -4.846 851 1HB LYS 19 1HB LYS 19 -24.744 -5.734 -7.137 852 2HB LYS 19 2HB LYS 19 -23.486 -6.868 -7.610 853 1HG LYS 19 1HG LYS 19 -24.823 -8.592 -7.238 854 2HG LYS 19 2HG LYS 19 -25.159 -8.040 -5.596 855 1HD LYS 19 1HD LYS 19 -27.148 -7.175 -6.173 856 2HD LYS 19 2HD LYS 19 -26.516 -6.485 -7.670 857 1HE LYS 19 1HE LYS 19 -27.784 -8.049 -8.664 858 2HE LYS 19 2HE LYS 19 -26.462 -9.138 -8.246 859 1HZ LYS 19 1HZ LYS 19 -28.535 -8.704 -6.235 860 2HZ LYS 19 2HZ LYS 19 -27.652 -10.101 -6.592 861 3HZ LYS 19 3HZ LYS 19 -28.947 -9.643 -7.580 862 H ARG 20 H ARG 20 -21.422 -7.611 -6.399 863 HA ARG 20 HA ARG 20 -21.863 -10.007 -4.955 864 1HB ARG 20 1HB ARG 20 -20.550 -9.699 -7.126 865 2HB ARG 20 2HB ARG 20 -19.222 -9.141 -6.118 866 1HG ARG 20 1HG ARG 20 -18.598 -11.275 -6.045 867 2HG ARG 20 2HG ARG 20 -19.934 -11.497 -4.914 868 1HD ARG 20 1HD ARG 20 -21.411 -12.056 -6.799 869 2HD ARG 20 2HD ARG 20 -20.050 -11.872 -7.905 870 HE ARG 20 HE ARG 20 -19.317 -13.724 -5.957 871 1HH1 ARG 20 1HH1 ARG 20 -21.624 -13.416 -8.545 872 2HH1 ARG 20 2HH1 ARG 20 -21.692 -15.117 -8.863 873 1HH2 ARG 20 1HH2 ARG 20 -19.398 -15.967 -6.365 874 2HH2 ARG 20 2HH2 ARG 20 -20.426 -16.568 -7.621 875 H LEU 21 H LEU 21 -19.937 -7.138 -4.352 876 HA LEU 21 HA LEU 21 -18.403 -8.179 -2.213 877 1HB LEU 21 1HB LEU 21 -18.911 -5.573 -3.430 878 2HB LEU 21 2HB LEU 21 -18.611 -5.492 -1.695 879 HG LEU 21 HG LEU 21 -16.446 -6.505 -1.970 880 1HD1 LEU 21 1HD1 LEU 21 -16.028 -6.552 -4.737 881 2HD1 LEU 21 2HD1 LEU 21 -17.556 -7.389 -4.465 882 3HD1 LEU 21 3HD1 LEU 21 -16.096 -7.927 -3.634 883 1HD2 LEU 21 1HD2 LEU 21 -15.473 -4.813 -3.683 884 2HD2 LEU 21 2HD2 LEU 21 -16.226 -4.217 -2.204 885 3HD2 LEU 21 3HD2 LEU 21 -17.119 -4.181 -3.725 886 H GLN 22 H GLN 22 -21.314 -6.121 -2.229 887 HA GLN 22 HA GLN 22 -21.661 -6.136 0.572 888 1HB GLN 22 1HB GLN 22 -22.888 -4.904 -1.621 889 2HB GLN 22 2HB GLN 22 -24.158 -5.857 -0.865 890 1HG GLN 22 1HG GLN 22 -24.300 -4.490 0.889 891 2HG GLN 22 2HG GLN 22 -22.549 -4.351 1.041 892 1HE2 GLN 22 1HE2 GLN 22 -21.462 -2.756 -0.148 893 2HE2 GLN 22 2HE2 GLN 22 -22.292 -1.384 -0.789 894 H SER 23 H SER 23 -22.463 -8.409 -1.900 895 HA SER 23 HA SER 23 -24.468 -9.806 -0.390 896 1HB SER 23 1HB SER 23 -24.447 -9.840 -2.860 897 2HB SER 23 2HB SER 23 -22.909 -10.702 -2.827 898 HG SER 23 HG SER 23 -23.921 -12.491 -2.350 899 H GLN 24 H GLN 24 -21.032 -9.846 -0.580 900 HA GLN 24 HA GLN 24 -20.889 -12.429 0.800 901 1HB GLN 24 1HB GLN 24 -18.526 -12.418 0.285 902 2HB GLN 24 2HB GLN 24 -19.441 -12.088 -1.180 903 1HG GLN 24 1HG GLN 24 -18.861 -9.806 -1.151 904 2HG GLN 24 2HG GLN 24 -18.254 -9.905 0.501 905 1HE2 GLN 24 1HE2 GLN 24 -16.539 -8.771 -1.003 906 2HE2 GLN 24 2HE2 GLN 24 -15.271 -9.816 -1.533 907 H LYS 25 H LYS 25 -19.643 -12.656 2.725 908 HA LYS 25 HA LYS 25 -19.996 -10.469 4.546 909 1HB LYS 25 1HB LYS 25 -19.807 -13.233 4.777 910 2HB LYS 25 2HB LYS 25 -18.330 -12.645 5.529 911 1HG LYS 25 1HG LYS 25 -20.770 -11.218 6.319 912 2HG LYS 25 2HG LYS 25 -20.699 -12.915 6.801 913 1HD LYS 25 1HD LYS 25 -18.668 -12.577 7.992 914 2HD LYS 25 2HD LYS 25 -18.461 -10.964 7.307 915 1HE LYS 25 1HE LYS 25 -20.444 -10.194 8.502 916 2HE LYS 25 2HE LYS 25 -20.682 -11.811 9.165 917 1HZ LYS 25 1HZ LYS 25 -18.154 -11.289 9.886 918 2HZ LYS 25 2HZ LYS 25 -19.500 -11.010 10.871 919 3HZ LYS 25 3HZ LYS 25 -18.833 -9.742 9.971 920 H GLY 26 H GLY 26 -18.326 -9.491 5.827 921 1HA GLY 26 1HA GLY 26 -15.988 -9.103 6.275 922 2HA GLY 26 2HA GLY 26 -15.634 -9.626 4.635 923 H VAL 27 H VAL 27 -17.326 -8.168 3.109 924 HA VAL 27 HA VAL 27 -16.053 -5.738 2.799 925 HB VAL 27 HB VAL 27 -18.888 -6.414 2.003 926 1HG1 VAL 27 1HG1 VAL 27 -17.033 -4.209 1.128 927 2HG1 VAL 27 2HG1 VAL 27 -18.481 -4.679 0.236 928 3HG1 VAL 27 3HG1 VAL 27 -18.620 -4.051 1.879 929 1HG2 VAL 27 1HG2 VAL 27 -17.841 -6.899 -0.206 930 2HG2 VAL 27 2HG2 VAL 27 -16.260 -6.740 0.560 931 3HG2 VAL 27 3HG2 VAL 27 -17.364 -8.016 1.074 932 H GLN 28 H GLN 28 -16.114 -3.852 3.829 933 HA GLN 28 HA GLN 28 -18.194 -3.438 5.854 934 1HB GLN 28 1HB GLN 28 -15.368 -2.566 5.560 935 2HB GLN 28 2HB GLN 28 -16.465 -1.470 6.387 936 1HG GLN 28 1HG GLN 28 -16.513 -2.725 8.224 937 2HG GLN 28 2HG GLN 28 -16.698 -4.219 7.307 938 1HE2 GLN 28 1HE2 GLN 28 -14.738 -5.098 6.315 939 2HE2 GLN 28 2HE2 GLN 28 -13.234 -4.907 7.143 940 H GLY 29 H GLY 29 -16.925 -2.169 2.885 941 1HA GLY 29 1HA GLY 29 -19.148 -0.708 2.180 942 2HA GLY 29 2HA GLY 29 -18.134 0.415 3.074 943 H ILE 30 H ILE 30 -18.941 0.374 0.229 944 HA ILE 30 HA ILE 30 -16.248 0.294 -0.969 945 HB ILE 30 HB ILE 30 -18.832 -0.039 -2.487 946 1HG1 ILE 30 1HG1 ILE 30 -17.559 -2.470 -2.593 947 2HG1 ILE 30 2HG1 ILE 30 -17.261 -1.972 -0.931 948 1HG2 ILE 30 1HG2 ILE 30 -17.194 -1.030 -4.170 949 2HG2 ILE 30 2HG2 ILE 30 -17.159 0.718 -3.946 950 3HG2 ILE 30 3HG2 ILE 30 -15.925 -0.293 -3.193 951 1HD1 ILE 30 1HD1 ILE 30 -19.464 -3.290 -1.778 952 2HD1 ILE 30 2HD1 ILE 30 -19.392 -2.284 -0.331 953 3HD1 ILE 30 3HD1 ILE 30 -20.023 -1.618 -1.837 954 H ILE 31 H ILE 31 -15.478 2.164 -1.696 955 HA ILE 31 HA ILE 31 -17.375 4.381 -2.120 956 HB ILE 31 HB ILE 31 -14.503 4.545 -1.199 957 1HG1 ILE 31 1HG1 ILE 31 -16.842 5.512 0.391 958 2HG1 ILE 31 2HG1 ILE 31 -16.488 3.788 0.374 959 1HG2 ILE 31 1HG2 ILE 31 -15.071 6.968 -0.864 960 2HG2 ILE 31 2HG2 ILE 31 -14.961 6.448 -2.545 961 3HG2 ILE 31 3HG2 ILE 31 -16.540 6.678 -1.795 962 1HD1 ILE 31 1HD1 ILE 31 -15.335 4.494 2.225 963 2HD1 ILE 31 2HD1 ILE 31 -14.082 4.562 0.985 964 3HD1 ILE 31 3HD1 ILE 31 -14.897 6.039 1.498 965 H VAL 32 H VAL 32 -17.088 5.725 -3.889 966 HA VAL 32 HA VAL 32 -14.972 5.021 -5.795 967 HB VAL 32 HB VAL 32 -17.797 5.481 -6.725 968 1HG1 VAL 32 1HG1 VAL 32 -15.457 4.131 -8.064 969 2HG1 VAL 32 2HG1 VAL 32 -17.017 4.524 -8.790 970 3HG1 VAL 32 3HG1 VAL 32 -15.916 5.815 -8.310 971 1HG2 VAL 32 1HG2 VAL 32 -16.464 2.836 -6.153 972 2HG2 VAL 32 2HG2 VAL 32 -17.847 3.517 -5.297 973 3HG2 VAL 32 3HG2 VAL 32 -18.003 3.043 -6.988 974 H VAL 33 H VAL 33 -13.857 6.825 -6.114 975 HA VAL 33 HA VAL 33 -15.327 9.375 -6.298 976 HB VAL 33 HB VAL 33 -12.418 9.150 -5.559 977 1HG1 VAL 33 1HG1 VAL 33 -14.501 11.310 -5.322 978 2HG1 VAL 33 2HG1 VAL 33 -12.930 11.385 -4.522 979 3HG1 VAL 33 3HG1 VAL 33 -13.023 11.330 -6.283 980 1HG2 VAL 33 1HG2 VAL 33 -14.784 9.218 -3.689 981 2HG2 VAL 33 2HG2 VAL 33 -13.662 7.874 -3.907 982 3HG2 VAL 33 3HG2 VAL 33 -13.096 9.391 -3.208 983 H ASN 34 H ASN 34 -14.456 10.971 -7.765 984 HA ASN 34 HA ASN 34 -13.463 9.735 -10.202 985 1HB ASN 34 1HB ASN 34 -14.090 12.658 -9.933 986 2HB ASN 34 2HB ASN 34 -14.251 11.613 -11.341 987 1HD2 ASN 34 1HD2 ASN 34 -16.171 13.412 -10.024 988 2HD2 ASN 34 2HD2 ASN 34 -17.544 12.431 -9.652 989 H THR 35 H THR 35 -12.054 11.606 -11.469 990 HA THR 35 HA THR 35 -9.527 11.537 -10.102 991 HB THR 35 HB THR 35 -8.733 12.798 -12.175 992 HG1 THR 35 HG1 THR 35 -10.246 12.724 -13.931 993 1HG2 THR 35 1HG2 THR 35 -9.853 10.479 -13.423 994 2HG2 THR 35 2HG2 THR 35 -9.393 10.083 -11.767 995 3HG2 THR 35 3HG2 THR 35 -8.199 10.754 -12.877 996 H GLU 36 H GLU 36 -12.029 13.884 -10.646 997 HA GLU 36 HA GLU 36 -10.451 16.196 -10.093 998 1HB GLU 36 1HB GLU 36 -13.360 15.613 -10.389 999 2HB GLU 36 2HB GLU 36 -12.894 17.103 -9.581 1000 1HG GLU 36 1HG GLU 36 -11.309 17.076 -11.834 1001 2HG GLU 36 2HG GLU 36 -12.844 16.416 -12.397 1002 H GLY 37 H GLY 37 -12.357 13.969 -8.163 1003 1HA GLY 37 1HA GLY 37 -11.499 13.716 -5.839 1004 2HA GLY 37 2HA GLY 37 -11.536 15.471 -5.752 1005 H ILE 38 H ILE 38 -14.125 14.140 -7.499 1006 HA ILE 38 HA ILE 38 -15.902 14.586 -5.196 1007 HB ILE 38 HB ILE 38 -16.709 14.586 -8.101 1008 1HG1 ILE 38 1HG1 ILE 38 -15.992 16.939 -6.339 1009 2HG1 ILE 38 2HG1 ILE 38 -15.057 16.360 -7.713 1010 1HG2 ILE 38 1HG2 ILE 38 -18.447 14.186 -6.346 1011 2HG2 ILE 38 2HG2 ILE 38 -18.087 15.790 -5.710 1012 3HG2 ILE 38 3HG2 ILE 38 -18.725 15.613 -7.344 1013 1HD1 ILE 38 1HD1 ILE 38 -17.413 16.766 -8.916 1014 2HD1 ILE 38 2HD1 ILE 38 -17.515 17.975 -7.636 1015 3HD1 ILE 38 3HD1 ILE 38 -16.166 18.004 -8.771 1016 HA PRO 39 HA PRO 39 -16.769 10.243 -5.233 1017 1HB PRO 39 1HB PRO 39 -18.898 10.315 -3.550 1018 2HB PRO 39 2HB PRO 39 -17.228 10.483 -2.994 1019 1HG PRO 39 1HG PRO 39 -19.276 12.605 -3.508 1020 2HG PRO 39 2HG PRO 39 -18.134 12.456 -2.161 1021 1HD PRO 39 1HD PRO 39 -17.703 14.113 -4.258 1022 2HD PRO 39 2HD PRO 39 -16.380 13.311 -3.388 1023 H ILE 40 H ILE 40 -18.210 8.828 -6.186 1024 HA ILE 40 HA ILE 40 -20.504 10.056 -7.572 1025 HB ILE 40 HB ILE 40 -20.107 8.025 -9.189 1026 1HG1 ILE 40 1HG1 ILE 40 -17.302 8.536 -8.180 1027 2HG1 ILE 40 2HG1 ILE 40 -18.253 7.112 -7.774 1028 1HG2 ILE 40 1HG2 ILE 40 -20.035 10.083 -10.196 1029 2HG2 ILE 40 2HG2 ILE 40 -18.791 10.694 -9.107 1030 3HG2 ILE 40 3HG2 ILE 40 -18.360 9.571 -10.396 1031 1HD1 ILE 40 1HD1 ILE 40 -16.509 7.318 -9.858 1032 2HD1 ILE 40 2HD1 ILE 40 -17.803 6.127 -9.720 1033 3HD1 ILE 40 3HD1 ILE 40 -18.063 7.610 -10.639 1034 H LYS 41 H LYS 41 -19.269 7.303 -5.804 1035 HA LYS 41 HA LYS 41 -21.955 6.531 -5.079 1036 1HB LYS 41 1HB LYS 41 -20.219 4.817 -6.830 1037 2HB LYS 41 2HB LYS 41 -21.379 4.082 -5.731 1038 1HG LYS 41 1HG LYS 41 -22.979 5.865 -6.926 1039 2HG LYS 41 2HG LYS 41 -21.820 5.590 -8.228 1040 1HD LYS 41 1HD LYS 41 -23.128 3.835 -8.732 1041 2HD LYS 41 2HD LYS 41 -22.307 3.046 -7.384 1042 1HE LYS 41 1HE LYS 41 -24.608 2.714 -7.007 1043 2HE LYS 41 2HE LYS 41 -24.129 4.002 -5.903 1044 1HZ LYS 41 1HZ LYS 41 -25.245 5.580 -7.115 1045 2HZ LYS 41 2HZ LYS 41 -26.265 4.246 -7.322 1046 3HZ LYS 41 3HZ LYS 41 -25.195 4.692 -8.555 1047 H SER 42 H SER 42 -21.959 5.944 -3.011 1048 HA SER 42 HA SER 42 -19.869 4.358 -1.852 1049 1HB SER 42 1HB SER 42 -18.751 6.517 -1.749 1050 2HB SER 42 2HB SER 42 -20.166 7.246 -0.990 1051 HG SER 42 HG SER 42 -19.819 5.938 0.813 1052 H THR 43 H THR 43 -20.965 2.987 -0.632 1053 HA THR 43 HA THR 43 -23.597 3.574 0.338 1054 HB THR 43 HB THR 43 -23.674 1.337 1.137 1055 HG1 THR 43 HG1 THR 43 -20.883 1.049 0.699 1056 1HG2 THR 43 1HG2 THR 43 -21.870 0.777 -1.131 1057 2HG2 THR 43 2HG2 THR 43 -23.195 1.894 -1.460 1058 3HG2 THR 43 3HG2 THR 43 -23.536 0.273 -0.856 1059 H MET 44 H MET 44 -20.485 4.135 1.523 1060 HA MET 44 HA MET 44 -20.792 3.736 4.278 1061 1HB MET 44 1HB MET 44 -19.152 5.873 2.906 1062 2HB MET 44 2HB MET 44 -18.926 5.280 4.546 1063 1HG MET 44 1HG MET 44 -18.854 3.202 2.486 1064 2HG MET 44 2HG MET 44 -17.571 4.403 2.366 1065 1HE MET 44 1HE MET 44 -19.054 3.640 5.968 1066 2HE MET 44 2HE MET 44 -19.544 2.294 4.939 1067 3HE MET 44 3HE MET 44 -18.375 2.034 6.235 1068 H ASP 45 H ASP 45 -20.367 6.036 5.618 1069 HA ASP 45 HA ASP 45 -22.991 7.193 5.681 1070 1HB ASP 45 1HB ASP 45 -20.873 6.893 7.498 1071 2HB ASP 45 2HB ASP 45 -21.057 8.631 7.276 1072 H ASN 46 H ASN 46 -23.318 9.574 5.746 1073 HA ASN 46 HA ASN 46 -22.515 10.764 3.342 1074 1HB ASN 46 1HB ASN 46 -24.314 11.360 5.427 1075 2HB ASN 46 2HB ASN 46 -23.254 12.760 5.287 1076 1HD2 ASN 46 1HD2 ASN 46 -22.724 12.739 2.588 1077 2HD2 ASN 46 2HD2 ASN 46 -24.180 13.071 1.718 1078 HA PRO 47 HA PRO 47 -19.508 13.506 5.952 1079 1HB PRO 47 1HB PRO 47 -19.051 12.749 8.519 1080 2HB PRO 47 2HB PRO 47 -20.350 13.857 8.061 1081 1HG PRO 47 1HG PRO 47 -20.480 10.923 8.640 1082 2HG PRO 47 2HG PRO 47 -21.584 12.214 9.149 1083 1HD PRO 47 1HD PRO 47 -22.131 10.563 7.074 1084 2HD PRO 47 2HD PRO 47 -22.676 12.252 7.120 1085 H THR 48 H THR 48 -19.603 10.044 6.417 1086 HA THR 48 HA THR 48 -16.771 9.747 6.797 1087 HB THR 48 HB THR 48 -18.802 7.634 6.050 1088 HG1 THR 48 HG1 THR 48 -18.574 7.224 8.416 1089 1HG2 THR 48 1HG2 THR 48 -16.412 7.048 5.663 1090 2HG2 THR 48 2HG2 THR 48 -17.194 6.047 6.887 1091 3HG2 THR 48 3HG2 THR 48 -16.105 7.345 7.373 1092 H THR 49 H THR 49 -19.016 9.512 4.096 1093 HA THR 49 HA THR 49 -17.197 8.391 2.237 1094 HB THR 49 HB THR 49 -19.682 10.048 1.764 1095 HG1 THR 49 HG1 THR 49 -19.748 7.859 2.826 1096 1HG2 THR 49 1HG2 THR 49 -18.081 8.362 -0.166 1097 2HG2 THR 49 2HG2 THR 49 -18.226 10.120 -0.192 1098 3HG2 THR 49 3HG2 THR 49 -19.639 9.113 -0.511 1099 H THR 50 H THR 50 -18.289 11.743 2.749 1100 HA THR 50 HA THR 50 -16.766 12.972 0.780 1101 HB THR 50 HB THR 50 -16.939 14.543 3.247 1102 HG1 THR 50 HG1 THR 50 -19.234 14.564 3.247 1103 1HG2 THR 50 1HG2 THR 50 -16.623 15.725 1.239 1104 2HG2 THR 50 2HG2 THR 50 -18.322 15.977 1.638 1105 3HG2 THR 50 3HG2 THR 50 -17.871 14.804 0.401 1106 H GLN 51 H GLN 51 -15.932 12.466 4.207 1107 HA GLN 51 HA GLN 51 -13.386 13.611 4.121 1108 1HB GLN 51 1HB GLN 51 -14.404 13.148 6.239 1109 2HB GLN 51 2HB GLN 51 -14.520 11.432 5.873 1110 1HG GLN 51 1HG GLN 51 -11.795 12.452 5.748 1111 2HG GLN 51 2HG GLN 51 -12.543 12.635 7.334 1112 1HE2 GLN 51 1HE2 GLN 51 -11.057 10.515 5.156 1113 2HE2 GLN 51 2HE2 GLN 51 -11.274 9.053 6.051 1114 H TYR 52 H TYR 52 -14.313 10.184 3.823 1115 HA TYR 52 HA TYR 52 -11.781 9.124 3.415 1116 1HB TYR 52 1HB TYR 52 -14.540 8.273 2.642 1117 2HB TYR 52 2HB TYR 52 -13.168 7.401 1.968 1118 HD1 TYR 52 HD1 TYR 52 -13.673 8.861 5.364 1119 HD2 TYR 52 HD2 TYR 52 -13.111 5.342 3.040 1120 HE1 TYR 52 HE1 TYR 52 -13.514 7.531 7.427 1121 HE2 TYR 52 HE2 TYR 52 -12.951 4.002 5.096 1122 HH TYR 52 HH TYR 52 -14.003 4.606 7.772 1123 H ALA 53 H ALA 53 -14.143 10.145 0.949 1124 HA ALA 53 HA ALA 53 -12.557 9.654 -1.294 1125 1HB ALA 53 1HB ALA 53 -14.732 11.701 -0.883 1126 2HB ALA 53 2HB ALA 53 -14.033 11.283 -2.448 1127 3HB ALA 53 3HB ALA 53 -14.913 10.067 -1.522 1128 H SER 54 H SER 54 -12.328 12.116 1.084 1129 HA SER 54 HA SER 54 -10.962 14.049 -0.530 1130 1HB SER 54 1HB SER 54 -12.076 13.975 2.066 1131 2HB SER 54 2HB SER 54 -10.363 14.341 2.268 1132 HG SER 54 HG SER 54 -11.494 16.253 1.949 1133 H LEU 55 H LEU 55 -9.882 11.903 2.108 1134 HA LEU 55 HA LEU 55 -7.113 12.390 1.555 1135 1HB LEU 55 1HB LEU 55 -6.673 11.207 3.444 1136 2HB LEU 55 2HB LEU 55 -8.349 11.649 3.762 1137 HG LEU 55 HG LEU 55 -8.782 9.295 2.600 1138 1HD1 LEU 55 1HD1 LEU 55 -6.017 9.310 2.717 1139 2HD1 LEU 55 2HD1 LEU 55 -7.052 7.906 2.465 1140 3HD1 LEU 55 3HD1 LEU 55 -6.502 8.315 4.090 1141 1HD2 LEU 55 1HD2 LEU 55 -9.118 10.277 5.052 1142 2HD2 LEU 55 2HD2 LEU 55 -7.857 9.096 5.408 1143 3HD2 LEU 55 3HD2 LEU 55 -9.372 8.574 4.671 1144 H MET 56 H MET 56 -9.457 10.417 0.160 1145 HA MET 56 HA MET 56 -8.037 8.093 -0.475 1146 1HB MET 56 1HB MET 56 -10.536 9.244 -1.147 1147 2HB MET 56 2HB MET 56 -9.741 8.827 -2.659 1148 1HG MET 56 1HG MET 56 -11.139 7.009 -1.887 1149 2HG MET 56 2HG MET 56 -9.440 6.540 -1.882 1150 1HE MET 56 1HE MET 56 -8.978 4.783 0.751 1151 2HE MET 56 2HE MET 56 -8.167 5.921 -0.325 1152 3HE MET 56 3HE MET 56 -8.247 6.249 1.406 1153 H HIS 57 H HIS 57 -8.725 10.743 -2.760 1154 HA HIS 57 HA HIS 57 -6.712 9.975 -4.580 1155 1HB HIS 57 1HB HIS 57 -7.200 12.009 -5.750 1156 2HB HIS 57 2HB HIS 57 -8.721 11.390 -5.113 1157 HD1 HIS 57 HD1 HIS 57 -6.135 14.055 -4.385 1158 HD2 HIS 57 HD2 HIS 57 -10.087 13.126 -3.502 1159 HE1 HIS 57 HE1 HIS 57 -7.046 16.068 -3.185 1160 H SER 58 H SER 58 -6.717 12.092 -1.803 1161 HA SER 58 HA SER 58 -4.254 13.398 -2.368 1162 1HB SER 58 1HB SER 58 -5.885 14.368 -0.820 1163 2HB SER 58 2HB SER 58 -5.686 12.997 0.271 1164 HG SER 58 HG SER 58 -4.207 15.230 0.079 1165 H PHE 59 H PHE 59 -5.085 10.321 -1.067 1166 HA PHE 59 HA PHE 59 -2.584 9.879 0.284 1167 1HB PHE 59 1HB PHE 59 -4.442 8.694 1.166 1168 2HB PHE 59 2HB PHE 59 -4.906 8.090 -0.421 1169 HD1 PHE 59 HD1 PHE 59 -1.599 8.110 1.285 1170 HD2 PHE 59 HD2 PHE 59 -4.793 5.788 -0.302 1171 HE1 PHE 59 HE1 PHE 59 -0.305 6.058 1.694 1172 HE2 PHE 59 HE2 PHE 59 -3.505 3.732 0.104 1173 HZ PHE 59 HZ PHE 59 -1.258 3.865 1.104 1174 H ILE 60 H ILE 60 -4.101 8.434 -2.604 1175 HA ILE 60 HA ILE 60 -1.895 6.965 -3.459 1176 HB ILE 60 HB ILE 60 -4.299 6.891 -4.342 1177 1HG1 ILE 60 1HG1 ILE 60 -2.947 6.711 -6.819 1178 2HG1 ILE 60 2HG1 ILE 60 -1.774 6.287 -5.578 1179 1HG2 ILE 60 1HG2 ILE 60 -5.016 8.344 -5.964 1180 2HG2 ILE 60 2HG2 ILE 60 -4.043 9.425 -4.968 1181 3HG2 ILE 60 3HG2 ILE 60 -3.379 8.768 -6.464 1182 1HD1 ILE 60 1HD1 ILE 60 -2.681 4.245 -6.005 1183 2HD1 ILE 60 2HD1 ILE 60 -3.745 4.784 -4.706 1184 3HD1 ILE 60 3HD1 ILE 60 -4.271 4.905 -6.384 1185 H LEU 61 H LEU 61 -2.611 10.355 -3.773 1186 HA LEU 61 HA LEU 61 -0.630 10.849 -5.801 1187 1HB LEU 61 1HB LEU 61 -2.605 12.411 -4.291 1188 2HB LEU 61 2HB LEU 61 -1.132 13.285 -4.704 1189 HG LEU 61 HG LEU 61 -1.513 12.923 -7.052 1190 1HD1 LEU 61 1HD1 LEU 61 -3.965 11.365 -6.249 1191 2HD1 LEU 61 2HD1 LEU 61 -2.474 10.670 -6.885 1192 3HD1 LEU 61 3HD1 LEU 61 -3.450 11.737 -7.894 1193 1HD2 LEU 61 1HD2 LEU 61 -2.607 14.857 -6.533 1194 2HD2 LEU 61 2HD2 LEU 61 -3.692 14.070 -5.387 1195 3HD2 LEU 61 3HD2 LEU 61 -3.967 13.902 -7.122 1196 H LYS 62 H LYS 62 -0.890 11.377 -2.304 1197 HA LYS 62 HA LYS 62 1.573 12.658 -1.933 1198 1HB LYS 62 1HB LYS 62 -0.295 12.474 -0.255 1199 2HB LYS 62 2HB LYS 62 0.214 10.816 0.039 1200 1HG LYS 62 1HG LYS 62 1.180 12.094 1.753 1201 2HG LYS 62 2HG LYS 62 2.490 11.760 0.618 1202 1HD LYS 62 1HD LYS 62 2.843 13.988 0.876 1203 2HD LYS 62 2HD LYS 62 1.632 14.074 -0.405 1204 1HE LYS 62 1HE LYS 62 0.458 15.387 0.960 1205 2HE LYS 62 2HE LYS 62 0.135 13.944 1.919 1206 1HZ LYS 62 1HZ LYS 62 0.996 15.493 3.416 1207 2HZ LYS 62 2HZ LYS 62 2.209 16.006 2.354 1208 3HZ LYS 62 3HZ LYS 62 2.309 14.481 3.079 1209 H ALA 63 H ALA 63 0.726 9.213 -1.691 1210 HA ALA 63 HA ALA 63 3.368 8.353 -1.097 1211 1HB ALA 63 1HB ALA 63 1.694 6.876 -0.428 1212 2HB ALA 63 2HB ALA 63 0.878 6.943 -1.990 1213 3HB ALA 63 3HB ALA 63 2.411 6.086 -1.832 1214 H ARG 64 H ARG 64 1.693 9.107 -4.030 1215 HA ARG 64 HA ARG 64 3.317 7.612 -5.816 1216 1HB ARG 64 1HB ARG 64 1.192 8.337 -6.605 1217 2HB ARG 64 2HB ARG 64 1.531 10.012 -6.189 1218 1HG ARG 64 1HG ARG 64 2.466 10.402 -8.163 1219 2HG ARG 64 2HG ARG 64 3.481 8.963 -8.048 1220 1HD ARG 64 1HD ARG 64 2.235 8.279 -9.800 1221 2HD ARG 64 2HD ARG 64 1.098 7.816 -8.534 1222 HE ARG 64 HE ARG 64 0.688 10.503 -9.374 1223 1HH1 ARG 64 1HH1 ARG 64 0.110 7.188 -10.267 1224 2HH1 ARG 64 2HH1 ARG 64 -1.301 7.551 -11.205 1225 1HH2 ARG 64 1HH2 ARG 64 -1.168 10.993 -10.605 1226 2HH2 ARG 64 2HH2 ARG 64 -2.027 9.715 -11.397 1227 H SER 65 H SER 65 3.369 11.014 -4.784 1228 HA SER 65 HA SER 65 5.483 11.901 -6.346 1229 1HB SER 65 1HB SER 65 3.916 13.190 -4.700 1230 2HB SER 65 2HB SER 65 5.176 12.853 -3.514 1231 HG SER 65 HG SER 65 6.650 13.814 -5.103 1232 H THR 66 H THR 66 5.497 9.900 -3.511 1233 HA THR 66 HA THR 66 8.327 10.216 -3.017 1234 HB THR 66 HB THR 66 6.596 8.042 -1.857 1235 HG1 THR 66 HG1 THR 66 6.915 10.583 -0.650 1236 1HG2 THR 66 1HG2 THR 66 8.871 9.582 -0.617 1237 2HG2 THR 66 2HG2 THR 66 9.098 8.080 -1.512 1238 3HG2 THR 66 3HG2 THR 66 8.129 8.091 -0.039 1239 H VAL 67 H VAL 67 6.188 7.814 -4.474 1240 HA VAL 67 HA VAL 67 7.939 5.699 -4.800 1241 HB VAL 67 HB VAL 67 5.804 6.615 -6.732 1242 1HG1 VAL 67 1HG1 VAL 67 6.813 5.068 -8.035 1243 2HG1 VAL 67 2HG1 VAL 67 7.588 4.262 -6.669 1244 3HG1 VAL 67 3HG1 VAL 67 5.890 3.950 -7.032 1245 1HG2 VAL 67 1HG2 VAL 67 4.388 6.045 -5.112 1246 2HG2 VAL 67 2HG2 VAL 67 4.935 4.381 -5.312 1247 3HG2 VAL 67 3HG2 VAL 67 5.694 5.420 -4.106 1248 H ARG 68 H ARG 68 7.647 8.657 -6.676 1249 HA ARG 68 HA ARG 68 9.173 7.974 -8.899 1250 1HB ARG 68 1HB ARG 68 8.756 10.597 -7.478 1251 2HB ARG 68 2HB ARG 68 9.726 10.475 -8.940 1252 1HG ARG 68 1HG ARG 68 7.914 10.524 -10.208 1253 2HG ARG 68 2HG ARG 68 7.208 9.165 -9.332 1254 1HD ARG 68 1HD ARG 68 6.282 10.644 -7.679 1255 2HD ARG 68 2HD ARG 68 7.120 12.025 -8.386 1256 HE ARG 68 HE ARG 68 4.675 10.814 -9.309 1257 1HH1 ARG 68 1HH1 ARG 68 7.415 12.786 -10.162 1258 2HH1 ARG 68 2HH1 ARG 68 6.609 13.565 -11.483 1259 1HH2 ARG 68 1HH2 ARG 68 3.603 11.832 -11.046 1260 2HH2 ARG 68 2HH2 ARG 68 4.440 13.022 -11.985 1261 H ASP 69 H ASP 69 10.135 8.603 -5.640 1262 HA ASP 69 HA ASP 69 12.893 9.139 -6.237 1263 1HB ASP 69 1HB ASP 69 11.218 9.332 -3.967 1264 2HB ASP 69 2HB ASP 69 12.513 8.216 -3.544 1265 H ILE 70 H ILE 70 10.951 6.327 -5.672 1266 HA ILE 70 HA ILE 70 13.034 4.542 -4.944 1267 HB ILE 70 HB ILE 70 10.439 3.825 -6.306 1268 1HG1 ILE 70 1HG1 ILE 70 11.001 4.094 -3.345 1269 2HG1 ILE 70 2HG1 ILE 70 10.081 5.250 -4.302 1270 1HG2 ILE 70 1HG2 ILE 70 12.235 2.085 -6.143 1271 2HG2 ILE 70 2HG2 ILE 70 12.104 2.207 -4.390 1272 3HG2 ILE 70 3HG2 ILE 70 10.722 1.666 -5.341 1273 1HD1 ILE 70 1HD1 ILE 70 8.436 3.495 -4.795 1274 2HD1 ILE 70 2HD1 ILE 70 9.345 2.382 -3.772 1275 3HD1 ILE 70 3HD1 ILE 70 8.593 3.813 -3.068 1276 H ASP 71 H ASP 71 11.588 5.467 -8.027 1277 HA ASP 71 HA ASP 71 13.936 4.493 -9.419 1278 1HB ASP 71 1HB ASP 71 11.258 3.204 -9.635 1279 2HB ASP 71 2HB ASP 71 12.198 3.393 -11.113 1280 HA PRO 72 HA PRO 72 13.178 7.893 -12.082 1281 1HB PRO 72 1HB PRO 72 14.006 6.950 -14.490 1282 2HB PRO 72 2HB PRO 72 15.122 7.347 -13.179 1283 1HG PRO 72 1HG PRO 72 14.056 4.678 -14.015 1284 2HG PRO 72 2HG PRO 72 15.707 5.128 -13.551 1285 1HD PRO 72 1HD PRO 72 14.004 3.885 -11.852 1286 2HD PRO 72 2HD PRO 72 15.232 5.040 -11.297 1287 H GLN 73 H GLN 73 12.143 4.839 -13.612 1288 HA GLN 73 HA GLN 73 9.736 6.245 -14.567 1289 1HB GLN 73 1HB GLN 73 11.240 3.968 -15.865 1290 2HB GLN 73 2HB GLN 73 9.692 4.586 -16.428 1291 1HG GLN 73 1HG GLN 73 10.877 6.851 -16.591 1292 2HG GLN 73 2HG GLN 73 12.370 5.923 -16.462 1293 1HE2 GLN 73 1HE2 GLN 73 13.100 6.331 -18.501 1294 2HE2 GLN 73 2HE2 GLN 73 12.330 5.734 -19.927 1295 H ASN 74 H ASN 74 8.156 5.699 -13.193 1296 HA ASN 74 HA ASN 74 7.498 2.875 -12.920 1297 1HB ASN 74 1HB ASN 74 7.017 3.440 -10.395 1298 2HB ASN 74 2HB ASN 74 8.632 2.961 -10.908 1299 1HD2 ASN 74 1HD2 ASN 74 6.713 5.949 -10.818 1300 2HD2 ASN 74 2HD2 ASN 74 7.952 6.921 -10.106 1301 H ASP 75 H ASP 75 5.375 2.817 -11.421 1302 HA ASP 75 HA ASP 75 3.616 5.033 -11.594 1303 1HB ASP 75 1HB ASP 75 3.880 3.582 -13.989 1304 2HB ASP 75 2HB ASP 75 2.346 3.071 -13.288 1305 H LEU 76 H LEU 76 2.063 4.779 -10.113 1306 HA LEU 76 HA LEU 76 1.906 2.311 -8.652 1307 1HB LEU 76 1HB LEU 76 0.609 4.999 -8.403 1308 2HB LEU 76 2HB LEU 76 0.043 3.635 -7.441 1309 HG LEU 76 HG LEU 76 1.541 4.987 -6.127 1310 1HD1 LEU 76 1HD1 LEU 76 3.050 3.311 -5.383 1311 2HD1 LEU 76 2HD1 LEU 76 3.038 2.511 -6.954 1312 3HD1 LEU 76 3HD1 LEU 76 1.595 2.485 -5.940 1313 1HD2 LEU 76 1HD2 LEU 76 3.435 5.917 -6.871 1314 2HD2 LEU 76 2HD2 LEU 76 2.830 5.517 -8.479 1315 3HD2 LEU 76 3HD2 LEU 76 3.962 4.434 -7.668 1316 H THR 77 H THR 77 0.751 0.649 -9.356 1317 HA THR 77 HA THR 77 -1.804 1.188 -10.725 1318 HB THR 77 HB THR 77 -0.151 0.098 -12.191 1319 HG1 THR 77 HG1 THR 77 -2.239 -0.462 -12.659 1320 1HG2 THR 77 1HG2 THR 77 1.174 -1.114 -10.590 1321 2HG2 THR 77 2HG2 THR 77 0.462 -2.273 -11.713 1322 3HG2 THR 77 3HG2 THR 77 -0.219 -2.076 -10.099 1323 H PHE 78 H PHE 78 -0.922 0.626 -7.795 1324 HA PHE 78 HA PHE 78 -3.277 -0.612 -6.952 1325 1HB PHE 78 1HB PHE 78 -1.622 -2.518 -7.994 1326 2HB PHE 78 2HB PHE 78 -1.161 -2.553 -6.295 1327 HD1 PHE 78 HD1 PHE 78 -3.066 -4.204 -8.530 1328 HD2 PHE 78 HD2 PHE 78 -3.489 -2.251 -4.772 1329 HE1 PHE 78 HE1 PHE 78 -5.034 -5.595 -8.032 1330 HE2 PHE 78 HE2 PHE 78 -5.457 -3.639 -4.268 1331 HZ PHE 78 HZ PHE 78 -6.231 -5.314 -5.898 1332 H LEU 79 H LEU 79 -3.591 0.039 -4.926 1333 HA LEU 79 HA LEU 79 -1.239 0.509 -3.218 1334 1HB LEU 79 1HB LEU 79 -2.942 2.453 -4.254 1335 2HB LEU 79 2HB LEU 79 -3.473 2.235 -2.587 1336 HG LEU 79 HG LEU 79 -1.200 2.732 -1.807 1337 1HD1 LEU 79 1HD1 LEU 79 0.055 1.932 -3.725 1338 2HD1 LEU 79 2HD1 LEU 79 0.459 3.613 -3.380 1339 3HD1 LEU 79 3HD1 LEU 79 -0.614 3.223 -4.724 1340 1HD2 LEU 79 1HD2 LEU 79 -1.847 4.977 -3.646 1341 2HD2 LEU 79 2HD2 LEU 79 -1.456 4.999 -1.926 1342 3HD2 LEU 79 3HD2 LEU 79 -3.058 4.489 -2.460 1343 H ARG 80 H ARG 80 -1.395 -1.201 -1.867 1344 HA ARG 80 HA ARG 80 -3.984 -1.705 -0.567 1345 1HB ARG 80 1HB ARG 80 -1.556 -3.454 -0.954 1346 2HB ARG 80 2HB ARG 80 -2.876 -3.882 0.126 1347 1HG ARG 80 1HG ARG 80 -4.185 -3.286 -2.208 1348 2HG ARG 80 2HG ARG 80 -2.699 -4.053 -2.774 1349 1HD ARG 80 1HD ARG 80 -3.351 -5.736 -0.787 1350 2HD ARG 80 2HD ARG 80 -4.961 -5.179 -1.240 1351 HE ARG 80 HE ARG 80 -3.430 -5.949 -3.515 1352 1HH1 ARG 80 1HH1 ARG 80 -5.319 -7.191 -0.868 1353 2HH1 ARG 80 2HH1 ARG 80 -5.759 -8.648 -1.695 1354 1HH2 ARG 80 1HH2 ARG 80 -4.003 -7.864 -4.615 1355 2HH2 ARG 80 2HH2 ARG 80 -5.010 -9.030 -3.826 1356 H ILE 81 H ILE 81 -4.215 -1.532 1.603 1357 HA ILE 81 HA ILE 81 -1.850 -1.138 3.272 1358 HB ILE 81 HB ILE 81 -3.116 0.800 4.404 1359 1HG1 ILE 81 1HG1 ILE 81 -4.408 0.840 1.667 1360 2HG1 ILE 81 2HG1 ILE 81 -5.230 0.511 3.189 1361 1HG2 ILE 81 1HG2 ILE 81 -2.289 1.985 1.923 1362 2HG2 ILE 81 2HG2 ILE 81 -1.492 2.010 3.495 1363 3HG2 ILE 81 3HG2 ILE 81 -1.190 0.682 2.375 1364 1HD1 ILE 81 1HD1 ILE 81 -5.657 2.772 2.470 1365 2HD1 ILE 81 2HD1 ILE 81 -4.688 2.782 3.944 1366 3HD1 ILE 81 3HD1 ILE 81 -3.927 3.101 2.386 1367 H ARG 82 H ARG 82 -2.313 -3.098 4.272 1368 HA ARG 82 HA ARG 82 -4.885 -3.698 5.359 1369 1HB ARG 82 1HB ARG 82 -2.630 -5.162 4.797 1370 2HB ARG 82 2HB ARG 82 -2.594 -5.087 6.553 1371 1HG ARG 82 1HG ARG 82 -4.922 -5.947 6.584 1372 2HG ARG 82 2HG ARG 82 -4.826 -6.142 4.833 1373 1HD ARG 82 1HD ARG 82 -3.965 -8.162 5.182 1374 2HD ARG 82 2HD ARG 82 -2.530 -7.371 5.833 1375 HE ARG 82 HE ARG 82 -4.371 -7.497 7.896 1376 1HH1 ARG 82 1HH1 ARG 82 -2.628 -9.723 5.864 1377 2HH1 ARG 82 2HH1 ARG 82 -2.577 -10.977 7.059 1378 1HH2 ARG 82 1HH2 ARG 82 -4.310 -9.140 9.477 1379 2HH2 ARG 82 2HH2 ARG 82 -3.535 -10.644 9.114 1380 H SER 83 H SER 83 -5.723 -2.613 7.010 1381 HA SER 83 HA SER 83 -4.004 -1.357 8.985 1382 1HB SER 83 1HB SER 83 -6.962 -1.293 9.283 1383 2HB SER 83 2HB SER 83 -5.780 -0.001 9.490 1384 HG SER 83 HG SER 83 -7.271 -0.605 7.334 1385 H LYS 84 H LYS 84 -5.454 -1.435 11.272 1386 HA LYS 84 HA LYS 84 -4.952 -4.132 12.188 1387 1HB LYS 84 1HB LYS 84 -5.321 -1.483 13.419 1388 2HB LYS 84 2HB LYS 84 -5.973 -2.822 14.354 1389 1HG LYS 84 1HG LYS 84 -3.495 -3.746 13.618 1390 2HG LYS 84 2HG LYS 84 -3.212 -2.027 13.898 1391 1HD LYS 84 1HD LYS 84 -2.989 -2.660 16.047 1392 2HD LYS 84 2HD LYS 84 -4.754 -2.649 16.040 1393 1HE LYS 84 1HE LYS 84 -4.811 -4.836 16.423 1394 2HE LYS 84 2HE LYS 84 -3.800 -5.147 15.013 1395 1HZ LYS 84 1HZ LYS 84 -3.023 -4.839 17.825 1396 2HZ LYS 84 2HZ LYS 84 -1.920 -4.380 16.628 1397 3HZ LYS 84 3HZ LYS 84 -2.497 -5.969 16.681 1398 H LYS 85 H LYS 85 -7.661 -2.191 11.295 1399 HA LYS 85 HA LYS 85 -9.541 -4.077 12.519 1400 1HB LYS 85 1HB LYS 85 -9.822 -1.313 11.376 1401 2HB LYS 85 2HB LYS 85 -11.233 -2.340 11.596 1402 1HG LYS 85 1HG LYS 85 -9.552 -2.225 13.964 1403 2HG LYS 85 2HG LYS 85 -10.151 -0.641 13.466 1404 1HD LYS 85 1HD LYS 85 -11.920 -3.060 13.773 1405 2HD LYS 85 2HD LYS 85 -11.623 -1.906 15.074 1406 1HE LYS 85 1HE LYS 85 -12.361 -0.134 13.333 1407 2HE LYS 85 2HE LYS 85 -13.063 -1.507 12.479 1408 1HZ LYS 85 1HZ LYS 85 -13.786 -0.401 15.112 1409 2HZ LYS 85 2HZ LYS 85 -14.132 -2.016 14.748 1410 3HZ LYS 85 3HZ LYS 85 -14.788 -0.777 13.802 1411 H ASN 86 H ASN 86 -8.873 -2.544 9.377 1412 HA ASN 86 HA ASN 86 -9.545 -4.987 8.001 1413 1HB ASN 86 1HB ASN 86 -11.243 -3.839 6.530 1414 2HB ASN 86 2HB ASN 86 -11.774 -4.138 8.182 1415 1HD2 ASN 86 1HD2 ASN 86 -11.682 -2.351 9.684 1416 2HD2 ASN 86 2HD2 ASN 86 -11.894 -0.740 9.097 1417 H GLU 87 H GLU 87 -9.243 -4.742 5.606 1418 HA GLU 87 HA GLU 87 -6.925 -3.033 5.134 1419 1HB GLU 87 1HB GLU 87 -6.553 -4.397 3.148 1420 2HB GLU 87 2HB GLU 87 -6.757 -5.417 4.565 1421 1HG GLU 87 1HG GLU 87 -9.029 -5.923 3.918 1422 2HG GLU 87 2HG GLU 87 -8.906 -4.827 2.543 1423 H ILE 88 H ILE 88 -6.748 -1.668 3.312 1424 HA ILE 88 HA ILE 88 -9.320 -0.904 2.091 1425 HB ILE 88 HB ILE 88 -7.111 1.036 2.761 1426 1HG1 ILE 88 1HG1 ILE 88 -8.074 0.077 4.824 1427 2HG1 ILE 88 2HG1 ILE 88 -8.480 1.779 4.639 1428 1HG2 ILE 88 1HG2 ILE 88 -8.300 2.120 1.157 1429 2HG2 ILE 88 2HG2 ILE 88 -9.778 1.217 1.486 1430 3HG2 ILE 88 3HG2 ILE 88 -9.297 2.538 2.551 1431 1HD1 ILE 88 1HD1 ILE 88 -10.349 -0.394 3.769 1432 2HD1 ILE 88 2HD1 ILE 88 -10.314 0.212 5.426 1433 3HD1 ILE 88 3HD1 ILE 88 -10.701 1.303 4.095 1434 H MET 89 H MET 89 -9.074 -1.829 0.115 1435 HA MET 89 HA MET 89 -6.582 -1.553 -1.343 1436 1HB MET 89 1HB MET 89 -9.152 -3.021 -1.792 1437 2HB MET 89 2HB MET 89 -8.075 -2.733 -3.151 1438 1HG MET 89 1HG MET 89 -6.384 -4.048 -2.252 1439 2HG MET 89 2HG MET 89 -7.061 -3.972 -0.627 1440 1HE MET 89 1HE MET 89 -8.160 -4.698 -4.165 1441 2HE MET 89 2HE MET 89 -8.961 -6.268 -4.106 1442 3HE MET 89 3HE MET 89 -9.793 -4.830 -3.513 1443 H VAL 90 H VAL 90 -6.146 0.031 -2.728 1444 HA VAL 90 HA VAL 90 -8.300 1.354 -4.176 1445 HB VAL 90 HB VAL 90 -6.352 2.884 -2.446 1446 1HG1 VAL 90 1HG1 VAL 90 -6.552 4.359 -4.156 1447 2HG1 VAL 90 2HG1 VAL 90 -8.082 3.678 -4.712 1448 3HG1 VAL 90 3HG1 VAL 90 -8.051 4.755 -3.315 1449 1HG2 VAL 90 1HG2 VAL 90 -9.343 2.534 -2.293 1450 2HG2 VAL 90 2HG2 VAL 90 -8.144 1.980 -1.124 1451 3HG2 VAL 90 3HG2 VAL 90 -8.426 3.706 -1.346 1452 H ALA 91 H ALA 91 -7.707 2.030 -6.174 1453 HA ALA 91 HA ALA 91 -4.915 2.404 -6.853 1454 1HB ALA 91 1HB ALA 91 -4.683 0.677 -8.397 1455 2HB ALA 91 2HB ALA 91 -5.495 -0.095 -7.034 1456 3HB ALA 91 3HB ALA 91 -6.419 0.372 -8.462 1457 HA PRO 92 HA PRO 92 -6.602 5.307 -9.684 1458 1HB PRO 92 1HB PRO 92 -4.663 5.353 -11.584 1459 2HB PRO 92 2HB PRO 92 -4.456 6.073 -9.983 1460 1HG PRO 92 1HG PRO 92 -3.513 3.422 -11.005 1461 2HG PRO 92 2HG PRO 92 -2.652 4.606 -10.004 1462 1HD PRO 92 1HD PRO 92 -3.813 2.392 -8.965 1463 2HD PRO 92 2HD PRO 92 -3.698 3.920 -8.069 1464 H ASP 93 H ASP 93 -8.415 4.573 -10.677 1465 HA ASP 93 HA ASP 93 -8.297 2.448 -12.638 1466 1HB ASP 93 1HB ASP 93 -10.257 3.378 -10.917 1467 2HB ASP 93 2HB ASP 93 -10.806 3.936 -12.495 1468 H LYS 94 H LYS 94 -10.182 3.232 -14.487 1469 HA LYS 94 HA LYS 94 -8.720 4.474 -16.451 1470 1HB LYS 94 1HB LYS 94 -11.425 3.610 -16.108 1471 2HB LYS 94 2HB LYS 94 -11.435 5.185 -16.890 1472 1HG LYS 94 1HG LYS 94 -9.720 4.208 -18.502 1473 2HG LYS 94 2HG LYS 94 -10.171 2.636 -17.837 1474 1HD LYS 94 1HD LYS 94 -11.645 2.735 -19.575 1475 2HD LYS 94 2HD LYS 94 -12.612 3.548 -18.342 1476 1HE LYS 94 1HE LYS 94 -12.232 5.649 -19.252 1477 2HE LYS 94 2HE LYS 94 -10.786 5.124 -20.112 1478 1HZ LYS 94 1HZ LYS 94 -12.048 4.077 -21.745 1479 2HZ LYS 94 2HZ LYS 94 -12.886 5.519 -21.464 1480 3HZ LYS 94 3HZ LYS 94 -13.457 4.069 -20.807 1481 H ASP 95 H ASP 95 -11.176 6.006 -14.373 1482 HA ASP 95 HA ASP 95 -9.705 8.505 -14.481 1483 1HB ASP 95 1HB ASP 95 -11.925 8.055 -16.197 1484 2HB ASP 95 2HB ASP 95 -12.440 9.192 -14.954 1485 H TYR 96 H TYR 96 -10.796 6.352 -12.585 1486 HA TYR 96 HA TYR 96 -11.686 8.244 -10.547 1487 1HB TYR 96 1HB TYR 96 -13.411 6.473 -9.822 1488 2HB TYR 96 2HB TYR 96 -13.805 7.486 -11.206 1489 HD1 TYR 96 HD1 TYR 96 -13.727 6.552 -13.489 1490 HD2 TYR 96 HD2 TYR 96 -13.087 4.110 -10.064 1491 HE1 TYR 96 HE1 TYR 96 -14.104 4.544 -14.858 1492 HE2 TYR 96 HE2 TYR 96 -13.462 2.095 -11.423 1493 HH TYR 96 HH TYR 96 -14.942 2.024 -14.235 1494 H PHE 97 H PHE 97 -11.757 7.146 -8.352 1495 HA PHE 97 HA PHE 97 -9.543 5.210 -8.173 1496 1HB PHE 97 1HB PHE 97 -10.308 7.521 -6.405 1497 2HB PHE 97 2HB PHE 97 -9.312 6.202 -5.799 1498 HD1 PHE 97 HD1 PHE 97 -7.241 5.607 -7.314 1499 HD2 PHE 97 HD2 PHE 97 -9.269 9.349 -7.325 1500 HE1 PHE 97 HE1 PHE 97 -5.239 6.686 -8.253 1501 HE2 PHE 97 HE2 PHE 97 -7.271 10.434 -8.265 1502 HZ PHE 97 HZ PHE 97 -5.252 9.102 -8.731 1503 H LEU 98 H LEU 98 -10.548 3.283 -7.983 1504 HA LEU 98 HA LEU 98 -12.970 2.895 -6.538 1505 1HB LEU 98 1HB LEU 98 -11.828 1.500 -8.453 1506 2HB LEU 98 2HB LEU 98 -11.091 0.650 -7.097 1507 HG LEU 98 HG LEU 98 -14.059 0.980 -7.179 1508 1HD1 LEU 98 1HD1 LEU 98 -14.038 0.031 -9.230 1509 2HD1 LEU 98 2HD1 LEU 98 -13.799 -1.441 -8.289 1510 3HD1 LEU 98 3HD1 LEU 98 -12.417 -0.634 -9.029 1511 1HD2 LEU 98 1HD2 LEU 98 -12.141 -0.379 -5.576 1512 2HD2 LEU 98 2HD2 LEU 98 -13.159 -1.580 -6.371 1513 3HD2 LEU 98 3HD2 LEU 98 -13.894 -0.314 -5.387 1514 H ILE 99 H ILE 99 -13.321 1.965 -4.537 1515 HA ILE 99 HA ILE 99 -10.974 1.446 -2.854 1516 HB ILE 99 HB ILE 99 -13.320 3.119 -1.951 1517 1HG1 ILE 99 1HG1 ILE 99 -10.974 4.621 -1.768 1518 2HG1 ILE 99 2HG1 ILE 99 -10.865 3.827 -3.335 1519 1HG2 ILE 99 1HG2 ILE 99 -12.607 2.236 0.012 1520 2HG2 ILE 99 2HG2 ILE 99 -10.984 1.914 -0.595 1521 3HG2 ILE 99 3HG2 ILE 99 -11.436 3.548 -0.112 1522 1HD1 ILE 99 1HD1 ILE 99 -12.988 4.758 -3.993 1523 2HD1 ILE 99 2HD1 ILE 99 -13.199 5.475 -2.395 1524 3HD1 ILE 99 3HD1 ILE 99 -11.908 6.043 -3.454 1525 H VAL 100 H VAL 100 -11.162 -0.573 -2.163 1526 HA VAL 100 HA VAL 100 -13.850 -1.616 -1.553 1527 HB VAL 100 HB VAL 100 -11.357 -3.160 -2.285 1528 1HG1 VAL 100 1HG1 VAL 100 -13.990 -3.953 -1.216 1529 2HG1 VAL 100 2HG1 VAL 100 -13.373 -4.918 -2.559 1530 3HG1 VAL 100 3HG1 VAL 100 -12.422 -4.749 -1.083 1531 1HG2 VAL 100 1HG2 VAL 100 -13.510 -1.987 -3.864 1532 2HG2 VAL 100 2HG2 VAL 100 -11.934 -2.594 -4.372 1533 3HG2 VAL 100 3HG2 VAL 100 -13.283 -3.710 -4.164 1534 H ILE 101 H ILE 101 -14.251 -1.620 0.555 1535 HA ILE 101 HA ILE 101 -12.033 -2.088 2.427 1536 HB ILE 101 HB ILE 101 -14.768 -0.993 3.079 1537 1HG1 ILE 101 1HG1 ILE 101 -12.184 0.513 2.615 1538 2HG1 ILE 101 2HG1 ILE 101 -13.561 0.494 1.517 1539 1HG2 ILE 101 1HG2 ILE 101 -14.132 -1.032 5.209 1540 2HG2 ILE 101 2HG2 ILE 101 -12.746 -1.998 4.706 1541 3HG2 ILE 101 3HG2 ILE 101 -12.601 -0.244 4.829 1542 1HD1 ILE 101 1HD1 ILE 101 -13.400 1.700 4.260 1543 2HD1 ILE 101 2HD1 ILE 101 -13.679 2.515 2.720 1544 3HD1 ILE 101 3HD1 ILE 101 -14.920 1.463 3.399 1545 H GLN 102 H GLN 102 -11.933 -3.928 3.534 1546 HA GLN 102 HA GLN 102 -14.223 -5.345 4.450 1547 1HB GLN 102 1HB GLN 102 -14.103 -7.320 3.124 1548 2HB GLN 102 2HB GLN 102 -14.174 -5.961 2.009 1549 1HG GLN 102 1HG GLN 102 -11.669 -6.104 1.848 1550 2HG GLN 102 2HG GLN 102 -11.781 -7.622 2.738 1551 1HE2 GLN 102 1HE2 GLN 102 -11.569 -6.323 -0.256 1552 2HE2 GLN 102 2HE2 GLN 102 -12.251 -7.609 -1.187 1553 H ASN 103 H ASN 103 -13.511 -7.582 5.331 1554 HA ASN 103 HA ASN 103 -11.499 -7.177 7.222 1555 1HB ASN 103 1HB ASN 103 -13.189 -9.429 6.358 1556 2HB ASN 103 2HB ASN 103 -11.665 -9.901 7.104 1557 1HD2 ASN 103 1HD2 ASN 103 -14.770 -9.467 7.763 1558 2HD2 ASN 103 2HD2 ASN 103 -14.687 -8.958 9.411 1559 HA PRO 104 HA PRO 104 -7.693 -8.201 5.298 1560 1HB PRO 104 1HB PRO 104 -6.423 -9.632 7.224 1561 2HB PRO 104 2HB PRO 104 -6.682 -7.888 7.337 1562 1HG PRO 104 1HG PRO 104 -8.232 -10.119 8.595 1563 2HG PRO 104 2HG PRO 104 -7.711 -8.579 9.305 1564 1HD PRO 104 1HD PRO 104 -10.234 -8.994 8.414 1565 2HD PRO 104 2HD PRO 104 -9.445 -7.405 8.342 1566 H THR 105 H THR 105 -6.619 -9.794 4.150 1567 HA THR 105 HA THR 105 -7.229 -12.587 4.546 1568 HB THR 105 HB THR 105 -9.022 -12.554 3.174 1569 HG1 THR 105 HG1 THR 105 -8.247 -12.574 0.845 1570 1HG2 THR 105 1HG2 THR 105 -9.466 -10.290 2.961 1571 2HG2 THR 105 2HG2 THR 105 -9.177 -10.761 1.286 1572 3HG2 THR 105 3HG2 THR 105 -7.910 -9.951 2.206 1573 H GLU 106 H GLU 106 -6.161 -10.567 1.804 1574 HA GLU 106 HA GLU 106 -3.748 -12.226 1.623 1575 1HB GLU 106 1HB GLU 106 -5.513 -11.067 -0.317 1576 2HB GLU 106 2HB GLU 106 -3.893 -10.429 -0.560 1577 1HG GLU 106 1HG GLU 106 -3.046 -12.765 -0.597 1578 2HG GLU 106 2HG GLU 106 -4.717 -13.321 -0.531 Start of MODEL 17 1 H MET 11 H MET 11 17.690 -9.492 15.321 2 HA MET 11 HA MET 11 17.654 -8.266 12.684 3 1HB MET 11 1HB MET 11 19.534 -8.449 14.881 4 2HB MET 11 2HB MET 11 20.299 -8.875 13.356 5 1HG MET 11 1HG MET 11 18.709 -6.550 12.957 6 2HG MET 11 2HG MET 11 19.722 -6.311 14.379 7 1HE MET 11 1HE MET 11 19.806 -6.092 10.398 8 2HE MET 11 2HE MET 11 21.142 -7.208 10.118 9 3HE MET 11 3HE MET 11 19.663 -7.779 10.891 10 H ALA 12 H ALA 12 19.062 -11.176 14.188 11 HA ALA 12 HA ALA 12 20.090 -12.385 11.932 12 1HB ALA 12 1HB ALA 12 20.703 -13.685 13.643 13 2HB ALA 12 2HB ALA 12 19.281 -13.258 14.596 14 3HB ALA 12 3HB ALA 12 19.176 -14.526 13.375 15 H GLU 13 H GLU 13 16.771 -12.417 13.136 16 HA GLU 13 HA GLU 13 15.665 -14.369 11.522 17 1HB GLU 13 1HB GLU 13 14.543 -13.043 13.376 18 2HB GLU 13 2HB GLU 13 14.281 -11.774 12.188 19 1HG GLU 13 1HG GLU 13 12.478 -12.793 11.419 20 2HG GLU 13 2HG GLU 13 13.385 -14.277 11.131 21 H VAL 14 H VAL 14 15.959 -10.891 10.816 22 HA VAL 14 HA VAL 14 14.877 -11.031 8.215 23 HB VAL 14 HB VAL 14 16.805 -9.004 9.358 24 1HG1 VAL 14 1HG1 VAL 14 16.942 -8.351 7.214 25 2HG1 VAL 14 2HG1 VAL 14 15.517 -9.276 6.736 26 3HG1 VAL 14 3HG1 VAL 14 15.330 -7.692 7.490 27 1HG2 VAL 14 1HG2 VAL 14 13.862 -9.362 9.517 28 2HG2 VAL 14 2HG2 VAL 14 14.991 -8.725 10.713 29 3HG2 VAL 14 3HG2 VAL 14 14.485 -7.720 9.355 30 H GLU 15 H GLU 15 18.169 -11.321 9.445 31 HA GLU 15 HA GLU 15 19.499 -11.259 6.963 32 1HB GLU 15 1HB GLU 15 20.231 -12.465 9.627 33 2HB GLU 15 2HB GLU 15 21.309 -12.521 8.239 34 1HG GLU 15 1HG GLU 15 21.477 -10.147 8.177 35 2HG GLU 15 2HG GLU 15 20.205 -9.971 9.384 36 H GLU 16 H GLU 16 18.113 -13.910 8.844 37 HA GLU 16 HA GLU 16 19.076 -16.020 7.247 38 1HB GLU 16 1HB GLU 16 17.641 -15.832 9.580 39 2HB GLU 16 2HB GLU 16 16.440 -16.456 8.458 40 1HG GLU 16 1HG GLU 16 18.963 -17.841 8.194 41 2HG GLU 16 2HG GLU 16 18.344 -17.912 9.843 42 H THR 17 H THR 17 16.275 -13.933 6.976 43 HA THR 17 HA THR 17 15.017 -15.467 4.903 44 HB THR 17 HB THR 17 14.520 -12.625 5.808 45 HG1 THR 17 HG1 THR 17 13.480 -13.594 7.365 46 1HG2 THR 17 1HG2 THR 17 13.293 -14.311 3.693 47 2HG2 THR 17 2HG2 THR 17 13.501 -12.561 3.768 48 3HG2 THR 17 3HG2 THR 17 12.210 -13.336 4.685 49 H LEU 18 H LEU 18 17.414 -12.977 5.049 50 HA LEU 18 HA LEU 18 17.144 -11.953 2.428 51 1HB LEU 18 1HB LEU 18 18.808 -11.523 4.659 52 2HB LEU 18 2HB LEU 18 19.871 -11.898 3.304 53 HG LEU 18 HG LEU 18 19.658 -9.532 3.423 54 1HD1 LEU 18 1HD1 LEU 18 18.699 -9.000 1.257 55 2HD1 LEU 18 2HD1 LEU 18 17.853 -10.547 1.232 56 3HD1 LEU 18 3HD1 LEU 18 19.615 -10.505 1.175 57 1HD2 LEU 18 1HD2 LEU 18 17.515 -9.618 4.758 58 2HD2 LEU 18 2HD2 LEU 18 16.668 -9.795 3.221 59 3HD2 LEU 18 3HD2 LEU 18 17.618 -8.343 3.543 60 H LYS 19 H LYS 19 19.254 -14.469 3.788 61 HA LYS 19 HA LYS 19 20.649 -15.106 1.458 62 1HB LYS 19 1HB LYS 19 19.855 -17.016 3.662 63 2HB LYS 19 2HB LYS 19 21.189 -17.216 2.534 64 1HG LYS 19 1HG LYS 19 20.953 -15.067 4.631 65 2HG LYS 19 2HG LYS 19 21.982 -16.499 4.714 66 1HD LYS 19 1HD LYS 19 22.745 -15.448 2.332 67 2HD LYS 19 2HD LYS 19 22.349 -13.983 3.233 68 1HE LYS 19 1HE LYS 19 24.034 -14.293 4.741 69 2HE LYS 19 2HE LYS 19 23.983 -16.049 4.603 70 1HZ LYS 19 1HZ LYS 19 25.268 -16.020 2.698 71 2HZ LYS 19 2HZ LYS 19 25.976 -14.794 3.624 72 3HZ LYS 19 3HZ LYS 19 24.932 -14.399 2.352 73 H ARG 20 H ARG 20 17.705 -16.606 2.786 74 HA ARG 20 HA ARG 20 17.308 -18.463 0.732 75 1HB ARG 20 1HB ARG 20 16.131 -18.221 3.034 76 2HB ARG 20 2HB ARG 20 15.020 -17.162 2.175 77 1HG ARG 20 1HG ARG 20 13.885 -19.080 1.874 78 2HG ARG 20 2HG ARG 20 14.998 -19.266 0.516 79 1HD ARG 20 1HD ARG 20 16.364 -20.263 2.740 80 2HD ARG 20 2HD ARG 20 14.716 -20.870 2.895 81 HE ARG 20 HE ARG 20 15.668 -21.234 0.253 82 1HH1 ARG 20 1HH1 ARG 20 15.981 -22.493 3.484 83 2HH1 ARG 20 2HH1 ARG 20 16.413 -24.087 2.961 84 1HH2 ARG 20 1HH2 ARG 20 16.235 -23.329 -0.448 85 2HH2 ARG 20 2HH2 ARG 20 16.558 -24.562 0.725 86 H LEU 21 H LEU 21 15.922 -15.211 1.151 87 HA LEU 21 HA LEU 21 14.362 -15.129 -1.140 88 1HB LEU 21 1HB LEU 21 15.563 -13.172 0.682 89 2HB LEU 21 2HB LEU 21 15.241 -12.555 -0.937 90 HG LEU 21 HG LEU 21 12.898 -13.034 -0.715 91 1HD1 LEU 21 1HD1 LEU 21 13.824 -14.728 1.471 92 2HD1 LEU 21 2HD1 LEU 21 12.366 -14.839 0.486 93 3HD1 LEU 21 3HD1 LEU 21 12.409 -13.758 1.879 94 1HD2 LEU 21 1HD2 LEU 21 14.272 -11.469 1.394 95 2HD2 LEU 21 2HD2 LEU 21 12.544 -11.762 1.593 96 3HD2 LEU 21 3HD2 LEU 21 13.141 -10.945 0.147 97 H GLN 22 H GLN 22 17.706 -13.954 -0.748 98 HA GLN 22 HA GLN 22 18.049 -13.345 -3.498 99 1HB GLN 22 1HB GLN 22 19.470 -12.881 -1.160 100 2HB GLN 22 2HB GLN 22 20.517 -13.956 -2.078 101 1HG GLN 22 1HG GLN 22 21.135 -12.314 -3.423 102 2HG GLN 22 2HG GLN 22 19.459 -11.904 -3.783 103 1HE2 GLN 22 1HE2 GLN 22 18.361 -10.460 -2.328 104 2HE2 GLN 22 2HE2 GLN 22 19.262 -9.279 -1.447 105 H SER 23 H SER 23 17.945 -16.273 -1.844 106 HA SER 23 HA SER 23 19.758 -17.680 -3.625 107 1HB SER 23 1HB SER 23 18.294 -18.319 -1.129 108 2HB SER 23 2HB SER 23 18.552 -19.663 -2.241 109 HG SER 23 HG SER 23 20.822 -18.943 -2.242 110 H GLN 24 H GLN 24 16.429 -16.895 -3.430 111 HA GLN 24 HA GLN 24 15.696 -18.995 -5.337 112 1HB GLN 24 1HB GLN 24 13.384 -18.390 -4.864 113 2HB GLN 24 2HB GLN 24 14.250 -18.711 -3.368 114 1HG GLN 24 1HG GLN 24 14.328 -16.447 -2.791 115 2HG GLN 24 2HG GLN 24 13.918 -15.928 -4.426 116 1HE2 GLN 24 1HE2 GLN 24 12.623 -15.133 -2.018 117 2HE2 GLN 24 2HE2 GLN 24 10.982 -15.664 -2.114 118 H LYS 25 H LYS 25 14.584 -18.485 -7.282 119 HA LYS 25 HA LYS 25 15.581 -16.092 -8.545 120 1HB LYS 25 1HB LYS 25 15.601 -18.145 -9.816 121 2HB LYS 25 2HB LYS 25 13.874 -18.366 -9.567 122 1HG LYS 25 1HG LYS 25 13.305 -16.826 -11.144 123 2HG LYS 25 2HG LYS 25 14.772 -15.875 -10.905 124 1HD LYS 25 1HD LYS 25 15.457 -16.806 -12.827 125 2HD LYS 25 2HD LYS 25 15.770 -18.240 -11.846 126 1HE LYS 25 1HE LYS 25 12.997 -17.957 -12.765 127 2HE LYS 25 2HE LYS 25 14.179 -18.179 -14.053 128 1HZ LYS 25 1HZ LYS 25 13.569 -20.325 -13.474 129 2HZ LYS 25 2HZ LYS 25 13.532 -19.992 -11.816 130 3HZ LYS 25 3HZ LYS 25 15.015 -20.107 -12.622 131 H GLY 26 H GLY 26 14.490 -14.267 -9.005 132 1HA GLY 26 1HA GLY 26 12.230 -13.393 -9.697 133 2HA GLY 26 2HA GLY 26 11.633 -14.199 -8.253 134 H VAL 27 H VAL 27 13.627 -13.533 -6.437 135 HA VAL 27 HA VAL 27 12.792 -11.056 -5.504 136 HB VAL 27 HB VAL 27 15.373 -12.515 -4.928 137 1HG1 VAL 27 1HG1 VAL 27 15.933 -10.467 -4.111 138 2HG1 VAL 27 2HG1 VAL 27 14.253 -9.975 -3.882 139 3HG1 VAL 27 3HG1 VAL 27 15.018 -11.070 -2.729 140 1HG2 VAL 27 1HG2 VAL 27 14.159 -13.137 -2.831 141 2HG2 VAL 27 2HG2 VAL 27 12.697 -12.453 -3.542 142 3HG2 VAL 27 3HG2 VAL 27 13.483 -13.837 -4.302 143 H GLN 28 H GLN 28 13.582 -8.987 -5.612 144 HA GLN 28 HA GLN 28 15.589 -8.500 -7.709 145 1HB GLN 28 1HB GLN 28 13.066 -7.164 -6.969 146 2HB GLN 28 2HB GLN 28 14.399 -6.083 -7.351 147 1HG GLN 28 1HG GLN 28 13.487 -6.321 -9.416 148 2HG GLN 28 2HG GLN 28 14.638 -7.656 -9.443 149 1HE2 GLN 28 1HE2 GLN 28 11.327 -7.048 -8.307 150 2HE2 GLN 28 2HE2 GLN 28 10.660 -8.508 -8.944 151 H GLY 29 H GLY 29 14.627 -7.739 -4.423 152 1HA GLY 29 1HA GLY 29 17.221 -7.249 -3.521 153 2HA GLY 29 2HA GLY 29 16.516 -5.693 -3.936 154 H ILE 30 H ILE 30 17.332 -6.394 -1.341 155 HA ILE 30 HA ILE 30 14.753 -6.212 0.041 156 HB ILE 30 HB ILE 30 17.017 -7.963 1.003 157 1HG1 ILE 30 1HG1 ILE 30 14.832 -9.587 0.667 158 2HG1 ILE 30 2HG1 ILE 30 14.684 -8.492 -0.704 159 1HG2 ILE 30 1HG2 ILE 30 14.412 -7.108 2.168 160 2HG2 ILE 30 2HG2 ILE 30 15.030 -8.717 2.537 161 3HG2 ILE 30 3HG2 ILE 30 15.986 -7.291 2.940 162 1HD1 ILE 30 1HD1 ILE 30 16.360 -10.747 -0.418 163 2HD1 ILE 30 2HD1 ILE 30 16.210 -9.653 -1.794 164 3HD1 ILE 30 3HD1 ILE 30 17.389 -9.319 -0.525 165 H ILE 31 H ILE 31 14.694 -4.535 1.381 166 HA ILE 31 HA ILE 31 17.250 -3.433 2.354 167 HB ILE 31 HB ILE 31 14.718 -1.922 1.700 168 1HG1 ILE 31 1HG1 ILE 31 17.305 -1.336 0.368 169 2HG1 ILE 31 2HG1 ILE 31 16.504 -2.832 -0.096 170 1HG2 ILE 31 1HG2 ILE 31 15.588 -0.676 3.417 171 2HG2 ILE 31 2HG2 ILE 31 17.248 -1.154 3.068 172 3HG2 ILE 31 3HG2 ILE 31 16.439 0.030 2.043 173 1HD1 ILE 31 1HD1 ILE 31 16.023 -0.738 -1.466 174 2HD1 ILE 31 2HD1 ILE 31 14.647 -1.708 -0.942 175 3HD1 ILE 31 3HD1 ILE 31 15.049 -0.216 -0.092 176 H VAL 32 H VAL 32 17.384 -2.767 4.477 177 HA VAL 32 HA VAL 32 15.024 -3.142 6.179 178 HB VAL 32 HB VAL 32 17.710 -4.180 7.043 179 1HG1 VAL 32 1HG1 VAL 32 16.490 -5.320 8.732 180 2HG1 VAL 32 2HG1 VAL 32 15.893 -3.660 8.705 181 3HG1 VAL 32 3HG1 VAL 32 14.948 -4.950 7.960 182 1HG2 VAL 32 1HG2 VAL 32 17.129 -5.407 5.033 183 2HG2 VAL 32 2HG2 VAL 32 16.931 -6.439 6.449 184 3HG2 VAL 32 3HG2 VAL 32 15.516 -5.731 5.670 185 H VAL 33 H VAL 33 14.703 -1.283 7.195 186 HA VAL 33 HA VAL 33 17.050 0.286 8.043 187 HB VAL 33 HB VAL 33 14.325 1.487 7.681 188 1HG1 VAL 33 1HG1 VAL 33 17.109 2.443 8.032 189 2HG1 VAL 33 2HG1 VAL 33 16.041 3.404 7.007 190 3HG1 VAL 33 3HG1 VAL 33 15.600 3.081 8.685 191 1HG2 VAL 33 1HG2 VAL 33 14.562 0.644 5.540 192 2HG2 VAL 33 2HG2 VAL 33 15.314 2.232 5.396 193 3HG2 VAL 33 3HG2 VAL 33 16.320 0.793 5.563 194 H ASN 34 H ASN 34 17.044 1.227 10.092 195 HA ASN 34 HA ASN 34 15.266 -0.091 12.003 196 1HB ASN 34 1HB ASN 34 16.910 0.940 13.684 197 2HB ASN 34 2HB ASN 34 17.520 -0.344 12.644 198 1HD2 ASN 34 1HD2 ASN 34 19.621 0.493 13.120 199 2HD2 ASN 34 2HD2 ASN 34 20.224 1.863 12.256 200 H THR 35 H THR 35 14.909 1.410 14.050 201 HA THR 35 HA THR 35 13.015 3.320 13.354 202 HB THR 35 HB THR 35 13.359 4.167 15.756 203 HG1 THR 35 HG1 THR 35 14.791 3.106 16.999 204 1HG2 THR 35 1HG2 THR 35 12.890 1.289 16.023 205 2HG2 THR 35 2HG2 THR 35 11.964 2.048 14.728 206 3HG2 THR 35 3HG2 THR 35 11.825 2.647 16.381 207 H GLU 36 H GLU 36 16.454 3.598 13.630 208 HA GLU 36 HA GLU 36 16.510 6.455 13.881 209 1HB GLU 36 1HB GLU 36 18.529 4.299 13.494 210 2HB GLU 36 2HB GLU 36 18.984 5.939 13.054 211 1HG GLU 36 1HG GLU 36 17.828 6.240 15.537 212 2HG GLU 36 2HG GLU 36 18.709 4.720 15.670 213 H GLY 37 H GLY 37 17.267 4.188 11.234 214 1HA GLY 37 1HA GLY 37 16.095 5.009 9.091 215 2HA GLY 37 2HA GLY 37 17.079 6.442 9.351 216 H ILE 38 H ILE 38 19.002 4.125 10.469 217 HA ILE 38 HA ILE 38 20.596 4.074 8.074 218 HB ILE 38 HB ILE 38 21.173 2.484 10.559 219 1HG1 ILE 38 1HG1 ILE 38 22.590 4.839 10.823 220 2HG1 ILE 38 2HG1 ILE 38 21.020 5.390 10.250 221 1HG2 ILE 38 1HG2 ILE 38 22.599 2.070 8.639 222 2HG2 ILE 38 2HG2 ILE 38 22.933 3.794 8.492 223 3HG2 ILE 38 3HG2 ILE 38 23.503 2.904 9.903 224 1HD1 ILE 38 1HD1 ILE 38 20.037 3.945 12.106 225 2HD1 ILE 38 2HD1 ILE 38 21.677 3.886 12.752 226 3HD1 ILE 38 3HD1 ILE 38 20.855 5.436 12.571 227 HA PRO 39 HA PRO 39 18.936 0.290 6.481 228 1HB PRO 39 1HB PRO 39 20.837 -0.137 4.591 229 2HB PRO 39 2HB PRO 39 19.564 1.076 4.415 230 1HG PRO 39 1HG PRO 39 22.411 1.429 5.269 231 2HG PRO 39 2HG PRO 39 21.443 2.422 4.164 232 1HD PRO 39 1HD PRO 39 21.888 3.122 6.742 233 2HD PRO 39 2HD PRO 39 20.387 3.532 5.886 234 H ILE 40 H ILE 40 19.482 -0.772 8.564 235 HA ILE 40 HA ILE 40 21.901 -1.869 9.270 236 HB ILE 40 HB ILE 40 20.497 -3.768 10.283 237 1HG1 ILE 40 1HG1 ILE 40 18.236 -1.935 9.464 238 2HG1 ILE 40 2HG1 ILE 40 18.614 -3.445 8.642 239 1HG2 ILE 40 1HG2 ILE 40 21.100 -1.249 11.129 240 2HG2 ILE 40 2HG2 ILE 40 19.349 -1.286 11.327 241 3HG2 ILE 40 3HG2 ILE 40 20.353 -2.497 12.124 242 1HD1 ILE 40 1HD1 ILE 40 18.243 -3.612 11.559 243 2HD1 ILE 40 2HD1 ILE 40 16.810 -3.240 10.600 244 3HD1 ILE 40 3HD1 ILE 40 17.729 -4.710 10.278 245 H LYS 41 H LYS 41 19.559 -3.067 6.930 246 HA LYS 41 HA LYS 41 21.591 -4.950 5.959 247 1HB LYS 41 1HB LYS 41 19.077 -5.640 7.175 248 2HB LYS 41 2HB LYS 41 19.079 -6.150 5.492 249 1HG LYS 41 1HG LYS 41 21.538 -6.796 6.935 250 2HG LYS 41 2HG LYS 41 20.092 -7.582 7.572 251 1HD LYS 41 1HD LYS 41 19.876 -8.911 5.770 252 2HD LYS 41 2HD LYS 41 20.312 -7.621 4.646 253 1HE LYS 41 1HE LYS 41 22.600 -8.015 4.900 254 2HE LYS 41 2HE LYS 41 22.372 -8.913 6.401 255 1HZ LYS 41 1HZ LYS 41 20.972 -10.381 4.632 256 2HZ LYS 41 2HZ LYS 41 22.569 -10.696 5.093 257 3HZ LYS 41 3HZ LYS 41 22.253 -9.834 3.672 258 H SER 42 H SER 42 21.755 -5.095 3.777 259 HA SER 42 HA SER 42 19.682 -4.347 1.978 260 1HB SER 42 1HB SER 42 20.434 -2.097 2.809 261 2HB SER 42 2HB SER 42 22.023 -2.435 2.121 262 HG SER 42 HG SER 42 20.994 -2.635 0.078 263 H THR 43 H THR 43 20.105 -5.014 -0.092 264 HA THR 43 HA THR 43 22.778 -6.162 -0.573 265 HB THR 43 HB THR 43 21.826 -7.998 -1.752 266 HG1 THR 43 HG1 THR 43 19.431 -6.497 -1.575 267 1HG2 THR 43 1HG2 THR 43 20.608 -9.140 -0.046 268 2HG2 THR 43 2HG2 THR 43 20.052 -7.621 0.657 269 3HG2 THR 43 3HG2 THR 43 21.754 -8.071 0.762 270 H MET 44 H MET 44 20.506 -3.913 -1.564 271 HA MET 44 HA MET 44 20.938 -4.021 -4.388 272 1HB MET 44 1HB MET 44 19.157 -2.719 -2.693 273 2HB MET 44 2HB MET 44 20.123 -1.418 -3.378 274 1HG MET 44 1HG MET 44 19.538 -2.057 -5.600 275 2HG MET 44 2HG MET 44 18.756 -3.527 -5.025 276 1HE MET 44 1HE MET 44 17.205 -3.107 -2.816 277 2HE MET 44 2HE MET 44 15.778 -2.083 -2.981 278 3HE MET 44 3HE MET 44 16.016 -3.448 -4.073 279 H ASP 45 H ASP 45 21.456 -1.440 -5.139 280 HA ASP 45 HA ASP 45 24.286 -1.336 -4.952 281 1HB ASP 45 1HB ASP 45 22.206 -0.016 -6.460 282 2HB ASP 45 2HB ASP 45 23.392 1.156 -5.892 283 H ASN 46 H ASN 46 25.485 0.659 -4.302 284 HA ASN 46 HA ASN 46 24.992 1.235 -1.578 285 1HB ASN 46 1HB ASN 46 27.121 1.566 -3.384 286 2HB ASN 46 2HB ASN 46 26.729 3.186 -2.812 287 1HD2 ASN 46 1HD2 ASN 46 25.897 2.637 -0.246 288 2HD2 ASN 46 2HD2 ASN 46 27.236 2.048 0.673 289 HA PRO 47 HA PRO 47 23.748 5.648 -3.115 290 1HB PRO 47 1HB PRO 47 23.322 5.958 -5.778 291 2HB PRO 47 2HB PRO 47 24.902 6.202 -5.023 292 1HG PRO 47 1HG PRO 47 23.857 3.819 -6.504 293 2HG PRO 47 2HG PRO 47 25.452 4.587 -6.603 294 1HD PRO 47 1HD PRO 47 25.007 2.333 -5.170 295 2HD PRO 47 2HD PRO 47 26.212 3.547 -4.691 296 H THR 48 H THR 48 22.436 2.794 -4.644 297 HA THR 48 HA THR 48 19.812 3.877 -5.058 298 HB THR 48 HB THR 48 20.775 1.011 -5.064 299 HG1 THR 48 HG1 THR 48 21.546 2.533 -6.736 300 1HG2 THR 48 1HG2 THR 48 18.664 0.517 -6.230 301 2HG2 THR 48 2HG2 THR 48 18.142 2.181 -5.970 302 3HG2 THR 48 3HG2 THR 48 18.387 1.109 -4.593 303 H THR 49 H THR 49 21.397 1.956 -2.571 304 HA THR 49 HA THR 49 19.044 1.310 -1.118 305 HB THR 49 HB THR 49 21.928 1.421 -0.215 306 HG1 THR 49 HG1 THR 49 22.013 -0.431 -1.217 307 1HG2 THR 49 1HG2 THR 49 20.450 1.622 1.707 308 2HG2 THR 49 2HG2 THR 49 21.183 0.018 1.671 309 3HG2 THR 49 3HG2 THR 49 19.511 0.236 1.155 310 H THR 50 H THR 50 21.452 3.892 -0.819 311 HA THR 50 HA THR 50 20.584 5.059 1.543 312 HB THR 50 HB THR 50 21.359 7.024 -0.487 313 HG1 THR 50 HG1 THR 50 23.592 6.016 -0.408 314 1HG2 THR 50 1HG2 THR 50 21.433 7.180 2.070 315 2HG2 THR 50 2HG2 THR 50 22.843 7.757 1.181 316 3HG2 THR 50 3HG2 THR 50 22.879 6.177 1.964 317 H GLN 51 H GLN 51 19.491 5.676 -1.780 318 HA GLN 51 HA GLN 51 17.653 7.713 -1.122 319 1HB GLN 51 1HB GLN 51 18.375 7.506 -3.391 320 2HB GLN 51 2HB GLN 51 17.829 5.837 -3.477 321 1HG GLN 51 1HG GLN 51 15.676 7.639 -2.778 322 2HG GLN 51 2HG GLN 51 16.444 8.082 -4.302 323 1HE2 GLN 51 1HE2 GLN 51 14.158 6.148 -2.849 324 2HE2 GLN 51 2HE2 GLN 51 13.899 5.023 -4.134 325 H TYR 52 H TYR 52 17.153 4.248 -1.777 326 HA TYR 52 HA TYR 52 14.409 4.162 -1.355 327 1HB TYR 52 1HB TYR 52 16.603 2.138 -1.101 328 2HB TYR 52 2HB TYR 52 14.973 1.718 -0.584 329 HD1 TYR 52 HD1 TYR 52 16.344 3.616 -3.504 330 HD2 TYR 52 HD2 TYR 52 13.941 0.377 -2.146 331 HE1 TYR 52 HE1 TYR 52 15.747 3.092 -5.831 332 HE2 TYR 52 HE2 TYR 52 13.339 -0.157 -4.470 333 HH TYR 52 HH TYR 52 14.794 1.560 -7.188 334 H ALA 53 H ALA 53 17.015 3.528 0.990 335 HA ALA 53 HA ALA 53 15.362 3.094 3.212 336 1HB ALA 53 1HB ALA 53 17.326 3.358 4.554 337 2HB ALA 53 2HB ALA 53 17.782 2.524 3.067 338 3HB ALA 53 3HB ALA 53 18.148 4.238 3.265 339 H SER 54 H SER 54 16.145 5.971 1.541 340 HA SER 54 HA SER 54 15.781 7.789 3.722 341 1HB SER 54 1HB SER 54 17.043 8.195 1.504 342 2HB SER 54 2HB SER 54 15.451 8.517 0.819 343 HG SER 54 HG SER 54 16.502 9.831 3.104 344 H LEU 55 H LEU 55 13.783 6.935 0.896 345 HA LEU 55 HA LEU 55 11.502 8.344 1.949 346 1HB LEU 55 1HB LEU 55 10.515 7.995 -0.075 347 2HB LEU 55 2HB LEU 55 12.212 7.872 -0.532 348 HG LEU 55 HG LEU 55 11.747 5.293 -0.083 349 1HD1 LEU 55 1HD1 LEU 55 9.143 6.471 0.018 350 2HD1 LEU 55 2HD1 LEU 55 9.612 4.783 0.220 351 3HD1 LEU 55 3HD1 LEU 55 9.260 5.414 -1.389 352 1HD2 LEU 55 1HD2 LEU 55 12.099 5.132 -2.281 353 2HD2 LEU 55 2HD2 LEU 55 12.139 6.895 -2.280 354 3HD2 LEU 55 3HD2 LEU 55 10.643 6.047 -2.671 355 H MET 56 H MET 56 12.837 5.243 2.324 356 HA MET 56 HA MET 56 10.661 3.568 2.595 357 1HB MET 56 1HB MET 56 13.403 3.488 3.250 358 2HB MET 56 2HB MET 56 12.536 3.048 4.715 359 1HG MET 56 1HG MET 56 13.084 1.076 3.442 360 2HG MET 56 2HG MET 56 11.338 1.311 3.481 361 1HE MET 56 1HE MET 56 10.276 0.770 0.247 362 2HE MET 56 2HE MET 56 9.968 1.225 1.923 363 3HE MET 56 3HE MET 56 10.080 2.470 0.678 364 H HIS 57 H HIS 57 12.110 5.669 5.074 365 HA HIS 57 HA HIS 57 10.082 5.017 7.008 366 1HB HIS 57 1HB HIS 57 12.584 5.822 7.340 367 2HB HIS 57 2HB HIS 57 11.836 7.416 7.307 368 HD1 HIS 57 HD1 HIS 57 13.046 5.338 9.720 369 HD2 HIS 57 HD2 HIS 57 9.281 7.011 9.182 370 HE1 HIS 57 HE1 HIS 57 11.970 5.317 11.993 371 H SER 58 H SER 58 10.871 7.830 4.995 372 HA SER 58 HA SER 58 8.921 9.581 5.907 373 1HB SER 58 1HB SER 58 10.823 9.994 4.220 374 2HB SER 58 2HB SER 58 9.694 9.407 2.999 375 HG SER 58 HG SER 58 9.857 11.833 3.908 376 H PHE 59 H PHE 59 8.627 6.778 3.891 377 HA PHE 59 HA PHE 59 6.056 7.426 2.813 378 1HB PHE 59 1HB PHE 59 7.424 5.898 1.575 379 2HB PHE 59 2HB PHE 59 7.611 4.842 2.972 380 HD1 PHE 59 HD1 PHE 59 6.582 2.831 2.594 381 HD2 PHE 59 HD2 PHE 59 4.651 6.405 1.322 382 HE1 PHE 59 HE1 PHE 59 4.637 1.515 1.860 383 HE2 PHE 59 HE2 PHE 59 2.703 5.094 0.587 384 HZ PHE 59 HZ PHE 59 2.693 2.646 0.856 385 H ILE 60 H ILE 60 7.115 5.024 5.229 386 HA ILE 60 HA ILE 60 4.562 4.240 6.050 387 HB ILE 60 HB ILE 60 7.105 4.276 7.679 388 1HG1 ILE 60 1HG1 ILE 60 7.318 3.004 5.590 389 2HG1 ILE 60 2HG1 ILE 60 7.322 1.931 6.986 390 1HG2 ILE 60 1HG2 ILE 60 5.481 2.151 8.470 391 2HG2 ILE 60 2HG2 ILE 60 5.829 3.622 9.377 392 3HG2 ILE 60 3HG2 ILE 60 4.401 3.539 8.345 393 1HD1 ILE 60 1HD1 ILE 60 4.979 2.458 5.173 394 2HD1 ILE 60 2HD1 ILE 60 5.997 1.017 5.172 395 3HD1 ILE 60 3HD1 ILE 60 4.984 1.382 6.569 396 H LEU 61 H LEU 61 6.724 6.725 7.376 397 HA LEU 61 HA LEU 61 5.081 7.498 9.519 398 1HB LEU 61 1HB LEU 61 7.535 8.316 8.367 399 2HB LEU 61 2HB LEU 61 6.523 9.749 8.530 400 HG LEU 61 HG LEU 61 6.268 9.274 10.931 401 1HD1 LEU 61 1HD1 LEU 61 7.532 6.777 10.140 402 2HD1 LEU 61 2HD1 LEU 61 6.586 7.165 11.577 403 3HD1 LEU 61 3HD1 LEU 61 8.311 7.531 11.531 404 1HD2 LEU 61 1HD2 LEU 61 8.913 9.732 9.659 405 2HD2 LEU 61 2HD2 LEU 61 8.864 9.483 11.405 406 3HD2 LEU 61 3HD2 LEU 61 7.943 10.799 10.674 407 H LYS 62 H LYS 62 4.948 8.202 6.134 408 HA LYS 62 HA LYS 62 3.285 10.526 6.360 409 1HB LYS 62 1HB LYS 62 4.700 10.200 4.400 410 2HB LYS 62 2HB LYS 62 3.850 8.711 4.008 411 1HG LYS 62 1HG LYS 62 3.021 10.390 2.562 412 2HG LYS 62 2HG LYS 62 1.763 10.077 3.760 413 1HD LYS 62 1HD LYS 62 1.852 12.414 3.593 414 2HD LYS 62 2HD LYS 62 2.763 12.041 5.058 415 1HE LYS 62 1HE LYS 62 4.625 12.932 4.220 416 2HE LYS 62 2HE LYS 62 4.463 12.021 2.719 417 1HZ LYS 62 1HZ LYS 62 3.517 13.750 1.672 418 2HZ LYS 62 2HZ LYS 62 4.274 14.672 2.870 419 3HZ LYS 62 3HZ LYS 62 2.642 14.257 3.029 420 H ALA 63 H ALA 63 2.688 7.165 5.333 421 HA ALA 63 HA ALA 63 -0.120 7.465 5.124 422 1HB ALA 63 1HB ALA 63 1.411 4.909 5.577 423 2HB ALA 63 2HB ALA 63 -0.200 5.080 4.881 424 3HB ALA 63 3HB ALA 63 1.207 5.684 4.006 425 H ARG 64 H ARG 64 2.008 6.397 7.728 426 HA ARG 64 HA ARG 64 0.125 5.368 9.490 427 1HB ARG 64 1HB ARG 64 2.651 5.341 9.719 428 2HB ARG 64 2HB ARG 64 2.530 6.986 10.327 429 1HG ARG 64 1HG ARG 64 0.710 5.635 11.874 430 2HG ARG 64 2HG ARG 64 2.006 4.456 11.661 431 1HD ARG 64 1HD ARG 64 2.348 5.846 13.653 432 2HD ARG 64 2HD ARG 64 3.634 6.066 12.467 433 HE ARG 64 HE ARG 64 1.939 8.063 11.859 434 1HH1 ARG 64 1HH1 ARG 64 3.341 7.006 14.865 435 2HH1 ARG 64 2HH1 ARG 64 3.349 8.590 15.568 436 1HH2 ARG 64 1HH2 ARG 64 1.944 10.152 12.774 437 2HH2 ARG 64 2HH2 ARG 64 2.554 10.378 14.378 438 H SER 65 H SER 65 1.070 8.707 8.887 439 HA SER 65 HA SER 65 -0.532 9.756 11.034 440 1HB SER 65 1HB SER 65 1.601 10.741 9.697 441 2HB SER 65 2HB SER 65 0.299 11.561 8.836 442 HG SER 65 HG SER 65 1.031 12.748 10.660 443 H THR 66 H THR 66 -1.022 8.919 7.731 444 HA THR 66 HA THR 66 -3.343 10.582 7.346 445 HB THR 66 HB THR 66 -2.682 8.199 5.639 446 HG1 THR 66 HG1 THR 66 -1.165 9.448 4.557 447 1HG2 THR 66 1HG2 THR 66 -4.741 9.798 5.408 448 2HG2 THR 66 2HG2 THR 66 -3.846 9.299 3.973 449 3HG2 THR 66 3HG2 THR 66 -3.564 10.889 4.680 450 H VAL 67 H VAL 67 -2.678 7.310 8.373 451 HA VAL 67 HA VAL 67 -5.120 6.076 7.999 452 HB VAL 67 HB VAL 67 -3.382 5.734 10.445 453 1HG1 VAL 67 1HG1 VAL 67 -4.876 4.195 11.019 454 2HG1 VAL 67 2HG1 VAL 67 -5.781 4.457 9.527 455 3HG1 VAL 67 3HG1 VAL 67 -4.454 3.295 9.563 456 1HG2 VAL 67 1HG2 VAL 67 -1.789 5.252 8.925 457 2HG2 VAL 67 2HG2 VAL 67 -2.655 3.721 8.794 458 3HG2 VAL 67 3HG2 VAL 67 -2.954 5.007 7.624 459 H ARG 68 H ARG 68 -4.117 8.267 10.580 460 HA ARG 68 HA ARG 68 -6.268 7.980 12.310 461 1HB ARG 68 1HB ARG 68 -4.669 10.461 11.656 462 2HB ARG 68 2HB ARG 68 -5.760 10.313 13.028 463 1HG ARG 68 1HG ARG 68 -3.862 8.139 12.959 464 2HG ARG 68 2HG ARG 68 -3.054 9.708 12.968 465 1HD ARG 68 1HD ARG 68 -4.118 10.352 14.977 466 2HD ARG 68 2HD ARG 68 -5.270 9.020 14.879 467 HE ARG 68 HE ARG 68 -2.536 8.162 15.067 468 1HH1 ARG 68 1HH1 ARG 68 -5.352 9.150 16.859 469 2HH1 ARG 68 2HH1 ARG 68 -4.882 8.324 18.307 470 1HH2 ARG 68 1HH2 ARG 68 -1.905 7.071 16.968 471 2HH2 ARG 68 2HH2 ARG 68 -2.920 7.143 18.368 472 H ASP 69 H ASP 69 -5.983 9.878 9.359 473 HA ASP 69 HA ASP 69 -8.254 11.453 9.547 474 1HB ASP 69 1HB ASP 69 -6.469 11.499 7.740 475 2HB ASP 69 2HB ASP 69 -7.322 10.154 6.987 476 H ILE 70 H ILE 70 -7.944 8.066 8.691 477 HA ILE 70 HA ILE 70 -10.585 7.715 7.717 478 HB ILE 70 HB ILE 70 -8.817 5.609 8.964 479 1HG1 ILE 70 1HG1 ILE 70 -8.989 6.425 6.056 480 2HG1 ILE 70 2HG1 ILE 70 -7.689 6.902 7.143 481 1HG2 ILE 70 1HG2 ILE 70 -10.375 4.132 8.388 482 2HG2 ILE 70 2HG2 ILE 70 -11.443 5.491 8.039 483 3HG2 ILE 70 3HG2 ILE 70 -10.469 4.781 6.751 484 1HD1 ILE 70 1HD1 ILE 70 -6.731 5.106 6.135 485 2HD1 ILE 70 2HD1 ILE 70 -7.504 4.300 7.501 486 3HD1 ILE 70 3HD1 ILE 70 -8.267 4.269 5.911 487 H ASP 71 H ASP 71 -9.151 7.634 10.906 488 HA ASP 71 HA ASP 71 -11.562 8.048 12.251 489 1HB ASP 71 1HB ASP 71 -11.074 5.290 11.565 490 2HB ASP 71 2HB ASP 71 -11.067 5.489 13.315 491 HA PRO 72 HA PRO 72 -8.802 8.963 15.533 492 1HB PRO 72 1HB PRO 72 -10.315 8.447 17.727 493 2HB PRO 72 2HB PRO 72 -10.597 9.836 16.671 494 1HG PRO 72 1HG PRO 72 -12.003 7.195 16.743 495 2HG PRO 72 2HG PRO 72 -12.687 8.822 16.574 496 1HD PRO 72 1HD PRO 72 -12.326 7.167 14.462 497 2HD PRO 72 2HD PRO 72 -12.195 8.932 14.325 498 H GLN 73 H GLN 73 -9.911 5.799 15.044 499 HA GLN 73 HA GLN 73 -7.866 4.765 16.892 500 1HB GLN 73 1HB GLN 73 -10.436 3.332 16.224 501 2HB GLN 73 2HB GLN 73 -9.242 2.883 17.435 502 1HG GLN 73 1HG GLN 73 -9.794 4.902 18.711 503 2HG GLN 73 2HG GLN 73 -11.015 5.314 17.508 504 1HE2 GLN 73 1HE2 GLN 73 -12.743 5.205 18.877 505 2HE2 GLN 73 2HE2 GLN 73 -13.306 3.733 19.583 506 H ASN 74 H ASN 74 -7.906 2.125 16.190 507 HA ASN 74 HA ASN 74 -7.109 0.630 14.672 508 1HB ASN 74 1HB ASN 74 -9.211 1.425 13.442 509 2HB ASN 74 2HB ASN 74 -8.131 2.431 12.481 510 1HD2 ASN 74 1HD2 ASN 74 -9.227 1.003 10.829 511 2HD2 ASN 74 2HD2 ASN 74 -8.413 -0.465 10.420 512 H ASP 75 H ASP 75 -5.377 0.292 13.149 513 HA ASP 75 HA ASP 75 -3.791 2.602 12.381 514 1HB ASP 75 1HB ASP 75 -3.227 1.398 14.794 515 2HB ASP 75 2HB ASP 75 -2.118 0.586 13.692 516 H LEU 76 H LEU 76 -1.748 1.825 11.193 517 HA LEU 76 HA LEU 76 -2.576 -0.324 9.383 518 1HB LEU 76 1HB LEU 76 -1.369 2.211 9.020 519 2HB LEU 76 2HB LEU 76 -0.197 0.993 8.520 520 HG LEU 76 HG LEU 76 -1.393 1.650 6.582 521 1HD1 LEU 76 1HD1 LEU 76 -1.611 -0.434 5.845 522 2HD1 LEU 76 2HD1 LEU 76 -3.000 -0.731 6.889 523 3HD1 LEU 76 3HD1 LEU 76 -1.365 -0.968 7.508 524 1HD2 LEU 76 1HD2 LEU 76 -4.021 1.052 6.790 525 2HD2 LEU 76 2HD2 LEU 76 -3.352 2.668 7.019 526 3HD2 LEU 76 3HD2 LEU 76 -3.691 1.648 8.418 527 H THR 77 H THR 77 -1.397 -2.145 9.058 528 HA THR 77 HA THR 77 1.176 -2.403 10.451 529 HB THR 77 HB THR 77 -0.563 -3.412 11.887 530 HG1 THR 77 HG1 THR 77 1.240 -4.520 12.230 531 1HG2 THR 77 1HG2 THR 77 -1.006 -5.279 9.553 532 2HG2 THR 77 2HG2 THR 77 -2.145 -4.061 10.128 533 3HG2 THR 77 3HG2 THR 77 -1.728 -5.433 11.154 534 H PHE 78 H PHE 78 0.174 -2.143 7.596 535 HA PHE 78 HA PHE 78 2.067 -3.837 6.389 536 1HB PHE 78 1HB PHE 78 -0.194 -5.250 7.009 537 2HB PHE 78 2HB PHE 78 -0.540 -4.732 5.363 538 HD1 PHE 78 HD1 PHE 78 1.766 -4.929 3.846 539 HD2 PHE 78 HD2 PHE 78 0.630 -7.375 7.140 540 HE1 PHE 78 HE1 PHE 78 3.175 -6.750 2.976 541 HE2 PHE 78 HE2 PHE 78 2.038 -9.198 6.276 542 HZ PHE 78 HZ PHE 78 3.313 -8.887 4.192 543 H LEU 79 H LEU 79 2.682 -2.830 4.595 544 HA LEU 79 HA LEU 79 0.692 -1.284 3.080 545 1HB LEU 79 1HB LEU 79 3.032 -0.317 4.475 546 2HB LEU 79 2HB LEU 79 3.116 0.050 2.754 547 HG LEU 79 HG LEU 79 1.074 1.304 2.858 548 1HD1 LEU 79 1HD1 LEU 79 -0.272 0.082 4.354 549 2HD1 LEU 79 2HD1 LEU 79 -0.014 1.649 5.120 550 3HD1 LEU 79 3HD1 LEU 79 0.898 0.242 5.664 551 1HD2 LEU 79 1HD2 LEU 79 2.291 2.352 5.319 552 2HD2 LEU 79 2HD2 LEU 79 2.006 3.138 3.767 553 3HD2 LEU 79 3HD2 LEU 79 3.410 2.091 3.981 554 H ARG 80 H ARG 80 0.517 -2.570 1.325 555 HA ARG 80 HA ARG 80 2.995 -3.369 -0.046 556 1HB ARG 80 1HB ARG 80 0.339 -4.639 0.273 557 2HB ARG 80 2HB ARG 80 1.095 -4.812 -1.306 558 1HG ARG 80 1HG ARG 80 2.660 -6.230 -0.546 559 2HG ARG 80 2HG ARG 80 2.851 -5.366 0.981 560 1HD ARG 80 1HD ARG 80 1.899 -7.697 1.146 561 2HD ARG 80 2HD ARG 80 0.960 -6.425 1.925 562 HE ARG 80 HE ARG 80 -0.745 -6.837 0.457 563 1HH1 ARG 80 1HH1 ARG 80 2.179 -8.284 -0.759 564 2HH1 ARG 80 2HH1 ARG 80 1.384 -9.111 -2.058 565 1HH2 ARG 80 1HH2 ARG 80 -1.803 -7.920 -1.249 566 2HH2 ARG 80 2HH2 ARG 80 -0.881 -8.903 -2.336 567 H ILE 81 H ILE 81 3.506 -2.350 -1.862 568 HA ILE 81 HA ILE 81 1.380 -0.902 -3.301 569 HB ILE 81 HB ILE 81 4.316 -0.240 -3.427 570 1HG1 ILE 81 1HG1 ILE 81 2.205 0.966 -1.625 571 2HG1 ILE 81 2HG1 ILE 81 3.568 -0.017 -1.101 572 1HG2 ILE 81 1HG2 ILE 81 3.686 1.217 -4.975 573 2HG2 ILE 81 2HG2 ILE 81 2.027 0.635 -4.843 574 3HG2 ILE 81 3HG2 ILE 81 2.575 1.971 -3.832 575 1HD1 ILE 81 1HD1 ILE 81 4.601 2.119 -2.634 576 2HD1 ILE 81 2HD1 ILE 81 3.441 2.787 -1.485 577 3HD1 ILE 81 3HD1 ILE 81 4.790 1.808 -0.908 578 H ARG 82 H ARG 82 0.827 -2.575 -4.697 579 HA ARG 82 HA ARG 82 2.702 -4.096 -6.174 580 1HB ARG 82 1HB ARG 82 0.044 -4.313 -5.719 581 2HB ARG 82 2HB ARG 82 0.025 -3.665 -7.354 582 1HG ARG 82 1HG ARG 82 1.219 -5.508 -8.207 583 2HG ARG 82 2HG ARG 82 1.657 -6.066 -6.591 584 1HD ARG 82 1HD ARG 82 -0.066 -7.502 -7.186 585 2HD ARG 82 2HD ARG 82 -0.891 -6.275 -6.226 586 HE ARG 82 HE ARG 82 -2.083 -5.699 -8.083 587 1HH1 ARG 82 1HH1 ARG 82 0.763 -7.440 -9.079 588 2HH1 ARG 82 2HH1 ARG 82 0.301 -7.498 -10.748 589 1HH2 ARG 82 1HH2 ARG 82 -2.702 -5.771 -10.277 590 2HH2 ARG 82 2HH2 ARG 82 -1.669 -6.548 -11.428 591 H SER 83 H SER 83 3.888 -3.545 -7.873 592 HA SER 83 HA SER 83 3.067 -1.196 -9.452 593 1HB SER 83 1HB SER 83 5.908 -1.984 -9.557 594 2HB SER 83 2HB SER 83 5.185 -0.382 -9.417 595 HG SER 83 HG SER 83 6.177 -1.990 -7.482 596 H LYS 84 H LYS 84 4.753 -1.386 -11.566 597 HA LYS 84 HA LYS 84 3.668 -3.695 -12.972 598 1HB LYS 84 1HB LYS 84 5.068 -1.188 -13.891 599 2HB LYS 84 2HB LYS 84 4.694 -2.514 -14.985 600 1HG LYS 84 1HG LYS 84 2.273 -2.179 -13.956 601 2HG LYS 84 2HG LYS 84 2.893 -0.547 -13.694 602 1HD LYS 84 1HD LYS 84 2.077 -0.267 -15.798 603 2HD LYS 84 2HD LYS 84 3.680 -0.875 -16.219 604 1HE LYS 84 1HE LYS 84 2.186 -2.121 -17.537 605 2HE LYS 84 2HE LYS 84 2.628 -3.192 -16.209 606 1HZ LYS 84 1HZ LYS 84 0.065 -2.065 -16.886 607 2HZ LYS 84 2HZ LYS 84 0.451 -1.926 -15.245 608 3HZ LYS 84 3HZ LYS 84 0.435 -3.448 -15.983 609 H LYS 85 H LYS 85 6.753 -2.344 -11.980 610 HA LYS 85 HA LYS 85 8.283 -4.357 -13.380 611 1HB LYS 85 1HB LYS 85 8.904 -1.996 -11.672 612 2HB LYS 85 2HB LYS 85 10.120 -3.261 -11.796 613 1HG LYS 85 1HG LYS 85 9.265 -2.765 -14.416 614 2HG LYS 85 2HG LYS 85 9.458 -1.184 -13.655 615 1HD LYS 85 1HD LYS 85 11.547 -1.815 -14.661 616 2HD LYS 85 2HD LYS 85 11.723 -1.885 -12.906 617 1HE LYS 85 1HE LYS 85 11.501 -4.278 -12.927 618 2HE LYS 85 2HE LYS 85 11.119 -4.271 -14.648 619 1HZ LYS 85 1HZ LYS 85 13.440 -3.100 -14.782 620 2HZ LYS 85 2HZ LYS 85 13.323 -4.786 -14.709 621 3HZ LYS 85 3HZ LYS 85 13.702 -3.903 -13.316 622 H ASN 86 H ASN 86 7.180 -3.730 -10.102 623 HA ASN 86 HA ASN 86 7.257 -6.420 -9.332 624 1HB ASN 86 1HB ASN 86 9.127 -6.284 -7.654 625 2HB ASN 86 2HB ASN 86 9.652 -6.286 -9.335 626 1HD2 ASN 86 1HD2 ASN 86 11.580 -5.273 -8.955 627 2HD2 ASN 86 2HD2 ASN 86 11.700 -3.618 -8.475 628 H GLU 87 H GLU 87 6.756 -6.723 -7.026 629 HA GLU 87 HA GLU 87 5.223 -4.438 -6.027 630 1HB GLU 87 1HB GLU 87 4.077 -6.622 -6.345 631 2HB GLU 87 2HB GLU 87 5.145 -7.326 -5.139 632 1HG GLU 87 1HG GLU 87 4.193 -6.083 -3.401 633 2HG GLU 87 2HG GLU 87 3.411 -4.963 -4.516 634 H ILE 88 H ILE 88 5.945 -3.264 -4.387 635 HA ILE 88 HA ILE 88 8.111 -4.354 -2.724 636 HB ILE 88 HB ILE 88 7.298 -1.468 -3.086 637 1HG1 ILE 88 1HG1 ILE 88 9.924 -2.139 -4.065 638 2HG1 ILE 88 2HG1 ILE 88 8.717 -3.161 -4.838 639 1HG2 ILE 88 1HG2 ILE 88 8.320 -1.745 -0.958 640 2HG2 ILE 88 2HG2 ILE 88 9.585 -2.773 -1.629 641 3HG2 ILE 88 3HG2 ILE 88 9.539 -1.056 -2.030 642 1HD1 ILE 88 1HD1 ILE 88 9.360 -0.897 -5.906 643 2HD1 ILE 88 2HD1 ILE 88 7.663 -1.375 -5.842 644 3HD1 ILE 88 3HD1 ILE 88 8.297 -0.212 -4.678 645 H MET 89 H MET 89 7.096 -5.387 -1.072 646 HA MET 89 HA MET 89 4.891 -4.093 0.317 647 1HB MET 89 1HB MET 89 4.868 -6.202 1.666 648 2HB MET 89 2HB MET 89 4.623 -6.444 -0.058 649 1HG MET 89 1HG MET 89 6.897 -7.178 -0.328 650 2HG MET 89 2HG MET 89 7.250 -6.808 1.359 651 1HE MET 89 1HE MET 89 7.908 -9.808 2.112 652 2HE MET 89 2HE MET 89 7.566 -8.228 2.816 653 3HE MET 89 3HE MET 89 6.603 -9.629 3.286 654 H VAL 90 H VAL 90 5.027 -3.107 2.251 655 HA VAL 90 HA VAL 90 7.422 -3.448 3.888 656 HB VAL 90 HB VAL 90 6.452 -0.743 2.952 657 1HG1 VAL 90 1HG1 VAL 90 8.669 -1.462 4.869 658 2HG1 VAL 90 2HG1 VAL 90 8.310 0.160 4.272 659 3HG1 VAL 90 3HG1 VAL 90 7.142 -0.686 5.287 660 1HG2 VAL 90 1HG2 VAL 90 9.062 -2.174 2.455 661 2HG2 VAL 90 2HG2 VAL 90 7.772 -1.946 1.274 662 3HG2 VAL 90 3HG2 VAL 90 8.647 -0.550 1.905 663 H ALA 91 H ALA 91 6.836 -3.745 5.928 664 HA ALA 91 HA ALA 91 4.429 -2.388 6.933 665 1HB ALA 91 1HB ALA 91 4.273 -4.960 6.329 666 2HB ALA 91 2HB ALA 91 5.000 -5.127 7.927 667 3HB ALA 91 3HB ALA 91 3.461 -4.286 7.742 668 HA PRO 92 HA PRO 92 6.848 -1.247 10.413 669 1HB PRO 92 1HB PRO 92 4.986 -1.253 12.389 670 2HB PRO 92 2HB PRO 92 5.040 -0.020 11.123 671 1HG PRO 92 1HG PRO 92 3.305 -2.451 11.328 672 2HG PRO 92 2HG PRO 92 2.870 -0.805 10.834 673 1HD PRO 92 1HD PRO 92 3.306 -2.793 9.049 674 2HD PRO 92 2HD PRO 92 3.685 -1.095 8.698 675 H ASP 93 H ASP 93 8.323 -2.525 11.324 676 HA ASP 93 HA ASP 93 7.533 -5.131 12.386 677 1HB ASP 93 1HB ASP 93 10.335 -4.037 12.131 678 2HB ASP 93 2HB ASP 93 9.848 -5.718 12.324 679 H LYS 94 H LYS 94 9.416 -5.600 14.286 680 HA LYS 94 HA LYS 94 8.331 -4.571 16.603 681 1HB LYS 94 1HB LYS 94 10.540 -6.240 15.902 682 2HB LYS 94 2HB LYS 94 11.080 -5.090 17.117 683 1HG LYS 94 1HG LYS 94 8.496 -6.412 17.638 684 2HG LYS 94 2HG LYS 94 9.932 -7.437 17.702 685 1HD LYS 94 1HD LYS 94 10.949 -5.714 19.239 686 2HD LYS 94 2HD LYS 94 9.356 -4.957 19.312 687 1HE LYS 94 1HE LYS 94 8.411 -6.770 20.422 688 2HE LYS 94 2HE LYS 94 9.689 -7.872 19.912 689 1HZ LYS 94 1HZ LYS 94 11.000 -7.274 21.614 690 2HZ LYS 94 2HZ LYS 94 9.556 -6.769 22.335 691 3HZ LYS 94 3HZ LYS 94 10.549 -5.644 21.554 692 H ASP 95 H ASP 95 11.334 -3.516 15.000 693 HA ASP 95 HA ASP 95 10.877 -0.807 15.936 694 1HB ASP 95 1HB ASP 95 12.924 -0.553 17.111 695 2HB ASP 95 2HB ASP 95 12.192 -2.030 17.734 696 H TYR 96 H TYR 96 11.248 -2.538 13.423 697 HA TYR 96 HA TYR 96 12.956 -0.605 12.043 698 1HB TYR 96 1HB TYR 96 13.930 -2.539 10.705 699 2HB TYR 96 2HB TYR 96 14.504 -2.370 12.360 700 HD1 TYR 96 HD1 TYR 96 13.700 -3.936 14.111 701 HD2 TYR 96 HD2 TYR 96 12.724 -4.474 10.005 702 HE1 TYR 96 HE1 TYR 96 13.063 -6.266 14.574 703 HE2 TYR 96 HE2 TYR 96 12.083 -6.805 10.457 704 HH TYR 96 HH TYR 96 12.314 -8.173 13.729 705 H PHE 97 H PHE 97 12.846 -1.223 9.545 706 HA PHE 97 HA PHE 97 10.030 -1.808 8.910 707 1HB PHE 97 1HB PHE 97 11.802 0.407 7.909 708 2HB PHE 97 2HB PHE 97 10.430 -0.154 6.959 709 HD1 PHE 97 HD1 PHE 97 8.254 -0.504 8.641 710 HD2 PHE 97 HD2 PHE 97 11.387 2.351 9.033 711 HE1 PHE 97 HE1 PHE 97 6.758 0.955 9.939 712 HE2 PHE 97 HE2 PHE 97 9.896 3.814 10.332 713 HZ PHE 97 HZ PHE 97 7.578 3.117 10.788 714 H LEU 98 H LEU 98 9.933 -3.642 7.806 715 HA LEU 98 HA LEU 98 12.197 -4.597 6.282 716 1HB LEU 98 1HB LEU 98 10.200 -5.824 7.694 717 2HB LEU 98 2HB LEU 98 9.672 -6.054 6.028 718 HG LEU 98 HG LEU 98 12.468 -6.726 6.350 719 1HD1 LEU 98 1HD1 LEU 98 12.459 -8.324 7.963 720 2HD1 LEU 98 2HD1 LEU 98 10.740 -8.668 7.772 721 3HD1 LEU 98 3HD1 LEU 98 11.259 -7.235 8.660 722 1HD2 LEU 98 1HD2 LEU 98 11.928 -8.355 4.882 723 2HD2 LEU 98 2HD2 LEU 98 10.485 -7.367 4.655 724 3HD2 LEU 98 3HD2 LEU 98 10.434 -8.770 5.723 725 H ILE 99 H ILE 99 12.339 -4.797 4.088 726 HA ILE 99 HA ILE 99 10.070 -3.908 2.459 727 HB ILE 99 HB ILE 99 12.874 -2.879 2.023 728 1HG1 ILE 99 1HG1 ILE 99 11.363 -0.682 2.588 729 2HG1 ILE 99 2HG1 ILE 99 10.642 -1.871 3.667 730 1HG2 ILE 99 1HG2 ILE 99 12.024 -2.627 -0.044 731 2HG2 ILE 99 2HG2 ILE 99 10.357 -2.762 0.513 732 3HG2 ILE 99 3HG2 ILE 99 11.215 -1.229 0.663 733 1HD1 ILE 99 1HD1 ILE 99 12.368 -0.655 4.815 734 2HD1 ILE 99 2HD1 ILE 99 12.874 -2.330 4.596 735 3HD1 ILE 99 3HD1 ILE 99 13.538 -1.066 3.562 736 H VAL 100 H VAL 100 9.673 -5.777 1.417 737 HA VAL 100 HA VAL 100 11.917 -7.260 0.248 738 HB VAL 100 HB VAL 100 9.021 -8.074 0.538 739 1HG1 VAL 100 1HG1 VAL 100 10.667 -10.310 0.164 740 2HG1 VAL 100 2HG1 VAL 100 9.479 -9.648 -0.961 741 3HG1 VAL 100 3HG1 VAL 100 11.165 -9.135 -1.052 742 1HG2 VAL 100 1HG2 VAL 100 11.470 -8.610 2.179 743 2HG2 VAL 100 2HG2 VAL 100 9.873 -8.081 2.707 744 3HG2 VAL 100 3HG2 VAL 100 10.118 -9.742 2.167 745 H ILE 101 H ILE 101 12.432 -6.713 -1.762 746 HA ILE 101 HA ILE 101 10.327 -5.760 -3.573 747 HB ILE 101 HB ILE 101 13.328 -5.558 -3.852 748 1HG1 ILE 101 1HG1 ILE 101 11.286 -3.413 -3.231 749 2HG1 ILE 101 2HG1 ILE 101 12.348 -4.159 -2.042 750 1HG2 ILE 101 1HG2 ILE 101 12.890 -5.244 -6.013 751 2HG2 ILE 101 2HG2 ILE 101 11.152 -5.166 -5.726 752 3HG2 ILE 101 3HG2 ILE 101 12.141 -3.718 -5.540 753 1HD1 ILE 101 1HD1 ILE 101 13.938 -2.705 -2.520 754 2HD1 ILE 101 2HD1 ILE 101 13.918 -3.194 -4.215 755 3HD1 ILE 101 3HD1 ILE 101 12.844 -1.913 -3.654 756 H GLN 102 H GLN 102 9.445 -7.346 -4.731 757 HA GLN 102 HA GLN 102 11.065 -8.915 -6.493 758 1HB GLN 102 1HB GLN 102 10.489 -11.106 -5.681 759 2HB GLN 102 2HB GLN 102 11.239 -10.205 -4.370 760 1HG GLN 102 1HG GLN 102 9.130 -9.830 -3.323 761 2HG GLN 102 2HG GLN 102 8.266 -10.491 -4.711 762 1HE2 GLN 102 1HE2 GLN 102 8.291 -11.271 -1.863 763 2HE2 GLN 102 2HE2 GLN 102 8.704 -12.949 -1.851 764 H ASN 103 H ASN 103 9.843 -10.001 -8.100 765 HA ASN 103 HA ASN 103 7.571 -8.698 -8.986 766 1HB ASN 103 1HB ASN 103 7.229 -10.948 -10.305 767 2HB ASN 103 2HB ASN 103 8.613 -9.916 -10.652 768 1HD2 ASN 103 1HD2 ASN 103 9.860 -11.593 -11.420 769 2HD2 ASN 103 2HD2 ASN 103 10.517 -12.814 -10.391 770 HA PRO 104 HA PRO 104 4.116 -10.291 -6.801 771 1HB PRO 104 1HB PRO 104 2.243 -10.498 -8.754 772 2HB PRO 104 2HB PRO 104 2.792 -8.946 -8.110 773 1HG PRO 104 1HG PRO 104 3.617 -10.354 -10.620 774 2HG PRO 104 2HG PRO 104 3.258 -8.636 -10.367 775 1HD PRO 104 1HD PRO 104 5.788 -9.594 -10.477 776 2HD PRO 104 2HD PRO 104 5.337 -8.204 -9.470 777 H THR 105 H THR 105 3.008 -12.171 -6.291 778 HA THR 105 HA THR 105 3.942 -14.572 -7.679 779 HB THR 105 HB THR 105 3.013 -15.786 -5.693 780 HG1 THR 105 HG1 THR 105 2.673 -14.257 -3.838 781 1HG2 THR 105 1HG2 THR 105 4.745 -14.072 -4.224 782 2HG2 THR 105 2HG2 THR 105 5.341 -14.170 -5.881 783 3HG2 THR 105 3HG2 THR 105 5.103 -15.642 -4.941 784 H GLU 106 H GLU 106 0.996 -12.871 -6.789 785 HA GLU 106 HA GLU 106 -1.195 -13.189 -7.338 786 1HB GLU 106 1HB GLU 106 -0.472 -12.575 -9.529 787 2HB GLU 106 2HB GLU 106 0.196 -14.174 -9.826 788 1HG GLU 106 1HG GLU 106 -1.979 -15.142 -9.949 789 2HG GLU 106 2HG GLU 106 -2.733 -13.642 -9.410 790 H MET 11 H MET 11 -18.857 4.108 -16.391 791 HA MET 11 HA MET 11 -19.250 4.017 -13.661 792 1HB MET 11 1HB MET 11 -20.897 4.629 -16.010 793 2HB MET 11 2HB MET 11 -21.821 4.082 -14.617 794 1HG MET 11 1HG MET 11 -19.916 5.970 -13.708 795 2HG MET 11 2HG MET 11 -20.716 6.641 -15.127 796 1HE MET 11 1HE MET 11 -21.338 6.505 -11.122 797 2HE MET 11 2HE MET 11 -20.485 7.548 -12.260 798 3HE MET 11 3HE MET 11 -22.071 8.020 -11.649 799 H ALA 12 H ALA 12 -20.970 1.999 -16.052 800 HA ALA 12 HA ALA 12 -22.280 0.322 -14.296 801 1HB ALA 12 1HB ALA 12 -21.430 -1.223 -16.538 802 2HB ALA 12 2HB ALA 12 -23.019 -0.532 -16.204 803 3HB ALA 12 3HB ALA 12 -21.812 0.412 -17.077 804 H GLU 13 H GLU 13 -18.972 0.099 -15.511 805 HA GLU 13 HA GLU 13 -18.286 -2.435 -14.644 806 1HB GLU 13 1HB GLU 13 -16.941 -0.338 -15.783 807 2HB GLU 13 2HB GLU 13 -16.203 -0.413 -14.189 808 1HG GLU 13 1HG GLU 13 -14.931 -2.084 -14.864 809 2HG GLU 13 2HG GLU 13 -16.370 -3.059 -15.156 810 H VAL 14 H VAL 14 -17.999 0.623 -12.841 811 HA VAL 14 HA VAL 14 -17.051 -0.535 -10.451 812 HB VAL 14 HB VAL 14 -18.569 2.051 -10.826 813 1HG1 VAL 14 1HG1 VAL 14 -18.641 2.035 -8.589 814 2HG1 VAL 14 2HG1 VAL 14 -17.472 0.718 -8.468 815 3HG1 VAL 14 3HG1 VAL 14 -16.914 2.379 -8.672 816 1HG2 VAL 14 1HG2 VAL 14 -15.653 1.349 -10.959 817 2HG2 VAL 14 2HG2 VAL 14 -16.633 2.219 -12.139 818 3HG2 VAL 14 3HG2 VAL 14 -16.199 2.990 -10.613 819 H GLU 15 H GLU 15 -20.297 0.140 -11.645 820 HA GLU 15 HA GLU 15 -21.688 -0.365 -9.248 821 1HB GLU 15 1HB GLU 15 -22.499 -0.495 -12.146 822 2HB GLU 15 2HB GLU 15 -23.627 -0.855 -10.847 823 1HG GLU 15 1HG GLU 15 -23.406 1.361 -9.961 824 2HG GLU 15 2HG GLU 15 -22.125 1.737 -11.112 825 H GLU 16 H GLU 16 -20.921 -2.477 -12.003 826 HA GLU 16 HA GLU 16 -22.208 -4.780 -11.154 827 1HB GLU 16 1HB GLU 16 -20.657 -4.134 -13.288 828 2HB GLU 16 2HB GLU 16 -19.567 -5.194 -12.405 829 1HG GLU 16 1HG GLU 16 -22.294 -6.220 -12.663 830 2HG GLU 16 2HG GLU 16 -21.442 -6.011 -14.192 831 H THR 17 H THR 17 -19.044 -3.517 -10.255 832 HA THR 17 HA THR 17 -18.317 -5.819 -8.706 833 HB THR 17 HB THR 17 -17.128 -3.045 -8.840 834 HG1 THR 17 HG1 THR 17 -16.537 -4.033 -10.668 835 1HG2 THR 17 1HG2 THR 17 -15.141 -4.309 -7.751 836 2HG2 THR 17 2HG2 THR 17 -16.377 -5.444 -7.208 837 3HG2 THR 17 3HG2 THR 17 -16.462 -3.750 -6.726 838 H LEU 18 H LEU 18 -20.066 -2.889 -8.134 839 HA LEU 18 HA LEU 18 -19.775 -2.883 -5.286 840 1HB LEU 18 1HB LEU 18 -20.872 -1.183 -7.265 841 2HB LEU 18 2HB LEU 18 -22.155 -1.544 -6.112 842 HG LEU 18 HG LEU 18 -20.198 -0.891 -4.399 843 1HD1 LEU 18 1HD1 LEU 18 -19.661 0.774 -6.853 844 2HD1 LEU 18 2HD1 LEU 18 -18.576 -0.434 -6.166 845 3HD1 LEU 18 3HD1 LEU 18 -18.962 1.025 -5.254 846 1HD2 LEU 18 1HD2 LEU 18 -21.172 1.516 -4.661 847 2HD2 LEU 18 2HD2 LEU 18 -22.211 0.193 -4.129 848 3HD2 LEU 18 3HD2 LEU 18 -22.266 0.738 -5.806 849 H LYS 19 H LYS 19 -22.437 -3.754 -7.486 850 HA LYS 19 HA LYS 19 -24.179 -4.686 -5.475 851 1HB LYS 19 1HB LYS 19 -24.095 -5.588 -8.357 852 2HB LYS 19 2HB LYS 19 -25.473 -5.656 -7.267 853 1HG LYS 19 1HG LYS 19 -24.526 -2.967 -7.412 854 2HG LYS 19 2HG LYS 19 -24.759 -3.597 -9.044 855 1HD LYS 19 1HD LYS 19 -26.880 -4.121 -7.027 856 2HD LYS 19 2HD LYS 19 -26.738 -2.485 -7.675 857 1HE LYS 19 1HE LYS 19 -27.701 -3.096 -9.585 858 2HE LYS 19 2HE LYS 19 -26.563 -4.426 -9.792 859 1HZ LYS 19 1HZ LYS 19 -27.944 -5.839 -8.483 860 2HZ LYS 19 2HZ LYS 19 -28.921 -5.122 -9.663 861 3HZ LYS 19 3HZ LYS 19 -28.975 -4.563 -8.067 862 H ARG 20 H ARG 20 -21.487 -6.143 -7.106 863 HA ARG 20 HA ARG 20 -22.171 -8.844 -6.380 864 1HB ARG 20 1HB ARG 20 -20.818 -8.256 -8.399 865 2HB ARG 20 2HB ARG 20 -19.515 -7.759 -7.328 866 1HG ARG 20 1HG ARG 20 -18.763 -9.839 -7.390 867 2HG ARG 20 2HG ARG 20 -20.207 -10.336 -6.506 868 1HD ARG 20 1HD ARG 20 -20.407 -9.971 -9.451 869 2HD ARG 20 2HD ARG 20 -19.570 -11.398 -8.842 870 HE ARG 20 HE ARG 20 -22.156 -10.950 -7.656 871 1HH1 ARG 20 1HH1 ARG 20 -20.408 -12.419 -10.284 872 2HH1 ARG 20 2HH1 ARG 20 -21.632 -13.601 -10.609 873 1HH2 ARG 20 1HH2 ARG 20 -23.775 -12.501 -8.075 874 2HH2 ARG 20 2HH2 ARG 20 -23.547 -13.646 -9.353 875 H LEU 21 H LEU 21 -20.005 -6.330 -5.177 876 HA LEU 21 HA LEU 21 -18.828 -7.986 -3.162 877 1HB LEU 21 1HB LEU 21 -18.674 -5.164 -3.997 878 2HB LEU 21 2HB LEU 21 -18.341 -5.476 -2.295 879 HG LEU 21 HG LEU 21 -16.487 -6.882 -2.843 880 1HD1 LEU 21 1HD1 LEU 21 -16.010 -6.789 -5.514 881 2HD1 LEU 21 2HD1 LEU 21 -17.767 -6.935 -5.479 882 3HD1 LEU 21 3HD1 LEU 21 -16.767 -8.143 -4.674 883 1HD2 LEU 21 1HD2 LEU 21 -16.160 -4.415 -2.890 884 2HD2 LEU 21 2HD2 LEU 21 -16.361 -4.466 -4.642 885 3HD2 LEU 21 3HD2 LEU 21 -15.009 -5.309 -3.884 886 H GLN 22 H GLN 22 -21.334 -5.479 -3.190 887 HA GLN 22 HA GLN 22 -21.839 -5.256 -0.490 888 1HB GLN 22 1HB GLN 22 -23.282 -4.702 -2.954 889 2HB GLN 22 2HB GLN 22 -24.365 -5.161 -1.647 890 1HG GLN 22 1HG GLN 22 -24.293 -2.960 -1.203 891 2HG GLN 22 2HG GLN 22 -22.822 -3.409 -0.341 892 1HE2 GLN 22 1HE2 GLN 22 -21.297 -1.972 -0.671 893 2HE2 GLN 22 2HE2 GLN 22 -20.938 -1.185 -2.166 894 H SER 23 H SER 23 -22.761 -7.809 -2.697 895 HA SER 23 HA SER 23 -24.611 -9.072 -0.923 896 1HB SER 23 1HB SER 23 -24.491 -9.319 -3.472 897 2HB SER 23 2HB SER 23 -23.155 -10.434 -3.188 898 HG SER 23 HG SER 23 -24.512 -11.889 -2.463 899 H GLN 24 H GLN 24 -21.175 -9.362 -1.562 900 HA GLN 24 HA GLN 24 -20.646 -11.787 -0.301 901 1HB GLN 24 1HB GLN 24 -18.923 -9.310 -0.470 902 2HB GLN 24 2HB GLN 24 -18.347 -10.895 0.027 903 1HG GLN 24 1HG GLN 24 -18.949 -11.795 -2.168 904 2HG GLN 24 2HG GLN 24 -19.498 -10.195 -2.664 905 1HE2 GLN 24 1HE2 GLN 24 -17.547 -8.588 -1.648 906 2HE2 GLN 24 2HE2 GLN 24 -16.040 -8.930 -2.419 907 H LYS 25 H LYS 25 -19.822 -12.270 1.793 908 HA LYS 25 HA LYS 25 -21.016 -10.597 3.872 909 1HB LYS 25 1HB LYS 25 -21.106 -13.283 3.513 910 2HB LYS 25 2HB LYS 25 -19.739 -13.157 4.613 911 1HG LYS 25 1HG LYS 25 -21.772 -11.490 5.634 912 2HG LYS 25 2HG LYS 25 -22.525 -13.023 5.188 913 1HD LYS 25 1HD LYS 25 -20.823 -14.221 6.495 914 2HD LYS 25 2HD LYS 25 -20.107 -12.677 6.962 915 1HE LYS 25 1HE LYS 25 -21.449 -13.195 8.781 916 2HE LYS 25 2HE LYS 25 -22.470 -12.111 7.838 917 1HZ LYS 25 1HZ LYS 25 -23.058 -14.572 6.848 918 2HZ LYS 25 2HZ LYS 25 -23.986 -13.716 7.974 919 3HZ LYS 25 3HZ LYS 25 -22.868 -14.871 8.502 920 H GLY 26 H GLY 26 -19.635 -8.985 4.396 921 1HA GLY 26 1HA GLY 26 -17.704 -8.997 6.159 922 2HA GLY 26 2HA GLY 26 -16.799 -9.622 4.789 923 H VAL 27 H VAL 27 -18.421 -7.921 2.933 924 HA VAL 27 HA VAL 27 -16.673 -5.780 2.663 925 HB VAL 27 HB VAL 27 -19.536 -5.967 1.715 926 1HG1 VAL 27 1HG1 VAL 27 -18.113 -4.401 -0.065 927 2HG1 VAL 27 2HG1 VAL 27 -19.282 -3.830 1.127 928 3HG1 VAL 27 3HG1 VAL 27 -17.561 -3.849 1.516 929 1HG2 VAL 27 1HG2 VAL 27 -18.282 -6.485 -0.478 930 2HG2 VAL 27 2HG2 VAL 27 -16.914 -6.861 0.569 931 3HG2 VAL 27 3HG2 VAL 27 -18.422 -7.761 0.732 932 H GLN 28 H GLN 28 -16.367 -4.051 3.888 933 HA GLN 28 HA GLN 28 -18.329 -3.265 5.857 934 1HB GLN 28 1HB GLN 28 -15.486 -2.831 5.397 935 2HB GLN 28 2HB GLN 28 -16.312 -1.361 5.893 936 1HG GLN 28 1HG GLN 28 -15.322 -2.752 7.737 937 2HG GLN 28 2HG GLN 28 -17.021 -2.318 7.921 938 1HE2 GLN 28 1HE2 GLN 28 -14.764 -4.882 7.290 939 2HE2 GLN 28 2HE2 GLN 28 -15.869 -6.189 7.526 940 H GLY 29 H GLY 29 -17.100 -2.090 2.794 941 1HA GLY 29 1HA GLY 29 -19.274 -0.662 2.002 942 2HA GLY 29 2HA GLY 29 -18.390 0.478 3.007 943 H ILE 30 H ILE 30 -18.986 0.371 0.064 944 HA ILE 30 HA ILE 30 -16.219 0.420 -0.942 945 HB ILE 30 HB ILE 30 -18.758 0.221 -2.564 946 1HG1 ILE 30 1HG1 ILE 30 -16.751 -1.962 -1.982 947 2HG1 ILE 30 2HG1 ILE 30 -18.265 -1.775 -1.104 948 1HG2 ILE 30 1HG2 ILE 30 -15.883 -0.182 -3.378 949 2HG2 ILE 30 2HG2 ILE 30 -17.298 -0.280 -4.424 950 3HG2 ILE 30 3HG2 ILE 30 -16.837 1.264 -3.708 951 1HD1 ILE 30 1HD1 ILE 30 -18.504 -1.868 -4.031 952 2HD1 ILE 30 2HD1 ILE 30 -17.954 -3.353 -3.253 953 3HD1 ILE 30 3HD1 ILE 30 -19.489 -2.626 -2.780 954 H ILE 31 H ILE 31 -15.436 2.211 -1.980 955 HA ILE 31 HA ILE 31 -17.213 4.554 -2.133 956 HB ILE 31 HB ILE 31 -14.347 4.561 -1.180 957 1HG1 ILE 31 1HG1 ILE 31 -16.552 5.624 0.489 958 2HG1 ILE 31 2HG1 ILE 31 -16.508 3.876 0.291 959 1HG2 ILE 31 1HG2 ILE 31 -14.964 7.004 -0.677 960 2HG2 ILE 31 2HG2 ILE 31 -14.597 6.563 -2.344 961 3HG2 ILE 31 3HG2 ILE 31 -16.273 6.761 -1.834 962 1HD1 ILE 31 1HD1 ILE 31 -14.509 3.669 1.404 963 2HD1 ILE 31 2HD1 ILE 31 -14.031 5.335 1.076 964 3HD1 ILE 31 3HD1 ILE 31 -15.276 4.994 2.278 965 H VAL 32 H VAL 32 -16.898 5.940 -3.849 966 HA VAL 32 HA VAL 32 -14.788 5.248 -5.775 967 HB VAL 32 HB VAL 32 -17.603 5.890 -6.642 968 1HG1 VAL 32 1HG1 VAL 32 -15.472 4.482 -8.215 969 2HG1 VAL 32 2HG1 VAL 32 -16.909 5.325 -8.798 970 3HG1 VAL 32 3HG1 VAL 32 -15.551 6.242 -8.145 971 1HG2 VAL 32 1HG2 VAL 32 -17.891 3.503 -7.103 972 2HG2 VAL 32 2HG2 VAL 32 -16.325 3.170 -6.363 973 3HG2 VAL 32 3HG2 VAL 32 -17.647 3.802 -5.382 974 H VAL 33 H VAL 33 -13.652 6.971 -6.359 975 HA VAL 33 HA VAL 33 -14.958 9.606 -6.374 976 HB VAL 33 HB VAL 33 -12.129 9.266 -5.412 977 1HG1 VAL 33 1HG1 VAL 33 -13.934 11.466 -4.568 978 2HG1 VAL 33 2HG1 VAL 33 -12.198 11.482 -4.886 979 3HG1 VAL 33 3HG1 VAL 33 -13.342 11.480 -6.229 980 1HG2 VAL 33 1HG2 VAL 33 -13.504 7.967 -3.900 981 2HG2 VAL 33 2HG2 VAL 33 -12.991 9.457 -3.108 982 3HG2 VAL 33 3HG2 VAL 33 -14.634 9.310 -3.731 983 H ASN 34 H ASN 34 -14.393 10.939 -8.028 984 HA ASN 34 HA ASN 34 -13.134 9.799 -10.301 985 1HB ASN 34 1HB ASN 34 -13.571 12.754 -9.976 986 2HB ASN 34 2HB ASN 34 -13.704 11.769 -11.430 987 1HD2 ASN 34 1HD2 ASN 34 -15.434 13.450 -9.258 988 2HD2 ASN 34 2HD2 ASN 34 -16.948 12.625 -9.368 989 H THR 35 H THR 35 -11.573 11.722 -11.416 990 HA THR 35 HA THR 35 -9.098 11.353 -10.005 991 HB THR 35 HB THR 35 -8.708 13.184 -12.126 992 HG1 THR 35 HG1 THR 35 -10.110 10.980 -13.159 993 1HG2 THR 35 1HG2 THR 35 -8.294 10.194 -11.997 994 2HG2 THR 35 2HG2 THR 35 -7.155 11.424 -11.449 995 3HG2 THR 35 3HG2 THR 35 -7.546 11.285 -13.163 996 H GLU 36 H GLU 36 -11.450 13.867 -10.298 997 HA GLU 36 HA GLU 36 -9.745 16.034 -9.550 998 1HB GLU 36 1HB GLU 36 -12.681 15.637 -9.878 999 2HB GLU 36 2HB GLU 36 -12.135 17.014 -8.931 1000 1HG GLU 36 1HG GLU 36 -10.560 17.281 -11.093 1001 2HG GLU 36 2HG GLU 36 -11.970 16.518 -11.826 1002 H GLY 37 H GLY 37 -11.831 13.786 -7.822 1003 1HA GLY 37 1HA GLY 37 -10.980 13.236 -5.542 1004 2HA GLY 37 2HA GLY 37 -10.876 14.972 -5.289 1005 H ILE 38 H ILE 38 -13.568 14.114 -7.135 1006 HA ILE 38 HA ILE 38 -15.304 14.518 -4.804 1007 HB ILE 38 HB ILE 38 -16.069 14.670 -7.719 1008 1HG1 ILE 38 1HG1 ILE 38 -15.338 16.902 -5.810 1009 2HG1 ILE 38 2HG1 ILE 38 -14.372 16.365 -7.180 1010 1HG2 ILE 38 1HG2 ILE 38 -18.038 15.845 -6.894 1011 2HG2 ILE 38 2HG2 ILE 38 -17.919 14.238 -6.180 1012 3HG2 ILE 38 3HG2 ILE 38 -17.467 15.657 -5.236 1013 1HD1 ILE 38 1HD1 ILE 38 -16.863 16.927 -8.262 1014 2HD1 ILE 38 2HD1 ILE 38 -16.575 18.216 -7.092 1015 3HD1 ILE 38 3HD1 ILE 38 -15.405 17.912 -8.375 1016 HA PRO 39 HA PRO 39 -16.469 10.250 -4.936 1017 1HB PRO 39 1HB PRO 39 -18.610 10.432 -3.276 1018 2HB PRO 39 2HB PRO 39 -16.939 10.479 -2.699 1019 1HG PRO 39 1HG PRO 39 -18.836 12.741 -3.195 1020 2HG PRO 39 2HG PRO 39 -17.723 12.492 -1.838 1021 1HD PRO 39 1HD PRO 39 -17.159 14.155 -3.899 1022 2HD PRO 39 2HD PRO 39 -15.902 13.252 -3.029 1023 H ILE 40 H ILE 40 -17.839 9.014 -6.122 1024 HA ILE 40 HA ILE 40 -20.143 10.368 -7.366 1025 HB ILE 40 HB ILE 40 -19.769 8.566 -9.203 1026 1HG1 ILE 40 1HG1 ILE 40 -16.984 8.765 -8.036 1027 2HG1 ILE 40 2HG1 ILE 40 -18.020 7.345 -7.939 1028 1HG2 ILE 40 1HG2 ILE 40 -19.508 11.046 -9.407 1029 2HG2 ILE 40 2HG2 ILE 40 -17.801 10.838 -9.017 1030 3HG2 ILE 40 3HG2 ILE 40 -18.468 10.107 -10.477 1031 1HD1 ILE 40 1HD1 ILE 40 -17.183 8.553 -10.554 1032 2HD1 ILE 40 2HD1 ILE 40 -16.233 7.325 -9.717 1033 3HD1 ILE 40 3HD1 ILE 40 -17.872 6.958 -10.252 1034 H LYS 41 H LYS 41 -18.893 7.412 -5.952 1035 HA LYS 41 HA LYS 41 -21.641 6.526 -5.487 1036 1HB LYS 41 1HB LYS 41 -19.654 5.175 -7.181 1037 2HB LYS 41 2HB LYS 41 -20.396 4.135 -5.973 1038 1HG LYS 41 1HG LYS 41 -22.269 5.827 -7.473 1039 2HG LYS 41 2HG LYS 41 -21.422 4.607 -8.427 1040 1HD LYS 41 1HD LYS 41 -22.404 2.863 -7.320 1041 2HD LYS 41 2HD LYS 41 -22.596 3.779 -5.823 1042 1HE LYS 41 1HE LYS 41 -24.348 5.139 -7.016 1043 2HE LYS 41 2HE LYS 41 -24.250 3.972 -8.333 1044 1HZ LYS 41 1HZ LYS 41 -25.133 3.494 -5.547 1045 2HZ LYS 41 2HZ LYS 41 -24.759 2.234 -6.612 1046 3HZ LYS 41 3HZ LYS 41 -26.027 3.296 -6.970 1047 H SER 42 H SER 42 -21.953 5.624 -3.522 1048 HA SER 42 HA SER 42 -19.889 4.374 -2.009 1049 1HB SER 42 1HB SER 42 -19.750 6.019 -0.184 1050 2HB SER 42 2HB SER 42 -19.179 6.708 -1.703 1051 HG SER 42 HG SER 42 -21.194 7.528 -0.124 1052 H THR 43 H THR 43 -20.715 3.168 -0.363 1053 HA THR 43 HA THR 43 -23.630 3.310 0.003 1054 HB THR 43 HB THR 43 -23.638 1.000 0.543 1055 HG1 THR 43 HG1 THR 43 -20.786 1.085 0.527 1056 1HG2 THR 43 1HG2 THR 43 -23.263 0.218 -1.535 1057 2HG2 THR 43 2HG2 THR 43 -21.571 0.717 -1.521 1058 3HG2 THR 43 3HG2 THR 43 -22.832 1.886 -1.909 1059 H MET 44 H MET 44 -20.800 4.141 1.521 1060 HA MET 44 HA MET 44 -21.477 3.407 4.211 1061 1HB MET 44 1HB MET 44 -19.193 4.374 2.883 1062 2HB MET 44 2HB MET 44 -19.617 5.605 4.065 1063 1HG MET 44 1HG MET 44 -19.433 4.082 5.859 1064 2HG MET 44 2HG MET 44 -19.365 2.699 4.769 1065 1HE MET 44 1HE MET 44 -15.847 3.075 3.140 1066 2HE MET 44 2HE MET 44 -17.387 2.217 3.144 1067 3HE MET 44 3HE MET 44 -17.294 3.858 2.504 1068 H ASP 45 H ASP 45 -21.007 5.649 5.698 1069 HA ASP 45 HA ASP 45 -23.531 6.966 5.576 1070 1HB ASP 45 1HB ASP 45 -21.551 6.582 7.512 1071 2HB ASP 45 2HB ASP 45 -21.588 8.323 7.247 1072 H ASN 46 H ASN 46 -23.639 9.423 5.738 1073 HA ASN 46 HA ASN 46 -22.703 10.527 3.314 1074 1HB ASN 46 1HB ASN 46 -24.577 11.226 5.288 1075 2HB ASN 46 2HB ASN 46 -23.432 12.563 5.232 1076 1HD2 ASN 46 1HD2 ASN 46 -22.736 12.529 2.567 1077 2HD2 ASN 46 2HD2 ASN 46 -24.112 12.956 1.614 1078 HA PRO 47 HA PRO 47 -19.684 13.119 6.062 1079 1HB PRO 47 1HB PRO 47 -19.382 12.339 8.645 1080 2HB PRO 47 2HB PRO 47 -20.600 13.513 8.132 1081 1HG PRO 47 1HG PRO 47 -20.906 10.589 8.697 1082 2HG PRO 47 2HG PRO 47 -21.965 11.935 9.159 1083 1HD PRO 47 1HD PRO 47 -22.502 10.314 7.057 1084 2HD PRO 47 2HD PRO 47 -22.961 12.029 7.083 1085 H THR 48 H THR 48 -19.977 9.667 6.502 1086 HA THR 48 HA THR 48 -17.213 9.191 7.062 1087 HB THR 48 HB THR 48 -19.188 7.184 5.971 1088 HG1 THR 48 HG1 THR 48 -19.682 8.501 8.046 1089 1HG2 THR 48 1HG2 THR 48 -16.859 6.449 6.005 1090 2HG2 THR 48 2HG2 THR 48 -17.803 5.580 7.216 1091 3HG2 THR 48 3HG2 THR 48 -16.732 6.893 7.706 1092 H THR 49 H THR 49 -19.215 9.204 4.167 1093 HA THR 49 HA THR 49 -17.265 8.089 2.429 1094 HB THR 49 HB THR 49 -19.696 9.785 1.839 1095 HG1 THR 49 HG1 THR 49 -20.690 7.930 1.989 1096 1HG2 THR 49 1HG2 THR 49 -18.115 10.032 0.016 1097 2HG2 THR 49 2HG2 THR 49 -19.444 8.987 -0.490 1098 3HG2 THR 49 3HG2 THR 49 -17.885 8.285 -0.057 1099 H THR 50 H THR 50 -18.342 11.440 2.976 1100 HA THR 50 HA THR 50 -16.639 12.716 1.197 1101 HB THR 50 HB THR 50 -16.984 14.188 3.707 1102 HG1 THR 50 HG1 THR 50 -18.881 13.191 4.028 1103 1HG2 THR 50 1HG2 THR 50 -17.089 15.880 2.257 1104 2HG2 THR 50 2HG2 THR 50 -18.464 15.152 1.426 1105 3HG2 THR 50 3HG2 THR 50 -16.820 14.711 0.964 1106 H GLN 51 H GLN 51 -16.086 11.950 4.626 1107 HA GLN 51 HA GLN 51 -13.533 13.081 4.829 1108 1HB GLN 51 1HB GLN 51 -14.697 12.503 6.829 1109 2HB GLN 51 2HB GLN 51 -14.849 10.823 6.333 1110 1HG GLN 51 1HG GLN 51 -12.100 11.852 6.556 1111 2HG GLN 51 2HG GLN 51 -13.003 11.718 8.064 1112 1HE2 GLN 51 1HE2 GLN 51 -11.345 10.054 5.588 1113 2HE2 GLN 51 2HE2 GLN 51 -11.558 8.454 6.202 1114 H TYR 52 H TYR 52 -14.494 9.725 4.144 1115 HA TYR 52 HA TYR 52 -11.926 8.658 3.883 1116 1HB TYR 52 1HB TYR 52 -14.636 7.874 2.909 1117 2HB TYR 52 2HB TYR 52 -13.237 7.048 2.233 1118 HD1 TYR 52 HD1 TYR 52 -13.039 4.949 3.168 1119 HD2 TYR 52 HD2 TYR 52 -14.082 8.218 5.683 1120 HE1 TYR 52 HE1 TYR 52 -12.970 3.459 5.123 1121 HE2 TYR 52 HE2 TYR 52 -14.014 6.737 7.646 1122 HH TYR 52 HH TYR 52 -12.849 3.449 7.427 1123 H ALA 53 H ALA 53 -14.123 9.835 1.335 1124 HA ALA 53 HA ALA 53 -12.355 9.488 -0.811 1125 1HB ALA 53 1HB ALA 53 -14.788 11.158 -0.367 1126 2HB ALA 53 2HB ALA 53 -13.821 11.394 -1.824 1127 3HB ALA 53 3HB ALA 53 -14.532 9.817 -1.483 1128 H SER 54 H SER 54 -12.373 11.796 1.713 1129 HA SER 54 HA SER 54 -11.012 13.894 0.324 1130 1HB SER 54 1HB SER 54 -12.420 14.119 2.449 1131 2HB SER 54 2HB SER 54 -11.020 13.483 3.313 1132 HG SER 54 HG SER 54 -10.696 15.622 3.358 1133 H LEU 55 H LEU 55 -9.989 11.437 2.687 1134 HA LEU 55 HA LEU 55 -7.205 12.119 2.339 1135 1HB LEU 55 1HB LEU 55 -6.777 10.779 4.135 1136 2HB LEU 55 2HB LEU 55 -8.456 11.213 4.453 1137 HG LEU 55 HG LEU 55 -8.884 8.947 3.124 1138 1HD1 LEU 55 1HD1 LEU 55 -6.678 7.800 4.573 1139 2HD1 LEU 55 2HD1 LEU 55 -6.103 8.939 3.356 1140 3HD1 LEU 55 3HD1 LEU 55 -7.142 7.594 2.884 1141 1HD2 LEU 55 1HD2 LEU 55 -8.023 8.521 5.920 1142 2HD2 LEU 55 2HD2 LEU 55 -9.543 8.113 5.123 1143 3HD2 LEU 55 3HD2 LEU 55 -9.236 9.771 5.644 1144 H MET 56 H MET 56 -9.457 10.063 0.831 1145 HA MET 56 HA MET 56 -7.847 7.913 0.039 1146 1HB MET 56 1HB MET 56 -10.457 8.923 -0.569 1147 2HB MET 56 2HB MET 56 -9.647 8.498 -2.071 1148 1HG MET 56 1HG MET 56 -10.955 6.642 -1.191 1149 2HG MET 56 2HG MET 56 -9.236 6.259 -1.250 1150 1HE MET 56 1HE MET 56 -8.621 4.528 1.207 1151 2HE MET 56 2HE MET 56 -7.823 5.829 0.322 1152 3HE MET 56 3HE MET 56 -7.973 5.918 2.078 1153 H HIS 57 H HIS 57 -8.836 10.642 -2.037 1154 HA HIS 57 HA HIS 57 -7.050 10.203 -4.095 1155 1HB HIS 57 1HB HIS 57 -8.860 11.802 -4.307 1156 2HB HIS 57 2HB HIS 57 -8.143 12.830 -3.069 1157 HD1 HIS 57 HD1 HIS 57 -8.007 14.810 -4.736 1158 HD2 HIS 57 HD2 HIS 57 -5.808 11.470 -5.866 1159 HE1 HIS 57 HE1 HIS 57 -6.503 15.592 -6.594 1160 H SER 58 H SER 58 -6.565 11.984 -1.087 1161 HA SER 58 HA SER 58 -4.017 13.029 -1.734 1162 1HB SER 58 1HB SER 58 -5.622 13.728 0.165 1163 2HB SER 58 2HB SER 58 -4.902 12.399 1.075 1164 HG SER 58 HG SER 58 -3.413 14.489 -0.135 1165 H PHE 59 H PHE 59 -5.098 9.970 -0.453 1166 HA PHE 59 HA PHE 59 -2.629 9.056 0.564 1167 1HB PHE 59 1HB PHE 59 -4.809 8.020 1.112 1168 2HB PHE 59 2HB PHE 59 -4.926 7.427 -0.541 1169 HD1 PHE 59 HD1 PHE 59 -4.352 5.241 -0.893 1170 HD2 PHE 59 HD2 PHE 59 -2.477 7.375 2.277 1171 HE1 PHE 59 HE1 PHE 59 -3.130 3.204 -0.249 1172 HE2 PHE 59 HE2 PHE 59 -1.252 5.342 2.925 1173 HZ PHE 59 HZ PHE 59 -1.577 3.254 1.662 1174 H ILE 60 H ILE 60 -4.264 8.270 -2.508 1175 HA ILE 60 HA ILE 60 -2.158 6.806 -3.624 1176 HB ILE 60 HB ILE 60 -4.264 8.423 -5.064 1177 1HG1 ILE 60 1HG1 ILE 60 -5.184 6.734 -3.513 1178 2HG1 ILE 60 2HG1 ILE 60 -5.506 6.327 -5.195 1179 1HG2 ILE 60 1HG2 ILE 60 -3.173 7.884 -6.923 1180 2HG2 ILE 60 2HG2 ILE 60 -2.020 6.899 -6.024 1181 3HG2 ILE 60 3HG2 ILE 60 -3.537 6.193 -6.580 1182 1HD1 ILE 60 1HD1 ILE 60 -4.310 4.730 -3.228 1183 2HD1 ILE 60 2HD1 ILE 60 -4.525 4.365 -4.940 1184 3HD1 ILE 60 3HD1 ILE 60 -3.040 5.136 -4.382 1185 H LEU 61 H LEU 61 -2.913 10.257 -3.785 1186 HA LEU 61 HA LEU 61 -0.940 10.976 -5.653 1187 1HB LEU 61 1HB LEU 61 -2.799 12.304 -3.900 1188 2HB LEU 61 2HB LEU 61 -1.246 13.136 -3.900 1189 HG LEU 61 HG LEU 61 -1.371 13.482 -6.278 1190 1HD1 LEU 61 1HD1 LEU 61 -2.358 11.592 -7.185 1191 2HD1 LEU 61 2HD1 LEU 61 -3.602 12.823 -7.397 1192 3HD1 LEU 61 3HD1 LEU 61 -3.734 11.655 -6.083 1193 1HD2 LEU 61 1HD2 LEU 61 -3.336 14.928 -6.397 1194 2HD2 LEU 61 2HD2 LEU 61 -2.504 15.108 -4.853 1195 3HD2 LEU 61 3HD2 LEU 61 -3.992 14.165 -4.948 1196 H LYS 62 H LYS 62 -0.806 10.355 -2.230 1197 HA LYS 62 HA LYS 62 1.718 11.593 -1.758 1198 1HB LYS 62 1HB LYS 62 -0.272 10.271 -0.219 1199 2HB LYS 62 2HB LYS 62 1.254 9.451 0.080 1200 1HG LYS 62 1HG LYS 62 0.846 11.236 1.693 1201 2HG LYS 62 2HG LYS 62 2.286 11.551 0.722 1202 1HD LYS 62 1HD LYS 62 1.415 13.419 -0.153 1203 2HD LYS 62 2HD LYS 62 -0.150 12.656 -0.443 1204 1HE LYS 62 1HE LYS 62 0.746 13.519 2.295 1205 2HE LYS 62 2HE LYS 62 -0.100 14.604 1.193 1206 1HZ LYS 62 1HZ LYS 62 -1.910 12.945 1.101 1207 2HZ LYS 62 2HZ LYS 62 -1.680 13.591 2.648 1208 3HZ LYS 62 3HZ LYS 62 -1.114 12.038 2.288 1209 H ALA 63 H ALA 63 0.744 8.184 -2.134 1210 HA ALA 63 HA ALA 63 3.387 7.168 -2.107 1211 1HB ALA 63 1HB ALA 63 1.199 5.916 -1.684 1212 2HB ALA 63 2HB ALA 63 1.073 5.798 -3.439 1213 3HB ALA 63 3HB ALA 63 2.451 5.082 -2.604 1214 H ARG 64 H ARG 64 1.173 8.058 -4.724 1215 HA ARG 64 HA ARG 64 2.661 7.135 -6.886 1216 1HB ARG 64 1HB ARG 64 0.299 8.104 -6.874 1217 2HB ARG 64 2HB ARG 64 1.061 9.689 -6.925 1218 1HG ARG 64 1HG ARG 64 2.273 8.207 -8.963 1219 2HG ARG 64 2HG ARG 64 0.549 7.842 -9.058 1220 1HD ARG 64 1HD ARG 64 1.435 10.673 -8.732 1221 2HD ARG 64 2HD ARG 64 1.548 9.910 -10.317 1222 HE ARG 64 HE ARG 64 -0.830 10.788 -8.998 1223 1HH1 ARG 64 1HH1 ARG 64 0.449 8.459 -11.247 1224 2HH1 ARG 64 2HH1 ARG 64 -1.061 8.225 -12.064 1225 1HH2 ARG 64 1HH2 ARG 64 -2.823 10.488 -10.064 1226 2HH2 ARG 64 2HH2 ARG 64 -2.922 9.380 -11.391 1227 H SER 65 H SER 65 2.898 10.159 -5.084 1228 HA SER 65 HA SER 65 4.802 11.375 -6.810 1229 1HB SER 65 1HB SER 65 3.251 12.365 -4.881 1230 2HB SER 65 2HB SER 65 4.710 12.112 -3.922 1231 HG SER 65 HG SER 65 4.237 13.877 -6.024 1232 H THR 66 H THR 66 5.010 9.142 -4.158 1233 HA THR 66 HA THR 66 7.849 9.515 -3.768 1234 HB THR 66 HB THR 66 6.467 7.098 -2.711 1235 HG1 THR 66 HG1 THR 66 6.118 9.518 -1.326 1236 1HG2 THR 66 1HG2 THR 66 8.764 7.437 -2.102 1237 2HG2 THR 66 2HG2 THR 66 7.771 7.760 -0.680 1238 3HG2 THR 66 3HG2 THR 66 8.440 9.100 -1.612 1239 H VAL 67 H VAL 67 5.733 7.362 -5.527 1240 HA VAL 67 HA VAL 67 7.438 5.228 -6.033 1241 HB VAL 67 HB VAL 67 5.377 6.421 -7.893 1242 1HG1 VAL 67 1HG1 VAL 67 6.360 5.004 -9.350 1243 2HG1 VAL 67 2HG1 VAL 67 7.114 4.045 -8.075 1244 3HG1 VAL 67 3HG1 VAL 67 5.416 3.794 -8.482 1245 1HG2 VAL 67 1HG2 VAL 67 3.802 5.518 -6.607 1246 2HG2 VAL 67 2HG2 VAL 67 4.639 3.966 -6.572 1247 3HG2 VAL 67 3HG2 VAL 67 5.048 5.215 -5.397 1248 H ARG 68 H ARG 68 7.487 8.456 -7.282 1249 HA ARG 68 HA ARG 68 9.027 7.953 -9.615 1250 1HB ARG 68 1HB ARG 68 8.845 10.508 -8.009 1251 2HB ARG 68 2HB ARG 68 9.383 10.356 -9.676 1252 1HG ARG 68 1HG ARG 68 6.798 9.198 -9.471 1253 2HG ARG 68 2HG ARG 68 6.766 10.785 -8.700 1254 1HD ARG 68 1HD ARG 68 7.250 11.892 -10.644 1255 2HD ARG 68 2HD ARG 68 8.127 10.524 -11.330 1256 HE ARG 68 HE ARG 68 5.338 9.986 -11.051 1257 1HH1 ARG 68 1HH1 ARG 68 7.707 11.568 -13.051 1258 2HH1 ARG 68 2HH1 ARG 68 6.754 11.458 -14.494 1259 1HH2 ARG 68 1HH2 ARG 68 4.073 9.835 -12.943 1260 2HH2 ARG 68 2HH2 ARG 68 4.687 10.472 -14.431 1261 H ASP 69 H ASP 69 9.793 8.272 -6.261 1262 HA ASP 69 HA ASP 69 12.592 8.828 -6.681 1263 1HB ASP 69 1HB ASP 69 10.782 8.899 -4.481 1264 2HB ASP 69 2HB ASP 69 12.111 7.825 -4.055 1265 H ILE 70 H ILE 70 10.584 6.025 -6.003 1266 HA ILE 70 HA ILE 70 12.781 4.246 -5.545 1267 HB ILE 70 HB ILE 70 9.959 3.493 -6.300 1268 1HG1 ILE 70 1HG1 ILE 70 11.110 3.933 -3.536 1269 2HG1 ILE 70 2HG1 ILE 70 10.013 5.039 -4.355 1270 1HG2 ILE 70 1HG2 ILE 70 10.436 1.367 -5.599 1271 2HG2 ILE 70 2HG2 ILE 70 12.007 1.844 -6.242 1272 3HG2 ILE 70 3HG2 ILE 70 11.713 1.895 -4.504 1273 1HD1 ILE 70 1HD1 ILE 70 9.339 2.932 -2.678 1274 2HD1 ILE 70 2HD1 ILE 70 8.250 3.879 -3.692 1275 3HD1 ILE 70 3HD1 ILE 70 8.933 2.372 -4.300 1276 H ASP 71 H ASP 71 10.665 4.970 -8.287 1277 HA ASP 71 HA ASP 71 12.588 3.583 -10.030 1278 1HB ASP 71 1HB ASP 71 10.402 3.183 -11.472 1279 2HB ASP 71 2HB ASP 71 10.875 2.061 -10.199 1280 HA PRO 72 HA PRO 72 12.660 7.185 -12.529 1281 1HB PRO 72 1HB PRO 72 12.804 6.156 -15.038 1282 2HB PRO 72 2HB PRO 72 14.151 6.093 -13.895 1283 1HG PRO 72 1HG PRO 72 12.159 3.971 -14.593 1284 2HG PRO 72 2HG PRO 72 13.912 3.828 -14.364 1285 1HD PRO 72 1HD PRO 72 12.131 3.122 -12.451 1286 2HD PRO 72 2HD PRO 72 13.734 3.779 -12.066 1287 H GLN 73 H GLN 73 10.311 4.729 -13.515 1288 HA GLN 73 HA GLN 73 8.381 6.854 -14.054 1289 1HB GLN 73 1HB GLN 73 9.134 4.684 -16.012 1290 2HB GLN 73 2HB GLN 73 7.651 5.621 -16.136 1291 1HG GLN 73 1HG GLN 73 9.345 7.644 -15.999 1292 2HG GLN 73 2HG GLN 73 10.460 6.432 -16.628 1293 1HE2 GLN 73 1HE2 GLN 73 10.537 6.206 -18.743 1294 2HE2 GLN 73 2HE2 GLN 73 9.326 6.714 -19.866 1295 H ASN 74 H ASN 74 8.367 3.363 -14.713 1296 HA ASN 74 HA ASN 74 6.913 1.724 -14.083 1297 1HB ASN 74 1HB ASN 74 8.241 2.536 -11.883 1298 2HB ASN 74 2HB ASN 74 6.591 2.868 -11.366 1299 1HD2 ASN 74 1HD2 ASN 74 8.472 0.902 -10.364 1300 2HD2 ASN 74 2HD2 ASN 74 7.710 -0.638 -10.549 1301 H ASP 75 H ASP 75 4.791 1.565 -12.383 1302 HA ASP 75 HA ASP 75 2.990 3.756 -12.594 1303 1HB ASP 75 1HB ASP 75 3.190 2.100 -14.890 1304 2HB ASP 75 2HB ASP 75 1.650 1.736 -14.116 1305 H LEU 76 H LEU 76 1.821 3.571 -10.811 1306 HA LEU 76 HA LEU 76 1.726 1.384 -9.134 1307 1HB LEU 76 1HB LEU 76 0.628 3.959 -9.197 1308 2HB LEU 76 2HB LEU 76 -0.735 2.867 -8.965 1309 HG LEU 76 HG LEU 76 -0.011 3.577 -6.816 1310 1HD1 LEU 76 1HD1 LEU 76 1.364 1.003 -6.695 1311 2HD1 LEU 76 2HD1 LEU 76 -0.186 0.947 -7.533 1312 3HD1 LEU 76 3HD1 LEU 76 -0.100 1.550 -5.878 1313 1HD2 LEU 76 1HD2 LEU 76 2.246 4.320 -7.525 1314 2HD2 LEU 76 2HD2 LEU 76 2.764 2.634 -7.528 1315 3HD2 LEU 76 3HD2 LEU 76 2.252 3.397 -6.022 1316 H THR 77 H THR 77 0.514 -0.418 -8.955 1317 HA THR 77 HA THR 77 -1.599 -0.830 -10.971 1318 HB THR 77 HB THR 77 -0.789 -3.365 -10.157 1319 HG1 THR 77 HG1 THR 77 1.363 -3.358 -10.030 1320 1HG2 THR 77 1HG2 THR 77 0.385 -2.102 -12.596 1321 2HG2 THR 77 2HG2 THR 77 -1.366 -2.266 -12.465 1322 3HG2 THR 77 3HG2 THR 77 -0.338 -3.697 -12.395 1323 H PHE 78 H PHE 78 -0.618 -1.193 -7.643 1324 HA PHE 78 HA PHE 78 -3.356 -1.422 -6.805 1325 1HB PHE 78 1HB PHE 78 -1.994 -3.817 -7.285 1326 2HB PHE 78 2HB PHE 78 -1.937 -3.609 -5.538 1327 HD1 PHE 78 HD1 PHE 78 -4.090 -4.149 -8.437 1328 HD2 PHE 78 HD2 PHE 78 -3.961 -3.637 -4.213 1329 HE1 PHE 78 HE1 PHE 78 -6.400 -4.978 -8.269 1330 HE2 PHE 78 HE2 PHE 78 -6.270 -4.467 -4.039 1331 HZ PHE 78 HZ PHE 78 -7.493 -5.140 -6.068 1332 H LEU 79 H LEU 79 -3.650 -0.744 -4.721 1333 HA LEU 79 HA LEU 79 -1.281 -0.350 -3.042 1334 1HB LEU 79 1HB LEU 79 -2.112 1.717 -4.453 1335 2HB LEU 79 2HB LEU 79 -3.309 1.828 -3.164 1336 HG LEU 79 HG LEU 79 -1.503 2.048 -1.517 1337 1HD1 LEU 79 1HD1 LEU 79 0.800 2.494 -2.372 1338 2HD1 LEU 79 2HD1 LEU 79 0.270 1.904 -3.947 1339 3HD1 LEU 79 3HD1 LEU 79 0.262 0.824 -2.553 1340 1HD2 LEU 79 1HD2 LEU 79 -0.758 4.294 -2.179 1341 2HD2 LEU 79 2HD2 LEU 79 -2.483 4.057 -2.459 1342 3HD2 LEU 79 3HD2 LEU 79 -1.353 3.999 -3.813 1343 H ARG 80 H ARG 80 -1.829 -1.760 -1.466 1344 HA ARG 80 HA ARG 80 -4.484 -1.461 -0.228 1345 1HB ARG 80 1HB ARG 80 -2.599 -3.812 -0.355 1346 2HB ARG 80 2HB ARG 80 -3.965 -3.753 0.750 1347 1HG ARG 80 1HG ARG 80 -5.259 -3.191 -1.503 1348 2HG ARG 80 2HG ARG 80 -3.910 -4.102 -2.186 1349 1HD ARG 80 1HD ARG 80 -5.928 -5.010 -0.150 1350 2HD ARG 80 2HD ARG 80 -5.634 -5.668 -1.759 1351 HE ARG 80 HE ARG 80 -3.270 -5.948 -0.348 1352 1HH1 ARG 80 1HH1 ARG 80 -6.554 -7.077 -0.104 1353 2HH1 ARG 80 2HH1 ARG 80 -6.123 -8.563 0.676 1354 1HH2 ARG 80 1HH2 ARG 80 -2.690 -7.901 0.677 1355 2HH2 ARG 80 2HH2 ARG 80 -3.925 -9.030 1.120 1356 H ILE 81 H ILE 81 -4.557 -1.813 2.137 1357 HA ILE 81 HA ILE 81 -2.090 -1.283 3.582 1358 HB ILE 81 HB ILE 81 -3.333 0.579 4.867 1359 1HG1 ILE 81 1HG1 ILE 81 -4.834 0.630 2.240 1360 2HG1 ILE 81 2HG1 ILE 81 -5.523 0.237 3.811 1361 1HG2 ILE 81 1HG2 ILE 81 -2.709 1.716 2.254 1362 2HG2 ILE 81 2HG2 ILE 81 -1.945 1.985 3.820 1363 3HG2 ILE 81 3HG2 ILE 81 -1.485 0.591 2.843 1364 1HD1 ILE 81 1HD1 ILE 81 -5.164 2.787 2.575 1365 2HD1 ILE 81 2HD1 ILE 81 -6.015 2.374 4.064 1366 3HD1 ILE 81 3HD1 ILE 81 -4.290 2.735 4.105 1367 H ARG 82 H ARG 82 -2.389 -3.280 4.573 1368 HA ARG 82 HA ARG 82 -4.796 -4.106 5.801 1369 1HB ARG 82 1HB ARG 82 -2.473 -5.348 5.195 1370 2HB ARG 82 2HB ARG 82 -2.248 -5.108 6.923 1371 1HG ARG 82 1HG ARG 82 -4.070 -6.445 7.472 1372 2HG ARG 82 2HG ARG 82 -4.765 -6.323 5.855 1373 1HD ARG 82 1HD ARG 82 -3.886 -8.459 5.845 1374 2HD ARG 82 2HD ARG 82 -2.586 -7.521 5.111 1375 HE ARG 82 HE ARG 82 -2.233 -7.688 7.915 1376 1HH1 ARG 82 1HH1 ARG 82 -1.953 -9.563 4.995 1377 2HH1 ARG 82 2HH1 ARG 82 -0.715 -10.598 5.624 1378 1HH2 ARG 82 1HH2 ARG 82 -0.603 -9.045 8.754 1379 2HH2 ARG 82 2HH2 ARG 82 0.052 -10.303 7.762 1380 H SER 83 H SER 83 -5.741 -3.058 7.420 1381 HA SER 83 HA SER 83 -4.119 -1.626 9.378 1382 1HB SER 83 1HB SER 83 -7.073 -1.626 9.621 1383 2HB SER 83 2HB SER 83 -5.930 -0.289 9.746 1384 HG SER 83 HG SER 83 -7.406 -1.052 7.640 1385 H LYS 84 H LYS 84 -5.654 -1.687 11.615 1386 HA LYS 84 HA LYS 84 -5.119 -4.356 12.609 1387 1HB LYS 84 1HB LYS 84 -5.597 -1.685 13.786 1388 2HB LYS 84 2HB LYS 84 -6.161 -3.051 14.740 1389 1HG LYS 84 1HG LYS 84 -3.776 -3.994 14.300 1390 2HG LYS 84 2HG LYS 84 -3.381 -2.309 13.953 1391 1HD LYS 84 1HD LYS 84 -4.888 -2.279 16.320 1392 2HD LYS 84 2HD LYS 84 -3.745 -3.613 16.490 1393 1HE LYS 84 1HE LYS 84 -1.913 -2.077 15.878 1394 2HE LYS 84 2HE LYS 84 -3.076 -0.754 15.798 1395 1HZ LYS 84 1HZ LYS 84 -3.587 -1.160 18.152 1396 2HZ LYS 84 2HZ LYS 84 -1.969 -0.732 17.912 1397 3HZ LYS 84 3HZ LYS 84 -2.382 -2.345 18.207 1398 H LYS 85 H LYS 85 -7.830 -2.461 11.622 1399 HA LYS 85 HA LYS 85 -9.711 -4.352 12.839 1400 1HB LYS 85 1HB LYS 85 -10.005 -1.599 11.672 1401 2HB LYS 85 2HB LYS 85 -11.408 -2.639 11.884 1402 1HG LYS 85 1HG LYS 85 -9.835 -2.571 14.289 1403 2HG LYS 85 2HG LYS 85 -10.253 -0.937 13.768 1404 1HD LYS 85 1HD LYS 85 -12.135 -1.396 14.954 1405 2HD LYS 85 2HD LYS 85 -12.628 -2.105 13.415 1406 1HE LYS 85 1HE LYS 85 -12.069 -4.296 14.156 1407 2HE LYS 85 2HE LYS 85 -11.262 -3.672 15.593 1408 1HZ LYS 85 1HZ LYS 85 -14.151 -3.261 15.089 1409 2HZ LYS 85 2HZ LYS 85 -13.306 -3.053 16.540 1410 3HZ LYS 85 3HZ LYS 85 -13.558 -4.608 15.924 1411 H ASN 86 H ASN 86 -9.422 -2.649 9.713 1412 HA ASN 86 HA ASN 86 -10.015 -5.173 8.349 1413 1HB ASN 86 1HB ASN 86 -11.465 -3.665 6.761 1414 2HB ASN 86 2HB ASN 86 -12.161 -4.310 8.246 1415 1HD2 ASN 86 1HD2 ASN 86 -10.793 -1.473 6.723 1416 2HD2 ASN 86 2HD2 ASN 86 -11.492 -0.321 7.804 1417 H GLU 87 H GLU 87 -9.628 -4.989 5.956 1418 HA GLU 87 HA GLU 87 -7.244 -3.331 5.506 1419 1HB GLU 87 1HB GLU 87 -6.563 -4.927 3.855 1420 2HB GLU 87 2HB GLU 87 -7.028 -5.815 5.299 1421 1HG GLU 87 1HG GLU 87 -9.237 -6.245 4.258 1422 2HG GLU 87 2HG GLU 87 -8.645 -5.479 2.785 1423 H ILE 88 H ILE 88 -7.153 -1.868 3.891 1424 HA ILE 88 HA ILE 88 -9.549 -1.597 2.194 1425 HB ILE 88 HB ILE 88 -7.691 0.642 2.985 1426 1HG1 ILE 88 1HG1 ILE 88 -10.361 -0.124 4.187 1427 2HG1 ILE 88 2HG1 ILE 88 -8.797 -0.260 4.983 1428 1HG2 ILE 88 1HG2 ILE 88 -8.963 2.000 1.732 1429 2HG2 ILE 88 2HG2 ILE 88 -9.465 0.512 0.930 1430 3HG2 ILE 88 3HG2 ILE 88 -10.461 1.202 2.212 1431 1HD1 ILE 88 1HD1 ILE 88 -10.554 2.022 4.718 1432 2HD1 ILE 88 2HD1 ILE 88 -9.207 1.750 5.823 1433 3HD1 ILE 88 3HD1 ILE 88 -8.906 2.384 4.206 1434 H MET 89 H MET 89 -9.229 -1.945 0.105 1435 HA MET 89 HA MET 89 -6.498 -1.722 -0.961 1436 1HB MET 89 1HB MET 89 -7.343 -3.168 -2.811 1437 2HB MET 89 2HB MET 89 -7.396 -3.935 -1.230 1438 1HG MET 89 1HG MET 89 -9.784 -3.444 -1.073 1439 2HG MET 89 2HG MET 89 -9.728 -2.684 -2.662 1440 1HE MET 89 1HE MET 89 -10.163 -4.868 -5.113 1441 2HE MET 89 2HE MET 89 -11.589 -5.087 -4.098 1442 3HE MET 89 3HE MET 89 -10.789 -3.515 -4.170 1443 H VAL 90 H VAL 90 -6.025 -0.299 -2.531 1444 HA VAL 90 HA VAL 90 -8.159 0.918 -4.099 1445 HB VAL 90 HB VAL 90 -6.253 2.568 -2.434 1446 1HG1 VAL 90 1HG1 VAL 90 -7.749 4.446 -3.373 1447 2HG1 VAL 90 2HG1 VAL 90 -6.489 3.775 -4.411 1448 3HG1 VAL 90 3HG1 VAL 90 -8.168 3.279 -4.627 1449 1HG2 VAL 90 1HG2 VAL 90 -8.118 1.625 -1.152 1450 2HG2 VAL 90 2HG2 VAL 90 -8.254 3.377 -1.306 1451 3HG2 VAL 90 3HG2 VAL 90 -9.257 2.323 -2.303 1452 H ALA 91 H ALA 91 -7.522 1.547 -6.110 1453 HA ALA 91 HA ALA 91 -4.688 1.772 -6.734 1454 1HB ALA 91 1HB ALA 91 -5.841 -0.672 -7.048 1455 2HB ALA 91 2HB ALA 91 -6.078 0.039 -8.645 1456 3HB ALA 91 3HB ALA 91 -4.454 -0.086 -7.968 1457 HA PRO 92 HA PRO 92 -6.035 4.798 -9.613 1458 1HB PRO 92 1HB PRO 92 -4.203 4.539 -11.599 1459 2HB PRO 92 2HB PRO 92 -3.818 5.242 -10.023 1460 1HG PRO 92 1HG PRO 92 -3.315 2.469 -11.034 1461 2HG PRO 92 2HG PRO 92 -2.246 3.530 -10.098 1462 1HD PRO 92 1HD PRO 92 -3.662 1.520 -8.963 1463 2HD PRO 92 2HD PRO 92 -3.286 3.027 -8.103 1464 H ASP 93 H ASP 93 -8.022 4.144 -10.381 1465 HA ASP 93 HA ASP 93 -8.310 2.047 -12.313 1466 1HB ASP 93 1HB ASP 93 -10.020 3.393 -10.580 1467 2HB ASP 93 2HB ASP 93 -10.544 3.909 -12.180 1468 H LYS 94 H LYS 94 -10.089 3.015 -14.152 1469 HA LYS 94 HA LYS 94 -8.508 3.961 -16.195 1470 1HB LYS 94 1HB LYS 94 -11.294 3.462 -15.780 1471 2HB LYS 94 2HB LYS 94 -11.119 4.986 -16.639 1472 1HG LYS 94 1HG LYS 94 -9.831 3.908 -18.372 1473 2HG LYS 94 2HG LYS 94 -9.869 2.381 -17.487 1474 1HD LYS 94 1HD LYS 94 -12.414 3.759 -18.260 1475 2HD LYS 94 2HD LYS 94 -11.545 2.760 -19.427 1476 1HE LYS 94 1HE LYS 94 -11.723 0.839 -18.005 1477 2HE LYS 94 2HE LYS 94 -12.389 1.811 -16.694 1478 1HZ LYS 94 1HZ LYS 94 -13.889 2.014 -19.134 1479 2HZ LYS 94 2HZ LYS 94 -14.423 1.698 -17.561 1480 3HZ LYS 94 3HZ LYS 94 -13.837 0.437 -18.523 1481 H ASP 95 H ASP 95 -10.719 5.881 -14.166 1482 HA ASP 95 HA ASP 95 -8.949 8.168 -14.403 1483 1HB ASP 95 1HB ASP 95 -11.120 7.941 -16.153 1484 2HB ASP 95 2HB ASP 95 -11.659 9.063 -14.907 1485 H TYR 96 H TYR 96 -10.273 6.258 -12.399 1486 HA TYR 96 HA TYR 96 -10.888 8.336 -10.444 1487 1HB TYR 96 1HB TYR 96 -12.817 6.830 -9.627 1488 2HB TYR 96 2HB TYR 96 -13.097 7.837 -11.044 1489 HD1 TYR 96 HD1 TYR 96 -13.164 6.818 -13.294 1490 HD2 TYR 96 HD2 TYR 96 -12.818 4.441 -9.782 1491 HE1 TYR 96 HE1 TYR 96 -13.820 4.829 -14.583 1492 HE2 TYR 96 HE2 TYR 96 -13.472 2.445 -11.062 1493 HH TYR 96 HH TYR 96 -14.104 1.645 -13.030 1494 H PHE 97 H PHE 97 -11.217 7.224 -8.207 1495 HA PHE 97 HA PHE 97 -9.127 5.165 -7.942 1496 1HB PHE 97 1HB PHE 97 -9.935 7.417 -6.105 1497 2HB PHE 97 2HB PHE 97 -8.939 6.070 -5.563 1498 HD1 PHE 97 HD1 PHE 97 -6.970 5.564 -7.421 1499 HD2 PHE 97 HD2 PHE 97 -8.763 9.325 -6.549 1500 HE1 PHE 97 HE1 PHE 97 -4.962 6.713 -8.258 1501 HE2 PHE 97 HE2 PHE 97 -6.758 10.479 -7.385 1502 HZ PHE 97 HZ PHE 97 -4.854 9.173 -8.242 1503 H LEU 98 H LEU 98 -10.140 3.257 -7.779 1504 HA LEU 98 HA LEU 98 -12.685 2.967 -6.482 1505 1HB LEU 98 1HB LEU 98 -11.578 1.607 -8.446 1506 2HB LEU 98 2HB LEU 98 -10.942 0.637 -7.120 1507 HG LEU 98 HG LEU 98 -13.870 1.165 -7.197 1508 1HD1 LEU 98 1HD1 LEU 98 -12.700 -1.078 -8.802 1509 2HD1 LEU 98 2HD1 LEU 98 -13.026 0.495 -9.530 1510 3HD1 LEU 98 3HD1 LEU 98 -14.343 -0.436 -8.817 1511 1HD2 LEU 98 1HD2 LEU 98 -12.000 -0.917 -6.168 1512 2HD2 LEU 98 2HD2 LEU 98 -13.673 -1.356 -6.514 1513 3HD2 LEU 98 3HD2 LEU 98 -13.319 -0.081 -5.348 1514 H ILE 99 H ILE 99 -13.128 2.243 -4.471 1515 HA ILE 99 HA ILE 99 -10.897 1.302 -2.806 1516 HB ILE 99 HB ILE 99 -12.987 3.233 -1.806 1517 1HG1 ILE 99 1HG1 ILE 99 -10.523 4.517 -1.746 1518 2HG1 ILE 99 2HG1 ILE 99 -10.536 3.711 -3.310 1519 1HG2 ILE 99 1HG2 ILE 99 -11.059 3.470 -0.041 1520 2HG2 ILE 99 2HG2 ILE 99 -12.224 2.152 0.065 1521 3HG2 ILE 99 3HG2 ILE 99 -10.625 1.862 -0.619 1522 1HD1 ILE 99 1HD1 ILE 99 -11.390 5.972 -3.481 1523 2HD1 ILE 99 2HD1 ILE 99 -12.655 4.798 -3.847 1524 3HD1 ILE 99 3HD1 ILE 99 -12.631 5.610 -2.282 1525 H VAL 100 H VAL 100 -11.349 -0.550 -1.821 1526 HA VAL 100 HA VAL 100 -14.163 -1.198 -1.242 1527 HB VAL 100 HB VAL 100 -12.081 -3.115 -2.302 1528 1HG1 VAL 100 1HG1 VAL 100 -13.905 -4.760 -2.308 1529 2HG1 VAL 100 2HG1 VAL 100 -13.534 -4.192 -0.678 1530 3HG1 VAL 100 3HG1 VAL 100 -14.958 -3.583 -1.524 1531 1HG2 VAL 100 1HG2 VAL 100 -13.734 -1.344 -3.681 1532 2HG2 VAL 100 2HG2 VAL 100 -12.858 -2.721 -4.350 1533 3HG2 VAL 100 3HG2 VAL 100 -14.528 -2.913 -3.816 1534 H ILE 101 H ILE 101 -14.380 -1.275 0.891 1535 HA ILE 101 HA ILE 101 -12.138 -2.247 2.521 1536 HB ILE 101 HB ILE 101 -14.590 -0.733 3.423 1537 1HG1 ILE 101 1HG1 ILE 101 -12.117 0.704 3.714 1538 2HG1 ILE 101 2HG1 ILE 101 -12.308 0.200 2.038 1539 1HG2 ILE 101 1HG2 ILE 101 -12.397 -2.060 4.819 1540 2HG2 ILE 101 2HG2 ILE 101 -12.635 -0.383 5.307 1541 3HG2 ILE 101 3HG2 ILE 101 -13.969 -1.531 5.418 1542 1HD1 ILE 101 1HD1 ILE 101 -13.233 2.477 2.737 1543 2HD1 ILE 101 2HD1 ILE 101 -14.269 1.422 1.774 1544 3HD1 ILE 101 3HD1 ILE 101 -14.527 1.562 3.513 1545 H GLN 102 H GLN 102 -12.345 -3.963 3.887 1546 HA GLN 102 HA GLN 102 -14.830 -5.121 4.621 1547 1HB GLN 102 1HB GLN 102 -14.744 -7.176 3.366 1548 2HB GLN 102 2HB GLN 102 -14.723 -5.826 2.238 1549 1HG GLN 102 1HG GLN 102 -12.305 -6.072 1.989 1550 2HG GLN 102 2HG GLN 102 -12.331 -7.431 3.112 1551 1HE2 GLN 102 1HE2 GLN 102 -12.104 -6.713 -0.019 1552 2HE2 GLN 102 2HE2 GLN 102 -12.821 -8.118 -0.724 1553 H ASN 103 H ASN 103 -14.401 -7.438 5.548 1554 HA ASN 103 HA ASN 103 -12.652 -7.225 7.672 1555 1HB ASN 103 1HB ASN 103 -14.151 -9.435 6.398 1556 2HB ASN 103 2HB ASN 103 -12.796 -9.918 7.414 1557 1HD2 ASN 103 1HD2 ASN 103 -15.972 -8.637 7.316 1558 2HD2 ASN 103 2HD2 ASN 103 -16.225 -8.539 9.022 1559 HA PRO 104 HA PRO 104 -8.601 -8.162 6.274 1560 1HB PRO 104 1HB PRO 104 -7.632 -9.720 8.275 1561 2HB PRO 104 2HB PRO 104 -7.906 -7.983 8.457 1562 1HG PRO 104 1HG PRO 104 -9.626 -10.273 9.329 1563 2HG PRO 104 2HG PRO 104 -9.217 -8.785 10.202 1564 1HD PRO 104 1HD PRO 104 -11.579 -9.121 8.922 1565 2HD PRO 104 2HD PRO 104 -10.788 -7.538 9.067 1566 H THR 105 H THR 105 -7.356 -9.698 5.218 1567 HA THR 105 HA THR 105 -8.639 -12.326 4.858 1568 HB THR 105 HB THR 105 -7.385 -12.398 2.675 1569 HG1 THR 105 HG1 THR 105 -5.961 -10.863 2.405 1570 1HG2 THR 105 1HG2 THR 105 -9.713 -11.893 2.603 1571 2HG2 THR 105 2HG2 THR 105 -8.905 -10.736 1.545 1572 3HG2 THR 105 3HG2 THR 105 -9.436 -10.241 3.152 1573 H GLU 106 H GLU 106 -5.600 -10.656 5.416 1574 HA GLU 106 HA GLU 106 -3.521 -11.386 6.004 1575 1HB GLU 106 1HB GLU 106 -4.584 -11.976 8.058 1576 2HB GLU 106 2HB GLU 106 -5.279 -13.430 7.355 1577 1HG GLU 106 1HG GLU 106 -3.238 -14.553 7.355 1578 2HG GLU 106 2HG GLU 106 -2.315 -13.064 7.545 Start of MODEL 18 1 H MET 11 H MET 11 19.107 -9.012 15.046 2 HA MET 11 HA MET 11 18.925 -8.123 12.274 3 1HB MET 11 1HB MET 11 20.830 -7.502 13.875 4 2HB MET 11 2HB MET 11 21.396 -9.152 13.653 5 1HG MET 11 1HG MET 11 22.402 -8.590 11.772 6 2HG MET 11 2HG MET 11 20.880 -8.010 11.098 7 1HE MET 11 1HE MET 11 20.126 -5.248 11.308 8 2HE MET 11 2HE MET 11 20.032 -5.854 12.962 9 3HE MET 11 3HE MET 11 20.873 -4.341 12.623 10 H ALA 12 H ALA 12 19.954 -11.004 14.094 11 HA ALA 12 HA ALA 12 20.573 -12.679 11.990 12 1HB ALA 12 1HB ALA 12 19.406 -14.395 13.779 13 2HB ALA 12 2HB ALA 12 21.075 -13.826 13.842 14 3HB ALA 12 3HB ALA 12 19.830 -13.015 14.792 15 H GLU 13 H GLU 13 17.403 -11.959 13.380 16 HA GLU 13 HA GLU 13 15.857 -13.861 12.103 17 1HB GLU 13 1HB GLU 13 15.239 -11.967 13.812 18 2HB GLU 13 2HB GLU 13 14.840 -11.058 12.361 19 1HG GLU 13 1HG GLU 13 13.227 -12.720 11.706 20 2HG GLU 13 2HG GLU 13 13.689 -13.748 13.062 21 H VAL 14 H VAL 14 16.659 -10.591 10.941 22 HA VAL 14 HA VAL 14 15.358 -10.833 8.454 23 HB VAL 14 HB VAL 14 17.758 -9.098 9.039 24 1HG1 VAL 14 1HG1 VAL 14 15.784 -7.883 7.384 25 2HG1 VAL 14 2HG1 VAL 14 17.454 -8.296 6.992 26 3HG1 VAL 14 3HG1 VAL 14 16.168 -9.474 6.729 27 1HG2 VAL 14 1HG2 VAL 14 16.241 -8.620 10.780 28 2HG2 VAL 14 2HG2 VAL 14 15.987 -7.360 9.572 29 3HG2 VAL 14 3HG2 VAL 14 14.851 -8.703 9.697 30 H GLU 15 H GLU 15 18.637 -11.592 9.499 31 HA GLU 15 HA GLU 15 19.752 -12.050 6.957 32 1HB GLU 15 1HB GLU 15 20.452 -13.057 9.707 33 2HB GLU 15 2HB GLU 15 21.373 -13.529 8.285 34 1HG GLU 15 1HG GLU 15 21.968 -11.242 7.848 35 2HG GLU 15 2HG GLU 15 20.934 -10.685 9.162 36 H GLU 16 H GLU 16 18.103 -14.204 9.231 37 HA GLU 16 HA GLU 16 18.518 -16.609 7.860 38 1HB GLU 16 1HB GLU 16 17.328 -15.931 10.203 39 2HB GLU 16 2HB GLU 16 15.916 -16.299 9.221 40 1HG GLU 16 1HG GLU 16 17.400 -18.438 8.639 41 2HG GLU 16 2HG GLU 16 18.036 -18.081 10.244 42 H THR 17 H THR 17 16.031 -14.135 7.510 43 HA THR 17 HA THR 17 14.543 -15.637 5.555 44 HB THR 17 HB THR 17 14.332 -12.734 6.378 45 HG1 THR 17 HG1 THR 17 13.415 -13.674 8.044 46 1HG2 THR 17 1HG2 THR 17 13.030 -14.281 4.257 47 2HG2 THR 17 2HG2 THR 17 13.147 -12.535 4.477 48 3HG2 THR 17 3HG2 THR 17 11.907 -13.450 5.334 49 H LEU 18 H LEU 18 17.155 -13.367 5.536 50 HA LEU 18 HA LEU 18 16.859 -12.541 2.813 51 1HB LEU 18 1HB LEU 18 18.537 -11.911 5.034 52 2HB LEU 18 2HB LEU 18 19.551 -12.264 3.636 53 HG LEU 18 HG LEU 18 17.738 -10.571 2.539 54 1HD1 LEU 18 1HD1 LEU 18 18.150 -9.677 5.388 55 2HD1 LEU 18 2HD1 LEU 18 16.619 -10.128 4.638 56 3HD1 LEU 18 3HD1 LEU 18 17.476 -8.685 4.095 57 1HD2 LEU 18 1HD2 LEU 18 20.450 -10.279 3.702 58 2HD2 LEU 18 2HD2 LEU 18 19.597 -8.805 3.242 59 3HD2 LEU 18 3HD2 LEU 18 19.897 -10.062 2.041 60 H LYS 19 H LYS 19 18.857 -14.928 4.501 61 HA LYS 19 HA LYS 19 20.453 -15.757 2.386 62 1HB LYS 19 1HB LYS 19 19.800 -16.693 5.014 63 2HB LYS 19 2HB LYS 19 19.796 -18.058 3.906 64 1HG LYS 19 1HG LYS 19 21.988 -18.115 4.358 65 2HG LYS 19 2HG LYS 19 22.078 -16.824 3.158 66 1HD LYS 19 1HD LYS 19 23.224 -15.854 4.891 67 2HD LYS 19 2HD LYS 19 21.587 -15.299 5.247 68 1HE LYS 19 1HE LYS 19 21.569 -16.382 7.191 69 2HE LYS 19 2HE LYS 19 22.077 -17.886 6.423 70 1HZ LYS 19 1HZ LYS 19 24.363 -16.520 6.423 71 2HZ LYS 19 2HZ LYS 19 23.902 -17.567 7.669 72 3HZ LYS 19 3HZ LYS 19 23.655 -15.901 7.829 73 H ARG 20 H ARG 20 17.314 -17.078 3.427 74 HA ARG 20 HA ARG 20 17.114 -18.979 1.349 75 1HB ARG 20 1HB ARG 20 15.798 -18.877 3.543 76 2HB ARG 20 2HB ARG 20 14.766 -17.702 2.738 77 1HG ARG 20 1HG ARG 20 13.562 -19.504 2.177 78 2HG ARG 20 2HG ARG 20 14.776 -19.695 0.911 79 1HD ARG 20 1HD ARG 20 15.042 -21.751 1.765 80 2HD ARG 20 2HD ARG 20 15.981 -20.933 3.013 81 HE ARG 20 HE ARG 20 13.297 -20.897 3.781 82 1HH1 ARG 20 1HH1 ARG 20 15.869 -23.188 3.279 83 2HH1 ARG 20 2HH1 ARG 20 15.270 -24.315 4.451 84 1HH2 ARG 20 1HH2 ARG 20 12.498 -22.372 5.327 85 2HH2 ARG 20 2HH2 ARG 20 13.352 -23.850 5.615 86 H LEU 21 H LEU 21 16.047 -15.632 1.644 87 HA LEU 21 HA LEU 21 14.468 -15.521 -0.677 88 1HB LEU 21 1HB LEU 21 15.639 -13.641 1.212 89 2HB LEU 21 2HB LEU 21 15.548 -12.997 -0.426 90 HG LEU 21 HG LEU 21 13.158 -13.301 -0.465 91 1HD1 LEU 21 1HD1 LEU 21 12.270 -14.958 0.716 92 2HD1 LEU 21 2HD1 LEU 21 12.443 -13.941 2.146 93 3HD1 LEU 21 3HD1 LEU 21 13.709 -15.095 1.727 94 1HD2 LEU 21 1HD2 LEU 21 12.625 -11.933 1.712 95 2HD2 LEU 21 2HD2 LEU 21 13.558 -11.215 0.398 96 3HD2 LEU 21 3HD2 LEU 21 14.383 -11.842 1.826 97 H GLN 22 H GLN 22 17.858 -14.543 -0.173 98 HA GLN 22 HA GLN 22 18.353 -13.921 -2.884 99 1HB GLN 22 1HB GLN 22 19.755 -13.739 -0.469 100 2HB GLN 22 2HB GLN 22 20.727 -14.800 -1.480 101 1HG GLN 22 1HG GLN 22 21.453 -13.102 -2.699 102 2HG GLN 22 2HG GLN 22 19.813 -12.516 -2.975 103 1HE2 GLN 22 1HE2 GLN 22 18.846 -11.470 -0.927 104 2HE2 GLN 22 2HE2 GLN 22 19.872 -10.335 -0.124 105 H SER 23 H SER 23 18.224 -16.896 -1.162 106 HA SER 23 HA SER 23 19.831 -18.389 -3.027 107 1HB SER 23 1HB SER 23 18.401 -18.928 -0.514 108 2HB SER 23 2HB SER 23 18.379 -20.270 -1.658 109 HG SER 23 HG SER 23 20.432 -20.580 -1.318 110 H GLN 24 H GLN 24 16.540 -17.417 -2.779 111 HA GLN 24 HA GLN 24 15.702 -19.381 -4.787 112 1HB GLN 24 1HB GLN 24 13.428 -18.747 -4.249 113 2HB GLN 24 2HB GLN 24 14.299 -19.115 -2.766 114 1HG GLN 24 1HG GLN 24 14.453 -16.849 -2.168 115 2HG GLN 24 2HG GLN 24 13.986 -16.311 -3.781 116 1HE2 GLN 24 1HE2 GLN 24 12.638 -15.170 -1.867 117 2HE2 GLN 24 2HE2 GLN 24 11.048 -15.824 -1.693 118 H LYS 25 H LYS 25 14.654 -18.735 -6.710 119 HA LYS 25 HA LYS 25 15.747 -16.351 -7.870 120 1HB LYS 25 1HB LYS 25 15.545 -18.344 -9.227 121 2HB LYS 25 2HB LYS 25 13.810 -18.408 -8.943 122 1HG LYS 25 1HG LYS 25 13.362 -16.741 -10.429 123 2HG LYS 25 2HG LYS 25 14.924 -15.955 -10.188 124 1HD LYS 25 1HD LYS 25 15.313 -18.572 -11.296 125 2HD LYS 25 2HD LYS 25 14.158 -17.672 -12.282 126 1HE LYS 25 1HE LYS 25 15.788 -15.776 -12.309 127 2HE LYS 25 2HE LYS 25 16.948 -16.834 -11.507 128 1HZ LYS 25 1HZ LYS 25 17.038 -18.242 -13.365 129 2HZ LYS 25 2HZ LYS 25 17.112 -16.677 -14.002 130 3HZ LYS 25 3HZ LYS 25 15.666 -17.553 -14.077 131 H GLY 26 H GLY 26 14.649 -14.532 -8.616 132 1HA GLY 26 1HA GLY 26 12.508 -13.419 -9.045 133 2HA GLY 26 2HA GLY 26 11.886 -14.228 -7.615 134 H VAL 27 H VAL 27 13.963 -13.781 -5.828 135 HA VAL 27 HA VAL 27 13.347 -11.250 -4.831 136 HB VAL 27 HB VAL 27 15.777 -12.950 -4.254 137 1HG1 VAL 27 1HG1 VAL 27 16.346 -10.832 -3.459 138 2HG1 VAL 27 2HG1 VAL 27 14.694 -10.476 -2.950 139 3HG1 VAL 27 3HG1 VAL 27 15.664 -11.641 -2.048 140 1HG2 VAL 27 1HG2 VAL 27 13.745 -14.139 -3.762 141 2HG2 VAL 27 2HG2 VAL 27 14.476 -13.616 -2.245 142 3HG2 VAL 27 3HG2 VAL 27 13.089 -12.747 -2.901 143 H GLN 28 H GLN 28 14.005 -9.273 -5.351 144 HA GLN 28 HA GLN 28 16.244 -8.982 -7.212 145 1HB GLN 28 1HB GLN 28 13.738 -7.583 -6.762 146 2HB GLN 28 2HB GLN 28 15.099 -6.472 -6.830 147 1HG GLN 28 1HG GLN 28 15.393 -6.766 -9.025 148 2HG GLN 28 2HG GLN 28 15.104 -8.503 -8.933 149 1HE2 GLN 28 1HE2 GLN 28 12.677 -8.909 -8.217 150 2HE2 GLN 28 2HE2 GLN 28 11.519 -8.092 -9.206 151 H GLY 29 H GLY 29 15.255 -8.195 -3.966 152 1HA GLY 29 1HA GLY 29 17.747 -7.855 -2.895 153 2HA GLY 29 2HA GLY 29 17.325 -6.261 -3.502 154 H ILE 30 H ILE 30 17.723 -7.309 -0.737 155 HA ILE 30 HA ILE 30 15.083 -6.585 0.356 156 HB ILE 30 HB ILE 30 17.172 -8.192 1.814 157 1HG1 ILE 30 1HG1 ILE 30 15.213 -9.988 1.263 158 2HG1 ILE 30 2HG1 ILE 30 15.180 -9.019 -0.207 159 1HG2 ILE 30 1HG2 ILE 30 15.506 -7.017 3.182 160 2HG2 ILE 30 2HG2 ILE 30 14.218 -7.832 2.297 161 3HG2 ILE 30 3HG2 ILE 30 15.333 -8.769 3.292 162 1HD1 ILE 30 1HD1 ILE 30 16.967 -11.089 0.507 163 2HD1 ILE 30 2HD1 ILE 30 16.929 -10.125 -0.970 164 3HD1 ILE 30 3HD1 ILE 30 17.886 -9.587 0.410 165 H ILE 31 H ILE 31 14.990 -4.738 1.442 166 HA ILE 31 HA ILE 31 17.508 -3.551 2.402 167 HB ILE 31 HB ILE 31 14.931 -2.162 1.660 168 1HG1 ILE 31 1HG1 ILE 31 17.569 -1.816 0.271 169 2HG1 ILE 31 2HG1 ILE 31 16.517 -3.161 -0.157 170 1HG2 ILE 31 1HG2 ILE 31 17.575 -1.063 2.601 171 2HG2 ILE 31 2HG2 ILE 31 16.262 -0.090 1.939 172 3HG2 ILE 31 3HG2 ILE 31 16.028 -0.979 3.445 173 1HD1 ILE 31 1HD1 ILE 31 15.233 -0.518 -0.076 174 2HD1 ILE 31 2HD1 ILE 31 16.438 -0.757 -1.342 175 3HD1 ILE 31 3HD1 ILE 31 15.051 -1.841 -1.228 176 H VAL 32 H VAL 32 17.634 -2.702 4.462 177 HA VAL 32 HA VAL 32 15.297 -2.991 6.210 178 HB VAL 32 HB VAL 32 18.020 -3.967 7.058 179 1HG1 VAL 32 1HG1 VAL 32 16.441 -3.243 8.820 180 2HG1 VAL 32 2HG1 VAL 32 15.285 -4.443 8.238 181 3HG1 VAL 32 3HG1 VAL 32 16.833 -4.960 8.907 182 1HG2 VAL 32 1HG2 VAL 32 15.693 -5.604 6.054 183 2HG2 VAL 32 2HG2 VAL 32 17.228 -5.366 5.219 184 3HG2 VAL 32 3HG2 VAL 32 17.182 -6.245 6.748 185 H VAL 33 H VAL 33 15.006 -1.255 7.446 186 HA VAL 33 HA VAL 33 17.327 0.415 8.129 187 HB VAL 33 HB VAL 33 14.679 1.639 7.397 188 1HG1 VAL 33 1HG1 VAL 33 16.575 2.792 8.753 189 2HG1 VAL 33 2HG1 VAL 33 17.364 2.934 7.181 190 3HG1 VAL 33 3HG1 VAL 33 15.782 3.668 7.444 191 1HG2 VAL 33 1HG2 VAL 33 15.625 2.157 5.187 192 2HG2 VAL 33 2HG2 VAL 33 17.030 1.160 5.566 193 3HG2 VAL 33 3HG2 VAL 33 15.434 0.421 5.435 194 H ASN 34 H ASN 34 17.304 1.312 10.146 195 HA ASN 34 HA ASN 34 15.619 0.137 12.099 196 1HB ASN 34 1HB ASN 34 17.285 2.613 12.528 197 2HB ASN 34 2HB ASN 34 16.857 1.370 13.700 198 1HD2 ASN 34 1HD2 ASN 34 19.321 2.543 11.964 199 2HD2 ASN 34 2HD2 ASN 34 20.292 1.123 11.800 200 H THR 35 H THR 35 14.937 2.086 13.868 201 HA THR 35 HA THR 35 12.575 3.180 12.639 202 HB THR 35 HB THR 35 12.807 4.242 15.231 203 HG1 THR 35 HG1 THR 35 13.609 2.646 16.457 204 1HG2 THR 35 1HG2 THR 35 11.019 2.622 15.749 205 2HG2 THR 35 2HG2 THR 35 11.355 1.790 14.230 206 3HG2 THR 35 3HG2 THR 35 10.747 3.445 14.214 207 H GLU 36 H GLU 36 15.724 4.321 13.485 208 HA GLU 36 HA GLU 36 15.061 7.102 13.589 209 1HB GLU 36 1HB GLU 36 17.578 5.503 13.560 210 2HB GLU 36 2HB GLU 36 17.675 7.207 13.140 211 1HG GLU 36 1HG GLU 36 16.201 7.352 15.389 212 2HG GLU 36 2HG GLU 36 17.169 5.920 15.733 213 H GLY 37 H GLY 37 16.123 4.868 11.097 214 1HA GLY 37 1HA GLY 37 15.263 5.475 8.833 215 2HA GLY 37 2HA GLY 37 15.928 7.073 9.138 216 H ILE 38 H ILE 38 17.867 4.614 10.403 217 HA ILE 38 HA ILE 38 19.753 4.950 8.180 218 HB ILE 38 HB ILE 38 20.343 3.830 10.918 219 1HG1 ILE 38 1HG1 ILE 38 20.735 6.657 9.910 220 2HG1 ILE 38 2HG1 ILE 38 19.515 6.154 11.074 221 1HG2 ILE 38 1HG2 ILE 38 21.916 3.237 9.117 222 2HG2 ILE 38 2HG2 ILE 38 22.171 4.953 8.799 223 3HG2 ILE 38 3HG2 ILE 38 22.656 4.261 10.347 224 1HD1 ILE 38 1HD1 ILE 38 22.453 6.447 11.411 225 2HD1 ILE 38 2HD1 ILE 38 21.135 6.977 12.456 226 3HD1 ILE 38 3HD1 ILE 38 21.587 5.274 12.403 227 HA PRO 39 HA PRO 39 18.964 0.784 6.907 228 1HB PRO 39 1HB PRO 39 21.066 0.550 5.204 229 2HB PRO 39 2HB PRO 39 19.611 1.476 4.813 230 1HG PRO 39 1HG PRO 39 22.263 2.445 5.809 231 2HG PRO 39 2HG PRO 39 21.227 3.125 4.541 232 1HD PRO 39 1HD PRO 39 21.315 4.139 7.050 233 2HD PRO 39 2HD PRO 39 19.843 4.172 6.058 234 H ILE 40 H ILE 40 19.629 -1.230 7.491 235 HA ILE 40 HA ILE 40 22.199 -1.427 8.924 236 HB ILE 40 HB ILE 40 20.994 -3.410 10.100 237 1HG1 ILE 40 1HG1 ILE 40 18.634 -1.721 9.244 238 2HG1 ILE 40 2HG1 ILE 40 18.983 -3.350 8.678 239 1HG2 ILE 40 1HG2 ILE 40 20.405 -1.998 11.912 240 2HG2 ILE 40 2HG2 ILE 40 21.762 -1.228 11.092 241 3HG2 ILE 40 3HG2 ILE 40 20.124 -0.626 10.839 242 1HD1 ILE 40 1HD1 ILE 40 17.436 -2.599 10.874 243 2HD1 ILE 40 2HD1 ILE 40 17.933 -4.227 10.412 244 3HD1 ILE 40 3HD1 ILE 40 18.912 -3.294 11.543 245 H LYS 41 H LYS 41 19.934 -2.978 6.738 246 HA LYS 41 HA LYS 41 22.099 -4.702 5.792 247 1HB LYS 41 1HB LYS 41 19.401 -5.637 6.745 248 2HB LYS 41 2HB LYS 41 20.351 -6.576 5.602 249 1HG LYS 41 1HG LYS 41 22.115 -5.957 7.668 250 2HG LYS 41 2HG LYS 41 20.594 -6.372 8.462 251 1HD LYS 41 1HD LYS 41 21.243 -8.500 8.216 252 2HD LYS 41 2HD LYS 41 20.807 -8.300 6.517 253 1HE LYS 41 1HE LYS 41 23.312 -7.261 6.538 254 2HE LYS 41 2HE LYS 41 23.453 -8.496 7.789 255 1HZ LYS 41 1HZ LYS 41 23.633 -8.896 5.092 256 2HZ LYS 41 2HZ LYS 41 22.087 -9.464 5.477 257 3HZ LYS 41 3HZ LYS 41 23.441 -10.097 6.268 258 H SER 42 H SER 42 22.245 -4.655 3.647 259 HA SER 42 HA SER 42 19.950 -4.565 1.937 260 1HB SER 42 1HB SER 42 20.657 -2.102 2.814 261 2HB SER 42 2HB SER 42 21.692 -2.233 1.393 262 HG SER 42 HG SER 42 19.906 -2.498 0.120 263 H THR 43 H THR 43 20.496 -5.902 0.362 264 HA THR 43 HA THR 43 23.292 -6.321 -0.310 265 HB THR 43 HB THR 43 22.620 -8.261 -1.483 266 HG1 THR 43 HG1 THR 43 20.018 -7.110 -1.440 267 1HG2 THR 43 1HG2 THR 43 20.467 -8.572 0.457 268 2HG2 THR 43 2HG2 THR 43 21.934 -7.893 1.163 269 3HG2 THR 43 3HG2 THR 43 21.996 -9.439 0.317 270 H MET 44 H MET 44 20.919 -4.244 -1.303 271 HA MET 44 HA MET 44 21.343 -4.311 -4.134 272 1HB MET 44 1HB MET 44 19.525 -3.080 -2.384 273 2HB MET 44 2HB MET 44 20.379 -1.762 -3.175 274 1HG MET 44 1HG MET 44 19.785 -2.644 -5.350 275 2HG MET 44 2HG MET 44 18.993 -4.024 -4.594 276 1HE MET 44 1HE MET 44 15.858 -2.500 -2.945 277 2HE MET 44 2HE MET 44 16.637 -3.980 -3.505 278 3HE MET 44 3HE MET 44 17.389 -3.013 -2.235 279 H ASP 45 H ASP 45 21.707 -1.700 -4.865 280 HA ASP 45 HA ASP 45 24.532 -1.426 -4.642 281 1HB ASP 45 1HB ASP 45 22.541 -0.478 -6.365 282 2HB ASP 45 2HB ASP 45 23.214 0.965 -5.613 283 H ASN 46 H ASN 46 25.557 0.702 -4.043 284 HA ASN 46 HA ASN 46 25.014 1.271 -1.329 285 1HB ASN 46 1HB ASN 46 27.101 1.772 -3.143 286 2HB ASN 46 2HB ASN 46 26.561 3.357 -2.596 287 1HD2 ASN 46 1HD2 ASN 46 25.788 2.777 -0.020 288 2HD2 ASN 46 2HD2 ASN 46 27.176 2.327 0.905 289 HA PRO 47 HA PRO 47 23.363 5.526 -2.927 290 1HB PRO 47 1HB PRO 47 22.905 5.755 -5.593 291 2HB PRO 47 2HB PRO 47 24.457 6.156 -4.847 292 1HG PRO 47 1HG PRO 47 23.636 3.664 -6.288 293 2HG PRO 47 2HG PRO 47 25.152 4.575 -6.404 294 1HD PRO 47 1HD PRO 47 24.922 2.312 -4.936 295 2HD PRO 47 2HD PRO 47 26.009 3.639 -4.480 296 H THR 48 H THR 48 22.320 2.540 -4.409 297 HA THR 48 HA THR 48 19.615 3.354 -4.863 298 HB THR 48 HB THR 48 20.590 0.511 -4.596 299 HG1 THR 48 HG1 THR 48 21.663 2.142 -6.200 300 1HG2 THR 48 1HG2 THR 48 18.351 1.736 -6.213 301 2HG2 THR 48 2HG2 THR 48 18.155 0.845 -4.703 302 3HG2 THR 48 3HG2 THR 48 18.767 0.024 -6.139 303 H THR 49 H THR 49 21.330 1.679 -2.282 304 HA THR 49 HA THR 49 19.026 0.913 -0.813 305 HB THR 49 HB THR 49 21.897 1.272 0.056 306 HG1 THR 49 HG1 THR 49 21.415 -0.456 -1.430 307 1HG2 THR 49 1HG2 THR 49 21.249 -0.047 2.053 308 2HG2 THR 49 2HG2 THR 49 19.560 0.100 1.567 309 3HG2 THR 49 3HG2 THR 49 20.482 1.540 2.000 310 H THR 50 H THR 50 21.303 3.625 -0.467 311 HA THR 50 HA THR 50 20.203 4.821 1.780 312 HB THR 50 HB THR 50 21.086 6.759 -0.232 313 HG1 THR 50 HG1 THR 50 23.004 5.886 -0.687 314 1HG2 THR 50 1HG2 THR 50 21.005 7.307 2.123 315 2HG2 THR 50 2HG2 THR 50 22.683 7.327 1.581 316 3HG2 THR 50 3HG2 THR 50 22.071 5.957 2.507 317 H GLN 51 H GLN 51 19.419 5.403 -1.641 318 HA GLN 51 HA GLN 51 17.488 7.384 -1.236 319 1HB GLN 51 1HB GLN 51 18.455 6.893 -3.432 320 2HB GLN 51 2HB GLN 51 17.656 5.326 -3.445 321 1HG GLN 51 1HG GLN 51 15.605 7.138 -3.001 322 2HG GLN 51 2HG GLN 51 16.644 7.926 -4.188 323 1HE2 GLN 51 1HE2 GLN 51 14.606 5.189 -3.525 324 2HE2 GLN 51 2HE2 GLN 51 14.450 4.652 -5.159 325 H TYR 52 H TYR 52 17.042 3.880 -1.708 326 HA TYR 52 HA TYR 52 14.271 3.828 -1.401 327 1HB TYR 52 1HB TYR 52 16.438 1.794 -1.019 328 2HB TYR 52 2HB TYR 52 14.786 1.401 -0.556 329 HD1 TYR 52 HD1 TYR 52 16.289 3.214 -3.464 330 HD2 TYR 52 HD2 TYR 52 13.802 0.033 -2.125 331 HE1 TYR 52 HE1 TYR 52 15.779 2.638 -5.800 332 HE2 TYR 52 HE2 TYR 52 13.285 -0.553 -4.457 333 HH TYR 52 HH TYR 52 14.813 -0.005 -6.874 334 H ALA 53 H ALA 53 16.838 3.502 1.021 335 HA ALA 53 HA ALA 53 15.104 3.047 3.217 336 1HB ALA 53 1HB ALA 53 17.976 3.850 2.960 337 2HB ALA 53 2HB ALA 53 17.182 3.831 4.535 338 3HB ALA 53 3HB ALA 53 17.287 2.350 3.582 339 H SER 54 H SER 54 16.214 5.910 1.590 340 HA SER 54 HA SER 54 15.525 7.726 3.704 341 1HB SER 54 1HB SER 54 16.165 8.164 0.780 342 2HB SER 54 2HB SER 54 15.855 9.473 1.921 343 HG SER 54 HG SER 54 18.145 8.588 1.485 344 H LEU 55 H LEU 55 13.900 6.311 0.973 345 HA LEU 55 HA LEU 55 11.617 8.110 1.271 346 1HB LEU 55 1HB LEU 55 10.989 7.533 -0.829 347 2HB LEU 55 2HB LEU 55 12.715 7.198 -0.955 348 HG LEU 55 HG LEU 55 11.849 4.776 -0.188 349 1HD1 LEU 55 1HD1 LEU 55 9.725 4.258 -0.757 350 2HD1 LEU 55 2HD1 LEU 55 9.677 5.419 -2.083 351 3HD1 LEU 55 3HD1 LEU 55 9.463 5.970 -0.422 352 1HD2 LEU 55 1HD2 LEU 55 11.690 5.706 -3.048 353 2HD2 LEU 55 2HD2 LEU 55 12.110 4.100 -2.451 354 3HD2 LEU 55 3HD2 LEU 55 13.210 5.454 -2.189 355 H MET 56 H MET 56 12.690 5.051 2.295 356 HA MET 56 HA MET 56 10.206 3.704 2.502 357 1HB MET 56 1HB MET 56 12.938 3.179 3.145 358 2HB MET 56 2HB MET 56 11.958 2.818 4.560 359 1HG MET 56 1HG MET 56 12.260 0.853 3.166 360 2HG MET 56 2HG MET 56 10.566 1.331 3.242 361 1HE MET 56 1HE MET 56 9.203 1.424 1.719 362 2HE MET 56 2HE MET 56 9.391 2.596 0.415 363 3HE MET 56 3HE MET 56 9.473 0.868 0.067 364 H HIS 57 H HIS 57 12.207 5.150 5.083 365 HA HIS 57 HA HIS 57 10.374 4.982 7.138 366 1HB HIS 57 1HB HIS 57 12.637 5.622 7.607 367 2HB HIS 57 2HB HIS 57 12.497 7.064 6.606 368 HD1 HIS 57 HD1 HIS 57 13.002 8.729 8.457 369 HD2 HIS 57 HD2 HIS 57 9.818 6.211 9.341 370 HE1 HIS 57 HE1 HIS 57 11.933 9.695 10.518 371 H SER 58 H SER 58 10.617 7.379 4.582 372 HA SER 58 HA SER 58 8.639 9.125 5.712 373 1HB SER 58 1HB SER 58 10.383 10.008 4.234 374 2HB SER 58 2HB SER 58 9.785 9.007 2.911 375 HG SER 58 HG SER 58 9.062 11.305 3.053 376 H PHE 59 H PHE 59 8.675 6.499 3.390 377 HA PHE 59 HA PHE 59 6.221 6.833 2.159 378 1HB PHE 59 1HB PHE 59 7.810 5.116 1.466 379 2HB PHE 59 2HB PHE 59 7.565 4.251 2.979 380 HD1 PHE 59 HD1 PHE 59 6.686 2.210 2.293 381 HD2 PHE 59 HD2 PHE 59 5.016 5.826 0.792 382 HE1 PHE 59 HE1 PHE 59 4.852 0.932 1.264 383 HE2 PHE 59 HE2 PHE 59 3.179 4.554 -0.239 384 HZ PHE 59 HZ PHE 59 3.095 2.104 -0.003 385 H ILE 60 H ILE 60 6.882 4.857 5.055 386 HA ILE 60 HA ILE 60 4.145 4.362 5.608 387 HB ILE 60 HB ILE 60 6.542 4.181 7.438 388 1HG1 ILE 60 1HG1 ILE 60 5.386 1.668 6.651 389 2HG1 ILE 60 2HG1 ILE 60 5.763 2.616 5.217 390 1HG2 ILE 60 1HG2 ILE 60 3.668 3.654 7.847 391 2HG2 ILE 60 2HG2 ILE 60 4.781 2.433 8.461 392 3HG2 ILE 60 3HG2 ILE 60 4.917 4.104 9.007 393 1HD1 ILE 60 1HD1 ILE 60 7.507 1.023 6.599 394 2HD1 ILE 60 2HD1 ILE 60 7.950 2.294 5.459 395 3HD1 ILE 60 3HD1 ILE 60 7.900 2.638 7.188 396 H LEU 61 H LEU 61 6.383 6.880 6.541 397 HA LEU 61 HA LEU 61 4.955 7.951 8.710 398 1HB LEU 61 1HB LEU 61 7.227 8.658 7.109 399 2HB LEU 61 2HB LEU 61 6.217 10.078 7.369 400 HG LEU 61 HG LEU 61 6.435 9.863 9.755 401 1HD1 LEU 61 1HD1 LEU 61 6.444 7.615 10.269 402 2HD1 LEU 61 2HD1 LEU 61 8.127 8.058 10.551 403 3HD1 LEU 61 3HD1 LEU 61 7.671 7.233 9.060 404 1HD2 LEU 61 1HD2 LEU 61 8.828 10.234 10.004 405 2HD2 LEU 61 2HD2 LEU 61 8.219 11.038 8.557 406 3HD2 LEU 61 3HD2 LEU 61 9.117 9.526 8.415 407 H LYS 62 H LYS 62 4.640 8.380 5.247 408 HA LYS 62 HA LYS 62 2.811 10.584 5.437 409 1HB LYS 62 1HB LYS 62 4.253 9.245 3.371 410 2HB LYS 62 2HB LYS 62 2.550 9.252 2.934 411 1HG LYS 62 1HG LYS 62 3.640 11.189 2.011 412 2HG LYS 62 2HG LYS 62 2.497 11.690 3.259 413 1HD LYS 62 1HD LYS 62 4.151 12.345 4.702 414 2HD LYS 62 2HD LYS 62 5.321 11.193 4.055 415 1HE LYS 62 1HE LYS 62 6.011 13.412 3.452 416 2HE LYS 62 2HE LYS 62 5.464 12.577 1.999 417 1HZ LYS 62 1HZ LYS 62 3.675 14.347 3.553 418 2HZ LYS 62 2HZ LYS 62 3.485 13.798 1.964 419 3HZ LYS 62 3HZ LYS 62 4.677 14.943 2.327 420 H ALA 63 H ALA 63 2.465 7.158 4.517 421 HA ALA 63 HA ALA 63 -0.323 7.167 4.251 422 1HB ALA 63 1HB ALA 63 -0.149 4.705 4.543 423 2HB ALA 63 2HB ALA 63 0.976 5.361 3.353 424 3HB ALA 63 3HB ALA 63 1.552 4.916 4.960 425 H ARG 64 H ARG 64 1.674 6.131 7.019 426 HA ARG 64 HA ARG 64 -0.344 5.446 8.773 427 1HB ARG 64 1HB ARG 64 2.178 5.216 9.079 428 2HB ARG 64 2HB ARG 64 2.162 6.885 9.633 429 1HG ARG 64 1HG ARG 64 0.155 5.584 11.087 430 2HG ARG 64 2HG ARG 64 1.535 4.483 11.065 431 1HD ARG 64 1HD ARG 64 1.680 7.395 11.832 432 2HD ARG 64 2HD ARG 64 1.537 6.067 12.982 433 HE ARG 64 HE ARG 64 3.899 6.900 11.593 434 1HH1 ARG 64 1HH1 ARG 64 2.285 4.195 13.076 435 2HH1 ARG 64 2HH1 ARG 64 3.752 3.333 13.405 436 1HH2 ARG 64 1HH2 ARG 64 5.836 5.776 12.021 437 2HH2 ARG 64 2HH2 ARG 64 5.771 4.234 12.805 438 H SER 65 H SER 65 1.093 8.642 8.221 439 HA SER 65 HA SER 65 -0.327 10.030 10.198 440 1HB SER 65 1HB SER 65 1.669 10.852 8.842 441 2HB SER 65 2HB SER 65 0.521 11.217 7.554 442 HG SER 65 HG SER 65 0.922 12.476 9.992 443 H THR 66 H THR 66 -1.227 8.997 6.995 444 HA THR 66 HA THR 66 -3.607 10.635 6.904 445 HB THR 66 HB THR 66 -3.113 8.304 5.077 446 HG1 THR 66 HG1 THR 66 -2.073 10.835 4.439 447 1HG2 THR 66 1HG2 THR 66 -4.294 11.043 4.601 448 2HG2 THR 66 2HG2 THR 66 -5.229 9.583 4.929 449 3HG2 THR 66 3HG2 THR 66 -4.259 9.698 3.461 450 H VAL 67 H VAL 67 -2.770 7.290 7.605 451 HA VAL 67 HA VAL 67 -5.262 6.096 7.571 452 HB VAL 67 HB VAL 67 -3.014 5.567 9.520 453 1HG1 VAL 67 1HG1 VAL 67 -5.009 4.567 10.369 454 2HG1 VAL 67 2HG1 VAL 67 -5.436 3.936 8.777 455 3HG1 VAL 67 3HG1 VAL 67 -4.039 3.288 9.638 456 1HG2 VAL 67 1HG2 VAL 67 -1.963 4.375 7.932 457 2HG2 VAL 67 2HG2 VAL 67 -3.468 3.741 7.268 458 3HG2 VAL 67 3HG2 VAL 67 -2.914 5.351 6.813 459 H ARG 68 H ARG 68 -3.791 8.102 10.066 460 HA ARG 68 HA ARG 68 -5.565 7.654 12.155 461 1HB ARG 68 1HB ARG 68 -3.861 9.978 11.348 462 2HB ARG 68 2HB ARG 68 -4.999 10.166 12.676 463 1HG ARG 68 1HG ARG 68 -3.637 9.124 14.077 464 2HG ARG 68 2HG ARG 68 -3.480 7.745 12.987 465 1HD ARG 68 1HD ARG 68 -1.849 9.207 11.668 466 2HD ARG 68 2HD ARG 68 -1.834 10.254 13.087 467 HE ARG 68 HE ARG 68 -0.578 7.681 12.814 468 1HH1 ARG 68 1HH1 ARG 68 -1.864 10.023 15.046 469 2HH1 ARG 68 2HH1 ARG 68 -0.907 9.470 16.380 470 1HH2 ARG 68 1HH2 ARG 68 0.686 6.943 14.563 471 2HH2 ARG 68 2HH2 ARG 68 0.544 7.719 16.104 472 H ASP 69 H ASP 69 -5.997 9.413 9.205 473 HA ASP 69 HA ASP 69 -8.281 10.915 10.082 474 1HB ASP 69 1HB ASP 69 -6.572 10.943 7.845 475 2HB ASP 69 2HB ASP 69 -8.177 10.574 7.220 476 H ILE 70 H ILE 70 -7.724 7.837 8.507 477 HA ILE 70 HA ILE 70 -10.311 7.333 7.563 478 HB ILE 70 HB ILE 70 -8.332 5.302 8.600 479 1HG1 ILE 70 1HG1 ILE 70 -8.706 6.308 5.773 480 2HG1 ILE 70 2HG1 ILE 70 -7.427 6.853 6.851 481 1HG2 ILE 70 1HG2 ILE 70 -9.485 3.718 7.193 482 2HG2 ILE 70 2HG2 ILE 70 -10.638 4.471 8.293 483 3HG2 ILE 70 3HG2 ILE 70 -10.569 4.980 6.606 484 1HD1 ILE 70 1HD1 ILE 70 -6.883 4.308 7.014 485 2HD1 ILE 70 2HD1 ILE 70 -7.771 4.232 5.491 486 3HD1 ILE 70 3HD1 ILE 70 -6.342 5.255 5.629 487 H ASP 71 H ASP 71 -8.821 6.634 10.702 488 HA ASP 71 HA ASP 71 -11.403 6.690 11.981 489 1HB ASP 71 1HB ASP 71 -10.025 4.145 11.398 490 2HB ASP 71 2HB ASP 71 -10.584 4.332 13.058 491 HA PRO 72 HA PRO 72 -9.073 8.086 15.424 492 1HB PRO 72 1HB PRO 72 -10.470 7.086 17.525 493 2HB PRO 72 2HB PRO 72 -11.065 8.413 16.521 494 1HG PRO 72 1HG PRO 72 -11.752 5.502 16.414 495 2HG PRO 72 2HG PRO 72 -12.823 6.910 16.288 496 1HD PRO 72 1HD PRO 72 -11.988 5.516 14.122 497 2HD PRO 72 2HD PRO 72 -12.307 7.262 14.070 498 H GLN 73 H GLN 73 -10.050 4.681 15.850 499 HA GLN 73 HA GLN 73 -7.394 4.155 17.010 500 1HB GLN 73 1HB GLN 73 -9.926 2.552 17.398 501 2HB GLN 73 2HB GLN 73 -8.383 2.282 18.197 502 1HG GLN 73 1HG GLN 73 -8.575 4.357 19.389 503 2HG GLN 73 2HG GLN 73 -10.038 4.776 18.498 504 1HE2 GLN 73 1HE2 GLN 73 -11.898 4.317 19.428 505 2HE2 GLN 73 2HE2 GLN 73 -12.141 3.191 20.715 506 H ASN 74 H ASN 74 -6.286 3.683 15.138 507 HA ASN 74 HA ASN 74 -6.776 1.060 14.030 508 1HB ASN 74 1HB ASN 74 -7.595 3.456 12.620 509 2HB ASN 74 2HB ASN 74 -6.377 2.572 11.706 510 1HD2 ASN 74 1HD2 ASN 74 -7.199 1.199 10.322 511 2HD2 ASN 74 2HD2 ASN 74 -8.669 0.311 10.509 512 H ASP 75 H ASP 75 -5.015 0.369 12.579 513 HA ASP 75 HA ASP 75 -2.612 1.937 12.467 514 1HB ASP 75 1HB ASP 75 -2.984 0.448 14.790 515 2HB ASP 75 2HB ASP 75 -1.924 -0.554 13.802 516 H LEU 76 H LEU 76 -1.854 1.512 10.511 517 HA LEU 76 HA LEU 76 -2.668 -0.526 8.837 518 1HB LEU 76 1HB LEU 76 -0.864 1.617 8.726 519 2HB LEU 76 2HB LEU 76 0.060 0.188 8.267 520 HG LEU 76 HG LEU 76 -0.892 1.418 6.341 521 1HD1 LEU 76 1HD1 LEU 76 -2.289 -1.213 6.442 522 2HD1 LEU 76 2HD1 LEU 76 -0.530 -1.163 6.545 523 3HD1 LEU 76 3HD1 LEU 76 -1.350 -0.483 5.140 524 1HD2 LEU 76 1HD2 LEU 76 -3.053 1.966 6.158 525 2HD2 LEU 76 2HD2 LEU 76 -3.132 1.663 7.894 526 3HD2 LEU 76 3HD2 LEU 76 -3.598 0.399 6.756 527 H THR 77 H THR 77 -1.572 -2.406 8.033 528 HA THR 77 HA THR 77 0.076 -3.712 10.096 529 HB THR 77 HB THR 77 -0.731 -5.853 9.256 530 HG1 THR 77 HG1 THR 77 -2.270 -5.911 7.591 531 1HG2 THR 77 1HG2 THR 77 -2.193 -4.052 10.718 532 2HG2 THR 77 2HG2 THR 77 -2.606 -5.751 10.489 533 3HG2 THR 77 3HG2 THR 77 -3.328 -4.520 9.454 534 H PHE 78 H PHE 78 -0.360 -3.374 6.592 535 HA PHE 78 HA PHE 78 2.487 -3.475 6.183 536 1HB PHE 78 1HB PHE 78 2.370 -5.372 4.558 537 2HB PHE 78 2HB PHE 78 2.086 -5.850 6.228 538 HD1 PHE 78 HD1 PHE 78 0.376 -5.060 3.039 539 HD2 PHE 78 HD2 PHE 78 0.119 -6.952 6.843 540 HE1 PHE 78 HE1 PHE 78 -1.749 -6.106 2.372 541 HE2 PHE 78 HE2 PHE 78 -2.005 -8.002 6.182 542 HZ PHE 78 HZ PHE 78 -2.942 -7.580 3.944 543 H LEU 79 H LEU 79 3.113 -2.571 4.244 544 HA LEU 79 HA LEU 79 0.930 -1.427 2.635 545 1HB LEU 79 1HB LEU 79 3.352 -0.329 3.750 546 2HB LEU 79 2HB LEU 79 3.312 -0.107 2.002 547 HG LEU 79 HG LEU 79 1.305 1.168 2.131 548 1HD1 LEU 79 1HD1 LEU 79 1.229 0.346 5.027 549 2HD1 LEU 79 2HD1 LEU 79 0.062 -0.046 3.765 550 3HD1 LEU 79 3HD1 LEU 79 0.219 1.615 4.333 551 1HD2 LEU 79 1HD2 LEU 79 2.308 2.578 4.376 552 2HD2 LEU 79 2HD2 LEU 79 2.526 2.940 2.663 553 3HD2 LEU 79 3HD2 LEU 79 3.683 1.903 3.501 554 H ARG 80 H ARG 80 0.617 -2.844 1.002 555 HA ARG 80 HA ARG 80 2.930 -3.921 -0.424 556 1HB ARG 80 1HB ARG 80 0.319 -4.888 0.169 557 2HB ARG 80 2HB ARG 80 0.465 -4.771 -1.579 558 1HG ARG 80 1HG ARG 80 2.081 -6.377 -1.695 559 2HG ARG 80 2HG ARG 80 2.683 -6.043 -0.070 560 1HD ARG 80 1HD ARG 80 1.559 -8.212 -0.181 561 2HD ARG 80 2HD ARG 80 0.711 -7.099 0.892 562 HE ARG 80 HE ARG 80 -1.088 -7.132 -0.536 563 1HH1 ARG 80 1HH1 ARG 80 1.668 -8.581 -2.094 564 2HH1 ARG 80 2HH1 ARG 80 0.757 -9.179 -3.441 565 1HH2 ARG 80 1HH2 ARG 80 -2.298 -7.914 -2.305 566 2HH2 ARG 80 2HH2 ARG 80 -1.499 -8.798 -3.560 567 H ILE 81 H ILE 81 3.698 -2.846 -2.109 568 HA ILE 81 HA ILE 81 1.806 -1.400 -3.841 569 HB ILE 81 HB ILE 81 3.790 0.184 -4.279 570 1HG1 ILE 81 1HG1 ILE 81 4.590 -0.954 -1.591 571 2HG1 ILE 81 2HG1 ILE 81 5.487 -1.131 -3.095 572 1HG2 ILE 81 1HG2 ILE 81 3.044 0.939 -1.626 573 2HG2 ILE 81 2HG2 ILE 81 2.490 1.595 -3.165 574 3HG2 ILE 81 3HG2 ILE 81 1.656 0.220 -2.441 575 1HD1 ILE 81 1HD1 ILE 81 5.665 0.921 -1.160 576 2HD1 ILE 81 2HD1 ILE 81 6.573 0.740 -2.662 577 3HD1 ILE 81 3HD1 ILE 81 5.053 1.634 -2.652 578 H ARG 82 H ARG 82 1.757 -3.070 -5.347 579 HA ARG 82 HA ARG 82 4.126 -4.247 -6.418 580 1HB ARG 82 1HB ARG 82 1.281 -4.606 -6.673 581 2HB ARG 82 2HB ARG 82 2.024 -4.575 -8.266 582 1HG ARG 82 1HG ARG 82 3.725 -6.229 -7.031 583 2HG ARG 82 2HG ARG 82 2.265 -6.559 -6.096 584 1HD ARG 82 1HD ARG 82 2.355 -8.103 -7.925 585 2HD ARG 82 2HD ARG 82 1.058 -6.949 -8.235 586 HE ARG 82 HE ARG 82 3.546 -6.186 -9.434 587 1HH1 ARG 82 1HH1 ARG 82 0.695 -8.147 -9.816 588 2HH1 ARG 82 2HH1 ARG 82 0.792 -8.184 -11.545 589 1HH2 ARG 82 1HH2 ARG 82 3.685 -6.227 -11.710 590 2HH2 ARG 82 2HH2 ARG 82 2.494 -7.092 -12.622 591 H SER 83 H SER 83 5.490 -3.338 -7.793 592 HA SER 83 HA SER 83 4.616 -1.029 -9.364 593 1HB SER 83 1HB SER 83 7.417 -1.667 -9.666 594 2HB SER 83 2HB SER 83 6.672 -0.218 -8.990 595 HG SER 83 HG SER 83 7.827 -2.323 -7.720 596 H LYS 84 H LYS 84 5.951 -0.907 -11.551 597 HA LYS 84 HA LYS 84 4.997 -3.124 -13.131 598 1HB LYS 84 1HB LYS 84 6.014 -0.395 -13.645 599 2HB LYS 84 2HB LYS 84 6.334 -1.577 -14.907 600 1HG LYS 84 1HG LYS 84 3.633 -1.882 -14.133 601 2HG LYS 84 2HG LYS 84 3.935 -0.157 -14.355 602 1HD LYS 84 1HD LYS 84 3.280 -0.940 -16.473 603 2HD LYS 84 2HD LYS 84 5.037 -0.802 -16.561 604 1HE LYS 84 1HE LYS 84 5.349 -3.083 -16.557 605 2HE LYS 84 2HE LYS 84 3.825 -3.396 -15.728 606 1HZ LYS 84 1HZ LYS 84 4.097 -2.506 -18.549 607 2HZ LYS 84 2HZ LYS 84 2.643 -2.840 -17.753 608 3HZ LYS 84 3HZ LYS 84 3.749 -4.085 -18.048 609 H LYS 85 H LYS 85 8.007 -2.053 -11.803 610 HA LYS 85 HA LYS 85 9.600 -3.758 -13.530 611 1HB LYS 85 1HB LYS 85 10.173 -1.758 -11.389 612 2HB LYS 85 2HB LYS 85 11.395 -2.973 -11.744 613 1HG LYS 85 1HG LYS 85 10.521 -1.922 -14.215 614 2HG LYS 85 2HG LYS 85 10.813 -0.559 -13.132 615 1HD LYS 85 1HD LYS 85 12.839 -2.727 -13.183 616 2HD LYS 85 2HD LYS 85 12.748 -1.664 -14.590 617 1HE LYS 85 1HE LYS 85 13.289 0.228 -13.345 618 2HE LYS 85 2HE LYS 85 12.847 -0.533 -11.818 619 1HZ LYS 85 1HZ LYS 85 15.341 -0.642 -13.282 620 2HZ LYS 85 2HZ LYS 85 14.829 -2.123 -12.647 621 3HZ LYS 85 3HZ LYS 85 15.051 -0.795 -11.622 622 H ASN 86 H ASN 86 8.234 -3.784 -10.319 623 HA ASN 86 HA ASN 86 8.401 -6.558 -10.030 624 1HB ASN 86 1HB ASN 86 10.104 -6.625 -8.154 625 2HB ASN 86 2HB ASN 86 10.763 -6.381 -9.769 626 1HD2 ASN 86 1HD2 ASN 86 11.886 -4.571 -10.209 627 2HD2 ASN 86 2HD2 ASN 86 12.190 -3.311 -9.066 628 H GLU 87 H GLU 87 7.893 -7.258 -7.742 629 HA GLU 87 HA GLU 87 5.922 -5.414 -6.658 630 1HB GLU 87 1HB GLU 87 5.146 -7.653 -6.978 631 2HB GLU 87 2HB GLU 87 6.528 -8.320 -6.122 632 1HG GLU 87 1HG GLU 87 5.733 -7.475 -4.036 633 2HG GLU 87 2HG GLU 87 4.447 -6.573 -4.835 634 H ILE 88 H ILE 88 6.287 -4.168 -4.953 635 HA ILE 88 HA ILE 88 8.410 -4.949 -3.065 636 HB ILE 88 HB ILE 88 7.730 -2.101 -3.790 637 1HG1 ILE 88 1HG1 ILE 88 10.027 -3.814 -4.765 638 2HG1 ILE 88 2HG1 ILE 88 8.674 -3.256 -5.742 639 1HG2 ILE 88 1HG2 ILE 88 10.360 -2.614 -2.710 640 2HG2 ILE 88 2HG2 ILE 88 9.112 -1.500 -2.154 641 3HG2 ILE 88 3HG2 ILE 88 9.093 -3.181 -1.623 642 1HD1 ILE 88 1HD1 ILE 88 11.127 -1.904 -5.020 643 2HD1 ILE 88 2HD1 ILE 88 9.964 -1.541 -6.296 644 3HD1 ILE 88 3HD1 ILE 88 9.698 -0.935 -4.661 645 H MET 89 H MET 89 7.909 -4.896 -0.948 646 HA MET 89 HA MET 89 5.465 -3.510 -0.108 647 1HB MET 89 1HB MET 89 5.011 -5.538 1.389 648 2HB MET 89 2HB MET 89 4.640 -5.699 -0.322 649 1HG MET 89 1HG MET 89 6.478 -7.075 -0.716 650 2HG MET 89 2HG MET 89 7.270 -6.598 0.784 651 1HE MET 89 1HE MET 89 7.630 -8.198 2.391 652 2HE MET 89 2HE MET 89 6.744 -9.701 2.651 653 3HE MET 89 3HE MET 89 7.647 -9.456 1.155 654 H VAL 90 H VAL 90 5.460 -2.776 2.017 655 HA VAL 90 HA VAL 90 7.772 -3.335 3.702 656 HB VAL 90 HB VAL 90 7.048 -0.526 2.856 657 1HG1 VAL 90 1HG1 VAL 90 7.661 -0.630 5.213 658 2HG1 VAL 90 2HG1 VAL 90 9.143 -1.494 4.799 659 3HG1 VAL 90 3HG1 VAL 90 8.917 0.174 4.272 660 1HG2 VAL 90 1HG2 VAL 90 9.290 -2.377 2.158 661 2HG2 VAL 90 2HG2 VAL 90 8.325 -1.342 1.106 662 3HG2 VAL 90 3HG2 VAL 90 9.550 -0.633 2.158 663 H ALA 91 H ALA 91 7.305 -3.282 5.835 664 HA ALA 91 HA ALA 91 4.831 -1.981 6.715 665 1HB ALA 91 1HB ALA 91 4.116 -3.930 7.959 666 2HB ALA 91 2HB ALA 91 4.287 -4.338 6.251 667 3HB ALA 91 3HB ALA 91 5.526 -4.833 7.405 668 HA PRO 92 HA PRO 92 7.233 -0.675 10.153 669 1HB PRO 92 1HB PRO 92 5.309 -0.449 12.056 670 2HB PRO 92 2HB PRO 92 5.465 0.684 10.708 671 1HG PRO 92 1HG PRO 92 3.606 -1.641 11.022 672 2HG PRO 92 2HG PRO 92 3.270 -0.016 10.397 673 1HD PRO 92 1HD PRO 92 3.664 -2.148 8.776 674 2HD PRO 92 2HD PRO 92 4.139 -0.500 8.318 675 H ASP 93 H ASP 93 8.577 -2.378 10.680 676 HA ASP 93 HA ASP 93 7.656 -4.730 12.013 677 1HB ASP 93 1HB ASP 93 9.996 -3.957 10.703 678 2HB ASP 93 2HB ASP 93 10.485 -4.186 12.380 679 H LYS 94 H LYS 94 9.452 -5.172 14.033 680 HA LYS 94 HA LYS 94 8.237 -4.105 16.262 681 1HB LYS 94 1HB LYS 94 10.517 -5.747 15.716 682 2HB LYS 94 2HB LYS 94 10.951 -4.573 16.951 683 1HG LYS 94 1HG LYS 94 8.369 -5.704 17.509 684 2HG LYS 94 2HG LYS 94 9.575 -6.975 17.296 685 1HD LYS 94 1HD LYS 94 10.906 -6.163 19.042 686 2HD LYS 94 2HD LYS 94 10.115 -4.585 19.030 687 1HE LYS 94 1HE LYS 94 9.406 -5.870 20.963 688 2HE LYS 94 2HE LYS 94 8.053 -5.629 19.859 689 1HZ LYS 94 1HZ LYS 94 9.224 -8.058 20.762 690 2HZ LYS 94 2HZ LYS 94 9.217 -7.988 19.072 691 3HZ LYS 94 3HZ LYS 94 7.770 -7.814 19.932 692 H ASP 95 H ASP 95 11.313 -3.044 14.808 693 HA ASP 95 HA ASP 95 10.771 -0.326 15.690 694 1HB ASP 95 1HB ASP 95 12.584 -2.048 17.090 695 2HB ASP 95 2HB ASP 95 13.503 -0.761 16.313 696 H TYR 96 H TYR 96 11.265 -2.094 13.208 697 HA TYR 96 HA TYR 96 12.908 -0.111 11.831 698 1HB TYR 96 1HB TYR 96 14.027 -2.067 10.588 699 2HB TYR 96 2HB TYR 96 14.591 -1.702 12.215 700 HD1 TYR 96 HD1 TYR 96 12.974 -4.149 10.079 701 HD2 TYR 96 HD2 TYR 96 13.942 -3.169 14.105 702 HE1 TYR 96 HE1 TYR 96 12.538 -6.476 10.744 703 HE2 TYR 96 HE2 TYR 96 13.510 -5.494 14.781 704 HH TYR 96 HH TYR 96 11.915 -7.474 13.642 705 H PHE 97 H PHE 97 12.917 -0.731 9.365 706 HA PHE 97 HA PHE 97 10.168 -1.520 8.650 707 1HB PHE 97 1HB PHE 97 11.940 0.596 7.419 708 2HB PHE 97 2HB PHE 97 10.444 0.031 6.683 709 HD1 PHE 97 HD1 PHE 97 11.691 2.689 8.304 710 HD2 PHE 97 HD2 PHE 97 8.519 -0.116 8.732 711 HE1 PHE 97 HE1 PHE 97 10.426 4.328 9.633 712 HE2 PHE 97 HE2 PHE 97 7.248 1.518 10.061 713 HZ PHE 97 HZ PHE 97 8.201 3.744 10.513 714 H LEU 98 H LEU 98 10.192 -3.447 7.708 715 HA LEU 98 HA LEU 98 12.534 -4.386 6.284 716 1HB LEU 98 1HB LEU 98 10.825 -5.679 7.848 717 2HB LEU 98 2HB LEU 98 9.990 -5.920 6.315 718 HG LEU 98 HG LEU 98 12.884 -6.623 6.524 719 1HD1 LEU 98 1HD1 LEU 98 10.603 -8.075 7.789 720 2HD1 LEU 98 2HD1 LEU 98 12.241 -7.815 8.387 721 3HD1 LEU 98 3HD1 LEU 98 11.948 -8.981 7.097 722 1HD2 LEU 98 1HD2 LEU 98 11.544 -8.547 5.103 723 2HD2 LEU 98 2HD2 LEU 98 12.372 -7.151 4.413 724 3HD2 LEU 98 3HD2 LEU 98 10.637 -7.084 4.721 725 H ILE 99 H ILE 99 12.702 -4.746 4.115 726 HA ILE 99 HA ILE 99 10.396 -4.028 2.435 727 HB ILE 99 HB ILE 99 13.236 -3.197 1.842 728 1HG1 ILE 99 1HG1 ILE 99 11.930 -0.867 2.176 729 2HG1 ILE 99 2HG1 ILE 99 11.040 -1.860 3.325 730 1HG2 ILE 99 1HG2 ILE 99 11.048 -1.825 0.494 731 2HG2 ILE 99 2HG2 ILE 99 12.525 -2.525 -0.166 732 3HG2 ILE 99 3HG2 ILE 99 11.120 -3.549 0.130 733 1HD1 ILE 99 1HD1 ILE 99 14.024 -1.478 3.304 734 2HD1 ILE 99 2HD1 ILE 99 12.888 -0.649 4.369 735 3HD1 ILE 99 3HD1 ILE 99 13.093 -2.397 4.486 736 H VAL 100 H VAL 100 9.879 -5.688 1.187 737 HA VAL 100 HA VAL 100 12.008 -7.537 0.334 738 HB VAL 100 HB VAL 100 9.053 -8.132 0.489 739 1HG1 VAL 100 1HG1 VAL 100 11.456 -9.917 0.114 740 2HG1 VAL 100 2HG1 VAL 100 9.789 -10.469 0.294 741 3HG1 VAL 100 3HG1 VAL 100 10.255 -9.509 -1.111 742 1HG2 VAL 100 1HG2 VAL 100 11.261 -8.674 2.463 743 2HG2 VAL 100 2HG2 VAL 100 9.774 -7.763 2.726 744 3HG2 VAL 100 3HG2 VAL 100 9.707 -9.509 2.488 745 H ILE 101 H ILE 101 12.610 -7.189 -1.697 746 HA ILE 101 HA ILE 101 10.563 -6.381 -3.655 747 HB ILE 101 HB ILE 101 13.547 -5.924 -3.768 748 1HG1 ILE 101 1HG1 ILE 101 11.761 -3.605 -3.793 749 2HG1 ILE 101 2HG1 ILE 101 11.662 -4.537 -2.303 750 1HG2 ILE 101 1HG2 ILE 101 11.535 -5.923 -5.810 751 2HG2 ILE 101 2HG2 ILE 101 12.197 -4.301 -5.616 752 3HG2 ILE 101 3HG2 ILE 101 13.272 -5.657 -5.955 753 1HD1 ILE 101 1HD1 ILE 101 13.595 -2.636 -3.046 754 2HD1 ILE 101 2HD1 ILE 101 13.536 -3.620 -1.583 755 3HD1 ILE 101 3HD1 ILE 101 14.402 -4.203 -3.004 756 H GLN 102 H GLN 102 10.118 -7.714 -5.289 757 HA GLN 102 HA GLN 102 12.036 -9.462 -6.464 758 1HB GLN 102 1HB GLN 102 11.206 -11.578 -5.794 759 2HB GLN 102 2HB GLN 102 11.421 -10.653 -4.314 760 1HG GLN 102 1HG GLN 102 9.020 -10.152 -4.296 761 2HG GLN 102 2HG GLN 102 8.820 -11.126 -5.751 762 1HE2 GLN 102 1HE2 GLN 102 8.810 -11.123 -2.404 763 2HE2 GLN 102 2HE2 GLN 102 8.807 -12.831 -2.142 764 H ASN 103 H ASN 103 10.823 -11.076 -7.988 765 HA ASN 103 HA ASN 103 9.429 -9.626 -9.877 766 1HB ASN 103 1HB ASN 103 9.960 -12.476 -9.377 767 2HB ASN 103 2HB ASN 103 8.515 -12.166 -10.335 768 1HD2 ASN 103 1HD2 ASN 103 11.500 -13.060 -10.723 769 2HD2 ASN 103 2HD2 ASN 103 11.932 -12.245 -12.184 770 HA PRO 104 HA PRO 104 5.242 -9.296 -8.610 771 1HB PRO 104 1HB PRO 104 3.888 -9.744 -10.920 772 2HB PRO 104 2HB PRO 104 4.811 -8.267 -10.618 773 1HG PRO 104 1HG PRO 104 5.588 -10.699 -12.181 774 2HG PRO 104 2HG PRO 104 5.832 -8.989 -12.579 775 1HD PRO 104 1HD PRO 104 7.801 -10.542 -11.559 776 2HD PRO 104 2HD PRO 104 7.680 -8.805 -11.215 777 H THR 105 H THR 105 3.457 -10.472 -7.951 778 HA THR 105 HA THR 105 3.618 -13.377 -8.412 779 HB THR 105 HB THR 105 2.359 -13.618 -6.282 780 HG1 THR 105 HG1 THR 105 2.828 -10.811 -6.067 781 1HG2 THR 105 1HG2 THR 105 4.902 -13.611 -6.467 782 2HG2 THR 105 2HG2 THR 105 4.223 -13.319 -4.865 783 3HG2 THR 105 3HG2 THR 105 4.835 -11.971 -5.823 784 H GLU 106 H GLU 106 1.442 -10.609 -8.248 785 HA GLU 106 HA GLU 106 -0.954 -12.049 -8.703 786 1HB GLU 106 1HB GLU 106 -0.306 -9.433 -8.098 787 2HB GLU 106 2HB GLU 106 -0.935 -9.315 -9.735 788 1HG GLU 106 1HG GLU 106 -2.699 -10.992 -8.347 789 2HG GLU 106 2HG GLU 106 -2.343 -9.646 -7.266 790 H MET 11 H MET 11 -18.689 4.639 -15.654 791 HA MET 11 HA MET 11 -18.735 4.035 -13.005 792 1HB MET 11 1HB MET 11 -20.470 5.429 -14.838 793 2HB MET 11 2HB MET 11 -21.423 4.586 -13.623 794 1HG MET 11 1HG MET 11 -19.414 5.760 -12.152 795 2HG MET 11 2HG MET 11 -19.776 6.963 -13.387 796 1HE MET 11 1HE MET 11 -21.958 4.628 -10.656 797 2HE MET 11 2HE MET 11 -20.436 5.419 -10.247 798 3HE MET 11 3HE MET 11 -21.959 6.067 -9.636 799 H ALA 12 H ALA 12 -20.827 2.572 -15.483 800 HA ALA 12 HA ALA 12 -22.334 0.901 -13.887 801 1HB ALA 12 1HB ALA 12 -21.340 -0.072 -16.533 802 2HB ALA 12 2HB ALA 12 -22.943 -0.223 -15.812 803 3HB ALA 12 3HB ALA 12 -22.405 1.331 -16.448 804 H GLU 13 H GLU 13 -19.086 0.381 -15.181 805 HA GLU 13 HA GLU 13 -18.719 -2.285 -14.546 806 1HB GLU 13 1HB GLU 13 -17.143 -0.606 -15.739 807 2HB GLU 13 2HB GLU 13 -16.530 -0.272 -14.125 808 1HG GLU 13 1HG GLU 13 -15.576 -2.340 -13.904 809 2HG GLU 13 2HG GLU 13 -16.691 -3.097 -15.040 810 H VAL 14 H VAL 14 -18.008 0.543 -12.501 811 HA VAL 14 HA VAL 14 -17.191 -0.925 -10.240 812 HB VAL 14 HB VAL 14 -18.445 1.821 -10.215 813 1HG1 VAL 14 1HG1 VAL 14 -16.577 1.920 -8.326 814 2HG1 VAL 14 2HG1 VAL 14 -18.212 1.340 -8.003 815 3HG1 VAL 14 3HG1 VAL 14 -16.904 0.188 -8.277 816 1HG2 VAL 14 1HG2 VAL 14 -15.841 2.371 -10.202 817 2HG2 VAL 14 2HG2 VAL 14 -15.791 0.886 -11.151 818 3HG2 VAL 14 3HG2 VAL 14 -16.771 2.247 -11.696 819 H GLU 15 H GLU 15 -20.340 0.205 -11.324 820 HA GLU 15 HA GLU 15 -21.752 -0.322 -8.933 821 1HB GLU 15 1HB GLU 15 -22.612 -0.073 -11.809 822 2HB GLU 15 2HB GLU 15 -23.760 -0.410 -10.521 823 1HG GLU 15 1HG GLU 15 -23.204 1.667 -9.426 824 2HG GLU 15 2HG GLU 15 -21.953 1.994 -10.625 825 H GLU 16 H GLU 16 -21.061 -2.278 -11.792 826 HA GLU 16 HA GLU 16 -22.695 -4.472 -11.150 827 1HB GLU 16 1HB GLU 16 -21.083 -3.805 -13.257 828 2HB GLU 16 2HB GLU 16 -20.172 -5.114 -12.517 829 1HG GLU 16 1HG GLU 16 -22.381 -6.412 -12.561 830 2HG GLU 16 2HG GLU 16 -22.923 -5.174 -13.692 831 H THR 17 H THR 17 -19.421 -3.619 -10.199 832 HA THR 17 HA THR 17 -18.919 -6.137 -8.897 833 HB THR 17 HB THR 17 -17.401 -3.525 -8.757 834 HG1 THR 17 HG1 THR 17 -17.441 -4.609 -10.827 835 1HG2 THR 17 1HG2 THR 17 -15.575 -5.357 -8.099 836 2HG2 THR 17 2HG2 THR 17 -17.006 -6.162 -7.454 837 3HG2 THR 17 3HG2 THR 17 -16.575 -4.546 -6.895 838 H LEU 18 H LEU 18 -20.289 -3.081 -8.027 839 HA LEU 18 HA LEU 18 -19.911 -3.294 -5.212 840 1HB LEU 18 1HB LEU 18 -21.117 -1.457 -7.064 841 2HB LEU 18 2HB LEU 18 -22.192 -1.736 -5.697 842 HG LEU 18 HG LEU 18 -19.897 -1.269 -4.378 843 1HD1 LEU 18 1HD1 LEU 18 -19.708 0.265 -6.961 844 2HD1 LEU 18 2HD1 LEU 18 -18.526 -0.851 -6.279 845 3HD1 LEU 18 3HD1 LEU 18 -18.830 0.698 -5.494 846 1HD2 LEU 18 1HD2 LEU 18 -22.051 -0.166 -4.017 847 2HD2 LEU 18 2HD2 LEU 18 -21.773 0.845 -5.435 848 3HD2 LEU 18 3HD2 LEU 18 -20.724 0.995 -4.024 849 H LYS 19 H LYS 19 -22.590 -4.063 -7.401 850 HA LYS 19 HA LYS 19 -24.482 -4.803 -5.490 851 1HB LYS 19 1HB LYS 19 -24.034 -5.457 -8.366 852 2HB LYS 19 2HB LYS 19 -25.208 -6.413 -7.471 853 1HG LYS 19 1HG LYS 19 -25.614 -3.617 -6.961 854 2HG LYS 19 2HG LYS 19 -25.602 -3.934 -8.698 855 1HD LYS 19 1HD LYS 19 -27.198 -5.643 -6.818 856 2HD LYS 19 2HD LYS 19 -27.839 -4.118 -7.435 857 1HE LYS 19 1HE LYS 19 -26.684 -5.778 -9.525 858 2HE LYS 19 2HE LYS 19 -27.998 -6.585 -8.670 859 1HZ LYS 19 1HZ LYS 19 -29.415 -4.685 -9.121 860 2HZ LYS 19 2HZ LYS 19 -28.811 -5.326 -10.564 861 3HZ LYS 19 3HZ LYS 19 -28.155 -3.901 -9.933 862 H ARG 20 H ARG 20 -22.056 -6.789 -7.162 863 HA ARG 20 HA ARG 20 -22.762 -9.224 -5.923 864 1HB ARG 20 1HB ARG 20 -21.307 -8.825 -8.010 865 2HB ARG 20 2HB ARG 20 -19.987 -8.565 -6.878 866 1HG ARG 20 1HG ARG 20 -19.668 -10.769 -7.176 867 2HG ARG 20 2HG ARG 20 -20.930 -10.902 -5.950 868 1HD ARG 20 1HD ARG 20 -22.293 -11.908 -7.389 869 2HD ARG 20 2HD ARG 20 -22.110 -10.591 -8.547 870 HE ARG 20 HE ARG 20 -19.832 -12.052 -8.837 871 1HH1 ARG 20 1HH1 ARG 20 -23.234 -12.778 -8.970 872 2HH1 ARG 20 2HH1 ARG 20 -23.047 -14.066 -10.113 873 1HH2 ARG 20 1HH2 ARG 20 -19.573 -13.747 -10.341 874 2HH2 ARG 20 2HH2 ARG 20 -20.964 -14.617 -10.892 875 H LEU 21 H LEU 21 -20.427 -6.708 -5.089 876 HA LEU 21 HA LEU 21 -19.200 -8.064 -2.945 877 1HB LEU 21 1HB LEU 21 -19.239 -5.363 -4.038 878 2HB LEU 21 2HB LEU 21 -19.053 -5.393 -2.286 879 HG LEU 21 HG LEU 21 -17.044 -6.705 -2.469 880 1HD1 LEU 21 1HD1 LEU 21 -16.398 -6.745 -5.168 881 2HD1 LEU 21 2HD1 LEU 21 -18.079 -7.272 -5.105 882 3HD1 LEU 21 3HD1 LEU 21 -16.853 -8.124 -4.167 883 1HD2 LEU 21 1HD2 LEU 21 -17.152 -4.321 -4.301 884 2HD2 LEU 21 2HD2 LEU 21 -15.648 -5.130 -3.861 885 3HD2 LEU 21 3HD2 LEU 21 -16.643 -4.376 -2.614 886 H GLN 22 H GLN 22 -21.725 -5.544 -2.917 887 HA GLN 22 HA GLN 22 -22.214 -5.645 -0.155 888 1HB GLN 22 1HB GLN 22 -23.278 -4.282 -2.419 889 2HB GLN 22 2HB GLN 22 -24.623 -4.964 -1.515 890 1HG GLN 22 1HG GLN 22 -24.147 -2.704 -0.789 891 2HG GLN 22 2HG GLN 22 -23.837 -3.858 0.507 892 1HE2 GLN 22 1HE2 GLN 22 -22.607 -1.303 -1.279 893 2HE2 GLN 22 2HE2 GLN 22 -20.962 -1.391 -0.759 894 H SER 23 H SER 23 -23.039 -7.816 -2.653 895 HA SER 23 HA SER 23 -25.329 -8.954 -1.306 896 1HB SER 23 1HB SER 23 -23.989 -9.290 -3.903 897 2HB SER 23 2HB SER 23 -24.632 -10.784 -3.222 898 HG SER 23 HG SER 23 -26.153 -9.610 -4.525 899 H GLN 24 H GLN 24 -21.911 -9.449 -1.413 900 HA GLN 24 HA GLN 24 -22.151 -12.045 -0.075 901 1HB GLN 24 1HB GLN 24 -19.723 -12.236 -0.450 902 2HB GLN 24 2HB GLN 24 -20.605 -11.973 -1.949 903 1HG GLN 24 1HG GLN 24 -19.863 -9.762 -2.132 904 2HG GLN 24 2HG GLN 24 -19.338 -9.710 -0.449 905 1HE2 GLN 24 1HE2 GLN 24 -17.484 -8.832 -1.935 906 2HE2 GLN 24 2HE2 GLN 24 -16.257 -9.992 -2.300 907 H LYS 25 H LYS 25 -20.895 -12.469 1.848 908 HA LYS 25 HA LYS 25 -21.066 -10.291 3.724 909 1HB LYS 25 1HB LYS 25 -21.164 -13.097 3.872 910 2HB LYS 25 2HB LYS 25 -19.730 -12.624 4.774 911 1HG LYS 25 1HG LYS 25 -21.622 -12.763 6.255 912 2HG LYS 25 2HG LYS 25 -21.104 -11.082 6.109 913 1HD LYS 25 1HD LYS 25 -22.926 -10.535 4.717 914 2HD LYS 25 2HD LYS 25 -23.309 -12.233 4.419 915 1HE LYS 25 1HE LYS 25 -24.463 -12.442 6.347 916 2HE LYS 25 2HE LYS 25 -23.356 -11.403 7.243 917 1HZ LYS 25 1HZ LYS 25 -24.421 -9.526 5.896 918 2HZ LYS 25 2HZ LYS 25 -25.317 -10.195 7.165 919 3HZ LYS 25 3HZ LYS 25 -25.659 -10.631 5.566 920 H GLY 26 H GLY 26 -19.358 -9.432 4.961 921 1HA GLY 26 1HA GLY 26 -16.989 -9.398 5.521 922 2HA GLY 26 2HA GLY 26 -16.657 -9.945 3.884 923 H VAL 27 H VAL 27 -18.234 -8.233 2.403 924 HA VAL 27 HA VAL 27 -16.614 -5.978 2.156 925 HB VAL 27 HB VAL 27 -19.471 -6.312 1.229 926 1HG1 VAL 27 1HG1 VAL 27 -18.856 -3.985 1.192 927 2HG1 VAL 27 2HG1 VAL 27 -17.329 -4.361 0.390 928 3HG1 VAL 27 3HG1 VAL 27 -18.856 -4.603 -0.459 929 1HG2 VAL 27 1HG2 VAL 27 -16.908 -6.775 -0.290 930 2HG2 VAL 27 2HG2 VAL 27 -17.877 -8.054 0.441 931 3HG2 VAL 27 3HG2 VAL 27 -18.552 -7.070 -0.857 932 H GLN 28 H GLN 28 -16.494 -4.129 3.242 933 HA GLN 28 HA GLN 28 -18.516 -3.546 5.261 934 1HB GLN 28 1HB GLN 28 -15.669 -3.011 4.933 935 2HB GLN 28 2HB GLN 28 -16.564 -1.585 5.442 936 1HG GLN 28 1HG GLN 28 -16.511 -2.335 7.517 937 2HG GLN 28 2HG GLN 28 -17.502 -3.706 7.021 938 1HE2 GLN 28 1HE2 GLN 28 -16.242 -5.519 5.989 939 2HE2 GLN 28 2HE2 GLN 28 -14.737 -5.937 6.727 940 H GLY 29 H GLY 29 -17.269 -2.312 2.247 941 1HA GLY 29 1HA GLY 29 -19.454 -0.880 1.475 942 2HA GLY 29 2HA GLY 29 -18.554 0.254 2.471 943 H ILE 30 H ILE 30 -19.171 0.292 -0.417 944 HA ILE 30 HA ILE 30 -16.402 0.435 -1.414 945 HB ILE 30 HB ILE 30 -18.805 -0.139 -3.141 946 1HG1 ILE 30 1HG1 ILE 30 -17.240 -2.428 -3.095 947 2HG1 ILE 30 2HG1 ILE 30 -17.260 -1.913 -1.412 948 1HG2 ILE 30 1HG2 ILE 30 -15.833 -0.266 -3.620 949 2HG2 ILE 30 2HG2 ILE 30 -17.046 -0.879 -4.743 950 3HG2 ILE 30 3HG2 ILE 30 -16.990 0.841 -4.358 951 1HD1 ILE 30 1HD1 ILE 30 -19.248 -3.306 -2.853 952 2HD1 ILE 30 2HD1 ILE 30 -19.274 -2.782 -1.169 953 3HD1 ILE 30 3HD1 ILE 30 -19.901 -1.723 -2.432 954 H ILE 31 H ILE 31 -15.789 2.436 -1.861 955 HA ILE 31 HA ILE 31 -17.853 4.430 -2.524 956 HB ILE 31 HB ILE 31 -15.116 4.877 -1.328 957 1HG1 ILE 31 1HG1 ILE 31 -17.729 5.497 0.009 958 2HG1 ILE 31 2HG1 ILE 31 -17.076 3.864 0.070 959 1HG2 ILE 31 1HG2 ILE 31 -17.113 6.683 -2.516 960 2HG2 ILE 31 2HG2 ILE 31 -16.447 7.196 -0.967 961 3HG2 ILE 31 3HG2 ILE 31 -15.371 6.880 -2.328 962 1HD1 ILE 31 1HD1 ILE 31 -16.535 5.306 2.033 963 2HD1 ILE 31 2HD1 ILE 31 -15.137 4.601 1.221 964 3HD1 ILE 31 3HD1 ILE 31 -15.550 6.295 0.956 965 H VAL 32 H VAL 32 -17.573 5.793 -4.266 966 HA VAL 32 HA VAL 32 -15.267 5.238 -6.014 967 HB VAL 32 HB VAL 32 -18.030 5.817 -7.066 968 1HG1 VAL 32 1HG1 VAL 32 -15.625 4.568 -8.388 969 2HG1 VAL 32 2HG1 VAL 32 -17.147 5.021 -9.159 970 3HG1 VAL 32 3HG1 VAL 32 -16.073 6.268 -8.523 971 1HG2 VAL 32 1HG2 VAL 32 -18.167 3.748 -5.813 972 2HG2 VAL 32 2HG2 VAL 32 -18.221 3.406 -7.542 973 3HG2 VAL 32 3HG2 VAL 32 -16.736 3.126 -6.634 974 H VAL 33 H VAL 33 -14.093 7.054 -5.841 975 HA VAL 33 HA VAL 33 -15.480 9.641 -6.073 976 HB VAL 33 HB VAL 33 -12.639 9.319 -5.147 977 1HG1 VAL 33 1HG1 VAL 33 -13.498 11.420 -3.827 978 2HG1 VAL 33 2HG1 VAL 33 -12.999 11.556 -5.515 979 3HG1 VAL 33 3HG1 VAL 33 -14.712 11.459 -5.105 980 1HG2 VAL 33 1HG2 VAL 33 -13.653 7.967 -3.567 981 2HG2 VAL 33 2HG2 VAL 33 -13.745 9.556 -2.807 982 3HG2 VAL 33 3HG2 VAL 33 -15.163 8.877 -3.605 983 H ASN 34 H ASN 34 -14.908 11.090 -7.636 984 HA ASN 34 HA ASN 34 -13.484 10.042 -9.911 985 1HB ASN 34 1HB ASN 34 -14.344 12.899 -9.762 986 2HB ASN 34 2HB ASN 34 -14.410 11.778 -11.119 987 1HD2 ASN 34 1HD2 ASN 34 -16.413 13.557 -9.713 988 2HD2 ASN 34 2HD2 ASN 34 -17.761 12.517 -9.420 989 H THR 35 H THR 35 -12.221 12.181 -11.007 990 HA THR 35 HA THR 35 -9.760 12.223 -9.559 991 HB THR 35 HB THR 35 -9.660 14.209 -11.563 992 HG1 THR 35 HG1 THR 35 -10.749 11.869 -12.700 993 1HG2 THR 35 1HG2 THR 35 -8.000 12.384 -10.809 994 2HG2 THR 35 2HG2 THR 35 -8.033 12.827 -12.516 995 3HG2 THR 35 3HG2 THR 35 -8.833 11.353 -11.971 996 H GLU 36 H GLU 36 -12.524 14.270 -9.685 997 HA GLU 36 HA GLU 36 -11.157 16.621 -8.711 998 1HB GLU 36 1HB GLU 36 -13.938 15.923 -9.484 999 2HB GLU 36 2HB GLU 36 -13.741 17.221 -8.315 1000 1HG GLU 36 1HG GLU 36 -11.923 17.946 -10.177 1001 2HG GLU 36 2HG GLU 36 -13.130 17.149 -11.184 1002 H GLY 37 H GLY 37 -13.328 14.145 -7.401 1003 1HA GLY 37 1HA GLY 37 -12.555 13.529 -5.041 1004 2HA GLY 37 2HA GLY 37 -12.838 15.231 -4.704 1005 H ILE 38 H ILE 38 -15.118 14.502 -6.893 1006 HA ILE 38 HA ILE 38 -17.182 14.343 -4.888 1007 HB ILE 38 HB ILE 38 -17.406 14.310 -7.900 1008 1HG1 ILE 38 1HG1 ILE 38 -17.774 16.570 -5.920 1009 2HG1 ILE 38 2HG1 ILE 38 -16.404 16.379 -7.009 1010 1HG2 ILE 38 1HG2 ILE 38 -19.558 13.852 -7.623 1011 2HG2 ILE 38 2HG2 ILE 38 -19.330 13.771 -5.877 1012 3HG2 ILE 38 3HG2 ILE 38 -19.737 15.306 -6.642 1013 1HD1 ILE 38 1HD1 ILE 38 -18.864 17.682 -7.480 1014 2HD1 ILE 38 2HD1 ILE 38 -17.494 17.488 -8.574 1015 3HD1 ILE 38 3HD1 ILE 38 -18.781 16.284 -8.552 1016 HA PRO 39 HA PRO 39 -17.148 9.866 -4.996 1017 1HB PRO 39 1HB PRO 39 -19.004 9.563 -3.037 1018 2HB PRO 39 2HB PRO 39 -17.311 9.949 -2.706 1019 1HG PRO 39 1HG PRO 39 -19.685 11.770 -2.809 1020 2HG PRO 39 2HG PRO 39 -18.351 11.736 -1.641 1021 1HD PRO 39 1HD PRO 39 -18.459 13.518 -3.677 1022 2HD PRO 39 2HD PRO 39 -16.927 12.884 -3.044 1023 H ILE 40 H ILE 40 -18.126 9.881 -7.133 1024 HA ILE 40 HA ILE 40 -20.761 10.359 -7.767 1025 HB ILE 40 HB ILE 40 -20.441 8.471 -9.495 1026 1HG1 ILE 40 1HG1 ILE 40 -17.574 8.711 -8.579 1027 2HG1 ILE 40 2HG1 ILE 40 -18.622 7.381 -8.101 1028 1HG2 ILE 40 1HG2 ILE 40 -19.029 11.057 -9.260 1029 2HG2 ILE 40 2HG2 ILE 40 -18.501 9.978 -10.550 1030 3HG2 ILE 40 3HG2 ILE 40 -20.184 10.499 -10.470 1031 1HD1 ILE 40 1HD1 ILE 40 -16.994 7.415 -10.286 1032 2HD1 ILE 40 2HD1 ILE 40 -18.380 6.347 -10.059 1033 3HD1 ILE 40 3HD1 ILE 40 -18.559 7.841 -10.979 1034 H LYS 41 H LYS 41 -19.347 7.489 -6.293 1035 HA LYS 41 HA LYS 41 -22.059 6.570 -5.643 1036 1HB LYS 41 1HB LYS 41 -20.261 5.274 -7.420 1037 2HB LYS 41 2HB LYS 41 -20.350 4.299 -5.958 1038 1HG LYS 41 1HG LYS 41 -22.958 5.204 -6.885 1039 2HG LYS 41 2HG LYS 41 -22.101 4.209 -8.065 1040 1HD LYS 41 1HD LYS 41 -22.131 2.354 -6.727 1041 2HD LYS 41 2HD LYS 41 -22.143 3.297 -5.235 1042 1HE LYS 41 1HE LYS 41 -24.394 3.435 -5.190 1043 2HE LYS 41 2HE LYS 41 -24.523 3.599 -6.940 1044 1HZ LYS 41 1HZ LYS 41 -24.869 1.426 -7.181 1045 2HZ LYS 41 2HZ LYS 41 -25.171 1.388 -5.517 1046 3HZ LYS 41 3HZ LYS 41 -23.634 0.999 -6.106 1047 H SER 42 H SER 42 -22.278 5.507 -3.673 1048 HA SER 42 HA SER 42 -20.058 4.786 -2.041 1049 1HB SER 42 1HB SER 42 -20.022 7.313 -1.909 1050 2HB SER 42 2HB SER 42 -21.591 7.220 -1.110 1051 HG SER 42 HG SER 42 -20.498 5.790 0.432 1052 H THR 43 H THR 43 -20.673 3.504 -0.355 1053 HA THR 43 HA THR 43 -23.572 3.213 0.095 1054 HB THR 43 HB THR 43 -23.359 0.857 0.306 1055 HG1 THR 43 HG1 THR 43 -20.605 1.432 0.449 1056 1HG2 THR 43 1HG2 THR 43 -23.256 0.493 -1.897 1057 2HG2 THR 43 2HG2 THR 43 -21.540 0.898 -1.952 1058 3HG2 THR 43 3HG2 THR 43 -22.751 2.174 -2.065 1059 H MET 44 H MET 44 -20.657 4.039 1.464 1060 HA MET 44 HA MET 44 -21.069 2.916 4.080 1061 1HB MET 44 1HB MET 44 -18.918 4.065 2.718 1062 2HB MET 44 2HB MET 44 -19.279 5.196 4.015 1063 1HG MET 44 1HG MET 44 -18.976 3.516 5.671 1064 2HG MET 44 2HG MET 44 -18.878 2.251 4.449 1065 1HE MET 44 1HE MET 44 -16.504 1.695 3.079 1066 2HE MET 44 2HE MET 44 -17.240 3.086 2.283 1067 3HE MET 44 3HE MET 44 -15.518 3.098 2.666 1068 H ASP 45 H ASP 45 -20.508 4.981 5.793 1069 HA ASP 45 HA ASP 45 -23.065 6.189 6.093 1070 1HB ASP 45 1HB ASP 45 -20.652 5.904 7.656 1071 2HB ASP 45 2HB ASP 45 -21.261 7.554 7.759 1072 H ASN 46 H ASN 46 -23.334 8.572 6.450 1073 HA ASN 46 HA ASN 46 -22.629 9.973 4.098 1074 1HB ASN 46 1HB ASN 46 -24.440 10.322 6.222 1075 2HB ASN 46 2HB ASN 46 -23.414 11.753 6.231 1076 1HD2 ASN 46 1HD2 ASN 46 -22.875 12.016 3.544 1077 2HD2 ASN 46 2HD2 ASN 46 -24.336 12.403 2.706 1078 HA PRO 47 HA PRO 47 -19.685 12.543 6.944 1079 1HB PRO 47 1HB PRO 47 -19.187 11.559 9.424 1080 2HB PRO 47 2HB PRO 47 -20.520 12.667 9.081 1081 1HG PRO 47 1HG PRO 47 -20.562 9.689 9.377 1082 2HG PRO 47 2HG PRO 47 -21.699 10.893 10.012 1083 1HD PRO 47 1HD PRO 47 -22.214 9.432 7.791 1084 2HD PRO 47 2HD PRO 47 -22.807 11.092 8.001 1085 H THR 48 H THR 48 -19.678 9.052 7.070 1086 HA THR 48 HA THR 48 -16.845 8.787 7.427 1087 HB THR 48 HB THR 48 -18.909 6.772 6.519 1088 HG1 THR 48 HG1 THR 48 -19.069 7.569 8.715 1089 1HG2 THR 48 1HG2 THR 48 -17.170 5.092 7.108 1090 2HG2 THR 48 2HG2 THR 48 -16.012 6.409 7.290 1091 3HG2 THR 48 3HG2 THR 48 -16.740 6.085 5.717 1092 H THR 49 H THR 49 -19.057 8.831 4.694 1093 HA THR 49 HA THR 49 -17.171 7.984 2.744 1094 HB THR 49 HB THR 49 -19.740 9.546 2.428 1095 HG1 THR 49 HG1 THR 49 -20.647 7.637 2.498 1096 1HG2 THR 49 1HG2 THR 49 -17.952 8.257 0.366 1097 2HG2 THR 49 2HG2 THR 49 -18.381 9.963 0.493 1098 3HG2 THR 49 3HG2 THR 49 -19.608 8.775 0.052 1099 H THR 50 H THR 50 -18.335 11.176 3.770 1100 HA THR 50 HA THR 50 -16.964 12.739 1.921 1101 HB THR 50 HB THR 50 -17.054 13.922 4.600 1102 HG1 THR 50 HG1 THR 50 -19.472 13.932 4.421 1103 1HG2 THR 50 1HG2 THR 50 -17.577 15.760 3.421 1104 2HG2 THR 50 2HG2 THR 50 -18.843 14.929 2.517 1105 3HG2 THR 50 3HG2 THR 50 -17.161 14.799 2.003 1106 H GLN 51 H GLN 51 -15.940 11.761 5.191 1107 HA GLN 51 HA GLN 51 -13.413 12.987 5.098 1108 1HB GLN 51 1HB GLN 51 -14.310 12.326 7.215 1109 2HB GLN 51 2HB GLN 51 -14.450 10.650 6.701 1110 1HG GLN 51 1HG GLN 51 -11.739 11.778 6.588 1111 2HG GLN 51 2HG GLN 51 -12.433 11.621 8.201 1112 1HE2 GLN 51 1HE2 GLN 51 -11.080 9.997 5.515 1113 2HE2 GLN 51 2HE2 GLN 51 -11.149 8.395 6.158 1114 H TYR 52 H TYR 52 -14.346 9.599 4.516 1115 HA TYR 52 HA TYR 52 -11.836 8.592 3.898 1116 1HB TYR 52 1HB TYR 52 -14.625 7.815 3.156 1117 2HB TYR 52 2HB TYR 52 -13.282 7.016 2.348 1118 HD1 TYR 52 HD1 TYR 52 -13.155 4.867 3.209 1119 HD2 TYR 52 HD2 TYR 52 -13.688 8.130 5.887 1120 HE1 TYR 52 HE1 TYR 52 -12.917 3.333 5.116 1121 HE2 TYR 52 HE2 TYR 52 -13.450 6.605 7.802 1122 HH TYR 52 HH TYR 52 -12.823 3.141 7.325 1123 H ALA 53 H ALA 53 -14.293 9.862 1.652 1124 HA ALA 53 HA ALA 53 -12.781 9.603 -0.689 1125 1HB ALA 53 1HB ALA 53 -14.336 11.243 -1.658 1126 2HB ALA 53 2HB ALA 53 -15.173 9.988 -0.744 1127 3HB ALA 53 3HB ALA 53 -14.954 11.592 -0.044 1128 H SER 54 H SER 54 -12.484 11.797 1.918 1129 HA SER 54 HA SER 54 -11.241 13.930 0.462 1130 1HB SER 54 1HB SER 54 -12.411 13.865 2.863 1131 2HB SER 54 2HB SER 54 -10.746 13.600 3.382 1132 HG SER 54 HG SER 54 -11.080 15.790 3.335 1133 H LEU 55 H LEU 55 -10.004 11.501 2.762 1134 HA LEU 55 HA LEU 55 -7.270 12.123 2.130 1135 1HB LEU 55 1HB LEU 55 -6.701 10.767 3.866 1136 2HB LEU 55 2HB LEU 55 -8.355 11.165 4.325 1137 HG LEU 55 HG LEU 55 -8.856 8.924 2.984 1138 1HD1 LEU 55 1HD1 LEU 55 -7.140 7.554 2.626 1139 2HD1 LEU 55 2HD1 LEU 55 -6.471 7.845 4.231 1140 3HD1 LEU 55 3HD1 LEU 55 -6.095 8.947 2.907 1141 1HD2 LEU 55 1HD2 LEU 55 -9.339 8.038 5.008 1142 2HD2 LEU 55 2HD2 LEU 55 -9.001 9.683 5.547 1143 3HD2 LEU 55 3HD2 LEU 55 -7.759 8.438 5.684 1144 H MET 56 H MET 56 -9.663 10.204 0.717 1145 HA MET 56 HA MET 56 -8.289 7.975 -0.208 1146 1HB MET 56 1HB MET 56 -10.787 9.195 -0.686 1147 2HB MET 56 2HB MET 56 -10.039 8.974 -2.262 1148 1HG MET 56 1HG MET 56 -11.409 7.069 -1.706 1149 2HG MET 56 2HG MET 56 -9.711 6.603 -1.772 1150 1HE MET 56 1HE MET 56 -8.541 5.587 -0.402 1151 2HE MET 56 2HE MET 56 -8.376 6.099 1.277 1152 3HE MET 56 3HE MET 56 -9.213 4.595 0.893 1153 H HIS 57 H HIS 57 -8.802 11.044 -1.959 1154 HA HIS 57 HA HIS 57 -7.013 10.402 -4.057 1155 1HB HIS 57 1HB HIS 57 -8.709 12.045 -4.461 1156 2HB HIS 57 2HB HIS 57 -8.157 13.033 -3.112 1157 HD1 HIS 57 HD1 HIS 57 -7.670 15.102 -4.515 1158 HD2 HIS 57 HD2 HIS 57 -5.633 11.719 -5.805 1159 HE1 HIS 57 HE1 HIS 57 -5.984 15.930 -6.187 1160 H SER 58 H SER 58 -6.643 12.133 -1.013 1161 HA SER 58 HA SER 58 -4.058 13.158 -1.498 1162 1HB SER 58 1HB SER 58 -5.912 13.443 0.503 1163 2HB SER 58 2HB SER 58 -4.661 12.489 1.301 1164 HG SER 58 HG SER 58 -4.616 15.106 0.460 1165 H PHE 59 H PHE 59 -5.201 10.021 -0.660 1166 HA PHE 59 HA PHE 59 -2.865 9.006 0.572 1167 1HB PHE 59 1HB PHE 59 -5.021 7.878 0.786 1168 2HB PHE 59 2HB PHE 59 -5.047 7.560 -0.945 1169 HD1 PHE 59 HD1 PHE 59 -5.005 5.246 -1.105 1170 HD2 PHE 59 HD2 PHE 59 -2.233 7.217 1.454 1171 HE1 PHE 59 HE1 PHE 59 -3.840 3.112 -0.730 1172 HE2 PHE 59 HE2 PHE 59 -1.062 5.086 1.832 1173 HZ PHE 59 HZ PHE 59 -1.865 3.030 0.739 1174 H ILE 60 H ILE 60 -4.101 8.552 -2.744 1175 HA ILE 60 HA ILE 60 -1.776 7.274 -3.707 1176 HB ILE 60 HB ILE 60 -3.907 8.777 -5.229 1177 1HG1 ILE 60 1HG1 ILE 60 -3.893 5.902 -5.520 1178 2HG1 ILE 60 2HG1 ILE 60 -4.013 6.348 -3.821 1179 1HG2 ILE 60 1HG2 ILE 60 -1.617 7.070 -6.142 1180 2HG2 ILE 60 2HG2 ILE 60 -3.071 7.265 -7.120 1181 3HG2 ILE 60 3HG2 ILE 60 -2.095 8.673 -6.700 1182 1HD1 ILE 60 1HD1 ILE 60 -5.774 7.908 -5.525 1183 2HD1 ILE 60 2HD1 ILE 60 -6.091 6.174 -5.595 1184 3HD1 ILE 60 3HD1 ILE 60 -6.120 7.014 -4.045 1185 H LEU 61 H LEU 61 -2.774 10.648 -3.597 1186 HA LEU 61 HA LEU 61 -0.763 11.691 -5.273 1187 1HB LEU 61 1HB LEU 61 -2.912 12.688 -3.794 1188 2HB LEU 61 2HB LEU 61 -1.489 13.501 -3.146 1189 HG LEU 61 HG LEU 61 -0.941 14.356 -5.351 1190 1HD1 LEU 61 1HD1 LEU 61 -1.611 12.796 -6.911 1191 2HD1 LEU 61 2HD1 LEU 61 -2.831 14.053 -7.109 1192 3HD1 LEU 61 3HD1 LEU 61 -3.206 12.598 -6.186 1193 1HD2 LEU 61 1HD2 LEU 61 -3.349 15.506 -5.701 1194 2HD2 LEU 61 2HD2 LEU 61 -2.212 15.981 -4.439 1195 3HD2 LEU 61 3HD2 LEU 61 -3.540 14.882 -4.062 1196 H LYS 62 H LYS 62 -0.772 10.708 -1.939 1197 HA LYS 62 HA LYS 62 1.662 12.059 -1.238 1198 1HB LYS 62 1HB LYS 62 -0.372 10.580 0.119 1199 2HB LYS 62 2HB LYS 62 1.187 9.862 0.506 1200 1HG LYS 62 1HG LYS 62 0.727 11.495 2.160 1201 2HG LYS 62 2HG LYS 62 1.992 12.151 1.118 1202 1HD LYS 62 1HD LYS 62 0.723 13.898 0.572 1203 2HD LYS 62 2HD LYS 62 -0.617 12.846 0.111 1204 1HE LYS 62 1HE LYS 62 -1.668 13.099 2.095 1205 2HE LYS 62 2HE LYS 62 -0.160 13.147 3.007 1206 1HZ LYS 62 1HZ LYS 62 -0.522 15.317 3.187 1207 2HZ LYS 62 2HZ LYS 62 -1.754 15.305 2.029 1208 3HZ LYS 62 3HZ LYS 62 -0.140 15.451 1.544 1209 H ALA 63 H ALA 63 0.804 8.644 -1.798 1210 HA ALA 63 HA ALA 63 3.447 7.669 -1.633 1211 1HB ALA 63 1HB ALA 63 2.532 5.643 -2.730 1212 2HB ALA 63 2HB ALA 63 1.582 6.178 -1.343 1213 3HB ALA 63 3HB ALA 63 1.014 6.506 -2.981 1214 H ARG 64 H ARG 64 1.414 8.504 -4.430 1215 HA ARG 64 HA ARG 64 3.119 7.792 -6.476 1216 1HB ARG 64 1HB ARG 64 0.762 8.665 -6.685 1217 2HB ARG 64 2HB ARG 64 1.415 10.284 -6.475 1218 1HG ARG 64 1HG ARG 64 2.980 9.344 -8.482 1219 2HG ARG 64 2HG ARG 64 1.454 8.522 -8.813 1220 1HD ARG 64 1HD ARG 64 1.591 10.666 -9.981 1221 2HD ARG 64 2HD ARG 64 0.283 10.655 -8.798 1222 HE ARG 64 HE ARG 64 2.311 11.739 -7.406 1223 1HH1 ARG 64 1HH1 ARG 64 0.992 12.430 -10.553 1224 2HH1 ARG 64 2HH1 ARG 64 1.395 14.114 -10.496 1225 1HH2 ARG 64 1HH2 ARG 64 2.847 13.955 -7.319 1226 2HH2 ARG 64 2HH2 ARG 64 2.451 14.980 -8.657 1227 H SER 65 H SER 65 3.246 10.585 -4.373 1228 HA SER 65 HA SER 65 5.112 12.095 -5.873 1229 1HB SER 65 1HB SER 65 3.598 12.747 -3.811 1230 2HB SER 65 2HB SER 65 5.023 12.275 -2.887 1231 HG SER 65 HG SER 65 6.197 13.849 -3.896 1232 H THR 66 H THR 66 5.442 9.597 -3.422 1233 HA THR 66 HA THR 66 8.312 9.894 -3.261 1234 HB THR 66 HB THR 66 7.064 7.427 -2.206 1235 HG1 THR 66 HG1 THR 66 6.622 9.768 -0.718 1236 1HG2 THR 66 1HG2 THR 66 9.449 8.303 -1.841 1237 2HG2 THR 66 2HG2 THR 66 8.558 7.745 -0.424 1238 3HG2 THR 66 3HG2 THR 66 8.712 9.472 -0.746 1239 H VAL 67 H VAL 67 5.996 7.782 -4.843 1240 HA VAL 67 HA VAL 67 7.601 5.676 -5.620 1241 HB VAL 67 HB VAL 67 5.410 6.996 -7.228 1242 1HG1 VAL 67 1HG1 VAL 67 5.247 4.603 -8.168 1243 2HG1 VAL 67 2HG1 VAL 67 6.522 5.661 -8.776 1244 3HG1 VAL 67 3HG1 VAL 67 6.899 4.420 -7.579 1245 1HG2 VAL 67 1HG2 VAL 67 4.966 4.450 -5.803 1246 2HG2 VAL 67 2HG2 VAL 67 5.136 5.886 -4.794 1247 3HG2 VAL 67 3HG2 VAL 67 3.885 5.824 -6.036 1248 H ARG 68 H ARG 68 7.361 8.901 -7.004 1249 HA ARG 68 HA ARG 68 8.717 8.518 -9.395 1250 1HB ARG 68 1HB ARG 68 8.886 10.949 -7.605 1251 2HB ARG 68 2HB ARG 68 9.219 10.899 -9.331 1252 1HG ARG 68 1HG ARG 68 6.626 9.866 -8.986 1253 2HG ARG 68 2HG ARG 68 6.739 11.315 -7.985 1254 1HD ARG 68 1HD ARG 68 6.968 12.694 -9.769 1255 2HD ARG 68 2HD ARG 68 7.875 11.505 -10.704 1256 HE ARG 68 HE ARG 68 5.129 10.781 -10.384 1257 1HH1 ARG 68 1HH1 ARG 68 7.331 12.746 -12.230 1258 2HH1 ARG 68 2HH1 ARG 68 6.315 12.798 -13.632 1259 1HH2 ARG 68 1HH2 ARG 68 3.782 10.842 -12.224 1260 2HH2 ARG 68 2HH2 ARG 68 4.296 11.715 -13.627 1261 H ASP 69 H ASP 69 9.927 8.685 -6.137 1262 HA ASP 69 HA ASP 69 12.681 9.019 -6.928 1263 1HB ASP 69 1HB ASP 69 11.189 9.210 -4.503 1264 2HB ASP 69 2HB ASP 69 12.484 8.041 -4.259 1265 H ILE 70 H ILE 70 10.502 6.398 -6.361 1266 HA ILE 70 HA ILE 70 12.476 4.390 -5.885 1267 HB ILE 70 HB ILE 70 9.701 3.912 -6.955 1268 1HG1 ILE 70 1HG1 ILE 70 10.563 4.313 -4.082 1269 2HG1 ILE 70 2HG1 ILE 70 9.539 5.399 -5.015 1270 1HG2 ILE 70 1HG2 ILE 70 10.728 2.075 -4.971 1271 2HG2 ILE 70 2HG2 ILE 70 10.103 1.755 -6.587 1272 3HG2 ILE 70 3HG2 ILE 70 11.797 2.194 -6.368 1273 1HD1 ILE 70 1HD1 ILE 70 8.071 4.191 -3.668 1274 2HD1 ILE 70 2HD1 ILE 70 7.955 3.419 -5.250 1275 3HD1 ILE 70 3HD1 ILE 70 8.905 2.667 -3.969 1276 H ASP 71 H ASP 71 11.030 5.805 -8.716 1277 HA ASP 71 HA ASP 71 12.982 4.582 -10.416 1278 1HB ASP 71 1HB ASP 71 10.302 3.414 -10.213 1279 2HB ASP 71 2HB ASP 71 10.765 3.825 -11.861 1280 HA PRO 72 HA PRO 72 12.254 8.152 -12.856 1281 1HB PRO 72 1HB PRO 72 12.694 7.246 -15.377 1282 2HB PRO 72 2HB PRO 72 13.992 7.477 -14.199 1283 1HG PRO 72 1HG PRO 72 12.575 4.960 -14.989 1284 2HG PRO 72 2HG PRO 72 14.306 5.231 -14.714 1285 1HD PRO 72 1HD PRO 72 12.700 4.078 -12.864 1286 2HD PRO 72 2HD PRO 72 14.093 5.086 -12.423 1287 H GLN 73 H GLN 73 10.351 5.322 -13.415 1288 HA GLN 73 HA GLN 73 8.161 6.991 -14.377 1289 1HB GLN 73 1HB GLN 73 9.213 4.567 -15.835 1290 2HB GLN 73 2HB GLN 73 7.616 5.246 -16.122 1291 1HG GLN 73 1HG GLN 73 9.026 7.459 -16.464 1292 2HG GLN 73 2HG GLN 73 10.287 6.293 -16.858 1293 1HE2 GLN 73 1HE2 GLN 73 10.421 6.653 -19.009 1294 2HE2 GLN 73 2HE2 GLN 73 9.135 6.354 -20.124 1295 H ASN 74 H ASN 74 8.652 3.473 -14.235 1296 HA ASN 74 HA ASN 74 7.447 1.828 -13.217 1297 1HB ASN 74 1HB ASN 74 8.584 3.321 -11.282 1298 2HB ASN 74 2HB ASN 74 6.890 3.512 -10.840 1299 1HD2 ASN 74 1HD2 ASN 74 8.955 2.165 -9.372 1300 2HD2 ASN 74 2HD2 ASN 74 8.460 0.519 -9.204 1301 H ASP 75 H ASP 75 5.328 1.736 -11.522 1302 HA ASP 75 HA ASP 75 3.220 3.505 -11.999 1303 1HB ASP 75 1HB ASP 75 3.775 2.010 -14.279 1304 2HB ASP 75 2HB ASP 75 2.410 1.175 -13.543 1305 H LEU 76 H LEU 76 2.068 3.189 -10.224 1306 HA LEU 76 HA LEU 76 2.169 0.793 -8.710 1307 1HB LEU 76 1HB LEU 76 0.842 3.413 -8.512 1308 2HB LEU 76 2HB LEU 76 0.016 2.085 -7.700 1309 HG LEU 76 HG LEU 76 1.432 3.292 -6.146 1310 1HD1 LEU 76 1HD1 LEU 76 1.149 0.778 -6.038 1311 2HD1 LEU 76 2HD1 LEU 76 2.528 1.450 -5.169 1312 3HD1 LEU 76 3HD1 LEU 76 2.768 0.664 -6.729 1313 1HD2 LEU 76 1HD2 LEU 76 3.160 4.282 -7.270 1314 2HD2 LEU 76 2HD2 LEU 76 3.471 2.863 -8.271 1315 3HD2 LEU 76 3HD2 LEU 76 3.997 2.888 -6.587 1316 H THR 77 H THR 77 0.777 -0.891 -8.557 1317 HA THR 77 HA THR 77 -1.285 -1.074 -10.624 1318 HB THR 77 HB THR 77 -1.325 -3.492 -10.087 1319 HG1 THR 77 HG1 THR 77 0.014 -4.316 -8.548 1320 1HG2 THR 77 1HG2 THR 77 1.116 -3.928 -10.781 1321 2HG2 THR 77 2HG2 THR 77 1.271 -2.172 -10.817 1322 3HG2 THR 77 3HG2 THR 77 0.104 -2.976 -11.866 1323 H PHE 78 H PHE 78 -0.871 -1.539 -7.130 1324 HA PHE 78 HA PHE 78 -3.493 -0.595 -6.566 1325 1HB PHE 78 1HB PHE 78 -4.443 -2.655 -5.646 1326 2HB PHE 78 2HB PHE 78 -4.094 -2.843 -7.361 1327 HD1 PHE 78 HD1 PHE 78 -3.380 -3.996 -4.014 1328 HD2 PHE 78 HD2 PHE 78 -2.130 -4.171 -8.079 1329 HE1 PHE 78 HE1 PHE 78 -2.051 -6.006 -3.515 1330 HE2 PHE 78 HE2 PHE 78 -0.800 -6.182 -7.587 1331 HZ PHE 78 HZ PHE 78 -0.760 -7.102 -5.303 1332 H LEU 79 H LEU 79 -3.378 0.361 -4.648 1333 HA LEU 79 HA LEU 79 -1.128 -0.206 -2.904 1334 1HB LEU 79 1HB LEU 79 -2.841 2.038 -3.446 1335 2HB LEU 79 2HB LEU 79 -2.793 1.713 -1.715 1336 HG LEU 79 HG LEU 79 -0.428 2.035 -1.647 1337 1HD1 LEU 79 1HD1 LEU 79 0.274 0.985 -3.666 1338 2HD1 LEU 79 2HD1 LEU 79 0.818 2.661 -3.721 1339 3HD1 LEU 79 3HD1 LEU 79 -0.595 2.163 -4.650 1340 1HD2 LEU 79 1HD2 LEU 79 -2.243 4.040 -2.551 1341 2HD2 LEU 79 2HD2 LEU 79 -0.658 4.339 -3.263 1342 3HD2 LEU 79 3HD2 LEU 79 -0.828 4.212 -1.512 1343 H ARG 80 H ARG 80 -1.452 -2.035 -1.752 1344 HA ARG 80 HA ARG 80 -4.027 -2.521 -0.483 1345 1HB ARG 80 1HB ARG 80 -2.599 -4.308 -1.647 1346 2HB ARG 80 2HB ARG 80 -1.568 -4.237 -0.224 1347 1HG ARG 80 1HG ARG 80 -3.017 -6.033 0.154 1348 2HG ARG 80 2HG ARG 80 -3.661 -4.712 1.131 1349 1HD ARG 80 1HD ARG 80 -5.604 -5.322 0.153 1350 2HD ARG 80 2HD ARG 80 -5.012 -4.286 -1.146 1351 HE ARG 80 HE ARG 80 -4.822 -6.138 -2.464 1352 1HH1 ARG 80 1HH1 ARG 80 -4.946 -7.147 0.865 1353 2HH1 ARG 80 2HH1 ARG 80 -5.006 -8.837 0.486 1354 1HH2 ARG 80 1HH2 ARG 80 -4.902 -8.359 -2.976 1355 2HH2 ARG 80 2HH2 ARG 80 -4.981 -9.525 -1.699 1356 H ILE 81 H ILE 81 -4.456 -1.809 1.489 1357 HA ILE 81 HA ILE 81 -2.263 -1.603 3.436 1358 HB ILE 81 HB ILE 81 -3.535 0.447 4.342 1359 1HG1 ILE 81 1HG1 ILE 81 -4.529 0.416 1.483 1360 2HG1 ILE 81 2HG1 ILE 81 -5.521 0.208 2.922 1361 1HG2 ILE 81 1HG2 ILE 81 -1.708 1.457 3.593 1362 2HG2 ILE 81 2HG2 ILE 81 -1.449 0.137 2.453 1363 3HG2 ILE 81 3HG2 ILE 81 -2.403 1.541 1.974 1364 1HD1 ILE 81 1HD1 ILE 81 -4.561 2.538 3.574 1365 2HD1 ILE 81 2HD1 ILE 81 -4.236 2.666 1.845 1366 3HD1 ILE 81 3HD1 ILE 81 -5.885 2.411 2.416 1367 H ARG 82 H ARG 82 -2.936 -3.490 4.460 1368 HA ARG 82 HA ARG 82 -5.657 -3.804 5.350 1369 1HB ARG 82 1HB ARG 82 -4.485 -5.805 4.785 1370 2HB ARG 82 2HB ARG 82 -3.134 -5.385 5.831 1371 1HG ARG 82 1HG ARG 82 -4.344 -5.865 7.777 1372 2HG ARG 82 2HG ARG 82 -5.888 -5.848 6.922 1373 1HD ARG 82 1HD ARG 82 -5.725 -8.024 6.505 1374 2HD ARG 82 2HD ARG 82 -4.159 -7.790 5.730 1375 HE ARG 82 HE ARG 82 -3.968 -7.786 8.579 1376 1HH1 ARG 82 1HH1 ARG 82 -4.210 -9.842 5.780 1377 2HH1 ARG 82 2HH1 ARG 82 -3.435 -11.191 6.542 1378 1HH2 ARG 82 1HH2 ARG 82 -2.946 -9.556 9.593 1379 2HH2 ARG 82 2HH2 ARG 82 -2.717 -11.028 8.711 1380 H SER 83 H SER 83 -6.503 -3.134 7.212 1381 HA SER 83 HA SER 83 -4.678 -2.055 9.251 1382 1HB SER 83 1HB SER 83 -7.573 -1.401 9.352 1383 2HB SER 83 2HB SER 83 -6.174 -0.379 9.680 1384 HG SER 83 HG SER 83 -7.559 -0.762 7.348 1385 H LYS 84 H LYS 84 -5.638 -2.132 11.522 1386 HA LYS 84 HA LYS 84 -5.931 -4.812 12.302 1387 1HB LYS 84 1HB LYS 84 -6.416 -2.211 13.745 1388 2HB LYS 84 2HB LYS 84 -6.640 -3.769 14.530 1389 1HG LYS 84 1HG LYS 84 -4.208 -4.215 13.691 1390 2HG LYS 84 2HG LYS 84 -4.131 -2.454 13.606 1391 1HD LYS 84 1HD LYS 84 -3.469 -2.679 15.760 1392 2HD LYS 84 2HD LYS 84 -5.210 -2.733 16.046 1393 1HE LYS 84 1HE LYS 84 -5.215 -5.022 16.368 1394 2HE LYS 84 2HE LYS 84 -3.724 -5.258 15.459 1395 1HZ LYS 84 1HZ LYS 84 -3.574 -5.505 17.948 1396 2HZ LYS 84 2HZ LYS 84 -3.787 -3.831 18.052 1397 3HZ LYS 84 3HZ LYS 84 -2.444 -4.463 17.241 1398 H LYS 85 H LYS 85 -8.241 -2.457 11.295 1399 HA LYS 85 HA LYS 85 -10.480 -4.025 12.335 1400 1HB LYS 85 1HB LYS 85 -10.209 -1.274 11.173 1401 2HB LYS 85 2HB LYS 85 -11.781 -2.061 11.204 1402 1HG LYS 85 1HG LYS 85 -10.835 -2.412 13.771 1403 2HG LYS 85 2HG LYS 85 -10.294 -0.788 13.343 1404 1HD LYS 85 1HD LYS 85 -12.378 -0.289 14.127 1405 2HD LYS 85 2HD LYS 85 -12.779 -0.602 12.437 1406 1HE LYS 85 1HE LYS 85 -13.808 -2.585 12.906 1407 2HE LYS 85 2HE LYS 85 -12.791 -2.905 14.311 1408 1HZ LYS 85 1HZ LYS 85 -14.632 -0.643 14.470 1409 2HZ LYS 85 2HZ LYS 85 -14.140 -1.724 15.675 1410 3HZ LYS 85 3HZ LYS 85 -15.305 -2.194 14.542 1411 H ASN 86 H ASN 86 -9.072 -2.931 9.287 1412 HA ASN 86 HA ASN 86 -9.855 -5.191 7.844 1413 1HB ASN 86 1HB ASN 86 -11.560 -4.033 6.331 1414 2HB ASN 86 2HB ASN 86 -12.120 -4.518 7.929 1415 1HD2 ASN 86 1HD2 ASN 86 -12.574 -2.957 9.464 1416 2HD2 ASN 86 2HD2 ASN 86 -12.746 -1.286 9.060 1417 H GLU 87 H GLU 87 -9.667 -4.781 5.394 1418 HA GLU 87 HA GLU 87 -7.418 -2.936 4.996 1419 1HB GLU 87 1HB GLU 87 -6.888 -4.301 3.018 1420 2HB GLU 87 2HB GLU 87 -6.934 -5.265 4.487 1421 1HG GLU 87 1HG GLU 87 -9.128 -6.101 3.910 1422 2HG GLU 87 2HG GLU 87 -9.165 -5.076 2.477 1423 H ILE 88 H ILE 88 -7.319 -1.605 3.143 1424 HA ILE 88 HA ILE 88 -9.871 -1.205 1.735 1425 HB ILE 88 HB ILE 88 -8.117 1.067 2.660 1426 1HG1 ILE 88 1HG1 ILE 88 -10.518 1.246 4.032 1427 2HG1 ILE 88 2HG1 ILE 88 -10.141 -0.472 4.096 1428 1HG2 ILE 88 1HG2 ILE 88 -10.600 0.821 1.075 1429 2HG2 ILE 88 2HG2 ILE 88 -10.524 2.151 2.229 1430 3HG2 ILE 88 3HG2 ILE 88 -9.298 2.005 0.970 1431 1HD1 ILE 88 1HD1 ILE 88 -9.301 0.904 6.013 1432 2HD1 ILE 88 2HD1 ILE 88 -8.082 -0.065 5.185 1433 3HD1 ILE 88 3HD1 ILE 88 -8.187 1.669 4.880 1434 H MET 89 H MET 89 -9.354 -1.890 -0.262 1435 HA MET 89 HA MET 89 -6.769 -1.400 -1.427 1436 1HB MET 89 1HB MET 89 -9.277 -2.478 -2.726 1437 2HB MET 89 2HB MET 89 -7.646 -2.566 -3.378 1438 1HG MET 89 1HG MET 89 -7.133 -4.360 -2.162 1439 2HG MET 89 2HG MET 89 -7.884 -3.705 -0.709 1440 1HE MET 89 1HE MET 89 -10.525 -4.106 -3.870 1441 2HE MET 89 2HE MET 89 -8.841 -4.492 -4.224 1442 3HE MET 89 3HE MET 89 -10.042 -5.781 -4.140 1443 H VAL 90 H VAL 90 -6.203 0.468 -2.308 1444 HA VAL 90 HA VAL 90 -8.223 2.000 -3.799 1445 HB VAL 90 HB VAL 90 -6.181 3.162 -1.900 1446 1HG1 VAL 90 1HG1 VAL 90 -7.658 4.313 -4.144 1447 2HG1 VAL 90 2HG1 VAL 90 -7.845 5.204 -2.633 1448 3HG1 VAL 90 3HG1 VAL 90 -6.235 4.914 -3.293 1449 1HG2 VAL 90 1HG2 VAL 90 -8.577 2.114 -1.237 1450 2HG2 VAL 90 2HG2 VAL 90 -7.826 3.461 -0.383 1451 3HG2 VAL 90 3HG2 VAL 90 -9.050 3.771 -1.614 1452 H ALA 91 H ALA 91 -7.583 1.892 -5.852 1453 HA ALA 91 HA ALA 91 -4.775 2.526 -6.462 1454 1HB ALA 91 1HB ALA 91 -6.176 0.657 -8.282 1455 2HB ALA 91 2HB ALA 91 -4.475 0.734 -7.821 1456 3HB ALA 91 3HB ALA 91 -5.655 0.023 -6.721 1457 HA PRO 92 HA PRO 92 -6.319 5.486 -9.311 1458 1HB PRO 92 1HB PRO 92 -4.420 5.408 -11.250 1459 2HB PRO 92 2HB PRO 92 -4.138 6.120 -9.657 1460 1HG PRO 92 1HG PRO 92 -3.377 3.413 -10.683 1461 2HG PRO 92 2HG PRO 92 -2.425 4.547 -9.707 1462 1HD PRO 92 1HD PRO 92 -3.696 2.411 -8.633 1463 2HD PRO 92 2HD PRO 92 -3.471 3.933 -7.747 1464 H ASP 93 H ASP 93 -8.040 5.237 -10.578 1465 HA ASP 93 HA ASP 93 -8.140 2.978 -12.442 1466 1HB ASP 93 1HB ASP 93 -10.372 4.841 -11.604 1467 2HB ASP 93 2HB ASP 93 -10.537 3.346 -12.522 1468 H LYS 94 H LYS 94 -9.948 3.866 -14.285 1469 HA LYS 94 HA LYS 94 -8.422 5.097 -16.211 1470 1HB LYS 94 1HB LYS 94 -11.155 4.302 -15.917 1471 2HB LYS 94 2HB LYS 94 -11.109 5.887 -16.678 1472 1HG LYS 94 1HG LYS 94 -9.864 5.099 -18.500 1473 2HG LYS 94 2HG LYS 94 -9.426 3.608 -17.663 1474 1HD LYS 94 1HD LYS 94 -12.290 4.265 -18.265 1475 2HD LYS 94 2HD LYS 94 -11.254 3.509 -19.478 1476 1HE LYS 94 1HE LYS 94 -11.134 2.250 -16.835 1477 2HE LYS 94 2HE LYS 94 -12.721 2.173 -17.599 1478 1HZ LYS 94 1HZ LYS 94 -11.952 0.475 -18.772 1479 2HZ LYS 94 2HZ LYS 94 -10.374 0.700 -18.204 1480 3HZ LYS 94 3HZ LYS 94 -10.907 1.538 -19.573 1481 H ASP 95 H ASP 95 -10.866 6.658 -14.140 1482 HA ASP 95 HA ASP 95 -9.329 9.118 -14.181 1483 1HB ASP 95 1HB ASP 95 -11.911 8.773 -15.611 1484 2HB ASP 95 2HB ASP 95 -11.698 10.263 -14.696 1485 H TYR 96 H TYR 96 -10.507 6.964 -12.341 1486 HA TYR 96 HA TYR 96 -11.383 8.844 -10.287 1487 1HB TYR 96 1HB TYR 96 -13.188 7.176 -9.613 1488 2HB TYR 96 2HB TYR 96 -13.502 8.126 -11.061 1489 HD1 TYR 96 HD1 TYR 96 -13.369 7.074 -13.287 1490 HD2 TYR 96 HD2 TYR 96 -12.904 4.797 -9.723 1491 HE1 TYR 96 HE1 TYR 96 -13.744 5.007 -14.566 1492 HE2 TYR 96 HE2 TYR 96 -13.276 2.723 -10.992 1493 HH TYR 96 HH TYR 96 -14.229 2.783 -14.371 1494 H PHE 97 H PHE 97 -11.853 7.305 -8.199 1495 HA PHE 97 HA PHE 97 -9.549 5.484 -7.981 1496 1HB PHE 97 1HB PHE 97 -10.432 7.638 -6.062 1497 2HB PHE 97 2HB PHE 97 -9.378 6.315 -5.574 1498 HD1 PHE 97 HD1 PHE 97 -7.583 6.000 -7.814 1499 HD2 PHE 97 HD2 PHE 97 -9.165 9.558 -6.095 1500 HE1 PHE 97 HE1 PHE 97 -5.629 7.257 -8.626 1501 HE2 PHE 97 HE2 PHE 97 -7.215 10.821 -6.905 1502 HZ PHE 97 HZ PHE 97 -5.444 9.670 -8.173 1503 H LEU 98 H LEU 98 -10.294 3.501 -7.652 1504 HA LEU 98 HA LEU 98 -12.896 3.033 -6.506 1505 1HB LEU 98 1HB LEU 98 -11.343 1.695 -8.304 1506 2HB LEU 98 2HB LEU 98 -11.107 0.735 -6.845 1507 HG LEU 98 HG LEU 98 -13.912 1.349 -7.406 1508 1HD1 LEU 98 1HD1 LEU 98 -12.191 0.075 -9.468 1509 2HD1 LEU 98 2HD1 LEU 98 -13.619 1.094 -9.655 1510 3HD1 LEU 98 3HD1 LEU 98 -13.797 -0.595 -9.180 1511 1HD2 LEU 98 1HD2 LEU 98 -13.738 -0.265 -5.823 1512 2HD2 LEU 98 2HD2 LEU 98 -12.224 -0.896 -6.471 1513 3HD2 LEU 98 3HD2 LEU 98 -13.755 -1.309 -7.244 1514 H ILE 99 H ILE 99 -13.372 2.095 -4.548 1515 HA ILE 99 HA ILE 99 -11.145 1.522 -2.726 1516 HB ILE 99 HB ILE 99 -13.529 3.190 -1.921 1517 1HG1 ILE 99 1HG1 ILE 99 -11.245 4.731 -1.612 1518 2HG1 ILE 99 2HG1 ILE 99 -10.986 3.923 -3.154 1519 1HG2 ILE 99 1HG2 ILE 99 -12.431 1.724 -0.195 1520 2HG2 ILE 99 2HG2 ILE 99 -10.974 2.693 -0.412 1521 3HG2 ILE 99 3HG2 ILE 99 -12.454 3.448 0.178 1522 1HD1 ILE 99 1HD1 ILE 99 -13.462 5.479 -2.455 1523 2HD1 ILE 99 2HD1 ILE 99 -12.082 6.133 -3.339 1524 3HD1 ILE 99 3HD1 ILE 99 -13.026 4.812 -4.028 1525 H VAL 100 H VAL 100 -11.439 -0.591 -2.370 1526 HA VAL 100 HA VAL 100 -14.156 -1.531 -1.721 1527 HB VAL 100 HB VAL 100 -11.825 -3.217 -2.638 1528 1HG1 VAL 100 1HG1 VAL 100 -13.718 -4.840 -3.116 1529 2HG1 VAL 100 2HG1 VAL 100 -13.323 -4.567 -1.418 1530 3HG1 VAL 100 3HG1 VAL 100 -14.733 -3.785 -2.133 1531 1HG2 VAL 100 1HG2 VAL 100 -12.535 -1.645 -4.390 1532 2HG2 VAL 100 2HG2 VAL 100 -12.910 -3.316 -4.810 1533 3HG2 VAL 100 3HG2 VAL 100 -14.188 -2.241 -4.241 1534 H ILE 101 H ILE 101 -14.456 -1.723 0.394 1535 HA ILE 101 HA ILE 101 -12.197 -2.596 2.070 1536 HB ILE 101 HB ILE 101 -14.680 -1.103 2.923 1537 1HG1 ILE 101 1HG1 ILE 101 -12.250 0.338 3.364 1538 2HG1 ILE 101 2HG1 ILE 101 -12.298 -0.172 1.680 1539 1HG2 ILE 101 1HG2 ILE 101 -13.584 -0.875 5.071 1540 2HG2 ILE 101 2HG2 ILE 101 -13.738 -2.580 4.650 1541 3HG2 ILE 101 3HG2 ILE 101 -12.183 -1.766 4.478 1542 1HD1 ILE 101 1HD1 ILE 101 -13.317 1.901 1.645 1543 2HD1 ILE 101 2HD1 ILE 101 -14.686 0.790 1.696 1544 3HD1 ILE 101 3HD1 ILE 101 -14.170 1.621 3.163 1545 H GLN 102 H GLN 102 -12.422 -4.313 3.442 1546 HA GLN 102 HA GLN 102 -14.913 -5.519 4.079 1547 1HB GLN 102 1HB GLN 102 -14.831 -7.510 2.793 1548 2HB GLN 102 2HB GLN 102 -14.592 -6.188 1.658 1549 1HG GLN 102 1HG GLN 102 -12.170 -6.598 1.722 1550 2HG GLN 102 2HG GLN 102 -12.448 -7.960 2.807 1551 1HE2 GLN 102 1HE2 GLN 102 -12.265 -6.928 -0.400 1552 2HE2 GLN 102 2HE2 GLN 102 -12.804 -8.383 -1.160 1553 H ASN 103 H ASN 103 -14.561 -7.697 5.169 1554 HA ASN 103 HA ASN 103 -12.785 -7.452 7.266 1555 1HB ASN 103 1HB ASN 103 -14.436 -9.631 6.151 1556 2HB ASN 103 2HB ASN 103 -13.083 -10.152 7.151 1557 1HD2 ASN 103 1HD2 ASN 103 -16.088 -8.414 7.067 1558 2HD2 ASN 103 2HD2 ASN 103 -16.315 -8.321 8.777 1559 HA PRO 104 HA PRO 104 -8.805 -8.698 5.903 1560 1HB PRO 104 1HB PRO 104 -7.903 -10.175 7.995 1561 2HB PRO 104 2HB PRO 104 -8.079 -8.418 8.065 1562 1HG PRO 104 1HG PRO 104 -9.913 -10.548 9.096 1563 2HG PRO 104 2HG PRO 104 -9.414 -9.031 9.868 1564 1HD PRO 104 1HD PRO 104 -11.804 -9.317 8.628 1565 2HD PRO 104 2HD PRO 104 -10.926 -7.775 8.664 1566 H THR 105 H THR 105 -7.676 -10.355 4.916 1567 HA THR 105 HA THR 105 -8.418 -13.112 5.252 1568 HB THR 105 HB THR 105 -10.094 -13.053 3.740 1569 HG1 THR 105 HG1 THR 105 -9.278 -13.351 1.568 1570 1HG2 THR 105 1HG2 THR 105 -10.464 -10.781 3.469 1571 2HG2 THR 105 2HG2 THR 105 -10.054 -11.281 1.827 1572 3HG2 THR 105 3HG2 THR 105 -8.844 -10.489 2.836 1573 H GLU 106 H GLU 106 -7.083 -11.149 2.586 1574 HA GLU 106 HA GLU 106 -4.658 -12.811 2.708 1575 1HB GLU 106 1HB GLU 106 -5.993 -12.824 0.580 1576 2HB GLU 106 2HB GLU 106 -5.609 -11.118 0.395 1577 1HG GLU 106 1HG GLU 106 -3.856 -11.815 -0.779 1578 2HG GLU 106 2HG GLU 106 -3.141 -12.227 0.779 Start of MODEL 19 1 H MET 11 H MET 11 17.538 -9.914 15.287 2 HA MET 11 HA MET 11 17.578 -8.867 12.583 3 1HB MET 11 1HB MET 11 19.424 -8.466 14.245 4 2HB MET 11 2HB MET 11 19.832 -10.171 14.112 5 1HG MET 11 1HG MET 11 21.220 -9.546 12.496 6 2HG MET 11 2HG MET 11 19.780 -9.372 11.497 7 1HE MET 11 1HE MET 11 21.548 -8.241 10.238 8 2HE MET 11 2HE MET 11 20.700 -6.736 9.882 9 3HE MET 11 3HE MET 11 22.305 -6.693 10.614 10 H ALA 12 H ALA 12 18.248 -11.971 14.187 11 HA ALA 12 HA ALA 12 18.881 -13.505 11.984 12 1HB ALA 12 1HB ALA 12 18.628 -14.031 14.597 13 2HB ALA 12 2HB ALA 12 17.158 -14.804 14.001 14 3HB ALA 12 3HB ALA 12 18.730 -15.289 13.365 15 H GLU 13 H GLU 13 15.685 -12.643 13.226 16 HA GLU 13 HA GLU 13 14.091 -14.284 11.675 17 1HB GLU 13 1HB GLU 13 13.588 -12.356 13.485 18 2HB GLU 13 2HB GLU 13 13.163 -11.489 12.016 19 1HG GLU 13 1HG GLU 13 11.282 -12.654 11.728 20 2HG GLU 13 2HG GLU 13 12.048 -14.183 12.155 21 H VAL 14 H VAL 14 15.225 -11.001 10.885 22 HA VAL 14 HA VAL 14 14.100 -10.923 8.300 23 HB VAL 14 HB VAL 14 16.550 -9.419 9.218 24 1HG1 VAL 14 1HG1 VAL 14 14.823 -9.331 6.858 25 2HG1 VAL 14 2HG1 VAL 14 15.092 -7.760 7.616 26 3HG1 VAL 14 3HG1 VAL 14 16.466 -8.731 7.087 27 1HG2 VAL 14 1HG2 VAL 14 14.596 -7.643 9.582 28 2HG2 VAL 14 2HG2 VAL 14 13.687 -9.116 9.921 29 3HG2 VAL 14 3HG2 VAL 14 15.132 -8.736 10.858 30 H GLU 15 H GLU 15 17.232 -12.001 9.504 31 HA GLU 15 HA GLU 15 18.495 -12.315 7.002 32 1HB GLU 15 1HB GLU 15 18.965 -13.622 9.680 33 2HB GLU 15 2HB GLU 15 19.982 -13.930 8.279 34 1HG GLU 15 1HG GLU 15 20.681 -11.653 8.193 35 2HG GLU 15 2HG GLU 15 19.506 -11.191 9.423 36 H GLU 16 H GLU 16 16.483 -14.463 8.942 37 HA GLU 16 HA GLU 16 16.891 -16.798 7.404 38 1HB GLU 16 1HB GLU 16 15.583 -16.201 9.747 39 2HB GLU 16 2HB GLU 16 14.251 -16.550 8.654 40 1HG GLU 16 1HG GLU 16 15.412 -18.697 8.081 41 2HG GLU 16 2HG GLU 16 16.540 -18.352 9.391 42 H THR 17 H THR 17 14.685 -14.092 7.112 43 HA THR 17 HA THR 17 13.106 -15.338 5.044 44 HB THR 17 HB THR 17 13.158 -12.475 6.017 45 HG1 THR 17 HG1 THR 17 12.390 -14.103 7.516 46 1HG2 THR 17 1HG2 THR 17 12.308 -12.471 3.784 47 2HG2 THR 17 2HG2 THR 17 10.924 -12.362 4.871 48 3HG2 THR 17 3HG2 THR 17 11.318 -13.896 4.097 49 H LEU 18 H LEU 18 15.896 -13.277 5.239 50 HA LEU 18 HA LEU 18 15.785 -12.346 2.534 51 1HB LEU 18 1HB LEU 18 17.528 -12.039 4.844 52 2HB LEU 18 2HB LEU 18 18.420 -12.146 3.328 53 HG LEU 18 HG LEU 18 16.677 -10.305 2.579 54 1HD1 LEU 18 1HD1 LEU 18 16.260 -8.757 4.488 55 2HD1 LEU 18 2HD1 LEU 18 16.764 -10.048 5.578 56 3HD1 LEU 18 3HD1 LEU 18 15.342 -10.260 4.558 57 1HD2 LEU 18 1HD2 LEU 18 18.872 -9.407 4.403 58 2HD2 LEU 18 2HD2 LEU 18 18.355 -8.733 2.858 59 3HD2 LEU 18 3HD2 LEU 18 19.247 -10.255 2.902 60 H LYS 19 H LYS 19 17.598 -14.874 4.237 61 HA LYS 19 HA LYS 19 19.182 -15.741 2.111 62 1HB LYS 19 1HB LYS 19 18.627 -16.581 4.753 63 2HB LYS 19 2HB LYS 19 18.375 -17.980 3.718 64 1HG LYS 19 1HG LYS 19 20.564 -18.311 3.796 65 2HG LYS 19 2HG LYS 19 20.748 -16.861 2.807 66 1HD LYS 19 1HD LYS 19 22.085 -16.307 4.581 67 2HD LYS 19 2HD LYS 19 20.544 -15.657 5.145 68 1HE LYS 19 1HE LYS 19 21.400 -16.845 6.977 69 2HE LYS 19 2HE LYS 19 20.193 -17.918 6.269 70 1HZ LYS 19 1HZ LYS 19 23.122 -18.086 5.807 71 2HZ LYS 19 2HZ LYS 19 21.957 -19.128 5.162 72 3HZ LYS 19 3HZ LYS 19 22.232 -19.097 6.831 73 H ARG 20 H ARG 20 15.917 -16.716 3.075 74 HA ARG 20 HA ARG 20 15.648 -18.728 1.081 75 1HB ARG 20 1HB ARG 20 14.301 -18.447 3.250 76 2HB ARG 20 2HB ARG 20 13.359 -17.255 2.366 77 1HG ARG 20 1HG ARG 20 12.066 -19.021 1.878 78 2HG ARG 20 2HG ARG 20 13.278 -19.313 0.629 79 1HD ARG 20 1HD ARG 20 12.926 -21.372 1.769 80 2HD ARG 20 2HD ARG 20 14.497 -20.752 2.276 81 HE ARG 20 HE ARG 20 12.421 -19.947 4.051 82 1HH1 ARG 20 1HH1 ARG 20 14.482 -22.618 3.191 83 2HH1 ARG 20 2HH1 ARG 20 14.430 -23.336 4.767 84 1HH2 ARG 20 1HH2 ARG 20 12.344 -20.883 6.130 85 2HH2 ARG 20 2HH2 ARG 20 13.212 -22.348 6.438 86 H LEU 21 H LEU 21 14.883 -15.300 1.234 87 HA LEU 21 HA LEU 21 13.367 -15.190 -1.158 88 1HB LEU 21 1HB LEU 21 14.527 -13.296 0.748 89 2HB LEU 21 2HB LEU 21 14.445 -12.689 -0.905 90 HG LEU 21 HG LEU 21 12.056 -12.972 -0.947 91 1HD1 LEU 21 1HD1 LEU 21 11.115 -14.574 0.262 92 2HD1 LEU 21 2HD1 LEU 21 11.362 -13.577 1.696 93 3HD1 LEU 21 3HD1 LEU 21 12.576 -14.770 1.231 94 1HD2 LEU 21 1HD2 LEU 21 12.746 -10.882 -0.052 95 2HD2 LEU 21 2HD2 LEU 21 13.091 -11.596 1.524 96 3HD2 LEU 21 3HD2 LEU 21 11.424 -11.463 0.961 97 H GLN 22 H GLN 22 16.739 -14.254 -0.470 98 HA GLN 22 HA GLN 22 17.423 -13.672 -3.135 99 1HB GLN 22 1HB GLN 22 18.708 -13.649 -0.620 100 2HB GLN 22 2HB GLN 22 19.700 -14.645 -1.678 101 1HG GLN 22 1HG GLN 22 20.312 -12.230 -1.624 102 2HG GLN 22 2HG GLN 22 19.975 -12.875 -3.230 103 1HE2 GLN 22 1HE2 GLN 22 18.194 -11.398 -0.535 104 2HE2 GLN 22 2HE2 GLN 22 17.254 -10.333 -1.517 105 H SER 23 H SER 23 16.894 -16.639 -1.562 106 HA SER 23 HA SER 23 18.599 -18.202 -3.301 107 1HB SER 23 1HB SER 23 16.937 -18.703 -0.919 108 2HB SER 23 2HB SER 23 16.969 -20.026 -2.085 109 HG SER 23 HG SER 23 18.776 -19.506 -0.299 110 H GLN 24 H GLN 24 15.317 -17.111 -3.207 111 HA GLN 24 HA GLN 24 14.521 -18.971 -5.318 112 1HB GLN 24 1HB GLN 24 12.255 -18.135 -4.950 113 2HB GLN 24 2HB GLN 24 12.977 -18.668 -3.438 114 1HG GLN 24 1HG GLN 24 13.307 -16.455 -2.698 115 2HG GLN 24 2HG GLN 24 12.976 -15.794 -4.298 116 1HE2 GLN 24 1HE2 GLN 24 11.646 -14.710 -2.276 117 2HE2 GLN 24 2HE2 GLN 24 9.992 -15.209 -2.264 118 H LYS 25 H LYS 25 13.585 -18.223 -7.284 119 HA LYS 25 HA LYS 25 14.922 -15.905 -8.342 120 1HB LYS 25 1HB LYS 25 14.037 -18.279 -9.418 121 2HB LYS 25 2HB LYS 25 12.855 -17.126 -10.023 122 1HG LYS 25 1HG LYS 25 15.521 -16.081 -10.300 123 2HG LYS 25 2HG LYS 25 15.383 -17.667 -11.063 124 1HD LYS 25 1HD LYS 25 13.473 -16.909 -12.355 125 2HD LYS 25 2HD LYS 25 13.517 -15.343 -11.542 126 1HE LYS 25 1HE LYS 25 16.027 -15.416 -12.451 127 2HE LYS 25 2HE LYS 25 15.267 -16.439 -13.668 128 1HZ LYS 25 1HZ LYS 25 14.628 -14.584 -14.668 129 2HZ LYS 25 2HZ LYS 25 15.159 -13.620 -13.385 130 3HZ LYS 25 3HZ LYS 25 13.597 -14.268 -13.364 131 H GLY 26 H GLY 26 14.070 -13.948 -8.850 132 1HA GLY 26 1HA GLY 26 11.999 -12.732 -9.526 133 2HA GLY 26 2HA GLY 26 11.222 -13.540 -8.172 134 H VAL 27 H VAL 27 13.229 -13.258 -6.243 135 HA VAL 27 HA VAL 27 12.663 -10.709 -5.225 136 HB VAL 27 HB VAL 27 14.919 -12.575 -4.477 137 1HG1 VAL 27 1HG1 VAL 27 15.635 -10.987 -3.103 138 2HG1 VAL 27 2HG1 VAL 27 14.345 -9.908 -3.636 139 3HG1 VAL 27 3HG1 VAL 27 14.073 -11.012 -2.287 140 1HG2 VAL 27 1HG2 VAL 27 12.219 -12.212 -3.185 141 2HG2 VAL 27 2HG2 VAL 27 12.630 -13.525 -4.288 142 3HG2 VAL 27 3HG2 VAL 27 13.462 -13.381 -2.740 143 H GLN 28 H GLN 28 13.451 -8.784 -5.739 144 HA GLN 28 HA GLN 28 15.801 -8.587 -7.432 145 1HB GLN 28 1HB GLN 28 13.452 -6.974 -6.906 146 2HB GLN 28 2HB GLN 28 14.918 -6.006 -6.827 147 1HG GLN 28 1HG GLN 28 15.485 -6.469 -9.043 148 2HG GLN 28 2HG GLN 28 14.382 -7.841 -9.131 149 1HE2 GLN 28 1HE2 GLN 28 12.614 -7.484 -10.245 150 2HE2 GLN 28 2HE2 GLN 28 11.832 -5.959 -10.465 151 H GLY 29 H GLY 29 14.831 -7.894 -4.146 152 1HA GLY 29 1HA GLY 29 17.305 -7.967 -2.995 153 2HA GLY 29 2HA GLY 29 17.143 -6.300 -3.528 154 H ILE 30 H ILE 30 17.262 -7.588 -0.815 155 HA ILE 30 HA ILE 30 14.743 -6.483 0.246 156 HB ILE 30 HB ILE 30 16.470 -8.609 1.517 157 1HG1 ILE 30 1HG1 ILE 30 13.778 -9.416 0.855 158 2HG1 ILE 30 2HG1 ILE 30 14.617 -8.850 -0.584 159 1HG2 ILE 30 1HG2 ILE 30 15.367 -7.319 3.199 160 2HG2 ILE 30 2HG2 ILE 30 13.839 -7.386 2.322 161 3HG2 ILE 30 3HG2 ILE 30 14.507 -8.850 3.042 162 1HD1 ILE 30 1HD1 ILE 30 16.497 -10.447 0.569 163 2HD1 ILE 30 2HD1 ILE 30 14.998 -11.280 0.980 164 3HD1 ILE 30 3HD1 ILE 30 15.383 -10.937 -0.707 165 H ILE 31 H ILE 31 14.931 -4.715 1.444 166 HA ILE 31 HA ILE 31 17.572 -4.063 2.574 167 HB ILE 31 HB ILE 31 15.321 -2.180 1.858 168 1HG1 ILE 31 1HG1 ILE 31 17.880 -1.862 0.486 169 2HG1 ILE 31 2HG1 ILE 31 17.128 -3.420 0.164 170 1HG2 ILE 31 1HG2 ILE 31 18.055 -1.722 3.020 171 2HG2 ILE 31 2HG2 ILE 31 17.126 -0.448 2.232 172 3HG2 ILE 31 3HG2 ILE 31 16.493 -1.236 3.677 173 1HD1 ILE 31 1HD1 ILE 31 15.583 -0.872 -0.097 174 2HD1 ILE 31 2HD1 ILE 31 16.606 -1.471 -1.403 175 3HD1 ILE 31 3HD1 ILE 31 15.260 -2.448 -0.819 176 H VAL 32 H VAL 32 17.745 -3.360 4.688 177 HA VAL 32 HA VAL 32 15.307 -3.491 6.331 178 HB VAL 32 HB VAL 32 17.964 -4.579 7.248 179 1HG1 VAL 32 1HG1 VAL 32 16.457 -3.887 9.022 180 2HG1 VAL 32 2HG1 VAL 32 15.160 -4.861 8.325 181 3HG1 VAL 32 3HG1 VAL 32 16.595 -5.645 8.987 182 1HG2 VAL 32 1HG2 VAL 32 17.064 -6.818 6.857 183 2HG2 VAL 32 2HG2 VAL 32 15.617 -6.116 6.135 184 3HG2 VAL 32 3HG2 VAL 32 17.182 -5.908 5.351 185 H VAL 33 H VAL 33 15.044 -1.423 6.922 186 HA VAL 33 HA VAL 33 17.391 0.079 7.868 187 HB VAL 33 HB VAL 33 14.702 1.273 7.230 188 1HG1 VAL 33 1HG1 VAL 33 16.430 3.202 6.692 189 2HG1 VAL 33 2HG1 VAL 33 15.858 2.903 8.335 190 3HG1 VAL 33 3HG1 VAL 33 17.431 2.291 7.822 191 1HG2 VAL 33 1HG2 VAL 33 17.029 0.876 5.351 192 2HG2 VAL 33 2HG2 VAL 33 15.449 0.103 5.234 193 3HG2 VAL 33 3HG2 VAL 33 15.596 1.846 5.011 194 H ASN 34 H ASN 34 17.161 1.411 9.764 195 HA ASN 34 HA ASN 34 15.351 0.199 11.731 196 1HB ASN 34 1HB ASN 34 17.590 2.034 12.493 197 2HB ASN 34 2HB ASN 34 16.907 0.676 13.383 198 1HD2 ASN 34 1HD2 ASN 34 19.686 1.416 12.545 199 2HD2 ASN 34 2HD2 ASN 34 20.294 0.001 11.761 200 H THR 35 H THR 35 15.268 2.106 13.664 201 HA THR 35 HA THR 35 13.359 3.953 12.581 202 HB THR 35 HB THR 35 13.892 4.774 15.189 203 HG1 THR 35 HG1 THR 35 14.917 3.115 16.024 204 1HG2 THR 35 1HG2 THR 35 11.873 2.824 14.082 205 2HG2 THR 35 2HG2 THR 35 11.675 4.562 14.306 206 3HG2 THR 35 3HG2 THR 35 11.796 3.500 15.708 207 H GLU 36 H GLU 36 16.724 4.040 13.351 208 HA GLU 36 HA GLU 36 16.893 6.908 13.546 209 1HB GLU 36 1HB GLU 36 18.804 4.634 13.652 210 2HB GLU 36 2HB GLU 36 19.447 6.200 13.178 211 1HG GLU 36 1HG GLU 36 17.981 6.865 15.364 212 2HG GLU 36 2HG GLU 36 18.534 5.247 15.789 213 H GLY 37 H GLY 37 17.422 4.459 11.077 214 1HA GLY 37 1HA GLY 37 16.888 5.236 8.778 215 2HA GLY 37 2HA GLY 37 17.887 6.638 9.134 216 H ILE 38 H ILE 38 18.977 3.632 10.376 217 HA ILE 38 HA ILE 38 21.109 3.604 8.352 218 HB ILE 38 HB ILE 38 21.130 2.218 11.032 219 1HG1 ILE 38 1HG1 ILE 38 22.292 4.905 10.265 220 2HG1 ILE 38 2HG1 ILE 38 20.930 4.643 11.349 221 1HG2 ILE 38 1HG2 ILE 38 22.785 2.004 8.781 222 2HG2 ILE 38 2HG2 ILE 38 23.690 2.948 9.962 223 3HG2 ILE 38 3HG2 ILE 38 23.073 1.354 10.394 224 1HD1 ILE 38 1HD1 ILE 38 23.758 4.587 11.893 225 2HD1 ILE 38 2HD1 ILE 38 22.393 4.648 13.009 226 3HD1 ILE 38 3HD1 ILE 38 22.972 3.095 12.408 227 HA PRO 39 HA PRO 39 19.069 -0.076 6.819 228 1HB PRO 39 1HB PRO 39 20.747 -0.424 4.713 229 2HB PRO 39 2HB PRO 39 19.441 0.767 4.714 230 1HG PRO 39 1HG PRO 39 22.362 1.157 5.243 231 2HG PRO 39 2HG PRO 39 21.256 2.155 4.281 232 1HD PRO 39 1HD PRO 39 21.983 2.807 6.807 233 2HD PRO 39 2HD PRO 39 20.388 3.206 6.139 234 H ILE 40 H ILE 40 19.813 -1.237 8.749 235 HA ILE 40 HA ILE 40 22.320 -2.276 9.203 236 HB ILE 40 HB ILE 40 21.064 -4.268 10.234 237 1HG1 ILE 40 1HG1 ILE 40 18.684 -2.480 9.714 238 2HG1 ILE 40 2HG1 ILE 40 19.042 -3.917 8.762 239 1HG2 ILE 40 1HG2 ILE 40 21.284 -1.505 11.027 240 2HG2 ILE 40 2HG2 ILE 40 19.871 -2.264 11.760 241 3HG2 ILE 40 3HG2 ILE 40 21.470 -2.970 11.992 242 1HD1 ILE 40 1HD1 ILE 40 17.467 -3.829 10.989 243 2HD1 ILE 40 2HD1 ILE 40 18.212 -5.278 10.314 244 3HD1 ILE 40 3HD1 ILE 40 19.002 -4.412 11.631 245 H LYS 41 H LYS 41 19.838 -3.431 6.993 246 HA LYS 41 HA LYS 41 21.817 -5.288 5.855 247 1HB LYS 41 1HB LYS 41 19.377 -5.986 7.109 248 2HB LYS 41 2HB LYS 41 19.152 -6.240 5.384 249 1HG LYS 41 1HG LYS 41 21.422 -7.377 7.001 250 2HG LYS 41 2HG LYS 41 19.946 -8.247 6.576 251 1HD LYS 41 1HD LYS 41 20.496 -7.796 4.166 252 2HD LYS 41 2HD LYS 41 22.060 -7.183 4.709 253 1HE LYS 41 1HE LYS 41 21.294 -9.829 5.752 254 2HE LYS 41 2HE LYS 41 21.591 -9.754 4.015 255 1HZ LYS 41 1HZ LYS 41 23.620 -10.284 5.136 256 2HZ LYS 41 2HZ LYS 41 23.469 -8.955 6.171 257 3HZ LYS 41 3HZ LYS 41 23.754 -8.714 4.521 258 H SER 42 H SER 42 21.906 -5.401 3.647 259 HA SER 42 HA SER 42 19.879 -4.219 1.983 260 1HB SER 42 1HB SER 42 21.496 -2.575 0.939 261 2HB SER 42 2HB SER 42 20.956 -2.163 2.566 262 HG SER 42 HG SER 42 23.439 -3.271 1.777 263 H THR 43 H THR 43 19.742 -5.902 0.631 264 HA THR 43 HA THR 43 22.121 -7.286 -0.285 265 HB THR 43 HB THR 43 20.685 -8.895 -1.261 266 HG1 THR 43 HG1 THR 43 19.199 -7.621 -2.335 267 1HG2 THR 43 1HG2 THR 43 20.618 -8.434 1.368 268 2HG2 THR 43 2HG2 THR 43 19.680 -9.721 0.611 269 3HG2 THR 43 3HG2 THR 43 18.911 -8.185 1.008 270 H MET 44 H MET 44 20.567 -4.525 -1.191 271 HA MET 44 HA MET 44 20.968 -4.907 -4.063 272 1HB MET 44 1HB MET 44 19.072 -3.494 -2.567 273 2HB MET 44 2HB MET 44 20.089 -2.257 -3.295 274 1HG MET 44 1HG MET 44 19.653 -3.117 -5.493 275 2HG MET 44 2HG MET 44 18.768 -4.485 -4.823 276 1HE MET 44 1HE MET 44 15.832 -4.041 -4.042 277 2HE MET 44 2HE MET 44 17.139 -3.903 -2.867 278 3HE MET 44 3HE MET 44 15.908 -2.643 -2.969 279 H ASP 45 H ASP 45 21.571 -2.370 -4.886 280 HA ASP 45 HA ASP 45 24.374 -2.260 -4.430 281 1HB ASP 45 1HB ASP 45 22.553 -1.200 -6.310 282 2HB ASP 45 2HB ASP 45 23.376 0.179 -5.585 283 H ASN 46 H ASN 46 25.595 -0.518 -3.538 284 HA ASN 46 HA ASN 46 24.772 0.312 -1.010 285 1HB ASN 46 1HB ASN 46 27.118 0.462 -2.531 286 2HB ASN 46 2HB ASN 46 26.721 2.134 -2.142 287 1HD2 ASN 46 1HD2 ASN 46 25.529 1.786 0.331 288 2HD2 ASN 46 2HD2 ASN 46 26.724 1.250 1.459 289 HA PRO 47 HA PRO 47 23.884 4.673 -2.904 290 1HB PRO 47 1HB PRO 47 23.766 4.843 -5.611 291 2HB PRO 47 2HB PRO 47 25.261 5.079 -4.698 292 1HG PRO 47 1HG PRO 47 24.296 2.649 -6.156 293 2HG PRO 47 2HG PRO 47 25.920 3.359 -6.117 294 1HD PRO 47 1HD PRO 47 25.235 1.207 -4.624 295 2HD PRO 47 2HD PRO 47 26.424 2.407 -4.079 296 H THR 48 H THR 48 22.640 1.778 -4.408 297 HA THR 48 HA THR 48 20.120 2.921 -5.170 298 HB THR 48 HB THR 48 20.987 0.034 -4.934 299 HG1 THR 48 HG1 THR 48 20.999 0.244 -7.261 300 1HG2 THR 48 1HG2 THR 48 18.973 -0.404 -6.360 301 2HG2 THR 48 2HG2 THR 48 18.454 1.250 -6.032 302 3HG2 THR 48 3HG2 THR 48 18.603 0.093 -4.710 303 H THR 49 H THR 49 21.352 1.094 -2.427 304 HA THR 49 HA THR 49 18.761 0.763 -1.218 305 HB THR 49 HB THR 49 21.544 0.302 -0.133 306 HG1 THR 49 HG1 THR 49 20.941 -1.203 -1.705 307 1HG2 THR 49 1HG2 THR 49 19.013 0.475 1.244 308 2HG2 THR 49 2HG2 THR 49 20.633 0.245 1.903 309 3HG2 THR 49 3HG2 THR 49 19.690 -1.148 1.375 310 H THR 50 H THR 50 21.543 2.895 -0.773 311 HA THR 50 HA THR 50 20.802 4.168 1.577 312 HB THR 50 HB THR 50 22.168 5.465 -0.789 313 HG1 THR 50 HG1 THR 50 23.003 3.395 0.412 314 1HG2 THR 50 1HG2 THR 50 22.076 6.150 2.148 315 2HG2 THR 50 2HG2 THR 50 21.512 7.133 0.796 316 3HG2 THR 50 3HG2 THR 50 23.237 6.842 1.017 317 H GLN 51 H GLN 51 19.782 4.804 -1.743 318 HA GLN 51 HA GLN 51 18.298 7.157 -1.104 319 1HB GLN 51 1HB GLN 51 19.130 6.808 -3.358 320 2HB GLN 51 2HB GLN 51 18.190 5.329 -3.508 321 1HG GLN 51 1HG GLN 51 16.484 7.530 -2.809 322 2HG GLN 51 2HG GLN 51 17.436 7.914 -4.242 323 1HE2 GLN 51 1HE2 GLN 51 15.135 5.678 -2.849 324 2HE2 GLN 51 2HE2 GLN 51 14.557 5.039 -4.346 325 H TYR 52 H TYR 52 17.329 3.821 -1.896 326 HA TYR 52 HA TYR 52 14.589 4.118 -1.571 327 1HB TYR 52 1HB TYR 52 16.457 1.792 -1.290 328 2HB TYR 52 2HB TYR 52 14.761 1.602 -0.860 329 HD1 TYR 52 HD1 TYR 52 13.588 0.502 -2.506 330 HD2 TYR 52 HD2 TYR 52 16.568 3.312 -3.656 331 HE1 TYR 52 HE1 TYR 52 13.027 0.120 -4.870 332 HE2 TYR 52 HE2 TYR 52 16.015 2.939 -6.024 333 HH TYR 52 HH TYR 52 14.975 1.073 -7.398 334 H ALA 53 H ALA 53 16.984 3.068 0.847 335 HA ALA 53 HA ALA 53 15.207 2.803 2.995 336 1HB ALA 53 1HB ALA 53 17.259 1.818 3.371 337 2HB ALA 53 2HB ALA 53 18.158 3.217 2.784 338 3HB ALA 53 3HB ALA 53 17.371 3.273 4.361 339 H SER 54 H SER 54 16.409 5.598 1.436 340 HA SER 54 HA SER 54 16.169 7.390 3.661 341 1HB SER 54 1HB SER 54 17.456 7.566 1.290 342 2HB SER 54 2HB SER 54 15.999 8.484 0.913 343 HG SER 54 HG SER 54 17.880 9.636 1.890 344 H LEU 55 H LEU 55 14.228 6.789 0.738 345 HA LEU 55 HA LEU 55 12.089 8.475 1.715 346 1HB LEU 55 1HB LEU 55 11.177 8.330 -0.376 347 2HB LEU 55 2HB LEU 55 12.881 8.068 -0.741 348 HG LEU 55 HG LEU 55 12.139 5.524 -0.474 349 1HD1 LEU 55 1HD1 LEU 55 9.682 6.870 -0.330 350 2HD1 LEU 55 2HD1 LEU 55 9.957 5.136 -0.497 351 3HD1 LEU 55 3HD1 LEU 55 9.751 6.139 -1.934 352 1HD2 LEU 55 1HD2 LEU 55 12.513 5.403 -2.692 353 2HD2 LEU 55 2HD2 LEU 55 12.944 7.103 -2.507 354 3HD2 LEU 55 3HD2 LEU 55 11.332 6.658 -3.069 355 H MET 56 H MET 56 13.053 5.333 2.250 356 HA MET 56 HA MET 56 10.609 3.930 2.250 357 1HB MET 56 1HB MET 56 13.308 3.392 2.910 358 2HB MET 56 2HB MET 56 12.345 2.958 4.316 359 1HG MET 56 1HG MET 56 12.641 1.051 2.862 360 2HG MET 56 2HG MET 56 10.946 1.527 2.924 361 1HE MET 56 1HE MET 56 9.605 1.696 1.364 362 2HE MET 56 2HE MET 56 9.854 3.009 0.213 363 3HE MET 56 3HE MET 56 9.887 1.333 -0.339 364 H HIS 57 H HIS 57 12.438 5.064 5.098 365 HA HIS 57 HA HIS 57 10.397 4.725 6.952 366 1HB HIS 57 1HB HIS 57 12.641 5.092 7.712 367 2HB HIS 57 2HB HIS 57 12.713 6.664 6.922 368 HD1 HIS 57 HD1 HIS 57 13.066 8.113 8.946 369 HD2 HIS 57 HD2 HIS 57 9.795 5.581 9.335 370 HE1 HIS 57 HE1 HIS 57 11.887 8.854 11.041 371 H SER 58 H SER 58 10.987 7.327 4.702 372 HA SER 58 HA SER 58 9.154 9.165 5.914 373 1HB SER 58 1HB SER 58 11.155 9.633 4.291 374 2HB SER 58 2HB SER 58 9.962 9.325 3.029 375 HG SER 58 HG SER 58 9.133 11.212 3.407 376 H PHE 59 H PHE 59 8.895 6.517 3.729 377 HA PHE 59 HA PHE 59 6.544 7.229 2.359 378 1HB PHE 59 1HB PHE 59 8.024 5.366 1.681 379 2HB PHE 59 2HB PHE 59 7.511 4.460 3.101 380 HD1 PHE 59 HD1 PHE 59 5.499 6.504 0.737 381 HD2 PHE 59 HD2 PHE 59 6.361 2.630 2.273 382 HE1 PHE 59 HE1 PHE 59 3.610 5.581 -0.541 383 HE2 PHE 59 HE2 PHE 59 4.474 1.700 0.997 384 HZ PHE 59 HZ PHE 59 3.096 3.176 -0.413 385 H ILE 60 H ILE 60 6.942 5.072 5.173 386 HA ILE 60 HA ILE 60 4.173 4.810 5.670 387 HB ILE 60 HB ILE 60 6.510 4.408 7.540 388 1HG1 ILE 60 1HG1 ILE 60 5.238 1.984 6.791 389 2HG1 ILE 60 2HG1 ILE 60 5.510 2.905 5.316 390 1HG2 ILE 60 1HG2 ILE 60 4.550 4.733 8.864 391 2HG2 ILE 60 2HG2 ILE 60 3.605 3.667 7.825 392 3HG2 ILE 60 3HG2 ILE 60 4.894 3.004 8.829 393 1HD1 ILE 60 1HD1 ILE 60 7.327 1.280 6.566 394 2HD1 ILE 60 2HD1 ILE 60 7.698 2.518 5.365 395 3HD1 ILE 60 3HD1 ILE 60 7.816 2.893 7.084 396 H LEU 61 H LEU 61 6.554 7.160 6.651 397 HA LEU 61 HA LEU 61 5.205 8.296 8.834 398 1HB LEU 61 1HB LEU 61 7.559 8.778 7.404 399 2HB LEU 61 2HB LEU 61 6.630 10.272 7.293 400 HG LEU 61 HG LEU 61 6.546 10.431 9.714 401 1HD1 LEU 61 1HD1 LEU 61 8.226 8.729 10.862 402 2HD1 LEU 61 2HD1 LEU 61 7.680 7.697 9.541 403 3HD1 LEU 61 3HD1 LEU 61 6.509 8.371 10.674 404 1HD2 LEU 61 1HD2 LEU 61 9.039 10.355 8.190 405 2HD2 LEU 61 2HD2 LEU 61 9.262 10.203 9.934 406 3HD2 LEU 61 3HD2 LEU 61 8.405 11.596 9.271 407 H LYS 62 H LYS 62 4.954 8.862 5.370 408 HA LYS 62 HA LYS 62 3.186 11.108 5.638 409 1HB LYS 62 1HB LYS 62 4.761 10.176 3.619 410 2HB LYS 62 2HB LYS 62 3.177 9.627 3.090 411 1HG LYS 62 1HG LYS 62 3.381 11.704 2.093 412 2HG LYS 62 2HG LYS 62 2.424 12.046 3.536 413 1HD LYS 62 1HD LYS 62 3.935 13.593 4.068 414 2HD LYS 62 2HD LYS 62 5.082 12.282 4.352 415 1HE LYS 62 1HE LYS 62 6.268 13.471 2.815 416 2HE LYS 62 2HE LYS 62 5.343 12.446 1.719 417 1HZ LYS 62 1HZ LYS 62 5.154 14.625 0.900 418 2HZ LYS 62 2HZ LYS 62 4.831 15.275 2.427 419 3HZ LYS 62 3HZ LYS 62 3.674 14.310 1.657 420 H ALA 63 H ALA 63 2.761 7.746 4.532 421 HA ALA 63 HA ALA 63 -0.020 7.854 4.211 422 1HB ALA 63 1HB ALA 63 1.588 6.062 3.401 423 2HB ALA 63 2HB ALA 63 1.477 5.379 5.024 424 3HB ALA 63 3HB ALA 63 0.032 5.510 4.021 425 H ARG 64 H ARG 64 1.948 7.526 7.049 426 HA ARG 64 HA ARG 64 0.081 6.355 8.790 427 1HB ARG 64 1HB ARG 64 2.351 6.442 9.486 428 2HB ARG 64 2HB ARG 64 2.428 8.184 9.264 429 1HG ARG 64 1HG ARG 64 1.678 8.581 11.321 430 2HG ARG 64 2HG ARG 64 0.381 7.394 11.166 431 1HD ARG 64 1HD ARG 64 1.613 6.403 12.812 432 2HD ARG 64 2HD ARG 64 2.386 5.693 11.395 433 HE ARG 64 HE ARG 64 3.735 8.055 12.016 434 1HH1 ARG 64 1HH1 ARG 64 3.169 4.907 13.392 435 2HH1 ARG 64 2HH1 ARG 64 4.671 4.871 14.255 436 1HH2 ARG 64 1HH2 ARG 64 5.715 8.019 13.148 437 2HH2 ARG 64 2HH2 ARG 64 6.118 6.642 14.116 438 H SER 65 H SER 65 0.946 9.796 8.409 439 HA SER 65 HA SER 65 -0.917 10.885 10.129 440 1HB SER 65 1HB SER 65 0.967 11.927 8.489 441 2HB SER 65 2HB SER 65 -0.492 12.382 7.609 442 HG SER 65 HG SER 65 -0.373 12.829 10.373 443 H THR 66 H THR 66 -1.366 9.614 6.915 444 HA THR 66 HA THR 66 -3.978 10.738 6.532 445 HB THR 66 HB THR 66 -3.532 8.378 4.935 446 HG1 THR 66 HG1 THR 66 -1.632 9.537 3.859 447 1HG2 THR 66 1HG2 THR 66 -4.898 10.518 4.501 448 2HG2 THR 66 2HG2 THR 66 -4.002 9.820 3.152 449 3HG2 THR 66 3HG2 THR 66 -3.363 11.227 4.002 450 H VAL 67 H VAL 67 -2.700 7.589 7.524 451 HA VAL 67 HA VAL 67 -5.014 6.089 7.570 452 HB VAL 67 HB VAL 67 -2.756 5.997 9.575 453 1HG1 VAL 67 1HG1 VAL 67 -4.208 4.628 10.633 454 2HG1 VAL 67 2HG1 VAL 67 -5.166 4.342 9.179 455 3HG1 VAL 67 3HG1 VAL 67 -3.654 3.467 9.427 456 1HG2 VAL 67 1HG2 VAL 67 -2.595 3.866 7.764 457 2HG2 VAL 67 2HG2 VAL 67 -2.907 5.302 6.790 458 3HG2 VAL 67 3HG2 VAL 67 -1.521 5.259 7.879 459 H ARG 68 H ARG 68 -3.747 8.223 10.112 460 HA ARG 68 HA ARG 68 -5.601 7.739 12.099 461 1HB ARG 68 1HB ARG 68 -3.925 10.080 11.341 462 2HB ARG 68 2HB ARG 68 -5.207 10.343 12.516 463 1HG ARG 68 1HG ARG 68 -3.455 9.845 13.894 464 2HG ARG 68 2HG ARG 68 -4.162 8.242 13.674 465 1HD ARG 68 1HD ARG 68 -2.019 7.696 13.197 466 2HD ARG 68 2HD ARG 68 -2.479 8.265 11.593 467 HE ARG 68 HE ARG 68 -0.966 9.946 11.839 468 1HH1 ARG 68 1HH1 ARG 68 -1.888 8.829 15.004 469 2HH1 ARG 68 2HH1 ARG 68 -0.775 9.864 15.837 470 1HH2 ARG 68 1HH2 ARG 68 0.503 11.313 12.923 471 2HH2 ARG 68 2HH2 ARG 68 0.584 11.277 14.651 472 H ASP 69 H ASP 69 -5.954 9.567 9.151 473 HA ASP 69 HA ASP 69 -8.377 10.886 9.893 474 1HB ASP 69 1HB ASP 69 -6.608 11.356 7.949 475 2HB ASP 69 2HB ASP 69 -7.751 10.386 7.026 476 H ILE 70 H ILE 70 -7.569 7.874 8.279 477 HA ILE 70 HA ILE 70 -10.105 7.236 7.268 478 HB ILE 70 HB ILE 70 -8.016 5.295 8.261 479 1HG1 ILE 70 1HG1 ILE 70 -8.381 6.477 5.499 480 2HG1 ILE 70 2HG1 ILE 70 -7.114 6.933 6.633 481 1HG2 ILE 70 1HG2 ILE 70 -9.034 3.699 6.789 482 2HG2 ILE 70 2HG2 ILE 70 -10.284 4.368 7.837 483 3HG2 ILE 70 3HG2 ILE 70 -10.149 4.915 6.166 484 1HD1 ILE 70 1HD1 ILE 70 -7.345 4.578 4.900 485 2HD1 ILE 70 2HD1 ILE 70 -5.916 5.430 5.483 486 3HD1 ILE 70 3HD1 ILE 70 -6.736 4.268 6.525 487 H ASP 71 H ASP 71 -8.595 6.465 10.386 488 HA ASP 71 HA ASP 71 -11.235 6.207 11.577 489 1HB ASP 71 1HB ASP 71 -9.479 3.931 11.024 490 2HB ASP 71 2HB ASP 71 -9.962 4.042 12.714 491 HA PRO 72 HA PRO 72 -9.345 8.037 15.085 492 1HB PRO 72 1HB PRO 72 -10.648 6.841 17.144 493 2HB PRO 72 2HB PRO 72 -11.414 8.031 16.085 494 1HG PRO 72 1HG PRO 72 -11.585 5.043 16.013 495 2HG PRO 72 2HG PRO 72 -12.875 6.243 15.809 496 1HD PRO 72 1HD PRO 72 -11.711 4.984 13.713 497 2HD PRO 72 2HD PRO 72 -12.322 6.648 13.608 498 H GLN 73 H GLN 73 -9.756 4.526 15.577 499 HA GLN 73 HA GLN 73 -7.058 4.472 16.759 500 1HB GLN 73 1HB GLN 73 -9.392 2.651 17.367 501 2HB GLN 73 2HB GLN 73 -7.786 2.525 18.072 502 1HG GLN 73 1HG GLN 73 -8.103 4.813 19.012 503 2HG GLN 73 2HG GLN 73 -9.771 4.753 18.444 504 1HE2 GLN 73 1HE2 GLN 73 -9.855 5.160 20.903 505 2HE2 GLN 73 2HE2 GLN 73 -10.071 3.749 21.877 506 H ASN 74 H ASN 74 -5.711 3.736 15.243 507 HA ASN 74 HA ASN 74 -6.241 1.131 14.064 508 1HB ASN 74 1HB ASN 74 -5.373 2.190 11.812 509 2HB ASN 74 2HB ASN 74 -7.081 2.264 12.236 510 1HD2 ASN 74 1HD2 ASN 74 -7.539 4.095 11.103 511 2HD2 ASN 74 2HD2 ASN 74 -6.916 5.653 11.517 512 H ASP 75 H ASP 75 -4.253 0.476 12.678 513 HA ASP 75 HA ASP 75 -1.750 1.671 13.461 514 1HB ASP 75 1HB ASP 75 -2.832 -0.420 15.056 515 2HB ASP 75 2HB ASP 75 -1.462 -1.081 14.169 516 H LEU 76 H LEU 76 -0.422 1.515 11.784 517 HA LEU 76 HA LEU 76 -1.072 0.037 9.469 518 1HB LEU 76 1HB LEU 76 1.327 1.582 10.365 519 2HB LEU 76 2HB LEU 76 1.390 0.628 8.884 520 HG LEU 76 HG LEU 76 0.928 2.946 8.370 521 1HD1 LEU 76 1HD1 LEU 76 -0.435 2.348 6.719 522 2HD1 LEU 76 2HD1 LEU 76 -1.757 2.006 7.834 523 3HD1 LEU 76 3HD1 LEU 76 -0.546 0.769 7.497 524 1HD2 LEU 76 1HD2 LEU 76 -1.729 2.888 9.682 525 2HD2 LEU 76 2HD2 LEU 76 -0.644 4.244 9.373 526 3HD2 LEU 76 3HD2 LEU 76 -0.321 3.141 10.712 527 H THR 77 H THR 77 -0.764 -2.036 9.031 528 HA THR 77 HA THR 77 1.308 -3.499 10.535 529 HB THR 77 HB THR 77 -0.023 -5.468 10.485 530 HG1 THR 77 HG1 THR 77 -2.206 -5.228 9.415 531 1HG2 THR 77 1HG2 THR 77 -1.435 -4.828 12.106 532 2HG2 THR 77 2HG2 THR 77 -2.314 -3.743 11.028 533 3HG2 THR 77 3HG2 THR 77 -0.832 -3.197 11.812 534 H PHE 78 H PHE 78 0.035 -2.682 7.439 535 HA PHE 78 HA PHE 78 2.300 -3.940 6.148 536 1HB PHE 78 1HB PHE 78 -0.267 -5.208 6.152 537 2HB PHE 78 2HB PHE 78 0.092 -4.663 4.517 538 HD1 PHE 78 HD1 PHE 78 0.333 -7.356 6.634 539 HD2 PHE 78 HD2 PHE 78 2.687 -5.138 3.867 540 HE1 PHE 78 HE1 PHE 78 1.790 -9.313 6.309 541 HE2 PHE 78 HE2 PHE 78 4.146 -7.091 3.537 542 HZ PHE 78 HZ PHE 78 3.698 -9.182 4.758 543 H LEU 79 H LEU 79 2.666 -3.172 4.006 544 HA LEU 79 HA LEU 79 0.929 -1.180 2.869 545 1HB LEU 79 1HB LEU 79 2.469 -0.148 4.748 546 2HB LEU 79 2HB LEU 79 3.670 -0.179 3.459 547 HG LEU 79 HG LEU 79 2.081 1.177 2.070 548 1HD1 LEU 79 1HD1 LEU 79 0.242 2.292 3.120 549 2HD1 LEU 79 2HD1 LEU 79 0.638 1.579 4.683 550 3HD1 LEU 79 3HD1 LEU 79 0.052 0.556 3.372 551 1HD2 LEU 79 1HD2 LEU 79 3.986 1.987 3.721 552 2HD2 LEU 79 2HD2 LEU 79 2.616 2.734 4.543 553 3HD2 LEU 79 3HD2 LEU 79 2.956 3.129 2.857 554 H ARG 80 H ARG 80 0.928 -2.173 0.925 555 HA ARG 80 HA ARG 80 3.532 -2.678 -0.355 556 1HB ARG 80 1HB ARG 80 0.891 -3.835 -1.230 557 2HB ARG 80 2HB ARG 80 2.508 -4.366 -1.672 558 1HG ARG 80 1HG ARG 80 2.868 -5.029 0.700 559 2HG ARG 80 2HG ARG 80 1.172 -4.647 1.008 560 1HD ARG 80 1HD ARG 80 0.564 -6.275 -0.788 561 2HD ARG 80 2HD ARG 80 2.264 -6.733 -0.872 562 HE ARG 80 HE ARG 80 1.999 -7.939 1.055 563 1HH1 ARG 80 1HH1 ARG 80 -0.706 -5.781 0.676 564 2HH1 ARG 80 2HH1 ARG 80 -1.602 -6.462 1.993 565 1HH2 ARG 80 1HH2 ARG 80 0.830 -8.845 2.792 566 2HH2 ARG 80 2HH2 ARG 80 -0.727 -8.204 3.197 567 H ILE 81 H ILE 81 3.685 -2.246 -2.661 568 HA ILE 81 HA ILE 81 1.727 -0.401 -3.776 569 HB ILE 81 HB ILE 81 3.692 1.118 -4.479 570 1HG1 ILE 81 1HG1 ILE 81 4.877 -0.215 -2.035 571 2HG1 ILE 81 2HG1 ILE 81 5.489 -0.348 -3.680 572 1HG2 ILE 81 1HG2 ILE 81 2.800 2.554 -3.030 573 2HG2 ILE 81 2HG2 ILE 81 1.857 1.201 -2.407 574 3HG2 ILE 81 3HG2 ILE 81 3.388 1.633 -1.646 575 1HD1 ILE 81 1HD1 ILE 81 6.042 1.629 -1.696 576 2HD1 ILE 81 2HD1 ILE 81 6.779 1.399 -3.283 577 3HD1 ILE 81 3HD1 ILE 81 5.332 2.395 -3.117 578 H ARG 82 H ARG 82 1.303 -1.912 -5.370 579 HA ARG 82 HA ARG 82 3.246 -3.286 -6.867 580 1HB ARG 82 1HB ARG 82 0.513 -3.354 -6.696 581 2HB ARG 82 2HB ARG 82 0.754 -2.653 -8.290 582 1HG ARG 82 1HG ARG 82 1.252 -4.633 -9.144 583 2HG ARG 82 2HG ARG 82 2.507 -4.894 -7.931 584 1HD ARG 82 1HD ARG 82 -0.240 -5.200 -6.945 585 2HD ARG 82 2HD ARG 82 0.235 -6.375 -8.170 586 HE ARG 82 HE ARG 82 2.146 -6.045 -6.039 587 1HH1 ARG 82 1HH1 ARG 82 -0.687 -7.746 -7.135 588 2HH1 ARG 82 2HH1 ARG 82 -0.423 -9.115 -6.106 589 1HH2 ARG 82 1HH2 ARG 82 2.504 -7.841 -4.679 590 2HH2 ARG 82 2HH2 ARG 82 1.392 -9.167 -4.709 591 H SER 83 H SER 83 4.805 -2.258 -7.951 592 HA SER 83 HA SER 83 4.249 0.249 -9.318 593 1HB SER 83 1HB SER 83 6.911 -1.056 -9.551 594 2HB SER 83 2HB SER 83 6.506 0.638 -9.277 595 HG SER 83 HG SER 83 7.171 -1.228 -7.485 596 H LYS 84 H LYS 84 5.907 0.198 -11.462 597 HA LYS 84 HA LYS 84 4.436 -1.512 -13.292 598 1HB LYS 84 1HB LYS 84 6.475 0.670 -13.764 599 2HB LYS 84 2HB LYS 84 5.668 -0.222 -15.048 600 1HG LYS 84 1HG LYS 84 3.486 0.582 -13.981 601 2HG LYS 84 2HG LYS 84 4.497 1.729 -13.100 602 1HD LYS 84 1HD LYS 84 4.260 3.065 -14.877 603 2HD LYS 84 2HD LYS 84 5.387 1.979 -15.693 604 1HE LYS 84 1HE LYS 84 3.753 0.991 -16.927 605 2HE LYS 84 2HE LYS 84 2.535 1.184 -15.667 606 1HZ LYS 84 1HZ LYS 84 2.065 2.574 -17.589 607 2HZ LYS 84 2HZ LYS 84 3.556 3.354 -17.420 608 3HZ LYS 84 3HZ LYS 84 2.372 3.525 -16.224 609 H LYS 85 H LYS 85 7.614 -1.254 -11.898 610 HA LYS 85 HA LYS 85 8.693 -3.277 -13.706 611 1HB LYS 85 1HB LYS 85 9.895 -1.481 -11.618 612 2HB LYS 85 2HB LYS 85 10.785 -2.871 -12.228 613 1HG LYS 85 1HG LYS 85 10.144 -1.806 -14.560 614 2HG LYS 85 2HG LYS 85 10.052 -0.337 -13.585 615 1HD LYS 85 1HD LYS 85 12.263 -0.319 -14.244 616 2HD LYS 85 2HD LYS 85 12.368 -1.132 -12.681 617 1HE LYS 85 1HE LYS 85 12.405 -3.295 -13.784 618 2HE LYS 85 2HE LYS 85 12.213 -2.520 -15.356 619 1HZ LYS 85 1HZ LYS 85 14.355 -1.300 -14.751 620 2HZ LYS 85 2HZ LYS 85 14.478 -2.928 -15.194 621 3HZ LYS 85 3HZ LYS 85 14.558 -2.487 -13.563 622 H ASN 86 H ASN 86 8.164 -2.781 -10.225 623 HA ASN 86 HA ASN 86 7.495 -5.524 -9.823 624 1HB ASN 86 1HB ASN 86 9.446 -5.732 -8.062 625 2HB ASN 86 2HB ASN 86 9.719 -6.138 -9.753 626 1HD2 ASN 86 1HD2 ASN 86 10.397 -3.929 -7.190 627 2HD2 ASN 86 2HD2 ASN 86 11.621 -3.025 -8.008 628 H GLU 87 H GLU 87 6.986 -5.989 -7.542 629 HA GLU 87 HA GLU 87 5.869 -3.617 -6.279 630 1HB GLU 87 1HB GLU 87 4.710 -5.260 -4.808 631 2HB GLU 87 2HB GLU 87 4.370 -5.482 -6.518 632 1HG GLU 87 1HG GLU 87 5.221 -7.537 -6.532 633 2HG GLU 87 2HG GLU 87 6.641 -7.051 -5.608 634 H ILE 88 H ILE 88 6.198 -3.088 -4.081 635 HA ILE 88 HA ILE 88 8.553 -4.315 -2.818 636 HB ILE 88 HB ILE 88 8.024 -1.345 -2.813 637 1HG1 ILE 88 1HG1 ILE 88 10.371 -1.706 -4.186 638 2HG1 ILE 88 2HG1 ILE 88 9.406 -3.062 -4.758 639 1HG2 ILE 88 1HG2 ILE 88 9.947 -3.134 -1.491 640 2HG2 ILE 88 2HG2 ILE 88 10.638 -1.677 -2.205 641 3HG2 ILE 88 3HG2 ILE 88 9.351 -1.546 -1.006 642 1HD1 ILE 88 1HD1 ILE 88 7.700 -1.600 -5.552 643 2HD1 ILE 88 2HD1 ILE 88 8.471 -0.206 -4.795 644 3HD1 ILE 88 3HD1 ILE 88 9.251 -1.015 -6.154 645 H MET 89 H MET 89 7.494 -5.385 -1.219 646 HA MET 89 HA MET 89 5.336 -4.218 0.259 647 1HB MET 89 1HB MET 89 6.943 -6.744 0.544 648 2HB MET 89 2HB MET 89 5.773 -6.265 1.767 649 1HG MET 89 1HG MET 89 3.984 -6.663 0.416 650 2HG MET 89 2HG MET 89 4.885 -6.332 -1.062 651 1HE MET 89 1HE MET 89 5.202 -10.198 1.404 652 2HE MET 89 2HE MET 89 6.415 -8.940 1.643 653 3HE MET 89 3HE MET 89 4.718 -8.607 1.992 654 H VAL 90 H VAL 90 5.393 -3.083 2.105 655 HA VAL 90 HA VAL 90 7.784 -3.109 3.772 656 HB VAL 90 HB VAL 90 6.674 -0.562 2.585 657 1HG1 VAL 90 1HG1 VAL 90 7.358 0.374 4.495 658 2HG1 VAL 90 2HG1 VAL 90 8.220 -1.081 4.999 659 3HG1 VAL 90 3HG1 VAL 90 8.995 0.073 3.913 660 1HG2 VAL 90 1HG2 VAL 90 9.223 -2.093 2.168 661 2HG2 VAL 90 2HG2 VAL 90 8.066 -1.527 0.963 662 3HG2 VAL 90 3HG2 VAL 90 9.101 -0.372 1.802 663 H ALA 91 H ALA 91 7.350 -2.829 5.897 664 HA ALA 91 HA ALA 91 4.920 -1.557 6.794 665 1HB ALA 91 1HB ALA 91 4.553 -4.122 6.171 666 2HB ALA 91 2HB ALA 91 5.163 -4.326 7.813 667 3HB ALA 91 3HB ALA 91 3.727 -3.344 7.521 668 HA PRO 92 HA PRO 92 7.382 -0.692 10.325 669 1HB PRO 92 1HB PRO 92 5.488 -0.489 12.259 670 2HB PRO 92 2HB PRO 92 5.708 0.730 10.998 671 1HG PRO 92 1HG PRO 92 3.706 -1.490 11.156 672 2HG PRO 92 2HG PRO 92 3.471 0.195 10.658 673 1HD PRO 92 1HD PRO 92 3.720 -1.829 8.877 674 2HD PRO 92 2HD PRO 92 4.296 -0.184 8.539 675 H ASP 93 H ASP 93 8.687 -2.179 11.187 676 HA ASP 93 HA ASP 93 7.561 -4.642 12.289 677 1HB ASP 93 1HB ASP 93 9.838 -4.130 10.785 678 2HB ASP 93 2HB ASP 93 10.462 -4.394 12.411 679 H LYS 94 H LYS 94 9.466 -5.325 14.142 680 HA LYS 94 HA LYS 94 8.560 -4.212 16.486 681 1HB LYS 94 1HB LYS 94 10.624 -6.034 15.711 682 2HB LYS 94 2HB LYS 94 11.275 -4.933 16.919 683 1HG LYS 94 1HG LYS 94 9.753 -5.612 18.540 684 2HG LYS 94 2HG LYS 94 8.651 -6.307 17.349 685 1HD LYS 94 1HD LYS 94 10.825 -7.807 16.876 686 2HD LYS 94 2HD LYS 94 11.087 -7.445 18.583 687 1HE LYS 94 1HE LYS 94 9.536 -8.920 19.182 688 2HE LYS 94 2HE LYS 94 8.341 -8.147 18.142 689 1HZ LYS 94 1HZ LYS 94 9.315 -10.637 17.796 690 2HZ LYS 94 2HZ LYS 94 10.270 -9.746 16.721 691 3HZ LYS 94 3HZ LYS 94 8.584 -9.710 16.584 692 H ASP 95 H ASP 95 11.577 -3.379 14.783 693 HA ASP 95 HA ASP 95 11.350 -0.643 15.716 694 1HB ASP 95 1HB ASP 95 12.966 -2.477 17.126 695 2HB ASP 95 2HB ASP 95 14.067 -1.465 16.195 696 H TYR 96 H TYR 96 11.526 -2.396 13.207 697 HA TYR 96 HA TYR 96 13.317 -0.594 11.767 698 1HB TYR 96 1HB TYR 96 14.145 -2.635 10.446 699 2HB TYR 96 2HB TYR 96 14.816 -2.384 12.053 700 HD1 TYR 96 HD1 TYR 96 14.091 -3.820 13.935 701 HD2 TYR 96 HD2 TYR 96 12.820 -4.560 9.942 702 HE1 TYR 96 HE1 TYR 96 13.413 -6.095 14.579 703 HE2 TYR 96 HE2 TYR 96 12.137 -6.836 10.575 704 HH TYR 96 HH TYR 96 13.122 -8.367 13.274 705 H PHE 97 H PHE 97 13.083 -0.977 9.331 706 HA PHE 97 HA PHE 97 10.256 -1.556 8.733 707 1HB PHE 97 1HB PHE 97 12.093 0.596 7.727 708 2HB PHE 97 2HB PHE 97 10.723 0.071 6.754 709 HD1 PHE 97 HD1 PHE 97 8.450 -0.088 8.169 710 HD2 PHE 97 HD2 PHE 97 11.772 2.414 9.075 711 HE1 PHE 97 HE1 PHE 97 6.970 1.409 9.443 712 HE2 PHE 97 HE2 PHE 97 10.298 3.915 10.350 713 HZ PHE 97 HZ PHE 97 7.894 3.414 10.536 714 H LEU 98 H LEU 98 10.286 -3.562 7.891 715 HA LEU 98 HA LEU 98 12.402 -4.573 6.278 716 1HB LEU 98 1HB LEU 98 10.539 -5.767 7.724 717 2HB LEU 98 2HB LEU 98 9.681 -5.771 6.184 718 HG LEU 98 HG LEU 98 12.460 -6.844 6.274 719 1HD1 LEU 98 1HD1 LEU 98 11.703 -8.051 8.096 720 2HD1 LEU 98 2HD1 LEU 98 11.295 -9.105 6.742 721 3HD1 LEU 98 3HD1 LEU 98 10.045 -8.116 7.496 722 1HD2 LEU 98 1HD2 LEU 98 10.876 -8.497 4.778 723 2HD2 LEU 98 2HD2 LEU 98 11.823 -7.148 4.151 724 3HD2 LEU 98 3HD2 LEU 98 10.115 -6.925 4.533 725 H ILE 99 H ILE 99 12.522 -4.871 4.079 726 HA ILE 99 HA ILE 99 10.360 -3.759 2.433 727 HB ILE 99 HB ILE 99 13.284 -3.129 2.014 728 1HG1 ILE 99 1HG1 ILE 99 11.793 -0.772 2.356 729 2HG1 ILE 99 2HG1 ILE 99 11.256 -1.857 3.634 730 1HG2 ILE 99 1HG2 ILE 99 11.975 -3.332 -0.057 731 2HG2 ILE 99 2HG2 ILE 99 10.844 -2.127 0.555 732 3HG2 ILE 99 3HG2 ILE 99 12.517 -1.678 0.228 733 1HD1 ILE 99 1HD1 ILE 99 13.113 -0.401 4.317 734 2HD1 ILE 99 2HD1 ILE 99 13.518 -2.115 4.418 735 3HD1 ILE 99 3HD1 ILE 99 14.124 -1.143 3.077 736 H VAL 100 H VAL 100 9.687 -5.455 1.289 737 HA VAL 100 HA VAL 100 11.684 -7.326 0.213 738 HB VAL 100 HB VAL 100 8.703 -7.690 0.545 739 1HG1 VAL 100 1HG1 VAL 100 9.386 -10.127 0.067 740 2HG1 VAL 100 2HG1 VAL 100 9.257 -9.010 -1.293 741 3HG1 VAL 100 3HG1 VAL 100 10.841 -9.425 -0.639 742 1HG2 VAL 100 1HG2 VAL 100 11.041 -8.324 2.233 743 2HG2 VAL 100 2HG2 VAL 100 9.370 -7.990 2.687 744 3HG2 VAL 100 3HG2 VAL 100 9.819 -9.587 2.087 745 H ILE 101 H ILE 101 12.267 -6.902 -1.808 746 HA ILE 101 HA ILE 101 10.245 -5.837 -3.667 747 HB ILE 101 HB ILE 101 13.252 -5.601 -3.826 748 1HG1 ILE 101 1HG1 ILE 101 11.658 -3.153 -3.694 749 2HG1 ILE 101 2HG1 ILE 101 11.494 -4.155 -2.256 750 1HG2 ILE 101 1HG2 ILE 101 12.012 -3.783 -5.558 751 2HG2 ILE 101 2HG2 ILE 101 12.954 -5.209 -5.990 752 3HG2 ILE 101 3HG2 ILE 101 11.204 -5.328 -5.818 753 1HD1 ILE 101 1HD1 ILE 101 13.323 -3.093 -1.558 754 2HD1 ILE 101 2HD1 ILE 101 14.189 -4.173 -2.652 755 3HD1 ILE 101 3HD1 ILE 101 13.744 -2.551 -3.183 756 H GLN 102 H GLN 102 9.666 -7.032 -5.365 757 HA GLN 102 HA GLN 102 11.416 -8.851 -6.683 758 1HB GLN 102 1HB GLN 102 10.342 -10.933 -6.148 759 2HB GLN 102 2HB GLN 102 10.829 -10.162 -4.644 760 1HG GLN 102 1HG GLN 102 8.492 -9.316 -4.415 761 2HG GLN 102 2HG GLN 102 8.062 -10.306 -5.809 762 1HE2 GLN 102 1HE2 GLN 102 7.668 -10.254 -2.689 763 2HE2 GLN 102 2HE2 GLN 102 7.803 -11.928 -2.283 764 H ASN 103 H ASN 103 10.165 -10.174 -8.354 765 HA ASN 103 HA ASN 103 8.755 -8.498 -10.033 766 1HB ASN 103 1HB ASN 103 9.306 -11.374 -9.898 767 2HB ASN 103 2HB ASN 103 7.809 -10.985 -10.741 768 1HD2 ASN 103 1HD2 ASN 103 10.616 -11.910 -11.525 769 2HD2 ASN 103 2HD2 ASN 103 11.024 -10.875 -12.848 770 HA PRO 104 HA PRO 104 4.592 -8.293 -8.665 771 1HB PRO 104 1HB PRO 104 3.196 -8.458 -10.988 772 2HB PRO 104 2HB PRO 104 4.136 -7.032 -10.531 773 1HG PRO 104 1HG PRO 104 4.866 -9.269 -12.382 774 2HG PRO 104 2HG PRO 104 5.118 -7.525 -12.580 775 1HD PRO 104 1HD PRO 104 7.091 -9.200 -11.784 776 2HD PRO 104 2HD PRO 104 6.990 -7.514 -11.236 777 H THR 105 H THR 105 2.808 -9.527 -8.117 778 HA THR 105 HA THR 105 2.964 -12.366 -8.877 779 HB THR 105 HB THR 105 1.614 -12.780 -6.808 780 HG1 THR 105 HG1 THR 105 1.149 -11.136 -5.467 781 1HG2 THR 105 1HG2 THR 105 4.221 -11.333 -6.328 782 2HG2 THR 105 2HG2 THR 105 4.078 -13.012 -6.850 783 3HG2 THR 105 3HG2 THR 105 3.468 -12.524 -5.269 784 H GLU 106 H GLU 106 0.798 -9.613 -8.556 785 HA GLU 106 HA GLU 106 -1.656 -10.804 -8.976 786 1HB GLU 106 1HB GLU 106 -0.586 -8.162 -9.069 787 2HB GLU 106 2HB GLU 106 -1.604 -8.389 -10.484 788 1HG GLU 106 1HG GLU 106 -3.467 -9.034 -9.081 789 2HG GLU 106 2HG GLU 106 -2.454 -8.905 -7.644 790 H MET 11 H MET 11 -19.771 3.228 -15.746 791 HA MET 11 HA MET 11 -19.425 3.165 -12.867 792 1HB MET 11 1HB MET 11 -20.880 4.869 -13.759 793 2HB MET 11 2HB MET 11 -21.840 3.668 -14.610 794 1HG MET 11 1HG MET 11 -23.033 3.135 -12.789 795 2HG MET 11 2HG MET 11 -21.644 3.268 -11.712 796 1HE MET 11 1HE MET 11 -21.440 7.084 -11.027 797 2HE MET 11 2HE MET 11 -21.029 5.511 -10.344 798 3HE MET 11 3HE MET 11 -20.478 5.940 -11.964 799 H ALA 12 H ALA 12 -21.241 1.356 -15.329 800 HA ALA 12 HA ALA 12 -22.528 -0.474 -13.713 801 1HB ALA 12 1HB ALA 12 -22.033 -0.171 -16.474 802 2HB ALA 12 2HB ALA 12 -21.616 -1.831 -16.050 803 3HB ALA 12 3HB ALA 12 -23.224 -1.206 -15.686 804 H GLU 13 H GLU 13 -19.214 -0.561 -14.947 805 HA GLU 13 HA GLU 13 -18.482 -3.125 -14.217 806 1HB GLU 13 1HB GLU 13 -17.009 -0.553 -14.528 807 2HB GLU 13 2HB GLU 13 -16.170 -1.894 -13.762 808 1HG GLU 13 1HG GLU 13 -17.547 -2.647 -16.216 809 2HG GLU 13 2HG GLU 13 -16.309 -1.414 -16.451 810 H VAL 14 H VAL 14 -18.202 -0.161 -12.259 811 HA VAL 14 HA VAL 14 -17.236 -1.438 -9.939 812 HB VAL 14 HB VAL 14 -18.842 1.115 -9.994 813 1HG1 VAL 14 1HG1 VAL 14 -16.771 1.338 -8.177 814 2HG1 VAL 14 2HG1 VAL 14 -18.463 1.009 -7.798 815 3HG1 VAL 14 3HG1 VAL 14 -17.323 -0.325 -7.981 816 1HG2 VAL 14 1HG2 VAL 14 -16.300 1.978 -10.024 817 2HG2 VAL 14 2HG2 VAL 14 -16.129 0.519 -11.000 818 3HG2 VAL 14 3HG2 VAL 14 -17.270 1.774 -11.483 819 H GLU 15 H GLU 15 -20.495 -0.691 -11.062 820 HA GLU 15 HA GLU 15 -21.866 -1.331 -8.690 821 1HB GLU 15 1HB GLU 15 -22.722 -1.361 -11.582 822 2HB GLU 15 2HB GLU 15 -23.828 -1.704 -10.259 823 1HG GLU 15 1HG GLU 15 -23.612 0.483 -9.387 824 2HG GLU 15 2HG GLU 15 -22.243 0.840 -10.438 825 H GLU 16 H GLU 16 -20.712 -3.299 -11.356 826 HA GLU 16 HA GLU 16 -22.109 -5.667 -10.617 827 1HB GLU 16 1HB GLU 16 -20.662 -4.875 -12.809 828 2HB GLU 16 2HB GLU 16 -19.576 -6.034 -12.055 829 1HG GLU 16 1HG GLU 16 -21.412 -7.689 -12.051 830 2HG GLU 16 2HG GLU 16 -22.415 -6.529 -12.920 831 H THR 17 H THR 17 -18.999 -4.284 -9.784 832 HA THR 17 HA THR 17 -18.071 -6.652 -8.428 833 HB THR 17 HB THR 17 -16.975 -3.834 -8.434 834 HG1 THR 17 HG1 THR 17 -16.963 -5.273 -10.414 835 1HG2 THR 17 1HG2 THR 17 -16.031 -4.679 -6.512 836 2HG2 THR 17 2HG2 THR 17 -14.867 -5.236 -7.714 837 3HG2 THR 17 3HG2 THR 17 -16.088 -6.344 -7.088 838 H LEU 18 H LEU 18 -19.836 -3.780 -7.609 839 HA LEU 18 HA LEU 18 -19.385 -3.930 -4.785 840 1HB LEU 18 1HB LEU 18 -20.833 -2.228 -6.640 841 2HB LEU 18 2HB LEU 18 -21.738 -2.521 -5.156 842 HG LEU 18 HG LEU 18 -19.450 -1.829 -4.033 843 1HD1 LEU 18 1HD1 LEU 18 -18.470 0.058 -5.397 844 2HD1 LEU 18 2HD1 LEU 18 -19.319 -0.623 -6.784 845 3HD1 LEU 18 3HD1 LEU 18 -18.093 -1.575 -5.947 846 1HD2 LEU 18 1HD2 LEU 18 -21.759 -0.274 -5.017 847 2HD2 LEU 18 2HD2 LEU 18 -20.358 0.656 -4.485 848 3HD2 LEU 18 3HD2 LEU 18 -21.138 -0.476 -3.379 849 H LYS 19 H LYS 19 -21.779 -5.173 -7.019 850 HA LYS 19 HA LYS 19 -23.711 -5.952 -5.107 851 1HB LYS 19 1HB LYS 19 -23.484 -6.002 -7.888 852 2HB LYS 19 2HB LYS 19 -23.615 -7.694 -7.426 853 1HG LYS 19 1HG LYS 19 -25.817 -7.152 -7.690 854 2HG LYS 19 2HG LYS 19 -25.610 -6.823 -5.969 855 1HD LYS 19 1HD LYS 19 -26.049 -4.651 -6.245 856 2HD LYS 19 2HD LYS 19 -24.929 -4.526 -7.603 857 1HE LYS 19 1HE LYS 19 -26.854 -4.088 -8.722 858 2HE LYS 19 2HE LYS 19 -26.899 -5.848 -8.818 859 1HZ LYS 19 1HZ LYS 19 -28.168 -5.582 -6.567 860 2HZ LYS 19 2HZ LYS 19 -28.982 -5.404 -8.039 861 3HZ LYS 19 3HZ LYS 19 -28.506 -4.036 -7.165 862 H ARG 20 H ARG 20 -21.155 -7.806 -6.755 863 HA ARG 20 HA ARG 20 -21.633 -10.218 -5.365 864 1HB ARG 20 1HB ARG 20 -19.656 -11.028 -6.366 865 2HB ARG 20 2HB ARG 20 -20.332 -9.897 -7.531 866 1HG ARG 20 1HG ARG 20 -18.763 -8.167 -6.526 867 2HG ARG 20 2HG ARG 20 -17.964 -9.524 -5.729 868 1HD ARG 20 1HD ARG 20 -17.698 -10.576 -7.985 869 2HD ARG 20 2HD ARG 20 -18.301 -9.077 -8.689 870 HE ARG 20 HE ARG 20 -16.233 -8.175 -8.379 871 1HH1 ARG 20 1HH1 ARG 20 -16.594 -10.881 -6.219 872 2HH1 ARG 20 2HH1 ARG 20 -14.962 -10.804 -5.640 873 1HH2 ARG 20 1HH2 ARG 20 -14.083 -8.062 -7.625 874 2HH2 ARG 20 2HH2 ARG 20 -13.536 -9.199 -6.440 875 H LEU 21 H LEU 21 -19.766 -7.372 -4.618 876 HA LEU 21 HA LEU 21 -18.219 -8.544 -2.526 877 1HB LEU 21 1HB LEU 21 -18.630 -5.879 -3.673 878 2HB LEU 21 2HB LEU 21 -18.283 -5.877 -1.945 879 HG LEU 21 HG LEU 21 -16.173 -6.961 -2.306 880 1HD1 LEU 21 1HD1 LEU 21 -15.975 -8.387 -3.995 881 2HD1 LEU 21 2HD1 LEU 21 -15.792 -6.995 -5.062 882 3HD1 LEU 21 3HD1 LEU 21 -17.384 -7.712 -4.814 883 1HD2 LEU 21 1HD2 LEU 21 -15.264 -5.268 -4.142 884 2HD2 LEU 21 2HD2 LEU 21 -15.720 -4.743 -2.521 885 3HD2 LEU 21 3HD2 LEU 21 -16.841 -4.529 -3.866 886 H GLN 22 H GLN 22 -21.007 -6.320 -2.501 887 HA GLN 22 HA GLN 22 -21.386 -6.374 0.286 888 1HB GLN 22 1HB GLN 22 -22.582 -5.108 -1.925 889 2HB GLN 22 2HB GLN 22 -23.874 -5.980 -1.112 890 1HG GLN 22 1HG GLN 22 -23.579 -3.635 -0.353 891 2HG GLN 22 2HG GLN 22 -23.467 -4.836 0.933 892 1HE2 GLN 22 1HE2 GLN 22 -21.740 -2.522 -0.992 893 2HE2 GLN 22 2HE2 GLN 22 -20.303 -2.490 -0.034 894 H SER 23 H SER 23 -22.032 -8.703 -2.104 895 HA SER 23 HA SER 23 -24.175 -10.009 -0.659 896 1HB SER 23 1HB SER 23 -22.906 -10.277 -3.297 897 2HB SER 23 2HB SER 23 -23.364 -11.812 -2.560 898 HG SER 23 HG SER 23 -25.024 -10.746 -3.855 899 H GLN 24 H GLN 24 -20.728 -10.192 -0.906 900 HA GLN 24 HA GLN 24 -20.655 -12.772 0.469 901 1HB GLN 24 1HB GLN 24 -18.236 -12.700 0.055 902 2HB GLN 24 2HB GLN 24 -19.152 -12.499 -1.432 903 1HG GLN 24 1HG GLN 24 -18.704 -10.165 -1.487 904 2HG GLN 24 2HG GLN 24 -18.011 -10.202 0.134 905 1HE2 GLN 24 1HE2 GLN 24 -16.451 -9.056 -1.575 906 2HE2 GLN 24 2HE2 GLN 24 -15.164 -10.076 -2.109 907 H LYS 25 H LYS 25 -19.114 -13.002 2.301 908 HA LYS 25 HA LYS 25 -19.589 -10.876 4.216 909 1HB LYS 25 1HB LYS 25 -19.505 -13.616 4.419 910 2HB LYS 25 2HB LYS 25 -17.947 -13.146 5.087 911 1HG LYS 25 1HG LYS 25 -19.717 -11.394 6.276 912 2HG LYS 25 2HG LYS 25 -20.604 -12.919 6.223 913 1HD LYS 25 1HD LYS 25 -19.455 -13.016 8.252 914 2HD LYS 25 2HD LYS 25 -18.447 -13.966 7.157 915 1HE LYS 25 1HE LYS 25 -17.156 -11.798 6.754 916 2HE LYS 25 2HE LYS 25 -18.000 -11.172 8.170 917 1HZ LYS 25 1HZ LYS 25 -16.444 -12.127 9.399 918 2HZ LYS 25 2HZ LYS 25 -15.748 -12.882 8.055 919 3HZ LYS 25 3HZ LYS 25 -17.002 -13.643 8.897 920 H GLY 26 H GLY 26 -17.969 -9.812 5.409 921 1HA GLY 26 1HA GLY 26 -15.618 -9.472 5.914 922 2HA GLY 26 2HA GLY 26 -15.248 -10.007 4.282 923 H VAL 27 H VAL 27 -16.957 -8.541 2.751 924 HA VAL 27 HA VAL 27 -15.656 -6.134 2.402 925 HB VAL 27 HB VAL 27 -18.514 -6.784 1.666 926 1HG1 VAL 27 1HG1 VAL 27 -18.065 -5.052 -0.138 927 2HG1 VAL 27 2HG1 VAL 27 -18.307 -4.443 1.501 928 3HG1 VAL 27 3HG1 VAL 27 -16.679 -4.554 0.832 929 1HG2 VAL 27 1HG2 VAL 27 -15.970 -7.022 0.062 930 2HG2 VAL 27 2HG2 VAL 27 -16.877 -8.366 0.757 931 3HG2 VAL 27 3HG2 VAL 27 -17.598 -7.378 -0.514 932 H GLN 28 H GLN 28 -15.514 -4.429 3.690 933 HA GLN 28 HA GLN 28 -17.530 -3.932 5.714 934 1HB GLN 28 1HB GLN 28 -14.740 -3.174 5.260 935 2HB GLN 28 2HB GLN 28 -15.726 -1.856 5.879 936 1HG GLN 28 1HG GLN 28 -14.554 -3.241 7.606 937 2HG GLN 28 2HG GLN 28 -16.295 -3.063 7.824 938 1HE2 GLN 28 1HE2 GLN 28 -13.700 -5.225 7.350 939 2HE2 GLN 28 2HE2 GLN 28 -14.617 -6.689 7.340 940 H GLY 29 H GLY 29 -16.491 -2.618 2.658 941 1HA GLY 29 1HA GLY 29 -18.801 -1.307 2.014 942 2HA GLY 29 2HA GLY 29 -17.888 -0.125 2.940 943 H ILE 30 H ILE 30 -18.676 -0.002 0.152 944 HA ILE 30 HA ILE 30 -15.993 0.193 -1.048 945 HB ILE 30 HB ILE 30 -18.502 -0.498 -2.576 946 1HG1 ILE 30 1HG1 ILE 30 -16.644 -2.625 -2.658 947 2HG1 ILE 30 2HG1 ILE 30 -16.801 -2.168 -0.966 948 1HG2 ILE 30 1HG2 ILE 30 -16.969 0.587 -4.005 949 2HG2 ILE 30 2HG2 ILE 30 -15.599 -0.289 -3.325 950 3HG2 ILE 30 3HG2 ILE 30 -16.781 -1.138 -4.320 951 1HD1 ILE 30 1HD1 ILE 30 -18.553 -3.723 -2.555 952 2HD1 ILE 30 2HD1 ILE 30 -18.694 -3.295 -0.849 953 3HD1 ILE 30 3HD1 ILE 30 -19.399 -2.249 -2.082 954 H ILE 31 H ILE 31 -15.503 2.080 -2.021 955 HA ILE 31 HA ILE 31 -17.671 4.022 -2.454 956 HB ILE 31 HB ILE 31 -14.976 4.647 -1.240 957 1HG1 ILE 31 1HG1 ILE 31 -17.419 5.349 0.229 958 2HG1 ILE 31 2HG1 ILE 31 -17.190 3.616 0.023 959 1HG2 ILE 31 1HG2 ILE 31 -17.284 6.409 -2.031 960 2HG2 ILE 31 2HG2 ILE 31 -15.990 6.928 -0.953 961 3HG2 ILE 31 3HG2 ILE 31 -15.622 6.473 -2.616 962 1HD1 ILE 31 1HD1 ILE 31 -15.298 3.577 1.308 963 2HD1 ILE 31 2HD1 ILE 31 -14.913 5.268 0.987 964 3HD1 ILE 31 3HD1 ILE 31 -16.218 4.857 2.099 965 H VAL 32 H VAL 32 -17.425 5.416 -4.188 966 HA VAL 32 HA VAL 32 -15.072 4.977 -5.903 967 HB VAL 32 HB VAL 32 -17.755 5.452 -7.136 968 1HG1 VAL 32 1HG1 VAL 32 -15.551 5.552 -8.383 969 2HG1 VAL 32 2HG1 VAL 32 -15.443 3.808 -8.134 970 3HG1 VAL 32 3HG1 VAL 32 -16.784 4.487 -9.058 971 1HG2 VAL 32 1HG2 VAL 32 -16.697 2.773 -6.245 972 2HG2 VAL 32 2HG2 VAL 32 -18.164 3.571 -5.680 973 3HG2 VAL 32 3HG2 VAL 32 -18.055 3.004 -7.346 974 H VAL 33 H VAL 33 -14.024 6.828 -6.150 975 HA VAL 33 HA VAL 33 -15.568 9.338 -6.165 976 HB VAL 33 HB VAL 33 -12.626 9.097 -5.556 977 1HG1 VAL 33 1HG1 VAL 33 -14.675 11.273 -5.205 978 2HG1 VAL 33 2HG1 VAL 33 -13.088 11.306 -4.435 979 3HG1 VAL 33 3HG1 VAL 33 -13.216 11.304 -6.194 980 1HG2 VAL 33 1HG2 VAL 33 -13.320 9.375 -3.162 981 2HG2 VAL 33 2HG2 VAL 33 -14.973 9.024 -3.667 982 3HG2 VAL 33 3HG2 VAL 33 -13.712 7.808 -3.869 983 H ASN 34 H ASN 34 -15.245 10.821 -7.778 984 HA ASN 34 HA ASN 34 -13.950 9.816 -10.179 985 1HB ASN 34 1HB ASN 34 -15.010 11.783 -11.272 986 2HB ASN 34 2HB ASN 34 -16.171 10.752 -10.440 987 1HD2 ASN 34 1HD2 ASN 34 -17.598 12.548 -10.424 988 2HD2 ASN 34 2HD2 ASN 34 -17.416 13.805 -9.253 989 H THR 35 H THR 35 -13.096 11.961 -11.513 990 HA THR 35 HA THR 35 -10.580 12.509 -10.359 991 HB THR 35 HB THR 35 -10.458 14.272 -12.238 992 HG1 THR 35 HG1 THR 35 -12.730 14.457 -12.549 993 1HG2 THR 35 1HG2 THR 35 -9.487 12.646 -13.429 994 2HG2 THR 35 2HG2 THR 35 -11.015 11.794 -13.649 995 3HG2 THR 35 3HG2 THR 35 -10.059 11.529 -12.191 996 H GLU 36 H GLU 36 -13.578 14.348 -10.532 997 HA GLU 36 HA GLU 36 -12.555 16.809 -9.613 998 1HB GLU 36 1HB GLU 36 -15.260 15.575 -9.810 999 2HB GLU 36 2HB GLU 36 -15.076 16.997 -8.793 1000 1HG GLU 36 1HG GLU 36 -13.773 17.706 -11.112 1001 2HG GLU 36 2HG GLU 36 -15.151 16.769 -11.685 1002 H GLY 37 H GLY 37 -13.304 13.858 -7.995 1003 1HA GLY 37 1HA GLY 37 -12.375 13.449 -5.814 1004 2HA GLY 37 2HA GLY 37 -12.629 15.146 -5.434 1005 H ILE 38 H ILE 38 -15.327 14.256 -7.033 1006 HA ILE 38 HA ILE 38 -16.824 13.984 -4.559 1007 HB ILE 38 HB ILE 38 -17.865 14.147 -7.388 1008 1HG1 ILE 38 1HG1 ILE 38 -17.651 16.356 -5.336 1009 2HG1 ILE 38 2HG1 ILE 38 -16.513 16.131 -6.659 1010 1HG2 ILE 38 1HG2 ILE 38 -19.269 14.626 -4.764 1011 2HG2 ILE 38 2HG2 ILE 38 -19.984 14.712 -6.372 1012 3HG2 ILE 38 3HG2 ILE 38 -19.417 13.166 -5.741 1013 1HD1 ILE 38 1HD1 ILE 38 -17.825 17.276 -8.014 1014 2HD1 ILE 38 2HD1 ILE 38 -19.164 16.170 -7.704 1015 3HD1 ILE 38 3HD1 ILE 38 -18.921 17.573 -6.664 1016 HA PRO 39 HA PRO 39 -17.120 9.580 -4.867 1017 1HB PRO 39 1HB PRO 39 -19.089 9.239 -3.029 1018 2HB PRO 39 2HB PRO 39 -17.416 9.605 -2.589 1019 1HG PRO 39 1HG PRO 39 -19.769 11.445 -2.783 1020 2HG PRO 39 2HG PRO 39 -18.507 11.370 -1.540 1021 1HD PRO 39 1HD PRO 39 -18.485 13.206 -3.531 1022 2HD PRO 39 2HD PRO 39 -16.996 12.544 -2.826 1023 H ILE 40 H ILE 40 -17.958 9.529 -7.024 1024 HA ILE 40 HA ILE 40 -20.508 10.102 -7.875 1025 HB ILE 40 HB ILE 40 -20.157 8.135 -9.506 1026 1HG1 ILE 40 1HG1 ILE 40 -17.297 8.272 -8.641 1027 2HG1 ILE 40 2HG1 ILE 40 -18.392 7.196 -7.780 1028 1HG2 ILE 40 1HG2 ILE 40 -18.874 9.488 -10.899 1029 2HG2 ILE 40 2HG2 ILE 40 -19.620 10.635 -9.787 1030 3HG2 ILE 40 3HG2 ILE 40 -17.940 10.150 -9.558 1031 1HD1 ILE 40 1HD1 ILE 40 -18.355 5.701 -9.420 1032 2HD1 ILE 40 2HD1 ILE 40 -18.610 6.930 -10.660 1033 3HD1 ILE 40 3HD1 ILE 40 -16.983 6.604 -10.062 1034 H LYS 41 H LYS 41 -19.374 7.281 -6.118 1035 HA LYS 41 HA LYS 41 -22.102 6.611 -5.416 1036 1HB LYS 41 1HB LYS 41 -20.664 5.163 -7.466 1037 2HB LYS 41 2HB LYS 41 -21.040 4.110 -6.109 1038 1HG LYS 41 1HG LYS 41 -23.293 5.768 -6.896 1039 2HG LYS 41 2HG LYS 41 -22.713 4.728 -8.199 1040 1HD LYS 41 1HD LYS 41 -24.234 3.352 -7.138 1041 2HD LYS 41 2HD LYS 41 -22.722 2.883 -6.357 1042 1HE LYS 41 1HE LYS 41 -23.536 3.458 -4.374 1043 2HE LYS 41 2HE LYS 41 -23.850 5.095 -4.949 1044 1HZ LYS 41 1HZ LYS 41 -25.756 3.432 -4.137 1045 2HZ LYS 41 2HZ LYS 41 -25.754 3.070 -5.789 1046 3HZ LYS 41 3HZ LYS 41 -26.019 4.659 -5.272 1047 H SER 42 H SER 42 -22.254 5.590 -3.466 1048 HA SER 42 HA SER 42 -19.973 4.310 -2.253 1049 1HB SER 42 1HB SER 42 -20.060 5.847 -0.232 1050 2HB SER 42 2HB SER 42 -19.345 6.541 -1.687 1051 HG SER 42 HG SER 42 -21.784 7.113 -0.447 1052 H THR 43 H THR 43 -20.507 3.081 -0.430 1053 HA THR 43 HA THR 43 -23.394 2.900 0.142 1054 HB THR 43 HB THR 43 -23.107 0.879 -0.891 1055 HG1 THR 43 HG1 THR 43 -21.978 -0.104 1.472 1056 1HG2 THR 43 1HG2 THR 43 -20.865 -0.444 -0.398 1057 2HG2 THR 43 2HG2 THR 43 -20.259 1.182 -0.077 1058 3HG2 THR 43 3HG2 THR 43 -20.948 0.792 -1.653 1059 H MET 44 H MET 44 -20.331 3.491 1.393 1060 HA MET 44 HA MET 44 -20.655 2.405 4.007 1061 1HB MET 44 1HB MET 44 -18.865 4.680 3.141 1062 2HB MET 44 2HB MET 44 -18.695 3.705 4.594 1063 1HG MET 44 1HG MET 44 -18.652 1.790 2.682 1064 2HG MET 44 2HG MET 44 -17.901 3.138 1.831 1065 1HE MET 44 1HE MET 44 -16.556 0.841 5.461 1066 2HE MET 44 2HE MET 44 -17.107 2.436 5.972 1067 3HE MET 44 3HE MET 44 -18.190 1.376 5.068 1068 H ASP 45 H ASP 45 -20.074 4.405 5.759 1069 HA ASP 45 HA ASP 45 -22.612 5.553 6.235 1070 1HB ASP 45 1HB ASP 45 -20.189 5.225 7.662 1071 2HB ASP 45 2HB ASP 45 -20.566 6.945 7.687 1072 H ASN 46 H ASN 46 -23.111 7.839 6.440 1073 HA ASN 46 HA ASN 46 -22.528 9.283 4.099 1074 1HB ASN 46 1HB ASN 46 -24.312 9.521 6.266 1075 2HB ASN 46 2HB ASN 46 -23.401 11.028 6.223 1076 1HD2 ASN 46 1HD2 ASN 46 -22.953 11.285 3.521 1077 2HD2 ASN 46 2HD2 ASN 46 -24.460 11.538 2.714 1078 HA PRO 47 HA PRO 47 -19.729 12.096 6.861 1079 1HB PRO 47 1HB PRO 47 -19.116 11.181 9.342 1080 2HB PRO 47 2HB PRO 47 -20.533 12.185 9.011 1081 1HG PRO 47 1HG PRO 47 -20.350 9.215 9.342 1082 2HG PRO 47 2HG PRO 47 -21.561 10.340 9.985 1083 1HD PRO 47 1HD PRO 47 -22.006 8.818 7.790 1084 2HD PRO 47 2HD PRO 47 -22.716 10.432 7.992 1085 H THR 48 H THR 48 -19.461 8.616 7.033 1086 HA THR 48 HA THR 48 -16.606 8.575 7.326 1087 HB THR 48 HB THR 48 -18.513 6.377 6.499 1088 HG1 THR 48 HG1 THR 48 -18.026 5.719 8.738 1089 1HG2 THR 48 1HG2 THR 48 -16.657 4.858 7.110 1090 2HG2 THR 48 2HG2 THR 48 -15.607 6.261 7.314 1091 3HG2 THR 48 3HG2 THR 48 -16.269 5.879 5.725 1092 H THR 49 H THR 49 -18.887 8.345 4.654 1093 HA THR 49 HA THR 49 -17.011 7.594 2.670 1094 HB THR 49 HB THR 49 -19.671 9.004 2.398 1095 HG1 THR 49 HG1 THR 49 -20.428 7.052 2.646 1096 1HG2 THR 49 1HG2 THR 49 -18.272 9.422 0.437 1097 2HG2 THR 49 2HG2 THR 49 -19.592 8.321 0.043 1098 3HG2 THR 49 3HG2 THR 49 -17.962 7.694 0.281 1099 H THR 50 H THR 50 -18.434 10.752 3.502 1100 HA THR 50 HA THR 50 -17.105 12.306 1.627 1101 HB THR 50 HB THR 50 -17.365 13.623 4.231 1102 HG1 THR 50 HG1 THR 50 -19.179 12.671 4.756 1103 1HG2 THR 50 1HG2 THR 50 -18.016 15.352 2.945 1104 2HG2 THR 50 2HG2 THR 50 -19.139 14.361 2.014 1105 3HG2 THR 50 3HG2 THR 50 -17.423 14.370 1.607 1106 H GLN 51 H GLN 51 -16.082 11.398 4.902 1107 HA GLN 51 HA GLN 51 -13.667 12.866 4.875 1108 1HB GLN 51 1HB GLN 51 -14.561 12.168 6.980 1109 2HB GLN 51 2HB GLN 51 -14.564 10.480 6.488 1110 1HG GLN 51 1HG GLN 51 -11.938 11.777 6.405 1111 2HG GLN 51 2HG GLN 51 -12.655 11.648 8.010 1112 1HE2 GLN 51 1HE2 GLN 51 -11.186 9.982 5.400 1113 2HE2 GLN 51 2HE2 GLN 51 -11.156 8.414 6.123 1114 H TYR 52 H TYR 52 -14.337 9.422 4.278 1115 HA TYR 52 HA TYR 52 -11.727 8.609 3.750 1116 1HB TYR 52 1HB TYR 52 -14.429 7.589 2.993 1117 2HB TYR 52 2HB TYR 52 -13.020 6.901 2.193 1118 HD1 TYR 52 HD1 TYR 52 -12.712 4.778 3.071 1119 HD2 TYR 52 HD2 TYR 52 -13.529 8.004 5.723 1120 HE1 TYR 52 HE1 TYR 52 -12.348 3.284 4.991 1121 HE2 TYR 52 HE2 TYR 52 -13.166 6.519 7.650 1122 HH TYR 52 HH TYR 52 -12.074 3.187 7.222 1123 H ALA 53 H ALA 53 -14.239 9.611 1.429 1124 HA ALA 53 HA ALA 53 -12.688 9.436 -0.883 1125 1HB ALA 53 1HB ALA 53 -14.326 11.143 -1.798 1126 2HB ALA 53 2HB ALA 53 -15.019 9.657 -1.149 1127 3HB ALA 53 3HB ALA 53 -15.067 11.141 -0.197 1128 H SER 54 H SER 54 -12.615 11.734 1.672 1129 HA SER 54 HA SER 54 -11.447 13.884 0.185 1130 1HB SER 54 1HB SER 54 -12.703 13.882 2.511 1131 2HB SER 54 2HB SER 54 -11.077 13.628 3.143 1132 HG SER 54 HG SER 54 -11.867 15.887 2.841 1133 H LEU 55 H LEU 55 -10.126 11.663 2.646 1134 HA LEU 55 HA LEU 55 -7.424 12.420 2.090 1135 1HB LEU 55 1HB LEU 55 -6.847 11.124 3.865 1136 2HB LEU 55 2HB LEU 55 -8.549 11.388 4.240 1137 HG LEU 55 HG LEU 55 -8.797 9.113 2.882 1138 1HD1 LEU 55 1HD1 LEU 55 -6.957 7.889 2.620 1139 2HD1 LEU 55 2HD1 LEU 55 -6.406 8.227 4.261 1140 3HD1 LEU 55 3HD1 LEU 55 -6.045 9.360 2.959 1141 1HD2 LEU 55 1HD2 LEU 55 -9.361 8.235 4.876 1142 2HD2 LEU 55 2HD2 LEU 55 -9.087 9.878 5.457 1143 3HD2 LEU 55 3HD2 LEU 55 -7.820 8.661 5.620 1144 H MET 56 H MET 56 -9.620 10.366 0.569 1145 HA MET 56 HA MET 56 -8.026 8.237 -0.284 1146 1HB MET 56 1HB MET 56 -10.621 9.209 -0.813 1147 2HB MET 56 2HB MET 56 -9.829 9.044 -2.374 1148 1HG MET 56 1HG MET 56 -10.991 7.017 -1.867 1149 2HG MET 56 2HG MET 56 -9.257 6.716 -1.800 1150 1HE MET 56 1HE MET 56 -8.081 6.515 1.304 1151 2HE MET 56 2HE MET 56 -8.727 4.893 1.050 1152 3HE MET 56 3HE MET 56 -8.106 5.820 -0.317 1153 H HIS 57 H HIS 57 -8.951 11.024 -2.310 1154 HA HIS 57 HA HIS 57 -6.974 10.588 -4.250 1155 1HB HIS 57 1HB HIS 57 -8.880 11.937 -4.798 1156 2HB HIS 57 2HB HIS 57 -8.515 13.077 -3.506 1157 HD1 HIS 57 HD1 HIS 57 -8.149 15.148 -4.883 1158 HD2 HIS 57 HD2 HIS 57 -5.881 11.925 -6.199 1159 HE1 HIS 57 HE1 HIS 57 -6.578 16.090 -6.606 1160 H SER 58 H SER 58 -6.918 12.319 -1.221 1161 HA SER 58 HA SER 58 -4.509 13.760 -1.712 1162 1HB SER 58 1HB SER 58 -6.449 13.596 0.369 1163 2HB SER 58 2HB SER 58 -4.862 13.320 1.087 1164 HG SER 58 HG SER 58 -4.303 15.318 0.649 1165 H PHE 59 H PHE 59 -5.231 10.532 -0.757 1166 HA PHE 59 HA PHE 59 -2.756 9.956 0.538 1167 1HB PHE 59 1HB PHE 59 -4.714 8.590 0.987 1168 2HB PHE 59 2HB PHE 59 -4.819 8.129 -0.709 1169 HD1 PHE 59 HD1 PHE 59 -4.597 5.802 -0.551 1170 HD2 PHE 59 HD2 PHE 59 -1.746 8.333 1.340 1171 HE1 PHE 59 HE1 PHE 59 -3.164 3.851 -0.107 1172 HE2 PHE 59 HE2 PHE 59 -0.308 6.387 1.786 1173 HZ PHE 59 HZ PHE 59 -1.016 4.142 1.061 1174 H ILE 60 H ILE 60 -4.039 9.014 -2.656 1175 HA ILE 60 HA ILE 60 -1.678 7.870 -3.624 1176 HB ILE 60 HB ILE 60 -3.918 9.193 -5.157 1177 1HG1 ILE 60 1HG1 ILE 60 -3.768 6.328 -5.375 1178 2HG1 ILE 60 2HG1 ILE 60 -3.806 6.790 -3.676 1179 1HG2 ILE 60 1HG2 ILE 60 -2.097 9.140 -6.643 1180 2HG2 ILE 60 2HG2 ILE 60 -1.577 7.553 -6.079 1181 3HG2 ILE 60 3HG2 ILE 60 -3.053 7.710 -7.032 1182 1HD1 ILE 60 1HD1 ILE 60 -5.749 8.239 -5.272 1183 2HD1 ILE 60 2HD1 ILE 60 -5.977 6.491 -5.324 1184 3HD1 ILE 60 3HD1 ILE 60 -5.956 7.332 -3.774 1185 H LEU 61 H LEU 61 -2.801 11.200 -3.622 1186 HA LEU 61 HA LEU 61 -0.894 12.251 -5.409 1187 1HB LEU 61 1HB LEU 61 -2.998 13.228 -3.801 1188 2HB LEU 61 2HB LEU 61 -1.560 14.159 -3.385 1189 HG LEU 61 HG LEU 61 -1.299 14.832 -5.707 1190 1HD1 LEU 61 1HD1 LEU 61 -3.601 12.964 -6.128 1191 2HD1 LEU 61 2HD1 LEU 61 -2.072 13.063 -7.000 1192 3HD1 LEU 61 3HD1 LEU 61 -3.302 14.305 -7.234 1193 1HD2 LEU 61 1HD2 LEU 61 -3.670 15.951 -5.914 1194 2HD2 LEU 61 2HD2 LEU 61 -2.544 16.432 -4.644 1195 3HD2 LEU 61 3HD2 LEU 61 -3.864 15.321 -4.278 1196 H LYS 62 H LYS 62 -0.741 11.391 -2.046 1197 HA LYS 62 HA LYS 62 1.662 12.858 -1.486 1198 1HB LYS 62 1HB LYS 62 -0.276 11.448 0.013 1199 2HB LYS 62 2HB LYS 62 1.264 10.655 0.316 1200 1HG LYS 62 1HG LYS 62 1.124 12.270 1.980 1201 2HG LYS 62 2HG LYS 62 2.171 13.007 0.765 1202 1HD LYS 62 1HD LYS 62 0.604 14.553 0.154 1203 2HD LYS 62 2HD LYS 62 -0.752 13.499 0.559 1204 1HE LYS 62 1HE LYS 62 -0.957 14.875 2.331 1205 2HE LYS 62 2HE LYS 62 0.324 13.869 3.006 1206 1HZ LYS 62 1HZ LYS 62 1.777 15.640 1.686 1207 2HZ LYS 62 2HZ LYS 62 1.293 15.870 3.290 1208 3HZ LYS 62 3HZ LYS 62 0.435 16.610 2.034 1209 H ALA 63 H ALA 63 0.918 9.396 -1.898 1210 HA ALA 63 HA ALA 63 3.602 8.529 -1.799 1211 1HB ALA 63 1HB ALA 63 2.760 6.419 -2.696 1212 2HB ALA 63 2HB ALA 63 1.725 7.023 -1.401 1213 3HB ALA 63 3HB ALA 63 1.223 7.193 -3.083 1214 H ARG 64 H ARG 64 1.446 9.264 -4.523 1215 HA ARG 64 HA ARG 64 3.087 8.516 -6.620 1216 1HB ARG 64 1HB ARG 64 0.698 9.305 -6.764 1217 2HB ARG 64 2HB ARG 64 1.302 10.951 -6.621 1218 1HG ARG 64 1HG ARG 64 2.821 10.065 -8.660 1219 2HG ARG 64 2HG ARG 64 1.362 9.103 -8.906 1220 1HD ARG 64 1HD ARG 64 1.267 11.204 -10.151 1221 2HD ARG 64 2HD ARG 64 0.013 11.132 -8.914 1222 HE ARG 64 HE ARG 64 2.093 12.421 -7.705 1223 1HH1 ARG 64 1HH1 ARG 64 0.237 12.921 -10.607 1224 2HH1 ARG 64 2HH1 ARG 64 0.413 14.645 -10.579 1225 1HH2 ARG 64 1HH2 ARG 64 2.332 14.689 -7.656 1226 2HH2 ARG 64 2HH2 ARG 64 1.606 15.649 -8.901 1227 H SER 65 H SER 65 3.298 11.279 -4.523 1228 HA SER 65 HA SER 65 5.112 12.752 -6.195 1229 1HB SER 65 1HB SER 65 3.492 13.498 -4.171 1230 2HB SER 65 2HB SER 65 5.010 13.335 -3.289 1231 HG SER 65 HG SER 65 5.583 15.161 -4.126 1232 H THR 66 H THR 66 5.363 10.427 -3.605 1233 HA THR 66 HA THR 66 8.198 10.854 -3.227 1234 HB THR 66 HB THR 66 6.582 8.533 -2.176 1235 HG1 THR 66 HG1 THR 66 5.500 10.097 -1.200 1236 1HG2 THR 66 1HG2 THR 66 8.987 9.917 -0.994 1237 2HG2 THR 66 2HG2 THR 66 9.095 8.496 -2.032 1238 3HG2 THR 66 3HG2 THR 66 8.258 8.395 -0.484 1239 H VAL 67 H VAL 67 6.109 8.680 -4.991 1240 HA VAL 67 HA VAL 67 7.795 6.560 -5.528 1241 HB VAL 67 HB VAL 67 5.824 7.836 -7.431 1242 1HG1 VAL 67 1HG1 VAL 67 7.365 6.357 -8.595 1243 2HG1 VAL 67 2HG1 VAL 67 7.033 5.072 -7.432 1244 3HG1 VAL 67 3HG1 VAL 67 5.758 5.636 -8.512 1245 1HG2 VAL 67 1HG2 VAL 67 5.327 6.693 -4.977 1246 2HG2 VAL 67 2HG2 VAL 67 4.162 6.870 -6.289 1247 3HG2 VAL 67 3HG2 VAL 67 5.055 5.361 -6.101 1248 H ARG 68 H ARG 68 7.508 9.625 -7.309 1249 HA ARG 68 HA ARG 68 9.291 9.142 -9.357 1250 1HB ARG 68 1HB ARG 68 9.405 11.470 -9.677 1251 2HB ARG 68 2HB ARG 68 7.824 11.195 -8.958 1252 1HG ARG 68 1HG ARG 68 8.953 11.723 -6.724 1253 2HG ARG 68 2HG ARG 68 10.275 12.367 -7.700 1254 1HD ARG 68 1HD ARG 68 8.679 14.110 -7.025 1255 2HD ARG 68 2HD ARG 68 8.764 13.923 -8.776 1256 HE ARG 68 HE ARG 68 6.660 12.406 -7.520 1257 1HH1 ARG 68 1HH1 ARG 68 7.565 15.450 -8.946 1258 2HH1 ARG 68 2HH1 ARG 68 5.939 15.896 -9.343 1259 1HH2 ARG 68 1HH2 ARG 68 4.515 12.981 -8.038 1260 2HH2 ARG 68 2HH2 ARG 68 4.204 14.491 -8.826 1261 H ASP 69 H ASP 69 9.930 9.831 -6.000 1262 HA ASP 69 HA ASP 69 12.632 10.576 -6.198 1263 1HB ASP 69 1HB ASP 69 10.836 10.357 -4.151 1264 2HB ASP 69 2HB ASP 69 11.905 8.997 -3.822 1265 H ILE 70 H ILE 70 11.063 7.435 -6.078 1266 HA ILE 70 HA ILE 70 13.366 5.869 -5.646 1267 HB ILE 70 HB ILE 70 10.869 5.071 -7.145 1268 1HG1 ILE 70 1HG1 ILE 70 11.458 4.650 -4.215 1269 2HG1 ILE 70 2HG1 ILE 70 10.542 6.030 -4.811 1270 1HG2 ILE 70 1HG2 ILE 70 12.033 2.965 -5.631 1271 2HG2 ILE 70 2HG2 ILE 70 11.812 3.078 -7.376 1272 3HG2 ILE 70 3HG2 ILE 70 13.288 3.694 -6.633 1273 1HD1 ILE 70 1HD1 ILE 70 9.400 3.717 -5.949 1274 2HD1 ILE 70 2HD1 ILE 70 9.640 3.403 -4.230 1275 3HD1 ILE 70 3HD1 ILE 70 8.708 4.807 -4.749 1276 H ASP 71 H ASP 71 11.700 6.811 -8.642 1277 HA ASP 71 HA ASP 71 14.018 7.099 -10.162 1278 1HB ASP 71 1HB ASP 71 13.063 4.344 -9.921 1279 2HB ASP 71 2HB ASP 71 13.201 4.883 -11.592 1280 HA PRO 72 HA PRO 72 11.126 8.902 -12.922 1281 1HB PRO 72 1HB PRO 72 12.415 8.674 -15.300 1282 2HB PRO 72 2HB PRO 72 12.920 9.805 -14.039 1283 1HG PRO 72 1HG PRO 72 14.024 7.106 -14.715 1284 2HG PRO 72 2HG PRO 72 14.890 8.600 -14.315 1285 1HD PRO 72 1HD PRO 72 14.502 6.615 -12.515 1286 2HD PRO 72 2HD PRO 72 14.572 8.327 -12.049 1287 H GLN 73 H GLN 73 12.535 5.922 -14.292 1288 HA GLN 73 HA GLN 73 10.417 5.347 -16.037 1289 1HB GLN 73 1HB GLN 73 12.385 3.472 -14.716 1290 2HB GLN 73 2HB GLN 73 11.333 3.039 -16.057 1291 1HG GLN 73 1HG GLN 73 12.647 4.025 -17.569 1292 2HG GLN 73 2HG GLN 73 12.946 5.425 -16.540 1293 1HE2 GLN 73 1HE2 GLN 73 14.248 4.645 -14.459 1294 2HE2 GLN 73 2HE2 GLN 73 15.697 3.786 -14.842 1295 H ASN 74 H ASN 74 11.169 3.743 -12.937 1296 HA ASN 74 HA ASN 74 8.882 2.231 -12.694 1297 1HB ASN 74 1HB ASN 74 9.544 1.817 -10.539 1298 2HB ASN 74 2HB ASN 74 11.037 2.521 -11.154 1299 1HD2 ASN 74 1HD2 ASN 74 8.275 2.978 -9.119 1300 2HD2 ASN 74 2HD2 ASN 74 8.841 4.401 -8.318 1301 H ASP 75 H ASP 75 6.978 2.514 -11.350 1302 HA ASP 75 HA ASP 75 6.164 5.148 -10.558 1303 1HB ASP 75 1HB ASP 75 5.779 4.663 -13.209 1304 2HB ASP 75 2HB ASP 75 4.256 4.083 -12.540 1305 H LEU 76 H LEU 76 3.773 5.104 -9.879 1306 HA LEU 76 HA LEU 76 3.234 2.494 -8.626 1307 1HB LEU 76 1HB LEU 76 3.499 5.057 -7.504 1308 2HB LEU 76 2HB LEU 76 1.785 4.658 -7.418 1309 HG LEU 76 HG LEU 76 2.945 4.061 -5.359 1310 1HD1 LEU 76 1HD1 LEU 76 1.043 2.677 -6.388 1311 2HD1 LEU 76 2HD1 LEU 76 1.984 1.959 -5.081 1312 3HD1 LEU 76 3HD1 LEU 76 2.294 1.489 -6.752 1313 1HD2 LEU 76 1HD2 LEU 76 4.901 2.983 -5.267 1314 2HD2 LEU 76 2HD2 LEU 76 5.043 3.375 -6.981 1315 3HD2 LEU 76 3HD2 LEU 76 4.415 1.803 -6.484 1316 H THR 77 H THR 77 1.204 1.615 -8.728 1317 HA THR 77 HA THR 77 -0.968 3.107 -9.951 1318 HB THR 77 HB THR 77 0.176 2.187 -11.906 1319 HG1 THR 77 HG1 THR 77 -2.088 0.540 -11.585 1320 1HG2 THR 77 1HG2 THR 77 0.501 -0.091 -10.214 1321 2HG2 THR 77 2HG2 THR 77 1.194 0.208 -11.808 1322 3HG2 THR 77 3HG2 THR 77 -0.378 -0.578 -11.663 1323 H PHE 78 H PHE 78 -0.169 1.562 -7.426 1324 HA PHE 78 HA PHE 78 -2.764 0.512 -6.887 1325 1HB PHE 78 1HB PHE 78 -0.640 -1.328 -7.736 1326 2HB PHE 78 2HB PHE 78 -1.396 -1.770 -6.209 1327 HD1 PHE 78 HD1 PHE 78 -1.583 -2.081 -9.688 1328 HD2 PHE 78 HD2 PHE 78 -4.030 -1.688 -6.228 1329 HE1 PHE 78 HE1 PHE 78 -3.472 -3.067 -10.917 1330 HE2 PHE 78 HE2 PHE 78 -5.924 -2.674 -7.451 1331 HZ PHE 78 HZ PHE 78 -5.646 -3.366 -9.798 1332 H LEU 79 H LEU 79 -3.163 0.901 -4.813 1333 HA LEU 79 HA LEU 79 -0.918 0.870 -2.911 1334 1HB LEU 79 1HB LEU 79 -2.629 3.072 -3.661 1335 2HB LEU 79 2HB LEU 79 -2.761 2.724 -1.938 1336 HG LEU 79 HG LEU 79 -0.432 3.126 -1.603 1337 1HD1 LEU 79 1HD1 LEU 79 -0.256 3.314 -4.604 1338 2HD1 LEU 79 2HD1 LEU 79 0.504 2.114 -3.559 1339 3HD1 LEU 79 3HD1 LEU 79 1.031 3.796 -3.499 1340 1HD2 LEU 79 1HD2 LEU 79 -2.224 5.065 -2.448 1341 2HD2 LEU 79 2HD2 LEU 79 -0.754 5.407 -3.360 1342 3HD2 LEU 79 3HD2 LEU 79 -0.703 5.336 -1.597 1343 H ARG 80 H ARG 80 -1.354 -0.962 -1.814 1344 HA ARG 80 HA ARG 80 -4.068 -1.280 -0.711 1345 1HB ARG 80 1HB ARG 80 -1.965 -3.368 -1.311 1346 2HB ARG 80 2HB ARG 80 -3.483 -3.697 -0.487 1347 1HG ARG 80 1HG ARG 80 -4.080 -4.271 -2.597 1348 2HG ARG 80 2HG ARG 80 -4.484 -2.554 -2.653 1349 1HD ARG 80 1HD ARG 80 -3.238 -3.236 -4.639 1350 2HD ARG 80 2HD ARG 80 -2.324 -2.072 -3.680 1351 HE ARG 80 HE ARG 80 -0.708 -3.655 -3.415 1352 1HH1 ARG 80 1HH1 ARG 80 -3.691 -5.249 -4.242 1353 2HH1 ARG 80 2HH1 ARG 80 -2.972 -6.821 -4.350 1354 1HH2 ARG 80 1HH2 ARG 80 0.250 -5.720 -3.554 1355 2HH2 ARG 80 2HH2 ARG 80 -0.731 -7.089 -3.958 1356 H ILE 81 H ILE 81 -4.216 -0.782 1.365 1357 HA ILE 81 HA ILE 81 -1.846 -1.134 3.078 1358 HB ILE 81 HB ILE 81 -4.217 0.613 3.711 1359 1HG1 ILE 81 1HG1 ILE 81 -1.626 1.399 2.359 1360 2HG1 ILE 81 2HG1 ILE 81 -3.218 1.388 1.608 1361 1HG2 ILE 81 1HG2 ILE 81 -1.753 1.509 4.807 1362 2HG2 ILE 81 2HG2 ILE 81 -3.184 0.917 5.649 1363 3HG2 ILE 81 3HG2 ILE 81 -1.924 -0.212 5.153 1364 1HD1 ILE 81 1HD1 ILE 81 -3.581 3.451 2.302 1365 2HD1 ILE 81 2HD1 ILE 81 -3.320 2.966 3.978 1366 3HD1 ILE 81 3HD1 ILE 81 -1.956 3.485 2.987 1367 H ARG 82 H ARG 82 -2.031 -2.155 5.058 1368 HA ARG 82 HA ARG 82 -4.577 -3.563 5.534 1369 1HB ARG 82 1HB ARG 82 -2.179 -4.736 4.892 1370 2HB ARG 82 2HB ARG 82 -2.166 -4.808 6.649 1371 1HG ARG 82 1HG ARG 82 -4.644 -5.700 6.212 1372 2HG ARG 82 2HG ARG 82 -3.885 -6.212 4.703 1373 1HD ARG 82 1HD ARG 82 -3.495 -8.041 6.039 1374 2HD ARG 82 2HD ARG 82 -2.017 -7.113 6.291 1375 HE ARG 82 HE ARG 82 -3.618 -6.247 8.283 1376 1HH1 ARG 82 1HH1 ARG 82 -2.684 -9.419 7.195 1377 2HH1 ARG 82 2HH1 ARG 82 -2.798 -10.135 8.768 1378 1HH2 ARG 82 1HH2 ARG 82 -3.772 -7.178 10.359 1379 2HH2 ARG 82 2HH2 ARG 82 -3.418 -8.859 10.567 1380 H SER 83 H SER 83 -5.523 -2.558 7.194 1381 HA SER 83 HA SER 83 -3.873 -1.636 9.436 1382 1HB SER 83 1HB SER 83 -6.496 -0.836 9.922 1383 2HB SER 83 2HB SER 83 -5.207 0.163 9.251 1384 HG SER 83 HG SER 83 -7.318 -0.155 8.036 1385 H LYS 84 H LYS 84 -5.310 -1.718 11.586 1386 HA LYS 84 HA LYS 84 -5.535 -4.510 12.201 1387 1HB LYS 84 1HB LYS 84 -5.895 -1.975 13.777 1388 2HB LYS 84 2HB LYS 84 -6.324 -3.536 14.465 1389 1HG LYS 84 1HG LYS 84 -3.895 -4.180 13.710 1390 2HG LYS 84 2HG LYS 84 -3.648 -2.434 13.778 1391 1HD LYS 84 1HD LYS 84 -3.074 -3.090 15.921 1392 2HD LYS 84 2HD LYS 84 -4.768 -2.634 16.118 1393 1HE LYS 84 1HE LYS 84 -5.093 -4.653 16.999 1394 2HE LYS 84 2HE LYS 84 -4.861 -5.305 15.377 1395 1HZ LYS 84 1HZ LYS 84 -3.436 -6.251 17.236 1396 2HZ LYS 84 2HZ LYS 84 -2.574 -4.797 17.180 1397 3HZ LYS 84 3HZ LYS 84 -2.639 -5.795 15.816 1398 H LYS 85 H LYS 85 -7.720 -1.981 11.319 1399 HA LYS 85 HA LYS 85 -10.076 -3.333 12.302 1400 1HB LYS 85 1HB LYS 85 -9.465 -0.760 10.986 1401 2HB LYS 85 2HB LYS 85 -11.038 -1.446 10.603 1402 1HG LYS 85 1HG LYS 85 -10.257 -1.358 13.458 1403 2HG LYS 85 2HG LYS 85 -10.647 0.172 12.669 1404 1HD LYS 85 1HD LYS 85 -12.488 -2.141 12.295 1405 2HD LYS 85 2HD LYS 85 -12.513 -1.279 13.835 1406 1HE LYS 85 1HE LYS 85 -12.513 0.757 11.987 1407 2HE LYS 85 2HE LYS 85 -13.512 -0.473 11.214 1408 1HZ LYS 85 1HZ LYS 85 -13.921 0.612 13.949 1409 2HZ LYS 85 2HZ LYS 85 -14.883 -0.559 13.200 1410 3HZ LYS 85 3HZ LYS 85 -14.834 1.015 12.583 1411 H ASN 86 H ASN 86 -8.671 -2.611 9.114 1412 HA ASN 86 HA ASN 86 -9.342 -5.071 7.976 1413 1HB ASN 86 1HB ASN 86 -11.123 -4.015 6.346 1414 2HB ASN 86 2HB ASN 86 -11.616 -4.671 7.904 1415 1HD2 ASN 86 1HD2 ASN 86 -12.691 -3.398 9.250 1416 2HD2 ASN 86 2HD2 ASN 86 -12.885 -1.690 9.075 1417 H GLU 87 H GLU 87 -9.025 -5.091 5.593 1418 HA GLU 87 HA GLU 87 -6.851 -3.321 4.905 1419 1HB GLU 87 1HB GLU 87 -6.938 -5.811 4.397 1420 2HB GLU 87 2HB GLU 87 -8.106 -5.421 3.142 1421 1HG GLU 87 1HG GLU 87 -6.383 -3.873 2.168 1422 2HG GLU 87 2HG GLU 87 -5.232 -4.564 3.310 1423 H ILE 88 H ILE 88 -6.764 -1.986 3.054 1424 HA ILE 88 HA ILE 88 -9.327 -1.350 1.779 1425 HB ILE 88 HB ILE 88 -7.476 0.740 2.932 1426 1HG1 ILE 88 1HG1 ILE 88 -9.958 1.086 4.072 1427 2HG1 ILE 88 2HG1 ILE 88 -9.815 -0.667 4.004 1428 1HG2 ILE 88 1HG2 ILE 88 -10.086 0.979 1.446 1429 2HG2 ILE 88 2HG2 ILE 88 -9.273 2.310 2.268 1430 3HG2 ILE 88 3HG2 ILE 88 -8.499 1.516 0.897 1431 1HD1 ILE 88 1HD1 ILE 88 -7.694 1.100 5.183 1432 2HD1 ILE 88 2HD1 ILE 88 -9.025 0.421 6.121 1433 3HD1 ILE 88 3HD1 ILE 88 -7.865 -0.649 5.334 1434 H MET 89 H MET 89 -8.948 -1.773 -0.298 1435 HA MET 89 HA MET 89 -6.324 -1.280 -1.451 1436 1HB MET 89 1HB MET 89 -8.825 -2.588 -2.514 1437 2HB MET 89 2HB MET 89 -7.404 -2.303 -3.510 1438 1HG MET 89 1HG MET 89 -6.193 -3.930 -2.499 1439 2HG MET 89 2HG MET 89 -6.993 -3.714 -0.944 1440 1HE MET 89 1HE MET 89 -9.538 -4.251 -4.069 1441 2HE MET 89 2HE MET 89 -7.850 -4.388 -4.561 1442 3HE MET 89 3HE MET 89 -8.885 -5.817 -4.549 1443 H VAL 90 H VAL 90 -5.819 0.391 -2.732 1444 HA VAL 90 HA VAL 90 -7.924 1.935 -4.030 1445 HB VAL 90 HB VAL 90 -5.944 3.190 -2.124 1446 1HG1 VAL 90 1HG1 VAL 90 -7.725 4.330 -4.226 1447 2HG1 VAL 90 2HG1 VAL 90 -7.442 5.248 -2.746 1448 3HG1 VAL 90 3HG1 VAL 90 -6.083 4.786 -3.772 1449 1HG2 VAL 90 1HG2 VAL 90 -7.870 2.127 -1.030 1450 2HG2 VAL 90 2HG2 VAL 90 -7.904 3.882 -0.863 1451 3HG2 VAL 90 3HG2 VAL 90 -8.958 3.087 -2.032 1452 H ALA 91 H ALA 91 -7.329 2.484 -6.023 1453 HA ALA 91 HA ALA 91 -4.551 3.074 -6.639 1454 1HB ALA 91 1HB ALA 91 -4.345 1.454 -8.402 1455 2HB ALA 91 2HB ALA 91 -4.759 0.617 -6.905 1456 3HB ALA 91 3HB ALA 91 -5.995 0.890 -8.133 1457 HA PRO 92 HA PRO 92 -6.357 5.952 -9.421 1458 1HB PRO 92 1HB PRO 92 -4.398 6.156 -11.289 1459 2HB PRO 92 2HB PRO 92 -4.254 6.843 -9.667 1460 1HG PRO 92 1HG PRO 92 -3.150 4.276 -10.742 1461 2HG PRO 92 2HG PRO 92 -2.370 5.480 -9.698 1462 1HD PRO 92 1HD PRO 92 -3.420 3.177 -8.734 1463 2HD PRO 92 2HD PRO 92 -3.403 4.685 -7.797 1464 H ASP 93 H ASP 93 -8.079 5.314 -10.577 1465 HA ASP 93 HA ASP 93 -7.826 3.198 -12.559 1466 1HB ASP 93 1HB ASP 93 -10.294 4.769 -11.799 1467 2HB ASP 93 2HB ASP 93 -10.233 3.247 -12.685 1468 H LYS 94 H LYS 94 -9.696 3.922 -14.427 1469 HA LYS 94 HA LYS 94 -8.273 5.345 -16.299 1470 1HB LYS 94 1HB LYS 94 -10.912 4.261 -16.076 1471 2HB LYS 94 2HB LYS 94 -11.020 5.857 -16.806 1472 1HG LYS 94 1HG LYS 94 -9.749 5.244 -18.644 1473 2HG LYS 94 2HG LYS 94 -9.036 3.860 -17.813 1474 1HD LYS 94 1HD LYS 94 -10.957 2.566 -18.062 1475 2HD LYS 94 2HD LYS 94 -11.983 3.974 -18.347 1476 1HE LYS 94 1HE LYS 94 -10.615 4.316 -20.477 1477 2HE LYS 94 2HE LYS 94 -10.014 2.680 -20.212 1478 1HZ LYS 94 1HZ LYS 94 -12.700 2.414 -19.952 1479 2HZ LYS 94 2HZ LYS 94 -11.808 2.043 -21.340 1480 3HZ LYS 94 3HZ LYS 94 -12.563 3.550 -21.199 1481 H ASP 95 H ASP 95 -10.905 6.598 -14.249 1482 HA ASP 95 HA ASP 95 -9.635 9.206 -14.213 1483 1HB ASP 95 1HB ASP 95 -12.092 8.614 -15.753 1484 2HB ASP 95 2HB ASP 95 -12.145 10.063 -14.752 1485 H TYR 96 H TYR 96 -10.614 6.906 -12.437 1486 HA TYR 96 HA TYR 96 -11.763 8.644 -10.385 1487 1HB TYR 96 1HB TYR 96 -13.315 6.701 -9.762 1488 2HB TYR 96 2HB TYR 96 -13.751 7.657 -11.174 1489 HD1 TYR 96 HD1 TYR 96 -12.695 4.391 -9.965 1490 HD2 TYR 96 HD2 TYR 96 -13.465 6.726 -13.437 1491 HE1 TYR 96 HE1 TYR 96 -12.769 2.340 -11.320 1492 HE2 TYR 96 HE2 TYR 96 -13.542 4.681 -14.802 1493 HH TYR 96 HH TYR 96 -13.822 2.360 -14.627 1494 H PHE 97 H PHE 97 -11.915 7.300 -8.246 1495 HA PHE 97 HA PHE 97 -9.459 5.688 -8.012 1496 1HB PHE 97 1HB PHE 97 -10.537 7.863 -6.242 1497 2HB PHE 97 2HB PHE 97 -9.478 6.619 -5.585 1498 HD1 PHE 97 HD1 PHE 97 -9.478 9.834 -6.690 1499 HD2 PHE 97 HD2 PHE 97 -7.382 6.185 -7.329 1500 HE1 PHE 97 HE1 PHE 97 -7.518 11.100 -7.471 1501 HE2 PHE 97 HE2 PHE 97 -5.419 7.445 -8.110 1502 HZ PHE 97 HZ PHE 97 -5.484 9.906 -8.181 1503 H LEU 98 H LEU 98 -10.219 3.653 -7.893 1504 HA LEU 98 HA LEU 98 -12.657 2.944 -6.606 1505 1HB LEU 98 1HB LEU 98 -11.036 1.742 -8.418 1506 2HB LEU 98 2HB LEU 98 -10.625 0.847 -6.956 1507 HG LEU 98 HG LEU 98 -13.503 1.106 -7.389 1508 1HD1 LEU 98 1HD1 LEU 98 -11.780 -0.255 -9.445 1509 2HD1 LEU 98 2HD1 LEU 98 -13.019 0.973 -9.703 1510 3HD1 LEU 98 3HD1 LEU 98 -13.480 -0.650 -9.192 1511 1HD2 LEU 98 1HD2 LEU 98 -13.512 -1.149 -6.701 1512 2HD2 LEU 98 2HD2 LEU 98 -12.257 -0.363 -5.743 1513 3HD2 LEU 98 3HD2 LEU 98 -11.814 -1.367 -7.125 1514 H ILE 99 H ILE 99 -13.036 2.081 -4.613 1515 HA ILE 99 HA ILE 99 -10.742 1.732 -2.810 1516 HB ILE 99 HB ILE 99 -13.282 3.177 -2.048 1517 1HG1 ILE 99 1HG1 ILE 99 -11.052 4.847 -1.703 1518 2HG1 ILE 99 2HG1 ILE 99 -10.844 4.113 -3.289 1519 1HG2 ILE 99 1HG2 ILE 99 -10.740 2.691 -0.502 1520 2HG2 ILE 99 2HG2 ILE 99 -12.117 3.642 0.050 1521 3HG2 ILE 99 3HG2 ILE 99 -12.293 1.907 -0.216 1522 1HD1 ILE 99 1HD1 ILE 99 -12.033 6.247 -3.391 1523 2HD1 ILE 99 2HD1 ILE 99 -13.024 4.908 -3.970 1524 3HD1 ILE 99 3HD1 ILE 99 -13.302 5.580 -2.364 1525 H VAL 100 H VAL 100 -10.781 -0.332 -2.222 1526 HA VAL 100 HA VAL 100 -13.388 -1.591 -1.668 1527 HB VAL 100 HB VAL 100 -10.821 -3.019 -2.366 1528 1HG1 VAL 100 1HG1 VAL 100 -13.626 -4.086 -2.502 1529 2HG1 VAL 100 2HG1 VAL 100 -12.104 -4.980 -2.509 1530 3HG1 VAL 100 3HG1 VAL 100 -12.655 -4.187 -1.033 1531 1HG2 VAL 100 1HG2 VAL 100 -11.160 -2.449 -4.487 1532 2HG2 VAL 100 2HG2 VAL 100 -12.690 -3.325 -4.436 1533 3HG2 VAL 100 3HG2 VAL 100 -12.648 -1.600 -4.068 1534 H ILE 101 H ILE 101 -13.770 -1.708 0.440 1535 HA ILE 101 HA ILE 101 -11.508 -2.202 2.260 1536 HB ILE 101 HB ILE 101 -14.186 -0.958 2.892 1537 1HG1 ILE 101 1HG1 ILE 101 -11.743 0.612 3.303 1538 2HG1 ILE 101 2HG1 ILE 101 -12.049 0.214 1.616 1539 1HG2 ILE 101 1HG2 ILE 101 -12.201 -0.499 4.883 1540 2HG2 ILE 101 2HG2 ILE 101 -13.748 -1.331 5.034 1541 3HG2 ILE 101 3HG2 ILE 101 -12.304 -2.232 4.571 1542 1HD1 ILE 101 1HD1 ILE 101 -13.046 2.315 2.039 1543 2HD1 ILE 101 2HD1 ILE 101 -14.357 1.139 1.925 1544 3HD1 ILE 101 3HD1 ILE 101 -13.830 1.723 3.504 1545 H GLN 102 H GLN 102 -11.448 -4.052 3.361 1546 HA GLN 102 HA GLN 102 -13.780 -5.434 4.239 1547 1HB GLN 102 1HB GLN 102 -13.684 -7.388 2.896 1548 2HB GLN 102 2HB GLN 102 -13.663 -6.027 1.783 1549 1HG GLN 102 1HG GLN 102 -11.206 -6.251 1.623 1550 2HG GLN 102 2HG GLN 102 -11.306 -7.687 2.641 1551 1HE2 GLN 102 1HE2 GLN 102 -11.167 -6.609 -0.468 1552 2HE2 GLN 102 2HE2 GLN 102 -11.804 -7.994 -1.280 1553 H ASN 103 H ASN 103 -13.131 -7.665 5.149 1554 HA ASN 103 HA ASN 103 -11.232 -7.342 7.122 1555 1HB ASN 103 1HB ASN 103 -12.750 -9.604 6.009 1556 2HB ASN 103 2HB ASN 103 -11.248 -10.061 6.807 1557 1HD2 ASN 103 1HD2 ASN 103 -14.365 -9.930 7.344 1558 2HD2 ASN 103 2HD2 ASN 103 -14.410 -9.492 9.015 1559 HA PRO 104 HA PRO 104 -7.258 -8.046 5.401 1560 1HB PRO 104 1HB PRO 104 -6.040 -9.527 7.322 1561 2HB PRO 104 2HB PRO 104 -6.401 -7.808 7.519 1562 1HG PRO 104 1HG PRO 104 -7.904 -10.188 8.537 1563 2HG PRO 104 2HG PRO 104 -7.516 -8.671 9.368 1564 1HD PRO 104 1HD PRO 104 -9.950 -9.157 8.285 1565 2HD PRO 104 2HD PRO 104 -9.246 -7.529 8.359 1566 H THR 105 H THR 105 -6.028 -9.508 4.237 1567 HA THR 105 HA THR 105 -7.175 -12.210 3.993 1568 HB THR 105 HB THR 105 -6.114 -12.235 1.720 1569 HG1 THR 105 HG1 THR 105 -5.716 -9.939 0.974 1570 1HG2 THR 105 1HG2 THR 105 -8.224 -10.207 2.414 1571 2HG2 THR 105 2HG2 THR 105 -8.430 -11.823 1.739 1572 3HG2 THR 105 3HG2 THR 105 -7.756 -10.531 0.745 1573 H GLU 106 H GLU 106 -4.193 -10.370 4.285 1574 HA GLU 106 HA GLU 106 -2.588 -12.800 4.303 1575 1HB GLU 106 1HB GLU 106 -2.108 -10.091 3.632 1576 2HB GLU 106 2HB GLU 106 -1.088 -10.463 5.014 1577 1HG GLU 106 1HG GLU 106 -1.166 -12.333 2.694 1578 2HG GLU 106 2HG GLU 106 -0.218 -10.851 2.597 Start of MODEL 20 1 H MET 11 H MET 11 17.719 -8.556 15.318 2 HA MET 11 HA MET 11 17.755 -8.087 12.607 3 1HB MET 11 1HB MET 11 19.842 -8.725 14.629 4 2HB MET 11 2HB MET 11 20.305 -8.811 12.934 5 1HG MET 11 1HG MET 11 18.837 -6.395 13.465 6 2HG MET 11 2HG MET 11 20.210 -6.550 14.558 7 1HE MET 11 1HE MET 11 20.775 -7.746 10.388 8 2HE MET 11 2HE MET 11 19.206 -7.555 11.171 9 3HE MET 11 3HE MET 11 19.850 -6.261 10.160 10 H ALA 12 H ALA 12 18.703 -11.088 14.271 11 HA ALA 12 HA ALA 12 19.456 -12.602 12.092 12 1HB ALA 12 1HB ALA 12 19.205 -14.499 13.438 13 2HB ALA 12 2HB ALA 12 19.530 -13.194 14.579 14 3HB ALA 12 3HB ALA 12 17.882 -13.782 14.358 15 H GLU 13 H GLU 13 16.204 -12.004 13.343 16 HA GLU 13 HA GLU 13 14.753 -13.815 11.840 17 1HB GLU 13 1HB GLU 13 13.950 -12.178 13.653 18 2HB GLU 13 2HB GLU 13 13.783 -11.011 12.348 19 1HG GLU 13 1HG GLU 13 11.954 -12.010 11.502 20 2HG GLU 13 2HG GLU 13 12.523 -13.632 11.892 21 H VAL 14 H VAL 14 15.587 -10.462 10.972 22 HA VAL 14 HA VAL 14 14.437 -10.530 8.400 23 HB VAL 14 HB VAL 14 16.775 -8.820 9.250 24 1HG1 VAL 14 1HG1 VAL 14 14.870 -8.815 6.980 25 2HG1 VAL 14 2HG1 VAL 14 15.328 -7.252 7.658 26 3HG1 VAL 14 3HG1 VAL 14 16.568 -8.342 7.038 27 1HG2 VAL 14 1HG2 VAL 14 15.319 -8.255 10.912 28 2HG2 VAL 14 2HG2 VAL 14 14.728 -7.183 9.642 29 3HG2 VAL 14 3HG2 VAL 14 13.895 -8.702 9.971 30 H GLU 15 H GLU 15 17.632 -11.387 9.596 31 HA GLU 15 HA GLU 15 18.895 -11.638 7.079 32 1HB GLU 15 1HB GLU 15 19.491 -12.809 9.791 33 2HB GLU 15 2HB GLU 15 20.498 -13.136 8.388 34 1HG GLU 15 1HG GLU 15 21.031 -10.806 8.159 35 2HG GLU 15 2HG GLU 15 19.904 -10.384 9.447 36 H GLU 16 H GLU 16 17.243 -13.975 9.171 37 HA GLU 16 HA GLU 16 17.762 -16.286 7.706 38 1HB GLU 16 1HB GLU 16 16.369 -15.709 9.984 39 2HB GLU 16 2HB GLU 16 15.068 -16.132 8.880 40 1HG GLU 16 1HG GLU 16 16.853 -18.136 8.424 41 2HG GLU 16 2HG GLU 16 17.091 -17.820 10.141 42 H THR 17 H THR 17 15.309 -13.806 7.266 43 HA THR 17 HA THR 17 13.942 -15.247 5.179 44 HB THR 17 HB THR 17 13.688 -12.366 6.066 45 HG1 THR 17 HG1 THR 17 12.660 -13.342 7.644 46 1HG2 THR 17 1HG2 THR 17 12.432 -13.907 3.878 47 2HG2 THR 17 2HG2 THR 17 12.701 -12.171 4.034 48 3HG2 THR 17 3HG2 THR 17 11.344 -12.931 4.865 49 H LEU 18 H LEU 18 16.514 -12.921 5.400 50 HA LEU 18 HA LEU 18 16.411 -12.082 2.666 51 1HB LEU 18 1HB LEU 18 17.963 -11.485 5.025 52 2HB LEU 18 2HB LEU 18 19.001 -11.657 3.611 53 HG LEU 18 HG LEU 18 17.152 -10.015 2.586 54 1HD1 LEU 18 1HD1 LEU 18 15.754 -9.731 4.444 55 2HD1 LEU 18 2HD1 LEU 18 16.751 -8.277 4.404 56 3HD1 LEU 18 3HD1 LEU 18 17.116 -9.564 5.553 57 1HD2 LEU 18 1HD2 LEU 18 19.363 -8.964 4.332 58 2HD2 LEU 18 2HD2 LEU 18 18.722 -8.270 2.843 59 3HD2 LEU 18 3HD2 LEU 18 19.661 -9.762 2.788 60 H LYS 19 H LYS 19 18.392 -14.376 4.506 61 HA LYS 19 HA LYS 19 20.098 -15.146 2.419 62 1HB LYS 19 1HB LYS 19 20.659 -15.733 4.672 63 2HB LYS 19 2HB LYS 19 19.156 -16.623 4.878 64 1HG LYS 19 1HG LYS 19 20.051 -18.485 4.070 65 2HG LYS 19 2HG LYS 19 20.695 -17.647 2.657 66 1HD LYS 19 1HD LYS 19 22.645 -18.325 3.651 67 2HD LYS 19 2HD LYS 19 22.444 -16.743 4.408 68 1HE LYS 19 1HE LYS 19 21.044 -18.829 5.856 69 2HE LYS 19 2HE LYS 19 22.766 -19.177 5.702 70 1HZ LYS 19 1HZ LYS 19 23.286 -17.552 7.116 71 2HZ LYS 19 2HZ LYS 19 21.656 -17.565 7.568 72 3HZ LYS 19 3HZ LYS 19 22.206 -16.450 6.421 73 H ARG 20 H ARG 20 16.839 -16.098 3.221 74 HA ARG 20 HA ARG 20 16.819 -18.371 1.452 75 1HB ARG 20 1HB ARG 20 15.390 -18.022 3.568 76 2HB ARG 20 2HB ARG 20 14.379 -17.000 2.554 77 1HG ARG 20 1HG ARG 20 13.261 -18.902 2.171 78 2HG ARG 20 2HG ARG 20 14.556 -19.214 1.013 79 1HD ARG 20 1HD ARG 20 15.749 -20.541 2.618 80 2HD ARG 20 2HD ARG 20 14.613 -20.101 3.892 81 HE ARG 20 HE ARG 20 13.032 -21.281 2.048 82 1HH1 ARG 20 1HH1 ARG 20 15.993 -22.236 3.610 83 2HH1 ARG 20 2HH1 ARG 20 15.636 -23.930 3.541 84 1HH2 ARG 20 1HH2 ARG 20 12.551 -23.509 1.950 85 2HH2 ARG 20 2HH2 ARG 20 13.678 -24.653 2.596 86 H LEU 21 H LEU 21 15.928 -14.992 1.302 87 HA LEU 21 HA LEU 21 14.466 -15.198 -1.150 88 1HB LEU 21 1HB LEU 21 15.310 -13.073 0.688 89 2HB LEU 21 2HB LEU 21 15.219 -12.584 -1.002 90 HG LEU 21 HG LEU 21 12.886 -13.150 -1.100 91 1HD1 LEU 21 1HD1 LEU 21 12.153 -14.829 0.157 92 2HD1 LEU 21 2HD1 LEU 21 12.106 -13.694 1.505 93 3HD1 LEU 21 3HD1 LEU 21 13.530 -14.704 1.253 94 1HD2 LEU 21 1HD2 LEU 21 13.370 -10.944 -0.271 95 2HD2 LEU 21 2HD2 LEU 21 13.585 -11.561 1.367 96 3HD2 LEU 21 3HD2 LEU 21 11.990 -11.596 0.612 97 H GLN 22 H GLN 22 17.680 -13.905 -0.315 98 HA GLN 22 HA GLN 22 18.473 -13.344 -2.951 99 1HB GLN 22 1HB GLN 22 19.605 -13.162 -0.362 100 2HB GLN 22 2HB GLN 22 20.741 -14.066 -1.355 101 1HG GLN 22 1HG GLN 22 21.110 -11.602 -1.304 102 2HG GLN 22 2HG GLN 22 20.926 -12.294 -2.915 103 1HE2 GLN 22 1HE2 GLN 22 18.836 -11.006 -0.347 104 2HE2 GLN 22 2HE2 GLN 22 17.862 -10.037 -1.393 105 H SER 23 H SER 23 18.116 -16.303 -1.309 106 HA SER 23 HA SER 23 20.045 -17.756 -2.903 107 1HB SER 23 1HB SER 23 18.294 -18.340 -0.602 108 2HB SER 23 2HB SER 23 18.525 -19.686 -1.717 109 HG SER 23 HG SER 23 20.545 -18.194 -0.395 110 H GLN 24 H GLN 24 16.741 -16.853 -3.112 111 HA GLN 24 HA GLN 24 16.231 -18.854 -5.198 112 1HB GLN 24 1HB GLN 24 13.876 -18.305 -4.946 113 2HB GLN 24 2HB GLN 24 14.574 -18.703 -3.382 114 1HG GLN 24 1HG GLN 24 14.574 -16.456 -2.693 115 2HG GLN 24 2HG GLN 24 14.284 -15.872 -4.331 116 1HE2 GLN 24 1HE2 GLN 24 12.730 -15.021 -2.253 117 2HE2 GLN 24 2HE2 GLN 24 11.135 -15.666 -2.411 118 H LYS 25 H LYS 25 15.376 -18.224 -7.225 119 HA LYS 25 HA LYS 25 16.480 -15.757 -8.208 120 1HB LYS 25 1HB LYS 25 16.328 -18.050 -9.413 121 2HB LYS 25 2HB LYS 25 14.679 -17.569 -9.790 122 1HG LYS 25 1HG LYS 25 16.194 -15.363 -10.493 123 2HG LYS 25 2HG LYS 25 17.173 -16.742 -10.998 124 1HD LYS 25 1HD LYS 25 14.291 -16.879 -11.635 125 2HD LYS 25 2HD LYS 25 15.229 -15.669 -12.514 126 1HE LYS 25 1HE LYS 25 16.857 -17.494 -13.083 127 2HE LYS 25 2HE LYS 25 15.709 -18.641 -12.395 128 1HZ LYS 25 1HZ LYS 25 15.334 -18.584 -14.712 129 2HZ LYS 25 2HZ LYS 25 15.319 -16.893 -14.756 130 3HZ LYS 25 3HZ LYS 25 14.052 -17.730 -14.011 131 H GLY 26 H GLY 26 15.419 -13.936 -8.863 132 1HA GLY 26 1HA GLY 26 13.261 -12.986 -9.654 133 2HA GLY 26 2HA GLY 26 12.512 -13.866 -8.330 134 H VAL 27 H VAL 27 14.225 -13.332 -6.250 135 HA VAL 27 HA VAL 27 13.333 -10.885 -5.303 136 HB VAL 27 HB VAL 27 15.804 -12.413 -4.475 137 1HG1 VAL 27 1HG1 VAL 27 14.767 -10.954 -2.315 138 2HG1 VAL 27 2HG1 VAL 27 16.295 -10.692 -3.159 139 3HG1 VAL 27 3HG1 VAL 27 14.844 -9.831 -3.672 140 1HG2 VAL 27 1HG2 VAL 27 13.555 -13.563 -4.335 141 2HG2 VAL 27 2HG2 VAL 27 14.462 -13.450 -2.826 142 3HG2 VAL 27 3HG2 VAL 27 13.114 -12.354 -3.130 143 H GLN 28 H GLN 28 13.838 -8.861 -5.792 144 HA GLN 28 HA GLN 28 16.130 -8.296 -7.465 145 1HB GLN 28 1HB GLN 28 13.661 -6.892 -6.667 146 2HB GLN 28 2HB GLN 28 15.059 -5.858 -6.926 147 1HG GLN 28 1HG GLN 28 15.328 -6.746 -9.169 148 2HG GLN 28 2HG GLN 28 13.964 -7.834 -8.914 149 1HE2 GLN 28 1HE2 GLN 28 12.679 -7.027 -10.509 150 2HE2 GLN 28 2HE2 GLN 28 11.996 -5.440 -10.476 151 H GLY 29 H GLY 29 15.211 -7.973 -4.130 152 1HA GLY 29 1HA GLY 29 17.607 -7.785 -2.958 153 2HA GLY 29 2HA GLY 29 17.385 -6.138 -3.528 154 H ILE 30 H ILE 30 17.522 -7.348 -0.786 155 HA ILE 30 HA ILE 30 14.943 -6.327 0.215 156 HB ILE 30 HB ILE 30 16.727 -8.330 1.600 157 1HG1 ILE 30 1HG1 ILE 30 14.177 -9.395 0.855 158 2HG1 ILE 30 2HG1 ILE 30 14.944 -8.718 -0.577 159 1HG2 ILE 30 1HG2 ILE 30 14.757 -8.655 3.053 160 2HG2 ILE 30 2HG2 ILE 30 15.408 -7.019 3.140 161 3HG2 ILE 30 3HG2 ILE 30 13.946 -7.336 2.208 162 1HD1 ILE 30 1HD1 ILE 30 16.994 -10.105 0.567 163 2HD1 ILE 30 2HD1 ILE 30 15.596 -11.112 0.946 164 3HD1 ILE 30 3HD1 ILE 30 15.954 -10.694 -0.729 165 H ILE 31 H ILE 31 15.021 -4.575 1.457 166 HA ILE 31 HA ILE 31 17.632 -3.762 2.551 167 HB ILE 31 HB ILE 31 15.262 -2.029 1.842 168 1HG1 ILE 31 1HG1 ILE 31 17.866 -1.626 0.520 169 2HG1 ILE 31 2HG1 ILE 31 17.059 -3.137 0.116 170 1HG2 ILE 31 1HG2 ILE 31 16.328 -0.993 3.664 171 2HG2 ILE 31 2HG2 ILE 31 17.933 -1.400 3.060 172 3HG2 ILE 31 3HG2 ILE 31 16.963 -0.182 2.233 173 1HD1 ILE 31 1HD1 ILE 31 15.765 -2.061 -1.311 174 2HD1 ILE 31 2HD1 ILE 31 15.142 -1.053 -0.005 175 3HD1 ILE 31 3HD1 ILE 31 16.574 -0.548 -0.902 176 H VAL 32 H VAL 32 17.819 -3.178 4.675 177 HA VAL 32 HA VAL 32 15.405 -3.442 6.346 178 HB VAL 32 HB VAL 32 18.133 -4.258 7.310 179 1HG1 VAL 32 1HG1 VAL 32 15.381 -5.110 8.196 180 2HG1 VAL 32 2HG1 VAL 32 16.917 -5.448 8.998 181 3HG1 VAL 32 3HG1 VAL 32 16.299 -3.797 8.932 182 1HG2 VAL 32 1HG2 VAL 32 17.511 -6.592 6.813 183 2HG2 VAL 32 2HG2 VAL 32 16.087 -6.011 5.951 184 3HG2 VAL 32 3HG2 VAL 32 17.700 -5.620 5.354 185 H VAL 33 H VAL 33 14.957 -1.477 7.100 186 HA VAL 33 HA VAL 33 17.188 0.250 7.949 187 HB VAL 33 HB VAL 33 14.379 1.174 7.365 188 1HG1 VAL 33 1HG1 VAL 33 17.007 2.650 7.492 189 2HG1 VAL 33 2HG1 VAL 33 15.426 3.364 7.170 190 3HG1 VAL 33 3HG1 VAL 33 15.768 2.648 8.746 191 1HG2 VAL 33 1HG2 VAL 33 14.816 0.619 5.230 192 2HG2 VAL 33 2HG2 VAL 33 15.835 2.059 5.251 193 3HG2 VAL 33 3HG2 VAL 33 16.550 0.468 5.515 194 H ASN 34 H ASN 34 17.226 1.096 9.984 195 HA ASN 34 HA ASN 34 15.404 -0.113 11.911 196 1HB ASN 34 1HB ASN 34 16.986 0.805 13.602 197 2HB ASN 34 2HB ASN 34 17.763 -0.260 12.434 198 1HD2 ASN 34 1HD2 ASN 34 19.750 0.730 13.015 199 2HD2 ASN 34 2HD2 ASN 34 20.190 2.267 12.360 200 H THR 35 H THR 35 15.250 1.602 13.943 201 HA THR 35 HA THR 35 13.241 3.402 13.177 202 HB THR 35 HB THR 35 14.268 4.353 15.613 203 HG1 THR 35 HG1 THR 35 14.925 2.607 16.708 204 1HG2 THR 35 1HG2 THR 35 11.922 4.128 15.181 205 2HG2 THR 35 2HG2 THR 35 12.313 3.099 16.559 206 3HG2 THR 35 3HG2 THR 35 12.075 2.385 14.964 207 H GLU 36 H GLU 36 16.677 3.897 13.862 208 HA GLU 36 HA GLU 36 16.676 6.703 13.743 209 1HB GLU 36 1HB GLU 36 18.721 4.563 13.549 210 2HB GLU 36 2HB GLU 36 19.166 6.135 12.902 211 1HG GLU 36 1HG GLU 36 18.109 6.848 15.288 212 2HG GLU 36 2HG GLU 36 18.793 5.271 15.678 213 H GLY 37 H GLY 37 16.566 4.283 11.265 214 1HA GLY 37 1HA GLY 37 15.733 4.880 9.086 215 2HA GLY 37 2HA GLY 37 16.544 6.430 9.249 216 H ILE 38 H ILE 38 18.610 4.144 10.422 217 HA ILE 38 HA ILE 38 20.222 4.250 8.012 218 HB ILE 38 HB ILE 38 20.864 3.004 10.687 219 1HG1 ILE 38 1HG1 ILE 38 21.703 5.685 9.565 220 2HG1 ILE 38 2HG1 ILE 38 20.452 5.457 10.781 221 1HG2 ILE 38 1HG2 ILE 38 22.688 3.745 8.404 222 2HG2 ILE 38 2HG2 ILE 38 23.164 3.013 9.936 223 3HG2 ILE 38 3HG2 ILE 38 22.167 2.107 8.799 224 1HD1 ILE 38 1HD1 ILE 38 22.634 4.130 11.825 225 2HD1 ILE 38 2HD1 ILE 38 23.324 5.570 11.074 226 3HD1 ILE 38 3HD1 ILE 38 22.053 5.730 12.287 227 HA PRO 39 HA PRO 39 18.950 0.260 6.585 228 1HB PRO 39 1HB PRO 39 20.909 -0.085 4.738 229 2HB PRO 39 2HB PRO 39 19.538 1.003 4.492 230 1HG PRO 39 1HG PRO 39 22.331 1.642 5.359 231 2HG PRO 39 2HG PRO 39 21.297 2.495 4.198 232 1HD PRO 39 1HD PRO 39 21.640 3.348 6.745 233 2HD PRO 39 2HD PRO 39 20.123 3.586 5.855 234 H ILE 40 H ILE 40 19.552 -0.659 8.717 235 HA ILE 40 HA ILE 40 22.046 -1.504 9.505 236 HB ILE 40 HB ILE 40 20.795 -3.478 10.579 237 1HG1 ILE 40 1HG1 ILE 40 18.397 -1.884 9.660 238 2HG1 ILE 40 2HG1 ILE 40 18.920 -3.382 8.898 239 1HG2 ILE 40 1HG2 ILE 40 21.239 -1.780 12.050 240 2HG2 ILE 40 2HG2 ILE 40 20.383 -0.576 11.089 241 3HG2 ILE 40 3HG2 ILE 40 19.476 -1.743 12.051 242 1HD1 ILE 40 1HD1 ILE 40 18.590 -3.584 11.789 243 2HD1 ILE 40 2HD1 ILE 40 17.109 -3.189 10.917 244 3HD1 ILE 40 3HD1 ILE 40 18.018 -4.641 10.499 245 H LYS 41 H LYS 41 19.864 -3.004 7.185 246 HA LYS 41 HA LYS 41 22.075 -4.718 6.306 247 1HB LYS 41 1HB LYS 41 19.598 -5.604 7.522 248 2HB LYS 41 2HB LYS 41 19.770 -6.248 5.895 249 1HG LYS 41 1HG LYS 41 22.184 -6.437 7.547 250 2HG LYS 41 2HG LYS 41 20.808 -7.379 8.126 251 1HD LYS 41 1HD LYS 41 20.855 -8.789 6.349 252 2HD LYS 41 2HD LYS 41 21.389 -7.533 5.230 253 1HE LYS 41 1HE LYS 41 23.541 -7.795 6.909 254 2HE LYS 41 2HE LYS 41 22.947 -9.450 6.793 255 1HZ LYS 41 1HZ LYS 41 22.882 -8.846 4.257 256 2HZ LYS 41 2HZ LYS 41 24.310 -9.378 4.990 257 3HZ LYS 41 3HZ LYS 41 24.068 -7.728 4.708 258 H SER 42 H SER 42 22.036 -5.282 4.108 259 HA SER 42 HA SER 42 19.904 -4.552 2.368 260 1HB SER 42 1HB SER 42 20.528 -2.307 2.517 261 2HB SER 42 2HB SER 42 22.244 -2.691 2.656 262 HG SER 42 HG SER 42 22.328 -2.391 0.588 263 H THR 43 H THR 43 20.217 -5.285 0.252 264 HA THR 43 HA THR 43 22.714 -6.781 -0.211 265 HB THR 43 HB THR 43 21.549 -8.607 -1.166 266 HG1 THR 43 HG1 THR 43 19.917 -7.689 -2.324 267 1HG2 THR 43 1HG2 THR 43 19.970 -7.737 1.259 268 2HG2 THR 43 2HG2 THR 43 21.523 -8.574 1.293 269 3HG2 THR 43 3HG2 THR 43 20.099 -9.382 0.637 270 H MET 44 H MET 44 20.833 -4.285 -1.228 271 HA MET 44 HA MET 44 21.261 -4.693 -4.083 272 1HB MET 44 1HB MET 44 19.289 -3.392 -2.600 273 2HB MET 44 2HB MET 44 20.210 -2.091 -3.343 274 1HG MET 44 1HG MET 44 19.882 -3.142 -5.540 275 2HG MET 44 2HG MET 44 18.909 -4.395 -4.774 276 1HE MET 44 1HE MET 44 16.765 -4.302 -4.008 277 2HE MET 44 2HE MET 44 16.656 -2.962 -2.866 278 3HE MET 44 3HE MET 44 15.568 -3.030 -4.253 279 H ASP 45 H ASP 45 21.659 -2.127 -4.968 280 HA ASP 45 HA ASP 45 24.450 -1.824 -4.667 281 1HB ASP 45 1HB ASP 45 22.381 -0.718 -6.302 282 2HB ASP 45 2HB ASP 45 23.346 0.603 -5.649 283 H ASN 46 H ASN 46 25.564 0.140 -3.933 284 HA ASN 46 HA ASN 46 24.878 0.770 -1.264 285 1HB ASN 46 1HB ASN 46 27.130 1.068 -2.915 286 2HB ASN 46 2HB ASN 46 26.692 2.702 -2.423 287 1HD2 ASN 46 1HD2 ASN 46 25.674 2.220 0.092 288 2HD2 ASN 46 2HD2 ASN 46 26.946 1.669 1.123 289 HA PRO 47 HA PRO 47 23.728 5.143 -2.979 290 1HB PRO 47 1HB PRO 47 23.481 5.390 -5.671 291 2HB PRO 47 2HB PRO 47 25.005 5.659 -4.818 292 1HG PRO 47 1HG PRO 47 24.070 3.238 -6.310 293 2HG PRO 47 2HG PRO 47 25.666 4.011 -6.320 294 1HD PRO 47 1HD PRO 47 25.134 1.788 -4.868 295 2HD PRO 47 2HD PRO 47 26.299 3.019 -4.339 296 H THR 48 H THR 48 22.532 2.249 -4.528 297 HA THR 48 HA THR 48 19.938 3.310 -5.140 298 HB THR 48 HB THR 48 20.927 0.455 -5.028 299 HG1 THR 48 HG1 THR 48 21.625 2.145 -6.708 300 1HG2 THR 48 1HG2 THR 48 18.304 1.592 -5.996 301 2HG2 THR 48 2HG2 THR 48 18.549 0.428 -4.693 302 3HG2 THR 48 3HG2 THR 48 18.872 -0.036 -6.363 303 H THR 49 H THR 49 21.332 1.371 -2.541 304 HA THR 49 HA THR 49 18.894 0.782 -1.228 305 HB THR 49 HB THR 49 21.716 0.888 -0.148 306 HG1 THR 49 HG1 THR 49 21.284 -0.722 -1.757 307 1HG2 THR 49 1HG2 THR 49 20.111 1.148 1.672 308 2HG2 THR 49 2HG2 THR 49 20.854 -0.451 1.726 309 3HG2 THR 49 3HG2 THR 49 19.216 -0.260 1.101 310 H THR 50 H THR 50 21.207 3.428 -0.953 311 HA THR 50 HA THR 50 20.311 4.628 1.382 312 HB THR 50 HB THR 50 20.979 6.562 -0.716 313 HG1 THR 50 HG1 THR 50 23.236 5.686 -0.695 314 1HG2 THR 50 1HG2 THR 50 21.205 6.382 2.015 315 2HG2 THR 50 2HG2 THR 50 22.008 7.579 1.000 316 3HG2 THR 50 3HG2 THR 50 22.861 6.111 1.474 317 H GLN 51 H GLN 51 19.147 5.070 -1.942 318 HA GLN 51 HA GLN 51 17.253 7.070 -1.371 319 1HB GLN 51 1HB GLN 51 17.902 6.721 -3.641 320 2HB GLN 51 2HB GLN 51 17.423 5.030 -3.586 321 1HG GLN 51 1HG GLN 51 15.196 6.722 -2.935 322 2HG GLN 51 2HG GLN 51 15.914 7.202 -4.471 323 1HE2 GLN 51 1HE2 GLN 51 14.088 4.837 -2.791 324 2HE2 GLN 51 2HE2 GLN 51 13.772 3.801 -4.137 325 H TYR 52 H TYR 52 16.824 3.555 -1.777 326 HA TYR 52 HA TYR 52 14.090 3.492 -1.172 327 1HB TYR 52 1HB TYR 52 16.292 1.487 -1.224 328 2HB TYR 52 2HB TYR 52 14.802 1.041 -0.401 329 HD1 TYR 52 HD1 TYR 52 12.785 0.613 -1.631 330 HD2 TYR 52 HD2 TYR 52 16.286 1.956 -3.641 331 HE1 TYR 52 HE1 TYR 52 11.761 0.031 -3.790 332 HE2 TYR 52 HE2 TYR 52 15.272 1.378 -5.806 333 HH TYR 52 HH TYR 52 12.898 -0.609 -6.252 334 H ALA 53 H ALA 53 16.909 3.597 0.874 335 HA ALA 53 HA ALA 53 15.789 2.712 3.284 336 1HB ALA 53 1HB ALA 53 17.624 4.604 4.057 337 2HB ALA 53 2HB ALA 53 17.973 2.911 3.704 338 3HB ALA 53 3HB ALA 53 18.192 4.135 2.454 339 H SER 54 H SER 54 16.160 6.036 2.049 340 HA SER 54 HA SER 54 14.606 7.143 4.199 341 1HB SER 54 1HB SER 54 16.080 8.191 1.850 342 2HB SER 54 2HB SER 54 14.726 9.168 2.417 343 HG SER 54 HG SER 54 16.385 9.859 3.627 344 H LEU 55 H LEU 55 14.101 6.596 0.728 345 HA LEU 55 HA LEU 55 11.609 7.729 0.412 346 1HB LEU 55 1HB LEU 55 13.170 6.552 -1.282 347 2HB LEU 55 2HB LEU 55 12.273 5.096 -0.853 348 HG LEU 55 HG LEU 55 11.457 6.142 -2.924 349 1HD1 LEU 55 1HD1 LEU 55 9.117 6.050 -2.392 350 2HD1 LEU 55 2HD1 LEU 55 9.450 6.336 -0.685 351 3HD1 LEU 55 3HD1 LEU 55 9.964 4.829 -1.442 352 1HD2 LEU 55 1HD2 LEU 55 10.597 8.433 -1.164 353 2HD2 LEU 55 2HD2 LEU 55 10.350 8.271 -2.903 354 3HD2 LEU 55 3HD2 LEU 55 11.979 8.480 -2.259 355 H MET 56 H MET 56 12.258 4.305 1.191 356 HA MET 56 HA MET 56 9.566 3.630 1.665 357 1HB MET 56 1HB MET 56 12.083 2.334 2.725 358 2HB MET 56 2HB MET 56 10.479 1.616 2.769 359 1HG MET 56 1HG MET 56 11.992 2.358 0.275 360 2HG MET 56 2HG MET 56 11.847 0.734 0.945 361 1HE MET 56 1HE MET 56 10.494 1.364 -2.356 362 2HE MET 56 2HE MET 56 9.423 2.730 -2.043 363 3HE MET 56 3HE MET 56 11.115 2.803 -1.546 364 H HIS 57 H HIS 57 12.182 4.572 3.870 365 HA HIS 57 HA HIS 57 10.914 4.228 6.296 366 1HB HIS 57 1HB HIS 57 13.246 4.828 6.206 367 2HB HIS 57 2HB HIS 57 12.869 6.370 5.444 368 HD1 HIS 57 HD1 HIS 57 12.162 4.595 8.734 369 HD2 HIS 57 HD2 HIS 57 12.696 8.420 7.201 370 HE1 HIS 57 HE1 HIS 57 12.114 6.130 10.726 371 H SER 58 H SER 58 10.809 7.061 4.158 372 HA SER 58 HA SER 58 9.008 8.497 5.869 373 1HB SER 58 1HB SER 58 10.647 9.596 4.318 374 2HB SER 58 2HB SER 58 9.657 9.049 2.965 375 HG SER 58 HG SER 58 8.518 10.534 5.070 376 H PHE 59 H PHE 59 8.719 6.365 3.121 377 HA PHE 59 HA PHE 59 6.163 6.944 2.231 378 1HB PHE 59 1HB PHE 59 7.643 5.355 1.097 379 2HB PHE 59 2HB PHE 59 7.485 4.230 2.442 380 HD1 PHE 59 HD1 PHE 59 4.895 6.252 0.700 381 HD2 PHE 59 HD2 PHE 59 6.409 2.373 1.582 382 HE1 PHE 59 HE1 PHE 59 2.930 5.243 -0.383 383 HE2 PHE 59 HE2 PHE 59 4.447 1.357 0.500 384 HZ PHE 59 HZ PHE 59 2.704 2.792 -0.485 385 H ILE 60 H ILE 60 7.184 5.001 4.988 386 HA ILE 60 HA ILE 60 4.565 4.058 5.626 387 HB ILE 60 HB ILE 60 7.026 4.207 7.371 388 1HG1 ILE 60 1HG1 ILE 60 7.355 2.840 5.355 389 2HG1 ILE 60 2HG1 ILE 60 7.313 1.838 6.801 390 1HG2 ILE 60 1HG2 ILE 60 5.314 2.094 8.122 391 2HG2 ILE 60 2HG2 ILE 60 5.731 3.538 9.042 392 3HG2 ILE 60 3HG2 ILE 60 4.321 3.544 7.984 393 1HD1 ILE 60 1HD1 ILE 60 4.674 2.039 5.779 394 2HD1 ILE 60 2HD1 ILE 60 5.761 1.611 4.458 395 3HD1 ILE 60 3HD1 ILE 60 5.707 0.616 5.913 396 H LEU 61 H LEU 61 6.622 6.678 6.836 397 HA LEU 61 HA LEU 61 4.914 7.534 8.901 398 1HB LEU 61 1HB LEU 61 7.309 8.485 7.569 399 2HB LEU 61 2HB LEU 61 6.231 9.807 8.013 400 HG LEU 61 HG LEU 61 6.277 9.023 10.351 401 1HD1 LEU 61 1HD1 LEU 61 8.511 7.181 9.573 402 2HD1 LEU 61 2HD1 LEU 61 6.838 6.628 9.641 403 3HD1 LEU 61 3HD1 LEU 61 7.616 7.262 11.091 404 1HD2 LEU 61 1HD2 LEU 61 7.891 10.535 10.512 405 2HD2 LEU 61 2HD2 LEU 61 8.421 10.205 8.863 406 3HD2 LEU 61 3HD2 LEU 61 9.072 9.261 10.204 407 H LYS 62 H LYS 62 4.839 8.015 5.475 408 HA LYS 62 HA LYS 62 3.113 10.302 5.512 409 1HB LYS 62 1HB LYS 62 4.621 8.926 3.580 410 2HB LYS 62 2HB LYS 62 2.945 8.777 3.067 411 1HG LYS 62 1HG LYS 62 3.991 10.722 2.066 412 2HG LYS 62 2HG LYS 62 2.694 11.203 3.163 413 1HD LYS 62 1HD LYS 62 4.119 12.473 4.300 414 2HD LYS 62 2HD LYS 62 5.110 11.057 4.655 415 1HE LYS 62 1HE LYS 62 6.137 11.375 2.361 416 2HE LYS 62 2HE LYS 62 5.326 12.940 2.317 417 1HZ LYS 62 1HZ LYS 62 7.726 12.205 3.642 418 2HZ LYS 62 2HZ LYS 62 6.615 12.839 4.747 419 3HZ LYS 62 3HZ LYS 62 7.071 13.745 3.394 420 H ALA 63 H ALA 63 2.622 6.864 4.709 421 HA ALA 63 HA ALA 63 -0.189 7.078 4.428 422 1HB ALA 63 1HB ALA 63 0.463 5.187 3.385 423 2HB ALA 63 2HB ALA 63 1.790 4.893 4.510 424 3HB ALA 63 3HB ALA 63 0.140 4.463 4.961 425 H ARG 64 H ARG 64 1.904 6.128 7.119 426 HA ARG 64 HA ARG 64 -0.072 5.266 8.894 427 1HB ARG 64 1HB ARG 64 2.474 5.090 9.112 428 2HB ARG 64 2HB ARG 64 2.419 6.728 9.749 429 1HG ARG 64 1HG ARG 64 0.488 5.302 11.182 430 2HG ARG 64 2HG ARG 64 1.891 4.237 11.070 431 1HD ARG 64 1HD ARG 64 2.005 7.111 11.971 432 2HD ARG 64 2HD ARG 64 1.894 5.733 13.065 433 HE ARG 64 HE ARG 64 4.081 5.417 11.299 434 1HH1 ARG 64 1HH1 ARG 64 3.055 7.218 14.096 435 2HH1 ARG 64 2HH1 ARG 64 4.663 7.448 14.699 436 1HH2 ARG 64 1HH2 ARG 64 6.202 5.713 12.083 437 2HH2 ARG 64 2HH2 ARG 64 6.452 6.593 13.553 438 H SER 65 H SER 65 1.198 8.499 8.255 439 HA SER 65 HA SER 65 -0.152 9.818 10.354 440 1HB SER 65 1HB SER 65 1.784 10.669 8.863 441 2HB SER 65 2HB SER 65 0.515 11.137 7.731 442 HG SER 65 HG SER 65 1.054 12.113 10.310 443 H THR 66 H THR 66 -1.154 8.751 7.208 444 HA THR 66 HA THR 66 -3.544 10.374 7.159 445 HB THR 66 HB THR 66 -3.376 8.028 5.366 446 HG1 THR 66 HG1 THR 66 -1.777 9.149 4.073 447 1HG2 THR 66 1HG2 THR 66 -3.733 10.947 4.710 448 2HG2 THR 66 2HG2 THR 66 -5.058 9.922 5.262 449 3HG2 THR 66 3HG2 THR 66 -4.223 9.548 3.755 450 H VAL 67 H VAL 67 -2.657 7.072 7.965 451 HA VAL 67 HA VAL 67 -5.119 5.830 8.031 452 HB VAL 67 HB VAL 67 -2.853 5.456 9.995 453 1HG1 VAL 67 1HG1 VAL 67 -4.701 4.394 10.961 454 2HG1 VAL 67 2HG1 VAL 67 -5.312 3.840 9.401 455 3HG1 VAL 67 3HG1 VAL 67 -3.865 3.106 10.094 456 1HG2 VAL 67 1HG2 VAL 67 -3.223 3.477 7.882 457 2HG2 VAL 67 2HG2 VAL 67 -2.804 5.080 7.277 458 3HG2 VAL 67 3HG2 VAL 67 -1.754 4.275 8.443 459 H ARG 68 H ARG 68 -3.651 7.949 10.444 460 HA ARG 68 HA ARG 68 -5.434 7.587 12.541 461 1HB ARG 68 1HB ARG 68 -4.188 10.226 11.764 462 2HB ARG 68 2HB ARG 68 -4.705 9.723 13.368 463 1HG ARG 68 1HG ARG 68 -2.892 7.775 12.611 464 2HG ARG 68 2HG ARG 68 -2.194 9.279 12.007 465 1HD ARG 68 1HD ARG 68 -1.396 8.899 14.239 466 2HD ARG 68 2HD ARG 68 -2.507 10.268 14.260 467 HE ARG 68 HE ARG 68 -3.739 7.738 14.874 468 1HH1 ARG 68 1HH1 ARG 68 -2.063 10.511 16.148 469 2HH1 ARG 68 2HH1 ARG 68 -2.692 10.317 17.751 470 1HH2 ARG 68 1HH2 ARG 68 -4.572 7.472 16.980 471 2HH2 ARG 68 2HH2 ARG 68 -4.118 8.588 18.223 472 H ASP 69 H ASP 69 -5.779 9.420 9.584 473 HA ASP 69 HA ASP 69 -8.145 10.813 10.418 474 1HB ASP 69 1HB ASP 69 -6.346 10.923 8.216 475 2HB ASP 69 2HB ASP 69 -7.967 10.678 7.571 476 H ILE 70 H ILE 70 -7.432 7.757 8.951 477 HA ILE 70 HA ILE 70 -9.984 7.264 7.807 478 HB ILE 70 HB ILE 70 -7.957 5.233 8.748 479 1HG1 ILE 70 1HG1 ILE 70 -8.279 6.522 6.029 480 2HG1 ILE 70 2HG1 ILE 70 -6.987 6.871 7.173 481 1HG2 ILE 70 1HG2 ILE 70 -10.096 4.978 6.642 482 2HG2 ILE 70 2HG2 ILE 70 -9.021 3.711 7.230 483 3HG2 ILE 70 3HG2 ILE 70 -10.252 4.388 8.296 484 1HD1 ILE 70 1HD1 ILE 70 -6.524 4.322 7.014 485 2HD1 ILE 70 2HD1 ILE 70 -7.437 4.443 5.509 486 3HD1 ILE 70 3HD1 ILE 70 -5.974 5.401 5.733 487 H ASP 71 H ASP 71 -8.495 6.314 10.891 488 HA ASP 71 HA ASP 71 -11.122 6.178 12.112 489 1HB ASP 71 1HB ASP 71 -9.484 3.787 11.501 490 2HB ASP 71 2HB ASP 71 -10.177 3.856 13.119 491 HA PRO 72 HA PRO 72 -9.019 7.610 15.683 492 1HB PRO 72 1HB PRO 72 -10.381 6.399 17.695 493 2HB PRO 72 2HB PRO 72 -11.061 7.714 16.731 494 1HG PRO 72 1HG PRO 72 -11.489 4.762 16.477 495 2HG PRO 72 2HG PRO 72 -12.675 6.077 16.379 496 1HD PRO 72 1HD PRO 72 -11.662 4.861 14.181 497 2HD PRO 72 2HD PRO 72 -12.130 6.574 14.195 498 H GLN 73 H GLN 73 -9.715 4.120 15.954 499 HA GLN 73 HA GLN 73 -7.017 3.767 17.084 500 1HB GLN 73 1HB GLN 73 -9.416 1.995 17.563 501 2HB GLN 73 2HB GLN 73 -7.842 1.874 18.338 502 1HG GLN 73 1HG GLN 73 -8.242 4.141 19.311 503 2HG GLN 73 2HG GLN 73 -9.885 4.052 18.678 504 1HE2 GLN 73 1HE2 GLN 73 -10.673 4.211 20.812 505 2HE2 GLN 73 2HE2 GLN 73 -10.657 2.848 21.873 506 H ASN 74 H ASN 74 -5.681 2.299 16.167 507 HA ASN 74 HA ASN 74 -6.434 0.086 14.637 508 1HB ASN 74 1HB ASN 74 -6.919 2.375 13.205 509 2HB ASN 74 2HB ASN 74 -5.297 1.948 12.668 510 1HD2 ASN 74 1HD2 ASN 74 -7.396 1.935 10.924 511 2HD2 ASN 74 2HD2 ASN 74 -7.761 0.310 10.462 512 H ASP 75 H ASP 75 -4.416 -0.281 12.902 513 HA ASP 75 HA ASP 75 -1.876 0.604 13.788 514 1HB ASP 75 1HB ASP 75 -2.979 -1.368 15.422 515 2HB ASP 75 2HB ASP 75 -1.866 -2.242 14.372 516 H LEU 76 H LEU 76 -0.780 0.600 11.950 517 HA LEU 76 HA LEU 76 -1.515 -0.926 9.688 518 1HB LEU 76 1HB LEU 76 0.307 1.171 10.312 519 2HB LEU 76 2HB LEU 76 1.182 -0.087 9.442 520 HG LEU 76 HG LEU 76 0.292 1.726 7.994 521 1HD1 LEU 76 1HD1 LEU 76 -0.208 0.305 6.250 522 2HD1 LEU 76 2HD1 LEU 76 -1.127 -0.800 7.271 523 3HD1 LEU 76 3HD1 LEU 76 0.633 -0.774 7.363 524 1HD2 LEU 76 1HD2 LEU 76 -1.792 2.099 9.283 525 2HD2 LEU 76 2HD2 LEU 76 -2.403 0.558 8.681 526 3HD2 LEU 76 3HD2 LEU 76 -2.070 1.875 7.556 527 H THR 77 H THR 77 -0.708 -2.782 8.829 528 HA THR 77 HA THR 77 1.568 -4.084 10.116 529 HB THR 77 HB THR 77 -0.470 -4.905 11.293 530 HG1 THR 77 HG1 THR 77 0.803 -6.582 11.460 531 1HG2 THR 77 1HG2 THR 77 -1.748 -4.807 8.958 532 2HG2 THR 77 2HG2 THR 77 -2.228 -5.915 10.244 533 3HG2 THR 77 3HG2 THR 77 -1.238 -6.494 8.904 534 H PHE 78 H PHE 78 0.659 -2.897 7.431 535 HA PHE 78 HA PHE 78 2.173 -4.548 5.764 536 1HB PHE 78 1HB PHE 78 -0.409 -5.581 6.179 537 2HB PHE 78 2HB PHE 78 -0.438 -4.860 4.573 538 HD1 PHE 78 HD1 PHE 78 -0.143 -7.849 6.054 539 HD2 PHE 78 HD2 PHE 78 2.079 -5.368 3.404 540 HE1 PHE 78 HE1 PHE 78 0.990 -9.837 5.147 541 HE2 PHE 78 HE2 PHE 78 3.214 -7.351 2.493 542 HZ PHE 78 HZ PHE 78 2.669 -9.589 3.364 543 H LEU 79 H LEU 79 2.621 -3.548 3.844 544 HA LEU 79 HA LEU 79 0.911 -1.503 2.763 545 1HB LEU 79 1HB LEU 79 2.328 -0.515 4.710 546 2HB LEU 79 2HB LEU 79 3.645 -0.578 3.540 547 HG LEU 79 HG LEU 79 2.391 0.903 2.048 548 1HD1 LEU 79 1HD1 LEU 79 0.425 1.875 3.873 549 2HD1 LEU 79 2HD1 LEU 79 0.205 0.139 3.657 550 3HD1 LEU 79 3HD1 LEU 79 0.207 1.208 2.254 551 1HD2 LEU 79 1HD2 LEU 79 2.842 1.823 4.875 552 2HD2 LEU 79 2HD2 LEU 79 2.397 2.929 3.575 553 3HD2 LEU 79 3HD2 LEU 79 3.902 2.012 3.477 554 H ARG 80 H ARG 80 0.956 -2.406 0.774 555 HA ARG 80 HA ARG 80 3.595 -2.676 -0.512 556 1HB ARG 80 1HB ARG 80 1.102 -4.282 -1.106 557 2HB ARG 80 2HB ARG 80 2.666 -4.466 -1.889 558 1HG ARG 80 1HG ARG 80 3.551 -5.621 -0.163 559 2HG ARG 80 2HG ARG 80 2.638 -4.721 1.050 560 1HD ARG 80 1HD ARG 80 1.257 -6.454 1.212 561 2HD ARG 80 2HD ARG 80 0.737 -6.137 -0.442 562 HE ARG 80 HE ARG 80 2.483 -8.244 0.459 563 1HH1 ARG 80 1HH1 ARG 80 1.463 -6.306 -2.247 564 2HH1 ARG 80 2HH1 ARG 80 1.963 -7.466 -3.433 565 1HH2 ARG 80 1HH2 ARG 80 3.146 -9.779 -1.093 566 2HH2 ARG 80 2HH2 ARG 80 2.920 -9.441 -2.776 567 H ILE 81 H ILE 81 3.558 -2.381 -2.883 568 HA ILE 81 HA ILE 81 1.346 -0.813 -3.937 569 HB ILE 81 HB ILE 81 3.067 0.902 -4.800 570 1HG1 ILE 81 1HG1 ILE 81 4.548 -0.189 -2.396 571 2HG1 ILE 81 2HG1 ILE 81 5.072 -0.315 -4.072 572 1HG2 ILE 81 1HG2 ILE 81 1.344 0.861 -2.652 573 2HG2 ILE 81 2HG2 ILE 81 2.854 1.439 -1.950 574 3HG2 ILE 81 3HG2 ILE 81 2.136 2.288 -3.319 575 1HD1 ILE 81 1HD1 ILE 81 4.744 2.240 -2.517 576 2HD1 ILE 81 2HD1 ILE 81 6.269 1.439 -2.896 577 3HD1 ILE 81 3HD1 ILE 81 5.279 2.109 -4.192 578 H ARG 82 H ARG 82 1.035 -2.455 -5.437 579 HA ARG 82 HA ARG 82 3.055 -3.619 -7.008 580 1HB ARG 82 1HB ARG 82 0.330 -3.984 -6.675 581 2HB ARG 82 2HB ARG 82 0.466 -3.437 -8.341 582 1HG ARG 82 1HG ARG 82 2.218 -5.633 -7.316 583 2HG ARG 82 2HG ARG 82 0.562 -5.962 -7.831 584 1HD ARG 82 1HD ARG 82 2.405 -4.418 -9.608 585 2HD ARG 82 2HD ARG 82 2.521 -6.176 -9.534 586 HE ARG 82 HE ARG 82 -0.150 -5.570 -9.941 587 1HH1 ARG 82 1HH1 ARG 82 2.874 -5.122 -11.605 588 2HH1 ARG 82 2HH1 ARG 82 2.161 -5.159 -13.184 589 1HH2 ARG 82 1HH2 ARG 82 -1.102 -5.620 -12.013 590 2HH2 ARG 82 2HH2 ARG 82 -0.101 -5.441 -13.415 591 H SER 83 H SER 83 4.387 -2.439 -8.230 592 HA SER 83 HA SER 83 3.249 -0.274 -9.866 593 1HB SER 83 1HB SER 83 6.142 -0.346 -9.847 594 2HB SER 83 2HB SER 83 5.056 0.949 -9.344 595 HG SER 83 HG SER 83 6.279 -1.044 -7.834 596 H LYS 84 H LYS 84 5.154 0.015 -11.778 597 HA LYS 84 HA LYS 84 4.661 -2.316 -13.442 598 1HB LYS 84 1HB LYS 84 5.760 0.434 -14.008 599 2HB LYS 84 2HB LYS 84 5.733 -0.839 -15.221 600 1HG LYS 84 1HG LYS 84 3.164 -0.895 -14.391 601 2HG LYS 84 2HG LYS 84 3.548 0.812 -14.160 602 1HD LYS 84 1HD LYS 84 2.796 0.771 -16.349 603 2HD LYS 84 2HD LYS 84 4.545 0.645 -16.554 604 1HE LYS 84 1HE LYS 84 4.261 -1.253 -17.670 605 2HE LYS 84 2HE LYS 84 3.540 -1.979 -16.234 606 1HZ LYS 84 1HZ LYS 84 1.429 -1.579 -16.978 607 2HZ LYS 84 2HZ LYS 84 2.214 -1.853 -18.451 608 3HZ LYS 84 3HZ LYS 84 1.881 -0.271 -17.952 609 H LYS 85 H LYS 85 7.258 -0.822 -11.711 610 HA LYS 85 HA LYS 85 9.359 -2.188 -13.128 611 1HB LYS 85 1HB LYS 85 9.155 -0.149 -11.082 612 2HB LYS 85 2HB LYS 85 10.353 -1.359 -10.644 613 1HG LYS 85 1HG LYS 85 10.577 -0.530 -13.418 614 2HG LYS 85 2HG LYS 85 10.751 0.814 -12.286 615 1HD LYS 85 1HD LYS 85 12.201 -1.570 -11.448 616 2HD LYS 85 2HD LYS 85 12.731 -0.962 -13.018 617 1HE LYS 85 1HE LYS 85 12.730 1.347 -11.809 618 2HE LYS 85 2HE LYS 85 12.797 0.371 -10.343 619 1HZ LYS 85 1HZ LYS 85 14.701 -0.054 -12.562 620 2HZ LYS 85 2HZ LYS 85 14.849 -0.518 -10.942 621 3HZ LYS 85 3HZ LYS 85 14.987 1.113 -11.371 622 H ASN 86 H ASN 86 7.934 -2.461 -9.873 623 HA ASN 86 HA ASN 86 7.916 -5.254 -9.826 624 1HB ASN 86 1HB ASN 86 9.798 -5.395 -7.987 625 2HB ASN 86 2HB ASN 86 10.209 -5.490 -9.697 626 1HD2 ASN 86 1HD2 ASN 86 10.089 -3.374 -6.904 627 2HD2 ASN 86 2HD2 ASN 86 11.282 -2.257 -7.464 628 H GLU 87 H GLU 87 7.515 -6.122 -7.599 629 HA GLU 87 HA GLU 87 5.906 -4.187 -6.121 630 1HB GLU 87 1HB GLU 87 4.993 -6.185 -4.967 631 2HB GLU 87 2HB GLU 87 4.789 -6.244 -6.713 632 1HG GLU 87 1HG GLU 87 5.771 -8.218 -6.749 633 2HG GLU 87 2HG GLU 87 7.250 -7.488 -6.127 634 H ILE 88 H ILE 88 6.655 -3.242 -4.353 635 HA ILE 88 HA ILE 88 8.870 -4.527 -2.899 636 HB ILE 88 HB ILE 88 8.123 -1.605 -2.826 637 1HG1 ILE 88 1HG1 ILE 88 10.485 -1.667 -4.145 638 2HG1 ILE 88 2HG1 ILE 88 9.771 -3.167 -4.727 639 1HG2 ILE 88 1HG2 ILE 88 10.021 -3.273 -1.395 640 2HG2 ILE 88 2HG2 ILE 88 10.790 -1.897 -2.183 641 3HG2 ILE 88 3HG2 ILE 88 9.467 -1.636 -1.047 642 1HD1 ILE 88 1HD1 ILE 88 7.875 -1.994 -5.593 643 2HD1 ILE 88 2HD1 ILE 88 8.421 -0.484 -4.863 644 3HD1 ILE 88 3HD1 ILE 88 9.343 -1.212 -6.179 645 H MET 89 H MET 89 7.901 -5.702 -1.328 646 HA MET 89 HA MET 89 5.590 -4.813 0.093 647 1HB MET 89 1HB MET 89 7.479 -7.122 0.341 648 2HB MET 89 2HB MET 89 6.367 -6.773 1.658 649 1HG MET 89 1HG MET 89 4.505 -7.284 0.405 650 2HG MET 89 2HG MET 89 5.330 -7.000 -1.126 651 1HE MET 89 1HE MET 89 6.503 -10.617 1.471 652 2HE MET 89 2HE MET 89 7.247 -9.022 1.578 653 3HE MET 89 3HE MET 89 5.575 -9.252 2.092 654 H VAL 90 H VAL 90 5.447 -3.618 1.886 655 HA VAL 90 HA VAL 90 7.774 -3.318 3.628 656 HB VAL 90 HB VAL 90 6.296 -0.926 2.522 657 1HG1 VAL 90 1HG1 VAL 90 7.019 -0.419 4.710 658 2HG1 VAL 90 2HG1 VAL 90 8.570 -1.224 4.467 659 3HG1 VAL 90 3HG1 VAL 90 8.221 0.290 3.633 660 1HG2 VAL 90 1HG2 VAL 90 8.865 -2.235 1.749 661 2HG2 VAL 90 2HG2 VAL 90 7.606 -1.540 0.727 662 3HG2 VAL 90 3HG2 VAL 90 8.707 -0.484 1.613 663 H ALA 91 H ALA 91 7.232 -3.274 5.723 664 HA ALA 91 HA ALA 91 4.663 -2.280 6.601 665 1HB ALA 91 1HB ALA 91 4.705 -4.905 5.909 666 2HB ALA 91 2HB ALA 91 5.107 -4.993 7.625 667 3HB ALA 91 3HB ALA 91 3.618 -4.201 7.107 668 HA PRO 92 HA PRO 92 6.894 -1.310 10.254 669 1HB PRO 92 1HB PRO 92 4.966 -1.508 12.155 670 2HB PRO 92 2HB PRO 92 5.020 -0.194 10.974 671 1HG PRO 92 1HG PRO 92 3.366 -2.689 10.957 672 2HG PRO 92 2HG PRO 92 2.890 -1.029 10.555 673 1HD PRO 92 1HD PRO 92 3.459 -2.880 8.662 674 2HD PRO 92 2HD PRO 92 3.789 -1.151 8.436 675 H ASP 93 H ASP 93 8.293 -2.438 11.442 676 HA ASP 93 HA ASP 93 7.543 -5.159 12.284 677 1HB ASP 93 1HB ASP 93 9.726 -4.320 10.784 678 2HB ASP 93 2HB ASP 93 10.391 -4.553 12.399 679 H LYS 94 H LYS 94 9.501 -5.668 14.117 680 HA LYS 94 HA LYS 94 8.487 -4.701 16.487 681 1HB LYS 94 1HB LYS 94 10.711 -6.308 15.674 682 2HB LYS 94 2HB LYS 94 11.253 -5.184 16.913 683 1HG LYS 94 1HG LYS 94 8.769 -6.253 17.752 684 2HG LYS 94 2HG LYS 94 9.785 -7.593 17.216 685 1HD LYS 94 1HD LYS 94 11.452 -7.108 18.779 686 2HD LYS 94 2HD LYS 94 10.861 -5.466 19.037 687 1HE LYS 94 1HE LYS 94 9.236 -7.888 19.763 688 2HE LYS 94 2HE LYS 94 10.408 -7.179 20.873 689 1HZ LYS 94 1HZ LYS 94 9.198 -5.062 20.671 690 2HZ LYS 94 2HZ LYS 94 8.241 -6.294 21.324 691 3HZ LYS 94 3HZ LYS 94 8.033 -5.827 19.712 692 H ASP 95 H ASP 95 11.420 -3.564 14.811 693 HA ASP 95 HA ASP 95 10.944 -0.875 15.773 694 1HB ASP 95 1HB ASP 95 13.257 -0.681 16.720 695 2HB ASP 95 2HB ASP 95 12.182 -1.721 17.651 696 H TYR 96 H TYR 96 11.316 -2.561 13.252 697 HA TYR 96 HA TYR 96 12.999 -0.609 11.881 698 1HB TYR 96 1HB TYR 96 14.047 -2.524 10.565 699 2HB TYR 96 2HB TYR 96 14.609 -2.310 12.219 700 HD1 TYR 96 HD1 TYR 96 12.926 -4.515 9.887 701 HD2 TYR 96 HD2 TYR 96 13.843 -3.875 13.992 702 HE1 TYR 96 HE1 TYR 96 12.371 -6.862 10.371 703 HE2 TYR 96 HE2 TYR 96 13.291 -6.220 14.487 704 HH TYR 96 HH TYR 96 13.240 -8.422 13.148 705 H PHE 97 H PHE 97 12.879 -1.048 9.419 706 HA PHE 97 HA PHE 97 10.105 -1.787 8.753 707 1HB PHE 97 1HB PHE 97 11.824 0.487 7.830 708 2HB PHE 97 2HB PHE 97 10.574 -0.144 6.762 709 HD1 PHE 97 HD1 PHE 97 11.208 2.398 8.913 710 HD2 PHE 97 HD2 PHE 97 8.279 -0.616 8.244 711 HE1 PHE 97 HE1 PHE 97 9.532 3.774 10.075 712 HE2 PHE 97 HE2 PHE 97 6.598 0.755 9.404 713 HZ PHE 97 HZ PHE 97 7.223 2.953 10.321 714 H LEU 98 H LEU 98 10.165 -3.723 7.805 715 HA LEU 98 HA LEU 98 12.414 -4.664 6.314 716 1HB LEU 98 1HB LEU 98 10.449 -5.901 7.644 717 2HB LEU 98 2HB LEU 98 9.781 -5.984 6.015 718 HG LEU 98 HG LEU 98 12.556 -6.844 6.112 719 1HD1 LEU 98 1HD1 LEU 98 12.356 -7.791 8.177 720 2HD1 LEU 98 2HD1 LEU 98 11.687 -9.090 7.191 721 3HD1 LEU 98 3HD1 LEU 98 10.608 -7.987 8.044 722 1HD2 LEU 98 1HD2 LEU 98 10.480 -8.764 5.392 723 2HD2 LEU 98 2HD2 LEU 98 11.846 -8.163 4.452 724 3HD2 LEU 98 3HD2 LEU 98 10.351 -7.230 4.531 725 H ILE 99 H ILE 99 12.770 -4.662 4.169 726 HA ILE 99 HA ILE 99 10.611 -3.711 2.409 727 HB ILE 99 HB ILE 99 13.508 -2.955 2.056 728 1HG1 ILE 99 1HG1 ILE 99 12.594 -1.969 4.135 729 2HG1 ILE 99 2HG1 ILE 99 12.937 -0.749 2.914 730 1HG2 ILE 99 1HG2 ILE 99 10.987 -1.884 0.796 731 2HG2 ILE 99 2HG2 ILE 99 12.629 -1.337 0.464 732 3HG2 ILE 99 3HG2 ILE 99 12.140 -2.973 0.026 733 1HD1 ILE 99 1HD1 ILE 99 10.752 -0.591 4.250 734 2HD1 ILE 99 2HD1 ILE 99 10.693 -0.354 2.503 735 3HD1 ILE 99 3HD1 ILE 99 10.192 -1.894 3.201 736 H VAL 100 H VAL 100 10.094 -5.495 1.292 737 HA VAL 100 HA VAL 100 12.267 -7.147 0.195 738 HB VAL 100 HB VAL 100 9.339 -7.814 0.532 739 1HG1 VAL 100 1HG1 VAL 100 9.926 -9.103 -1.278 740 2HG1 VAL 100 2HG1 VAL 100 11.612 -9.238 -0.773 741 3HG1 VAL 100 3HG1 VAL 100 10.365 -10.175 0.051 742 1HG2 VAL 100 1HG2 VAL 100 11.663 -8.083 2.265 743 2HG2 VAL 100 2HG2 VAL 100 9.946 -8.224 2.644 744 3HG2 VAL 100 3HG2 VAL 100 10.823 -9.611 1.998 745 H ILE 101 H ILE 101 12.796 -6.653 -1.824 746 HA ILE 101 HA ILE 101 10.676 -5.754 -3.661 747 HB ILE 101 HB ILE 101 13.650 -5.284 -3.889 748 1HG1 ILE 101 1HG1 ILE 101 12.014 -2.917 -3.615 749 2HG1 ILE 101 2HG1 ILE 101 11.769 -3.997 -2.247 750 1HG2 ILE 101 1HG2 ILE 101 11.380 -4.136 -5.506 751 2HG2 ILE 101 2HG2 ILE 101 13.100 -3.819 -5.730 752 3HG2 ILE 101 3HG2 ILE 101 12.452 -5.430 -6.042 753 1HD1 ILE 101 1HD1 ILE 101 13.549 -2.943 -1.404 754 2HD1 ILE 101 2HD1 ILE 101 14.469 -4.020 -2.455 755 3HD1 ILE 101 3HD1 ILE 101 14.093 -2.381 -2.985 756 H GLN 102 H GLN 102 10.294 -6.851 -5.505 757 HA GLN 102 HA GLN 102 12.166 -8.580 -6.753 758 1HB GLN 102 1HB GLN 102 11.100 -10.719 -6.334 759 2HB GLN 102 2HB GLN 102 11.593 -9.992 -4.810 760 1HG GLN 102 1HG GLN 102 9.302 -9.265 -4.407 761 2HG GLN 102 2HG GLN 102 8.804 -9.977 -5.941 762 1HE2 GLN 102 1HE2 GLN 102 8.369 -10.471 -2.902 763 2HE2 GLN 102 2HE2 GLN 102 8.482 -12.190 -2.779 764 H ASN 103 H ASN 103 11.082 -9.893 -8.526 765 HA ASN 103 HA ASN 103 9.662 -8.248 -10.223 766 1HB ASN 103 1HB ASN 103 8.942 -10.545 -11.285 767 2HB ASN 103 2HB ASN 103 10.630 -10.044 -11.312 768 1HD2 ASN 103 1HD2 ASN 103 11.394 -12.133 -11.439 769 2HD2 ASN 103 2HD2 ASN 103 11.327 -13.232 -10.107 770 HA PRO 104 HA PRO 104 5.439 -8.296 -9.034 771 1HB PRO 104 1HB PRO 104 4.165 -8.397 -11.430 772 2HB PRO 104 2HB PRO 104 5.013 -6.958 -10.853 773 1HG PRO 104 1HG PRO 104 5.937 -9.056 -12.778 774 2HG PRO 104 2HG PRO 104 6.114 -7.294 -12.874 775 1HD PRO 104 1HD PRO 104 8.124 -8.919 -12.067 776 2HD PRO 104 2HD PRO 104 7.917 -7.272 -11.439 777 H THR 105 H THR 105 3.680 -9.631 -8.657 778 HA THR 105 HA THR 105 4.049 -12.430 -9.469 779 HB THR 105 HB THR 105 2.447 -12.931 -7.592 780 HG1 THR 105 HG1 THR 105 1.413 -11.085 -7.116 781 1HG2 THR 105 1HG2 THR 105 5.158 -11.764 -7.265 782 2HG2 THR 105 2HG2 THR 105 4.572 -13.387 -6.897 783 3HG2 THR 105 3HG2 THR 105 4.215 -12.051 -5.803 784 H GLU 106 H GLU 106 1.730 -9.792 -9.432 785 HA GLU 106 HA GLU 106 -0.587 -11.116 -10.164 786 1HB GLU 106 1HB GLU 106 0.041 -8.530 -9.749 787 2HB GLU 106 2HB GLU 106 -0.071 -8.523 -11.503 788 1HG GLU 106 1HG GLU 106 -2.292 -9.892 -10.205 789 2HG GLU 106 2HG GLU 106 -2.154 -8.191 -9.766 790 H MET 11 H MET 11 -19.149 3.989 -15.939 791 HA MET 11 HA MET 11 -19.181 3.784 -13.176 792 1HB MET 11 1HB MET 11 -20.472 5.411 -14.623 793 2HB MET 11 2HB MET 11 -21.646 4.127 -14.883 794 1HG MET 11 1HG MET 11 -22.666 5.080 -13.128 795 2HG MET 11 2HG MET 11 -21.532 4.097 -12.206 796 1HE MET 11 1HE MET 11 -21.645 7.082 -9.994 797 2HE MET 11 2HE MET 11 -22.182 5.445 -10.374 798 3HE MET 11 3HE MET 11 -20.503 5.739 -9.919 799 H ALA 12 H ALA 12 -21.286 2.029 -15.463 800 HA ALA 12 HA ALA 12 -22.592 0.398 -13.662 801 1HB ALA 12 1HB ALA 12 -22.463 0.617 -16.422 802 2HB ALA 12 2HB ALA 12 -21.958 -1.041 -16.092 803 3HB ALA 12 3HB ALA 12 -23.513 -0.458 -15.499 804 H GLU 13 H GLU 13 -19.421 -0.050 -15.152 805 HA GLU 13 HA GLU 13 -18.885 -2.661 -14.420 806 1HB GLU 13 1HB GLU 13 -17.477 -0.829 -15.726 807 2HB GLU 13 2HB GLU 13 -16.702 -0.646 -14.159 808 1HG GLU 13 1HG GLU 13 -15.846 -2.797 -14.184 809 2HG GLU 13 2HG GLU 13 -17.008 -3.352 -15.388 810 H VAL 14 H VAL 14 -18.193 0.295 -12.557 811 HA VAL 14 HA VAL 14 -17.160 -1.024 -10.290 812 HB VAL 14 HB VAL 14 -18.492 1.685 -10.432 813 1HG1 VAL 14 1HG1 VAL 14 -18.399 1.227 -8.168 814 2HG1 VAL 14 2HG1 VAL 14 -16.914 0.284 -8.314 815 3HG1 VAL 14 3HG1 VAL 14 -16.860 2.043 -8.444 816 1HG2 VAL 14 1HG2 VAL 14 -16.740 2.001 -11.852 817 2HG2 VAL 14 2HG2 VAL 14 -15.903 2.273 -10.323 818 3HG2 VAL 14 3HG2 VAL 14 -15.778 0.710 -11.132 819 H GLU 15 H GLU 15 -20.422 -0.086 -11.215 820 HA GLU 15 HA GLU 15 -21.648 -0.567 -8.712 821 1HB GLU 15 1HB GLU 15 -22.713 -0.476 -11.530 822 2HB GLU 15 2HB GLU 15 -23.752 -0.790 -10.147 823 1HG GLU 15 1HG GLU 15 -23.210 1.353 -9.193 824 2HG GLU 15 2HG GLU 15 -22.045 1.665 -10.479 825 H GLU 16 H GLU 16 -21.128 -2.600 -11.562 826 HA GLU 16 HA GLU 16 -22.602 -4.829 -10.728 827 1HB GLU 16 1HB GLU 16 -21.122 -4.181 -12.947 828 2HB GLU 16 2HB GLU 16 -20.151 -5.453 -12.217 829 1HG GLU 16 1HG GLU 16 -22.496 -6.663 -12.074 830 2HG GLU 16 2HG GLU 16 -22.858 -5.580 -13.418 831 H THR 17 H THR 17 -19.334 -3.797 -9.979 832 HA THR 17 HA THR 17 -18.650 -6.250 -8.628 833 HB THR 17 HB THR 17 -17.232 -3.579 -8.680 834 HG1 THR 17 HG1 THR 17 -16.909 -4.364 -10.655 835 1HG2 THR 17 1HG2 THR 17 -15.267 -5.037 -7.948 836 2HG2 THR 17 2HG2 THR 17 -16.476 -6.240 -7.498 837 3HG2 THR 17 3HG2 THR 17 -16.479 -4.655 -6.725 838 H LEU 18 H LEU 18 -20.004 -3.162 -7.781 839 HA LEU 18 HA LEU 18 -19.513 -3.371 -4.969 840 1HB LEU 18 1HB LEU 18 -20.681 -1.471 -6.791 841 2HB LEU 18 2HB LEU 18 -21.705 -1.677 -5.371 842 HG LEU 18 HG LEU 18 -19.405 -1.317 -4.109 843 1HD1 LEU 18 1HD1 LEU 18 -17.887 -1.122 -5.862 844 2HD1 LEU 18 2HD1 LEU 18 -18.210 0.550 -5.406 845 3HD1 LEU 18 3HD1 LEU 18 -18.985 -0.140 -6.832 846 1HD2 LEU 18 1HD2 LEU 18 -21.396 0.046 -3.823 847 2HD2 LEU 18 2HD2 LEU 18 -21.052 0.897 -5.329 848 3HD2 LEU 18 3HD2 LEU 18 -19.963 1.067 -3.952 849 H LYS 19 H LYS 19 -22.279 -4.011 -7.086 850 HA LYS 19 HA LYS 19 -24.203 -4.588 -5.175 851 1HB LYS 19 1HB LYS 19 -23.851 -5.004 -8.002 852 2HB LYS 19 2HB LYS 19 -24.588 -6.428 -7.278 853 1HG LYS 19 1HG LYS 19 -26.376 -5.071 -7.944 854 2HG LYS 19 2HG LYS 19 -26.247 -4.842 -6.199 855 1HD LYS 19 1HD LYS 19 -26.413 -2.660 -6.837 856 2HD LYS 19 2HD LYS 19 -24.663 -2.852 -6.963 857 1HE LYS 19 1HE LYS 19 -25.293 -1.806 -8.963 858 2HE LYS 19 2HE LYS 19 -25.081 -3.502 -9.394 859 1HZ LYS 19 1HZ LYS 19 -27.727 -3.178 -8.609 860 2HZ LYS 19 2HZ LYS 19 -27.141 -3.494 -10.164 861 3HZ LYS 19 3HZ LYS 19 -27.378 -1.897 -9.658 862 H ARG 20 H ARG 20 -21.929 -6.837 -6.742 863 HA ARG 20 HA ARG 20 -22.738 -9.107 -5.266 864 1HB ARG 20 1HB ARG 20 -21.463 -9.154 -7.420 865 2HB ARG 20 2HB ARG 20 -20.042 -8.612 -6.537 866 1HG ARG 20 1HG ARG 20 -19.616 -10.820 -6.454 867 2HG ARG 20 2HG ARG 20 -20.691 -10.747 -5.056 868 1HD ARG 20 1HD ARG 20 -22.379 -11.817 -6.128 869 2HD ARG 20 2HD ARG 20 -21.977 -11.108 -7.691 870 HE ARG 20 HE ARG 20 -19.926 -12.827 -7.197 871 1HH1 ARG 20 1HH1 ARG 20 -23.393 -13.129 -7.303 872 2HH1 ARG 20 2HH1 ARG 20 -23.363 -14.781 -7.825 873 1HH2 ARG 20 1HH2 ARG 20 -19.874 -15.001 -7.884 874 2HH2 ARG 20 2HH2 ARG 20 -21.361 -15.845 -8.154 875 H LEU 21 H LEU 21 -20.043 -6.832 -4.840 876 HA LEU 21 HA LEU 21 -18.819 -8.031 -2.654 877 1HB LEU 21 1HB LEU 21 -18.878 -5.359 -3.857 878 2HB LEU 21 2HB LEU 21 -18.482 -5.373 -2.140 879 HG LEU 21 HG LEU 21 -16.572 -6.791 -2.547 880 1HD1 LEU 21 1HD1 LEU 21 -16.291 -6.818 -5.328 881 2HD1 LEU 21 2HD1 LEU 21 -17.946 -7.338 -5.012 882 3HD1 LEU 21 3HD1 LEU 21 -16.595 -8.193 -4.266 883 1HD2 LEU 21 1HD2 LEU 21 -16.162 -4.439 -2.755 884 2HD2 LEU 21 2HD2 LEU 21 -16.742 -4.436 -4.421 885 3HD2 LEU 21 3HD2 LEU 21 -15.246 -5.276 -4.008 886 H GLN 22 H GLN 22 -21.435 -5.630 -2.714 887 HA GLN 22 HA GLN 22 -21.716 -5.224 0.014 888 1HB GLN 22 1HB GLN 22 -23.131 -4.526 -2.312 889 2HB GLN 22 2HB GLN 22 -24.303 -5.310 -1.261 890 1HG GLN 22 1HG GLN 22 -24.536 -3.354 -0.252 891 2HG GLN 22 2HG GLN 22 -22.932 -3.612 0.432 892 1HE2 GLN 22 1HE2 GLN 22 -21.102 -2.872 -0.936 893 2HE2 GLN 22 2HE2 GLN 22 -21.303 -1.401 -1.817 894 H SER 23 H SER 23 -22.618 -7.950 -1.928 895 HA SER 23 HA SER 23 -24.307 -9.088 0.146 896 1HB SER 23 1HB SER 23 -24.446 -9.289 -2.537 897 2HB SER 23 2HB SER 23 -23.494 -10.732 -2.189 898 HG SER 23 HG SER 23 -26.138 -10.168 -1.614 899 H GLN 24 H GLN 24 -21.050 -9.299 -1.011 900 HA GLN 24 HA GLN 24 -20.304 -11.821 -0.093 901 1HB GLN 24 1HB GLN 24 -18.712 -9.264 -0.298 902 2HB GLN 24 2HB GLN 24 -17.996 -10.825 0.078 903 1HG GLN 24 1HG GLN 24 -18.951 -11.667 -2.086 904 2HG GLN 24 2HG GLN 24 -19.371 -9.996 -2.460 905 1HE2 GLN 24 1HE2 GLN 24 -17.176 -8.672 -1.476 906 2HE2 GLN 24 2HE2 GLN 24 -15.781 -9.103 -2.398 907 H LYS 25 H LYS 25 -18.638 -12.085 1.760 908 HA LYS 25 HA LYS 25 -19.770 -10.818 4.168 909 1HB LYS 25 1HB LYS 25 -20.266 -13.180 4.133 910 2HB LYS 25 2HB LYS 25 -18.585 -13.572 3.794 911 1HG LYS 25 1HG LYS 25 -18.037 -13.526 5.949 912 2HG LYS 25 2HG LYS 25 -18.888 -12.004 6.218 913 1HD LYS 25 1HD LYS 25 -20.702 -14.236 5.787 914 2HD LYS 25 2HD LYS 25 -19.636 -14.488 7.171 915 1HE LYS 25 1HE LYS 25 -20.749 -12.996 8.395 916 2HE LYS 25 2HE LYS 25 -20.667 -11.789 7.112 917 1HZ LYS 25 1HZ LYS 25 -22.915 -12.133 7.317 918 2HZ LYS 25 2HZ LYS 25 -22.760 -13.785 7.647 919 3HZ LYS 25 3HZ LYS 25 -22.539 -13.214 6.070 920 H GLY 26 H GLY 26 -18.315 -9.087 4.211 921 1HA GLY 26 1HA GLY 26 -16.163 -9.099 5.781 922 2HA GLY 26 2HA GLY 26 -15.460 -9.657 4.270 923 H VAL 27 H VAL 27 -17.605 -7.887 2.922 924 HA VAL 27 HA VAL 27 -15.896 -5.648 2.508 925 HB VAL 27 HB VAL 27 -18.772 -6.054 1.672 926 1HG1 VAL 27 1HG1 VAL 27 -18.591 -3.818 1.334 927 2HG1 VAL 27 2HG1 VAL 27 -16.830 -3.862 1.234 928 3HG1 VAL 27 3HG1 VAL 27 -17.806 -4.359 -0.149 929 1HG2 VAL 27 1HG2 VAL 27 -16.182 -6.526 0.200 930 2HG2 VAL 27 2HG2 VAL 27 -17.320 -7.757 0.748 931 3HG2 VAL 27 3HG2 VAL 27 -17.789 -6.624 -0.519 932 H GLN 28 H GLN 28 -15.814 -3.761 3.540 933 HA GLN 28 HA GLN 28 -17.753 -3.247 5.661 934 1HB GLN 28 1HB GLN 28 -14.952 -2.509 5.139 935 2HB GLN 28 2HB GLN 28 -15.926 -1.227 5.845 936 1HG GLN 28 1HG GLN 28 -14.663 -2.741 7.439 937 2HG GLN 28 2HG GLN 28 -16.371 -2.462 7.774 938 1HE2 GLN 28 1HE2 GLN 28 -13.979 -4.758 6.778 939 2HE2 GLN 28 2HE2 GLN 28 -14.979 -6.163 6.889 940 H GLY 29 H GLY 29 -16.665 -1.960 2.600 941 1HA GLY 29 1HA GLY 29 -18.909 -0.651 1.850 942 2HA GLY 29 2HA GLY 29 -18.117 0.522 2.893 943 H ILE 30 H ILE 30 -18.654 0.129 -0.152 944 HA ILE 30 HA ILE 30 -15.902 0.607 -1.070 945 HB ILE 30 HB ILE 30 -18.303 0.067 -2.811 946 1HG1 ILE 30 1HG1 ILE 30 -16.942 -2.231 -2.966 947 2HG1 ILE 30 2HG1 ILE 30 -16.513 -1.784 -1.318 948 1HG2 ILE 30 1HG2 ILE 30 -16.434 -0.664 -4.384 949 2HG2 ILE 30 2HG2 ILE 30 -16.610 1.066 -4.090 950 3HG2 ILE 30 3HG2 ILE 30 -15.338 0.158 -3.273 951 1HD1 ILE 30 1HD1 ILE 30 -19.360 -1.533 -1.897 952 2HD1 ILE 30 2HD1 ILE 30 -18.735 -3.175 -2.054 953 3HD1 ILE 30 3HD1 ILE 30 -18.535 -2.296 -0.538 954 H ILE 31 H ILE 31 -15.364 2.446 -2.200 955 HA ILE 31 HA ILE 31 -17.449 4.491 -2.522 956 HB ILE 31 HB ILE 31 -14.714 4.979 -1.338 957 1HG1 ILE 31 1HG1 ILE 31 -16.995 5.855 0.221 958 2HG1 ILE 31 2HG1 ILE 31 -17.078 4.128 -0.106 959 1HG2 ILE 31 1HG2 ILE 31 -16.938 6.866 -2.082 960 2HG2 ILE 31 2HG2 ILE 31 -15.596 7.305 -1.027 961 3HG2 ILE 31 3HG2 ILE 31 -15.287 6.844 -2.701 962 1HD1 ILE 31 1HD1 ILE 31 -14.718 5.539 1.112 963 2HD1 ILE 31 2HD1 ILE 31 -15.950 4.649 2.008 964 3HD1 ILE 31 3HD1 ILE 31 -14.900 3.801 0.872 965 H VAL 32 H VAL 32 -17.203 5.869 -4.258 966 HA VAL 32 HA VAL 32 -14.921 5.321 -6.042 967 HB VAL 32 HB VAL 32 -17.673 6.010 -7.049 968 1HG1 VAL 32 1HG1 VAL 32 -15.344 4.656 -8.403 969 2HG1 VAL 32 2HG1 VAL 32 -16.848 5.193 -9.155 970 3HG1 VAL 32 3HG1 VAL 32 -15.706 6.378 -8.519 971 1HG2 VAL 32 1HG2 VAL 32 -16.497 3.261 -6.651 972 2HG2 VAL 32 2HG2 VAL 32 -17.885 3.939 -5.800 973 3HG2 VAL 32 3HG2 VAL 32 -17.983 3.617 -7.531 974 H VAL 33 H VAL 33 -13.690 7.089 -6.013 975 HA VAL 33 HA VAL 33 -14.999 9.725 -6.008 976 HB VAL 33 HB VAL 33 -12.088 9.233 -5.422 977 1HG1 VAL 33 1HG1 VAL 33 -12.005 11.442 -5.229 978 2HG1 VAL 33 2HG1 VAL 33 -13.706 11.541 -5.690 979 3HG1 VAL 33 3HG1 VAL 33 -13.259 11.396 -3.989 980 1HG2 VAL 33 1HG2 VAL 33 -13.357 7.878 -3.857 981 2HG2 VAL 33 2HG2 VAL 33 -12.664 9.273 -3.031 982 3HG2 VAL 33 3HG2 VAL 33 -14.376 9.260 -3.455 983 H ASN 34 H ASN 34 -14.602 11.190 -7.599 984 HA ASN 34 HA ASN 34 -13.264 10.179 -9.983 985 1HB ASN 34 1HB ASN 34 -14.287 12.157 -11.094 986 2HB ASN 34 2HB ASN 34 -15.473 11.117 -10.312 987 1HD2 ASN 34 1HD2 ASN 34 -16.925 12.871 -10.282 988 2HD2 ASN 34 2HD2 ASN 34 -16.776 14.132 -9.110 989 H THR 35 H THR 35 -12.365 12.333 -11.273 990 HA THR 35 HA THR 35 -9.885 12.867 -10.045 991 HB THR 35 HB THR 35 -9.376 14.252 -11.913 992 HG1 THR 35 HG1 THR 35 -12.169 14.307 -12.489 993 1HG2 THR 35 1HG2 THR 35 -11.311 12.198 -12.977 994 2HG2 THR 35 2HG2 THR 35 -9.714 11.795 -12.345 995 3HG2 THR 35 3HG2 THR 35 -9.867 12.830 -13.765 996 H GLU 36 H GLU 36 -12.856 14.754 -10.318 997 HA GLU 36 HA GLU 36 -11.861 17.181 -9.313 998 1HB GLU 36 1HB GLU 36 -14.527 15.969 -9.719 999 2HB GLU 36 2HB GLU 36 -14.447 17.247 -8.514 1000 1HG GLU 36 1HG GLU 36 -13.019 18.069 -10.842 1001 2HG GLU 36 2HG GLU 36 -14.619 17.496 -11.309 1002 H GLY 37 H GLY 37 -12.708 14.214 -7.753 1003 1HA GLY 37 1HA GLY 37 -11.852 13.741 -5.560 1004 2HA GLY 37 2HA GLY 37 -12.034 15.443 -5.164 1005 H ILE 38 H ILE 38 -14.711 14.440 -6.870 1006 HA ILE 38 HA ILE 38 -16.284 14.316 -4.413 1007 HB ILE 38 HB ILE 38 -17.280 14.462 -7.258 1008 1HG1 ILE 38 1HG1 ILE 38 -16.932 16.713 -5.266 1009 2HG1 ILE 38 2HG1 ILE 38 -15.855 16.408 -6.625 1010 1HG2 ILE 38 1HG2 ILE 38 -18.883 13.604 -5.594 1011 2HG2 ILE 38 2HG2 ILE 38 -18.668 15.080 -4.655 1012 3HG2 ILE 38 3HG2 ILE 38 -19.375 15.158 -6.269 1013 1HD1 ILE 38 1HD1 ILE 38 -18.175 17.973 -6.581 1014 2HD1 ILE 38 2HD1 ILE 38 -17.172 17.561 -7.972 1015 3HD1 ILE 38 3HD1 ILE 38 -18.556 16.552 -7.552 1016 HA PRO 39 HA PRO 39 -16.684 9.918 -4.704 1017 1HB PRO 39 1HB PRO 39 -18.688 9.639 -2.894 1018 2HB PRO 39 2HB PRO 39 -17.013 9.962 -2.431 1019 1HG PRO 39 1HG PRO 39 -19.313 11.863 -2.669 1020 2HG PRO 39 2HG PRO 39 -18.071 11.761 -1.406 1021 1HD PRO 39 1HD PRO 39 -17.971 13.585 -3.405 1022 2HD PRO 39 2HD PRO 39 -16.511 12.888 -2.675 1023 H ILE 40 H ILE 40 -17.514 10.144 -6.933 1024 HA ILE 40 HA ILE 40 -20.097 10.667 -7.700 1025 HB ILE 40 HB ILE 40 -19.685 8.895 -9.519 1026 1HG1 ILE 40 1HG1 ILE 40 -16.896 8.998 -8.358 1027 2HG1 ILE 40 2HG1 ILE 40 -18.001 7.650 -8.117 1028 1HG2 ILE 40 1HG2 ILE 40 -18.694 10.501 -10.773 1029 2HG2 ILE 40 2HG2 ILE 40 -19.072 11.490 -9.364 1030 3HG2 ILE 40 3HG2 ILE 40 -17.450 10.831 -9.568 1031 1HD1 ILE 40 1HD1 ILE 40 -17.658 6.840 -10.178 1032 2HD1 ILE 40 2HD1 ILE 40 -17.582 8.442 -10.912 1033 3HD1 ILE 40 3HD1 ILE 40 -16.171 7.783 -10.085 1034 H LYS 41 H LYS 41 -18.802 7.709 -6.297 1035 HA LYS 41 HA LYS 41 -21.560 6.756 -5.938 1036 1HB LYS 41 1HB LYS 41 -19.552 5.537 -7.540 1037 2HB LYS 41 2HB LYS 41 -19.797 4.516 -6.129 1038 1HG LYS 41 1HG LYS 41 -22.185 5.503 -7.601 1039 2HG LYS 41 2HG LYS 41 -21.224 4.204 -8.310 1040 1HD LYS 41 1HD LYS 41 -22.311 2.768 -7.004 1041 2HD LYS 41 2HD LYS 41 -21.549 3.532 -5.606 1042 1HE LYS 41 1HE LYS 41 -23.743 3.788 -5.032 1043 2HE LYS 41 2HE LYS 41 -23.503 5.278 -5.944 1044 1HZ LYS 41 1HZ LYS 41 -25.547 3.885 -6.474 1045 2HZ LYS 41 2HZ LYS 41 -24.489 2.816 -7.248 1046 3HZ LYS 41 3HZ LYS 41 -24.615 4.416 -7.783 1047 H SER 42 H SER 42 -22.031 5.926 -3.964 1048 HA SER 42 HA SER 42 -19.926 5.163 -2.128 1049 1HB SER 42 1HB SER 42 -20.033 7.607 -1.822 1050 2HB SER 42 2HB SER 42 -21.759 7.486 -1.480 1051 HG SER 42 HG SER 42 -21.267 6.999 0.492 1052 H THR 43 H THR 43 -20.599 3.655 -0.706 1053 HA THR 43 HA THR 43 -23.499 3.150 -0.534 1054 HB THR 43 HB THR 43 -22.804 1.302 -1.737 1055 HG1 THR 43 HG1 THR 43 -22.115 0.114 0.689 1056 1HG2 THR 43 1HG2 THR 43 -20.220 1.766 -0.380 1057 2HG2 THR 43 2HG2 THR 43 -20.559 1.314 -2.050 1058 3HG2 THR 43 3HG2 THR 43 -20.599 0.091 -0.780 1059 H MET 44 H MET 44 -20.761 4.010 1.152 1060 HA MET 44 HA MET 44 -21.542 2.716 3.646 1061 1HB MET 44 1HB MET 44 -19.091 3.512 2.573 1062 2HB MET 44 2HB MET 44 -19.397 4.656 3.873 1063 1HG MET 44 1HG MET 44 -19.801 2.709 5.382 1064 2HG MET 44 2HG MET 44 -19.264 1.661 4.072 1065 1HE MET 44 1HE MET 44 -15.646 3.057 3.480 1066 2HE MET 44 2HE MET 44 -16.435 1.482 3.394 1067 3HE MET 44 3HE MET 44 -17.194 2.890 2.650 1068 H ASP 45 H ASP 45 -20.809 4.616 5.498 1069 HA ASP 45 HA ASP 45 -23.153 6.167 5.706 1070 1HB ASP 45 1HB ASP 45 -20.785 5.658 7.301 1071 2HB ASP 45 2HB ASP 45 -21.262 7.351 7.393 1072 H ASN 46 H ASN 46 -23.506 8.379 5.506 1073 HA ASN 46 HA ASN 46 -22.359 9.670 3.332 1074 1HB ASN 46 1HB ASN 46 -24.433 10.194 5.138 1075 2HB ASN 46 2HB ASN 46 -23.349 11.575 5.280 1076 1HD2 ASN 46 1HD2 ASN 46 -22.386 11.707 2.690 1077 2HD2 ASN 46 2HD2 ASN 46 -23.678 12.153 1.633 1078 HA PRO 47 HA PRO 47 -19.704 12.276 6.424 1079 1HB PRO 47 1HB PRO 47 -19.562 11.385 8.985 1080 2HB PRO 47 2HB PRO 47 -20.797 12.522 8.430 1081 1HG PRO 47 1HG PRO 47 -20.992 9.562 8.836 1082 2HG PRO 47 2HG PRO 47 -22.152 10.831 9.273 1083 1HD PRO 47 1HD PRO 47 -22.440 9.292 7.064 1084 2HD PRO 47 2HD PRO 47 -22.989 10.979 7.131 1085 H THR 48 H THR 48 -19.850 8.796 6.676 1086 HA THR 48 HA THR 48 -17.107 8.438 7.420 1087 HB THR 48 HB THR 48 -19.088 6.468 6.261 1088 HG1 THR 48 HG1 THR 48 -19.149 5.779 8.494 1089 1HG2 THR 48 1HG2 THR 48 -16.920 5.602 5.822 1090 2HG2 THR 48 2HG2 THR 48 -17.493 4.783 7.275 1091 3HG2 THR 48 3HG2 THR 48 -16.326 6.098 7.406 1092 H THR 49 H THR 49 -18.929 8.318 4.393 1093 HA THR 49 HA THR 49 -16.666 7.529 2.818 1094 HB THR 49 HB THR 49 -19.402 8.555 2.062 1095 HG1 THR 49 HG1 THR 49 -18.733 6.258 2.879 1096 1HG2 THR 49 1HG2 THR 49 -18.515 9.123 0.083 1097 2HG2 THR 49 2HG2 THR 49 -18.339 7.391 -0.196 1098 3HG2 THR 49 3HG2 THR 49 -16.986 8.323 0.444 1099 H THR 50 H THR 50 -18.324 10.565 3.521 1100 HA THR 50 HA THR 50 -17.094 12.230 1.675 1101 HB THR 50 HB THR 50 -17.887 12.931 4.508 1102 HG1 THR 50 HG1 THR 50 -19.472 12.032 2.820 1103 1HG2 THR 50 1HG2 THR 50 -16.948 14.906 4.022 1104 2HG2 THR 50 2HG2 THR 50 -18.292 15.139 2.905 1105 3HG2 THR 50 3HG2 THR 50 -16.760 14.490 2.320 1106 H GLN 51 H GLN 51 -15.994 11.292 4.915 1107 HA GLN 51 HA GLN 51 -13.622 12.875 4.807 1108 1HB GLN 51 1HB GLN 51 -14.483 12.351 6.964 1109 2HB GLN 51 2HB GLN 51 -14.514 10.629 6.609 1110 1HG GLN 51 1HG GLN 51 -11.853 11.696 6.322 1111 2HG GLN 51 2HG GLN 51 -12.514 12.045 7.919 1112 1HE2 GLN 51 1HE2 GLN 51 -11.340 9.629 5.777 1113 2HE2 GLN 51 2HE2 GLN 51 -11.405 8.303 6.883 1114 H TYR 52 H TYR 52 -14.276 9.400 4.435 1115 HA TYR 52 HA TYR 52 -11.677 8.523 4.024 1116 1HB TYR 52 1HB TYR 52 -14.372 7.525 3.255 1117 2HB TYR 52 2HB TYR 52 -12.983 6.804 2.449 1118 HD1 TYR 52 HD1 TYR 52 -13.758 7.861 5.957 1119 HD2 TYR 52 HD2 TYR 52 -12.374 4.785 3.364 1120 HE1 TYR 52 HE1 TYR 52 -13.401 6.394 7.898 1121 HE2 TYR 52 HE2 TYR 52 -12.014 3.309 5.298 1122 HH TYR 52 HH TYR 52 -13.153 3.250 7.807 1123 H ALA 53 H ALA 53 -14.069 9.474 1.559 1124 HA ALA 53 HA ALA 53 -12.382 9.194 -0.661 1125 1HB ALA 53 1HB ALA 53 -14.589 9.352 -1.264 1126 2HB ALA 53 2HB ALA 53 -14.918 10.666 -0.134 1127 3HB ALA 53 3HB ALA 53 -14.035 10.987 -1.626 1128 H SER 54 H SER 54 -12.445 11.559 1.806 1129 HA SER 54 HA SER 54 -11.319 13.718 0.308 1130 1HB SER 54 1HB SER 54 -12.385 13.376 2.890 1131 2HB SER 54 2HB SER 54 -10.708 13.867 3.127 1132 HG SER 54 HG SER 54 -12.585 15.491 2.716 1133 H LEU 55 H LEU 55 -9.982 11.382 2.636 1134 HA LEU 55 HA LEU 55 -7.280 12.260 2.113 1135 1HB LEU 55 1HB LEU 55 -6.649 10.984 3.898 1136 2HB LEU 55 2HB LEU 55 -8.331 11.309 4.312 1137 HG LEU 55 HG LEU 55 -8.680 8.993 3.047 1138 1HD1 LEU 55 1HD1 LEU 55 -5.994 9.111 2.871 1139 2HD1 LEU 55 2HD1 LEU 55 -6.912 7.607 2.931 1140 3HD1 LEU 55 3HD1 LEU 55 -6.174 8.249 4.399 1141 1HD2 LEU 55 1HD2 LEU 55 -8.831 9.868 5.616 1142 2HD2 LEU 55 2HD2 LEU 55 -7.643 8.573 5.758 1143 3HD2 LEU 55 3HD2 LEU 55 -9.238 8.236 5.085 1144 H MET 56 H MET 56 -9.451 9.868 0.920 1145 HA MET 56 HA MET 56 -7.612 7.960 -0.026 1146 1HB MET 56 1HB MET 56 -10.427 8.694 -0.719 1147 2HB MET 56 2HB MET 56 -9.551 7.584 -1.765 1148 1HG MET 56 1HG MET 56 -9.915 7.186 1.194 1149 2HG MET 56 2HG MET 56 -10.959 6.485 -0.041 1150 1HE MET 56 1HE MET 56 -7.070 6.399 1.301 1151 2HE MET 56 2HE MET 56 -8.447 5.938 2.303 1152 3HE MET 56 3HE MET 56 -7.332 4.704 1.712 1153 H HIS 57 H HIS 57 -8.914 10.908 -1.470 1154 HA HIS 57 HA HIS 57 -7.763 10.537 -4.032 1155 1HB HIS 57 1HB HIS 57 -9.622 12.076 -3.693 1156 2HB HIS 57 2HB HIS 57 -8.635 13.071 -2.627 1157 HD1 HIS 57 HD1 HIS 57 -8.774 15.160 -4.084 1158 HD2 HIS 57 HD2 HIS 57 -7.237 11.854 -6.076 1159 HE1 HIS 57 HE1 HIS 57 -7.843 16.049 -6.245 1160 H SER 58 H SER 58 -6.770 12.570 -1.277 1161 HA SER 58 HA SER 58 -4.352 13.436 -2.454 1162 1HB SER 58 1HB SER 58 -5.258 14.723 -0.651 1163 2HB SER 58 2HB SER 58 -5.272 13.324 0.423 1164 HG SER 58 HG SER 58 -3.400 15.069 0.290 1165 H PHE 59 H PHE 59 -5.255 10.538 -0.811 1166 HA PHE 59 HA PHE 59 -2.778 9.672 0.150 1167 1HB PHE 59 1HB PHE 59 -4.775 8.516 0.811 1168 2HB PHE 59 2HB PHE 59 -5.160 8.114 -0.860 1169 HD1 PHE 59 HD1 PHE 59 -2.001 7.806 1.092 1170 HD2 PHE 59 HD2 PHE 59 -5.084 5.825 -1.073 1171 HE1 PHE 59 HE1 PHE 59 -0.795 5.675 1.332 1172 HE2 PHE 59 HE2 PHE 59 -3.883 3.690 -0.836 1173 HZ PHE 59 HZ PHE 59 -1.736 3.613 0.368 1174 H ILE 60 H ILE 60 -4.371 8.804 -2.921 1175 HA ILE 60 HA ILE 60 -2.318 7.321 -4.032 1176 HB ILE 60 HB ILE 60 -4.261 9.125 -5.479 1177 1HG1 ILE 60 1HG1 ILE 60 -5.373 7.452 -4.081 1178 2HG1 ILE 60 2HG1 ILE 60 -5.573 7.062 -5.786 1179 1HG2 ILE 60 1HG2 ILE 60 -2.911 8.669 -7.220 1180 2HG2 ILE 60 2HG2 ILE 60 -2.160 7.294 -6.413 1181 3HG2 ILE 60 3HG2 ILE 60 -3.729 7.107 -7.197 1182 1HD1 ILE 60 1HD1 ILE 60 -4.430 5.495 -3.680 1183 2HD1 ILE 60 2HD1 ILE 60 -4.834 5.031 -5.333 1184 3HD1 ILE 60 3HD1 ILE 60 -3.256 5.730 -4.974 1185 H LEU 61 H LEU 61 -2.900 10.817 -4.313 1186 HA LEU 61 HA LEU 61 -0.648 11.342 -5.942 1187 1HB LEU 61 1HB LEU 61 -2.680 12.877 -4.519 1188 2HB LEU 61 2HB LEU 61 -1.113 13.682 -4.575 1189 HG LEU 61 HG LEU 61 -1.135 13.555 -7.019 1190 1HD1 LEU 61 1HD1 LEU 61 -2.371 11.589 -7.457 1191 2HD1 LEU 61 2HD1 LEU 61 -3.320 12.925 -8.109 1192 3HD1 LEU 61 3HD1 LEU 61 -3.775 12.187 -6.573 1193 1HD2 LEU 61 1HD2 LEU 61 -2.204 15.445 -5.686 1194 2HD2 LEU 61 2HD2 LEU 61 -3.753 14.716 -6.111 1195 3HD2 LEU 61 3HD2 LEU 61 -2.672 15.292 -7.380 1196 H LYS 62 H LYS 62 -1.054 10.896 -2.537 1197 HA LYS 62 HA LYS 62 1.330 12.216 -1.702 1198 1HB LYS 62 1HB LYS 62 -0.618 11.699 -0.216 1199 2HB LYS 62 2HB LYS 62 -0.164 10.002 -0.287 1200 1HG LYS 62 1HG LYS 62 0.794 10.671 1.691 1201 2HG LYS 62 2HG LYS 62 2.139 10.851 0.562 1202 1HD LYS 62 1HD LYS 62 2.299 12.905 1.479 1203 2HD LYS 62 2HD LYS 62 0.988 13.292 0.362 1204 1HE LYS 62 1HE LYS 62 -0.478 12.377 2.380 1205 2HE LYS 62 2HE LYS 62 0.933 12.890 3.304 1206 1HZ LYS 62 1HZ LYS 62 -0.935 14.515 1.717 1207 2HZ LYS 62 2HZ LYS 62 0.651 15.058 1.944 1208 3HZ LYS 62 3HZ LYS 62 -0.348 14.780 3.281 1209 H ALA 63 H ALA 63 0.509 8.774 -2.128 1210 HA ALA 63 HA ALA 63 3.175 7.875 -1.678 1211 1HB ALA 63 1HB ALA 63 1.346 6.388 -1.233 1212 2HB ALA 63 2HB ALA 63 0.793 6.495 -2.905 1213 3HB ALA 63 3HB ALA 63 2.323 5.702 -2.532 1214 H ARG 64 H ARG 64 1.440 9.023 -4.444 1215 HA ARG 64 HA ARG 64 3.041 7.835 -6.459 1216 1HB ARG 64 1HB ARG 64 0.903 8.664 -7.095 1217 2HB ARG 64 2HB ARG 64 1.247 10.257 -6.433 1218 1HG ARG 64 1HG ARG 64 2.152 10.948 -8.338 1219 2HG ARG 64 2HG ARG 64 3.167 9.509 -8.461 1220 1HD ARG 64 1HD ARG 64 1.741 9.558 -10.373 1221 2HD ARG 64 2HD ARG 64 1.169 8.273 -9.310 1222 HE ARG 64 HE ARG 64 -0.781 9.443 -8.987 1223 1HH1 ARG 64 1HH1 ARG 64 1.571 11.494 -10.530 1224 2HH1 ARG 64 2HH1 ARG 64 0.438 12.760 -10.868 1225 1HH2 ARG 64 1HH2 ARG 64 -2.283 11.103 -9.427 1226 2HH2 ARG 64 2HH2 ARG 64 -1.754 12.537 -10.240 1227 H SER 65 H SER 65 3.192 10.930 -4.754 1228 HA SER 65 HA SER 65 5.262 12.089 -6.249 1229 1HB SER 65 1HB SER 65 3.690 13.013 -4.295 1230 2HB SER 65 2HB SER 65 5.121 12.656 -3.328 1231 HG SER 65 HG SER 65 6.180 14.224 -4.292 1232 H THR 66 H THR 66 5.286 9.680 -3.750 1233 HA THR 66 HA THR 66 8.122 9.905 -3.241 1234 HB THR 66 HB THR 66 7.000 7.410 -2.329 1235 HG1 THR 66 HG1 THR 66 4.995 8.388 -2.320 1236 1HG2 THR 66 1HG2 THR 66 8.231 7.920 -0.525 1237 2HG2 THR 66 2HG2 THR 66 7.468 9.500 -0.345 1238 3HG2 THR 66 3HG2 THR 66 8.812 9.291 -1.468 1239 H VAL 67 H VAL 67 5.976 7.481 -4.728 1240 HA VAL 67 HA VAL 67 7.856 5.614 -5.493 1241 HB VAL 67 HB VAL 67 5.396 6.445 -7.038 1242 1HG1 VAL 67 1HG1 VAL 67 5.734 3.803 -7.539 1243 2HG1 VAL 67 2HG1 VAL 67 6.294 5.097 -8.600 1244 3HG1 VAL 67 3HG1 VAL 67 7.410 4.347 -7.458 1245 1HG2 VAL 67 1HG2 VAL 67 5.032 4.002 -5.679 1246 2HG2 VAL 67 2HG2 VAL 67 5.721 5.136 -4.517 1247 3HG2 VAL 67 3HG2 VAL 67 4.234 5.545 -5.372 1248 H ARG 68 H ARG 68 6.803 8.504 -7.268 1249 HA ARG 68 HA ARG 68 8.314 8.109 -9.582 1250 1HB ARG 68 1HB ARG 68 8.058 10.517 -9.961 1251 2HB ARG 68 2HB ARG 68 6.548 9.793 -9.423 1252 1HG ARG 68 1HG ARG 68 6.877 10.661 -7.196 1253 2HG ARG 68 2HG ARG 68 8.460 11.296 -7.649 1254 1HD ARG 68 1HD ARG 68 6.585 12.975 -7.609 1255 2HD ARG 68 2HD ARG 68 7.499 12.891 -9.114 1256 HE ARG 68 HE ARG 68 5.218 11.202 -9.203 1257 1HH1 ARG 68 1HH1 ARG 68 6.209 14.533 -9.415 1258 2HH1 ARG 68 2HH1 ARG 68 4.867 15.005 -10.404 1259 1HH2 ARG 68 1HH2 ARG 68 3.447 11.811 -10.505 1260 2HH2 ARG 68 2HH2 ARG 68 3.296 13.456 -11.023 1261 H ASP 69 H ASP 69 9.226 9.262 -6.429 1262 HA ASP 69 HA ASP 69 11.648 10.531 -7.106 1263 1HB ASP 69 1HB ASP 69 10.213 10.090 -4.774 1264 2HB ASP 69 2HB ASP 69 11.702 9.183 -4.520 1265 H ILE 70 H ILE 70 10.874 7.179 -6.301 1266 HA ILE 70 HA ILE 70 13.404 6.111 -6.045 1267 HB ILE 70 HB ILE 70 11.030 4.811 -7.385 1268 1HG1 ILE 70 1HG1 ILE 70 11.919 4.468 -4.527 1269 2HG1 ILE 70 2HG1 ILE 70 10.788 5.732 -4.996 1270 1HG2 ILE 70 1HG2 ILE 70 12.473 3.174 -7.844 1271 2HG2 ILE 70 2HG2 ILE 70 13.728 3.888 -6.833 1272 3HG2 ILE 70 3HG2 ILE 70 12.495 2.855 -6.110 1273 1HD1 ILE 70 1HD1 ILE 70 9.764 3.421 -6.137 1274 2HD1 ILE 70 2HD1 ILE 70 10.329 2.928 -4.540 1275 3HD1 ILE 70 3HD1 ILE 70 9.173 4.251 -4.698 1276 H ASP 71 H ASP 71 11.538 6.600 -9.027 1277 HA ASP 71 HA ASP 71 13.909 7.009 -10.565 1278 1HB ASP 71 1HB ASP 71 12.575 4.351 -10.599 1279 2HB ASP 71 2HB ASP 71 13.089 5.013 -12.149 1280 HA PRO 72 HA PRO 72 11.128 9.156 -13.188 1281 1HB PRO 72 1HB PRO 72 12.246 8.815 -15.638 1282 2HB PRO 72 2HB PRO 72 12.953 9.855 -14.396 1283 1HG PRO 72 1HG PRO 72 13.683 7.054 -15.162 1284 2HG PRO 72 2HG PRO 72 14.744 8.427 -14.797 1285 1HD PRO 72 1HD PRO 72 14.220 6.472 -12.998 1286 2HD PRO 72 2HD PRO 72 14.522 8.155 -12.519 1287 H GLN 73 H GLN 73 11.767 5.802 -13.854 1288 HA GLN 73 HA GLN 73 9.330 5.638 -15.492 1289 1HB GLN 73 1HB GLN 73 11.528 3.583 -15.226 1290 2HB GLN 73 2HB GLN 73 10.183 3.545 -16.358 1291 1HG GLN 73 1HG GLN 73 11.050 5.398 -17.571 1292 2HG GLN 73 2HG GLN 73 12.277 5.701 -16.343 1293 1HE2 GLN 73 1HE2 GLN 73 14.122 5.374 -17.408 1294 2HE2 GLN 73 2HE2 GLN 73 14.547 3.920 -18.238 1295 H ASN 74 H ASN 74 7.626 5.223 -14.235 1296 HA ASN 74 HA ASN 74 7.287 2.767 -12.946 1297 1HB ASN 74 1HB ASN 74 8.599 4.774 -11.332 1298 2HB ASN 74 2HB ASN 74 7.043 4.340 -10.630 1299 1HD2 ASN 74 1HD2 ASN 74 10.180 3.668 -10.467 1300 2HD2 ASN 74 2HD2 ASN 74 10.131 2.006 -9.997 1301 H ASP 75 H ASP 75 5.208 2.599 -11.833 1302 HA ASP 75 HA ASP 75 3.387 4.805 -11.853 1303 1HB ASP 75 1HB ASP 75 3.670 3.659 -14.308 1304 2HB ASP 75 2HB ASP 75 2.351 2.701 -13.640 1305 H LEU 76 H LEU 76 1.859 4.469 -10.361 1306 HA LEU 76 HA LEU 76 1.804 1.965 -8.951 1307 1HB LEU 76 1HB LEU 76 0.430 4.605 -8.618 1308 2HB LEU 76 2HB LEU 76 -0.071 3.202 -7.676 1309 HG LEU 76 HG LEU 76 1.408 4.574 -6.361 1310 1HD1 LEU 76 1HD1 LEU 76 1.601 1.942 -6.552 1311 2HD1 LEU 76 2HD1 LEU 76 2.679 2.883 -5.523 1312 3HD1 LEU 76 3HD1 LEU 76 3.222 2.350 -7.113 1313 1HD2 LEU 76 1HD2 LEU 76 3.260 5.577 -7.118 1314 2HD2 LEU 76 2HD2 LEU 76 2.628 5.204 -8.722 1315 3HD2 LEU 76 3HD2 LEU 76 3.811 4.134 -7.968 1316 H THR 77 H THR 77 0.366 0.358 -9.120 1317 HA THR 77 HA THR 77 -2.111 0.833 -10.631 1318 HB THR 77 HB THR 77 -1.887 -1.194 -11.875 1319 HG1 THR 77 HG1 THR 77 0.648 -1.704 -10.722 1320 1HG2 THR 77 1HG2 THR 77 0.880 -0.460 -12.339 1321 2HG2 THR 77 2HG2 THR 77 -0.158 0.959 -12.191 1322 3HG2 THR 77 3HG2 THR 77 -0.524 -0.280 -13.391 1323 H PHE 78 H PHE 78 -1.157 0.320 -7.726 1324 HA PHE 78 HA PHE 78 -3.467 -0.956 -6.814 1325 1HB PHE 78 1HB PHE 78 -1.342 -2.764 -7.610 1326 2HB PHE 78 2HB PHE 78 -1.726 -2.941 -5.901 1327 HD1 PHE 78 HD1 PHE 78 -4.488 -2.708 -5.598 1328 HD2 PHE 78 HD2 PHE 78 -2.365 -4.342 -8.906 1329 HE1 PHE 78 HE1 PHE 78 -6.451 -4.072 -6.180 1330 HE2 PHE 78 HE2 PHE 78 -4.325 -5.708 -9.493 1331 HZ PHE 78 HZ PHE 78 -6.372 -5.574 -8.130 1332 H LEU 79 H LEU 79 -3.753 -0.253 -4.803 1333 HA LEU 79 HA LEU 79 -1.398 0.186 -3.101 1334 1HB LEU 79 1HB LEU 79 -3.187 2.168 -4.161 1335 2HB LEU 79 2HB LEU 79 -3.298 2.132 -2.403 1336 HG LEU 79 HG LEU 79 -0.953 2.615 -2.190 1337 1HD1 LEU 79 1HD1 LEU 79 -0.885 2.367 -5.190 1338 2HD1 LEU 79 2HD1 LEU 79 -0.034 1.371 -4.010 1339 3HD1 LEU 79 3HD1 LEU 79 0.417 3.062 -4.223 1340 1HD2 LEU 79 1HD2 LEU 79 -2.792 4.391 -2.977 1341 2HD2 LEU 79 2HD2 LEU 79 -1.654 4.548 -4.315 1342 3HD2 LEU 79 3HD2 LEU 79 -1.111 4.824 -2.659 1343 H ARG 80 H ARG 80 -1.710 -1.446 -1.683 1344 HA ARG 80 HA ARG 80 -4.337 -1.623 -0.363 1345 1HB ARG 80 1HB ARG 80 -2.188 -3.702 -0.779 1346 2HB ARG 80 2HB ARG 80 -3.547 -3.932 0.314 1347 1HG ARG 80 1HG ARG 80 -5.006 -3.399 -1.742 1348 2HG ARG 80 2HG ARG 80 -3.542 -3.735 -2.669 1349 1HD ARG 80 1HD ARG 80 -5.025 -5.587 -0.817 1350 2HD ARG 80 2HD ARG 80 -4.791 -5.758 -2.556 1351 HE ARG 80 HE ARG 80 -2.265 -5.754 -1.599 1352 1HH1 ARG 80 1HH1 ARG 80 -5.123 -7.565 -0.780 1353 2HH1 ARG 80 2HH1 ARG 80 -4.246 -8.973 -0.279 1354 1HH2 ARG 80 1HH2 ARG 80 -1.099 -7.601 -0.942 1355 2HH2 ARG 80 2HH2 ARG 80 -1.957 -8.992 -0.371 1356 H ILE 81 H ILE 81 -4.442 -1.758 1.886 1357 HA ILE 81 HA ILE 81 -1.966 -1.413 3.399 1358 HB ILE 81 HB ILE 81 -4.290 0.444 3.867 1359 1HG1 ILE 81 1HG1 ILE 81 -1.773 0.971 2.271 1360 2HG1 ILE 81 2HG1 ILE 81 -3.406 0.875 1.622 1361 1HG2 ILE 81 1HG2 ILE 81 -3.093 1.284 5.561 1362 2HG2 ILE 81 2HG2 ILE 81 -2.164 -0.211 5.455 1363 3HG2 ILE 81 3HG2 ILE 81 -1.589 1.244 4.641 1364 1HD1 ILE 81 1HD1 ILE 81 -2.027 3.114 2.733 1365 2HD1 ILE 81 2HD1 ILE 81 -3.595 3.053 1.927 1366 3HD1 ILE 81 3HD1 ILE 81 -3.487 2.790 3.667 1367 H ARG 82 H ARG 82 -2.304 -3.439 4.309 1368 HA ARG 82 HA ARG 82 -4.751 -4.257 5.480 1369 1HB ARG 82 1HB ARG 82 -2.347 -5.474 4.876 1370 2HB ARG 82 2HB ARG 82 -2.352 -5.465 6.634 1371 1HG ARG 82 1HG ARG 82 -4.880 -6.321 5.441 1372 2HG ARG 82 2HG ARG 82 -3.507 -7.365 5.067 1373 1HD ARG 82 1HD ARG 82 -3.130 -6.952 7.717 1374 2HD ARG 82 2HD ARG 82 -4.889 -6.887 7.620 1375 HE ARG 82 HE ARG 82 -4.119 -9.126 6.200 1376 1HH1 ARG 82 1HH1 ARG 82 -3.848 -7.959 9.469 1377 2HH1 ARG 82 2HH1 ARG 82 -3.847 -9.543 10.172 1378 1HH2 ARG 82 1HH2 ARG 82 -4.119 -11.216 7.114 1379 2HH2 ARG 82 2HH2 ARG 82 -4.000 -11.394 8.832 1380 H SER 83 H SER 83 -5.623 -3.780 7.388 1381 HA SER 83 HA SER 83 -3.897 -2.658 9.490 1382 1HB SER 83 1HB SER 83 -6.675 -1.650 9.389 1383 2HB SER 83 2HB SER 83 -5.176 -0.798 9.762 1384 HG SER 83 HG SER 83 -6.477 -1.121 7.353 1385 H LYS 84 H LYS 84 -4.763 -2.866 11.665 1386 HA LYS 84 HA LYS 84 -5.606 -5.439 12.282 1387 1HB LYS 84 1HB LYS 84 -5.756 -2.877 13.870 1388 2HB LYS 84 2HB LYS 84 -6.190 -4.442 14.545 1389 1HG LYS 84 1HG LYS 84 -3.735 -4.969 13.504 1390 2HG LYS 84 2HG LYS 84 -3.557 -3.285 14.005 1391 1HD LYS 84 1HD LYS 84 -2.917 -4.555 15.878 1392 2HD LYS 84 2HD LYS 84 -4.558 -4.010 16.232 1393 1HE LYS 84 1HE LYS 84 -5.370 -6.216 15.348 1394 2HE LYS 84 2HE LYS 84 -3.686 -6.733 15.281 1395 1HZ LYS 84 1HZ LYS 84 -4.788 -5.664 17.791 1396 2HZ LYS 84 2HZ LYS 84 -3.506 -6.744 17.560 1397 3HZ LYS 84 3HZ LYS 84 -5.101 -7.269 17.356 1398 H LYS 85 H LYS 85 -7.455 -2.638 11.419 1399 HA LYS 85 HA LYS 85 -9.963 -3.761 12.347 1400 1HB LYS 85 1HB LYS 85 -9.087 -1.186 11.139 1401 2HB LYS 85 2HB LYS 85 -10.764 -1.662 10.901 1402 1HG LYS 85 1HG LYS 85 -9.453 -1.523 13.603 1403 2HG LYS 85 2HG LYS 85 -10.333 -0.179 12.871 1404 1HD LYS 85 1HD LYS 85 -12.227 -1.030 13.664 1405 2HD LYS 85 2HD LYS 85 -11.985 -2.455 12.650 1406 1HE LYS 85 1HE LYS 85 -10.675 -3.501 14.425 1407 2HE LYS 85 2HE LYS 85 -10.888 -2.071 15.435 1408 1HZ LYS 85 1HZ LYS 85 -12.501 -4.247 15.427 1409 2HZ LYS 85 2HZ LYS 85 -13.364 -3.156 14.466 1410 3HZ LYS 85 3HZ LYS 85 -12.916 -2.726 16.039 1411 H ASN 86 H ASN 86 -8.491 -2.914 9.218 1412 HA ASN 86 HA ASN 86 -9.410 -5.185 7.877 1413 1HB ASN 86 1HB ASN 86 -11.082 -3.826 6.368 1414 2HB ASN 86 2HB ASN 86 -11.633 -4.546 7.878 1415 1HD2 ASN 86 1HD2 ASN 86 -10.086 -1.554 6.756 1416 2HD2 ASN 86 2HD2 ASN 86 -11.059 -0.494 7.713 1417 H GLU 87 H GLU 87 -9.207 -4.943 5.450 1418 HA GLU 87 HA GLU 87 -6.900 -3.236 4.906 1419 1HB GLU 87 1HB GLU 87 -6.687 -5.602 4.352 1420 2HB GLU 87 2HB GLU 87 -8.106 -5.508 3.319 1421 1HG GLU 87 1HG GLU 87 -6.997 -4.264 1.696 1422 2HG GLU 87 2HG GLU 87 -5.710 -3.793 2.805 1423 H ILE 88 H ILE 88 -6.944 -1.529 3.573 1424 HA ILE 88 HA ILE 88 -9.504 -0.890 2.280 1425 HB ILE 88 HB ILE 88 -7.201 0.964 2.897 1426 1HG1 ILE 88 1HG1 ILE 88 -9.844 0.600 4.326 1427 2HG1 ILE 88 2HG1 ILE 88 -8.270 0.109 4.942 1428 1HG2 ILE 88 1HG2 ILE 88 -9.364 1.247 1.136 1429 2HG2 ILE 88 2HG2 ILE 88 -9.754 2.227 2.549 1430 3HG2 ILE 88 3HG2 ILE 88 -8.245 2.498 1.677 1431 1HD1 ILE 88 1HD1 ILE 88 -7.558 2.401 5.070 1432 2HD1 ILE 88 2HD1 ILE 88 -9.059 2.943 4.319 1433 3HD1 ILE 88 3HD1 ILE 88 -9.089 2.210 5.922 1434 H MET 89 H MET 89 -9.409 -1.829 0.297 1435 HA MET 89 HA MET 89 -7.045 -1.808 -1.317 1436 1HB MET 89 1HB MET 89 -9.028 -3.487 -1.334 1437 2HB MET 89 2HB MET 89 -9.805 -2.313 -2.387 1438 1HG MET 89 1HG MET 89 -8.142 -2.555 -4.045 1439 2HG MET 89 2HG MET 89 -7.086 -3.449 -2.954 1440 1HE MET 89 1HE MET 89 -10.577 -5.034 -5.418 1441 2HE MET 89 2HE MET 89 -10.921 -3.766 -4.241 1442 3HE MET 89 3HE MET 89 -9.764 -3.473 -5.541 1443 H VAL 90 H VAL 90 -6.386 -0.334 -2.752 1444 HA VAL 90 HA VAL 90 -8.288 1.593 -3.846 1445 HB VAL 90 HB VAL 90 -5.718 2.519 -2.562 1446 1HG1 VAL 90 1HG1 VAL 90 -8.060 3.964 -3.787 1447 2HG1 VAL 90 2HG1 VAL 90 -6.812 4.757 -2.824 1448 3HG1 VAL 90 3HG1 VAL 90 -6.386 3.963 -4.341 1449 1HG2 VAL 90 1HG2 VAL 90 -7.319 1.689 -0.875 1450 2HG2 VAL 90 2HG2 VAL 90 -7.052 3.429 -0.761 1451 3HG2 VAL 90 3HG2 VAL 90 -8.528 2.811 -1.502 1452 H ALA 91 H ALA 91 -8.030 1.442 -5.968 1453 HA ALA 91 HA ALA 91 -5.302 1.428 -7.059 1454 1HB ALA 91 1HB ALA 91 -6.071 -0.863 -7.157 1455 2HB ALA 91 2HB ALA 91 -7.554 -0.359 -7.969 1456 3HB ALA 91 3HB ALA 91 -6.000 -0.187 -8.784 1457 HA PRO 92 HA PRO 92 -6.751 4.663 -9.660 1458 1HB PRO 92 1HB PRO 92 -5.038 4.388 -11.748 1459 2HB PRO 92 2HB PRO 92 -4.546 5.042 -10.181 1460 1HG PRO 92 1HG PRO 92 -4.194 2.278 -11.276 1461 2HG PRO 92 2HG PRO 92 -3.040 3.280 -10.377 1462 1HD PRO 92 1HD PRO 92 -4.462 1.293 -9.209 1463 2HD PRO 92 2HD PRO 92 -3.988 2.767 -8.340 1464 H ASP 93 H ASP 93 -8.159 5.000 -11.324 1465 HA ASP 93 HA ASP 93 -8.797 2.683 -13.031 1466 1HB ASP 93 1HB ASP 93 -10.465 3.918 -11.136 1467 2HB ASP 93 2HB ASP 93 -11.044 4.469 -12.706 1468 H LYS 94 H LYS 94 -10.599 3.828 -14.726 1469 HA LYS 94 HA LYS 94 -9.053 5.011 -16.674 1470 1HB LYS 94 1HB LYS 94 -11.825 4.419 -16.289 1471 2HB LYS 94 2HB LYS 94 -11.688 6.032 -16.975 1472 1HG LYS 94 1HG LYS 94 -10.283 5.110 -18.781 1473 2HG LYS 94 2HG LYS 94 -10.531 3.495 -18.112 1474 1HD LYS 94 1HD LYS 94 -13.061 4.114 -18.315 1475 2HD LYS 94 2HD LYS 94 -12.477 5.306 -19.479 1476 1HE LYS 94 1HE LYS 94 -11.348 3.490 -20.715 1477 2HE LYS 94 2HE LYS 94 -12.026 2.324 -19.580 1478 1HZ LYS 94 1HZ LYS 94 -13.606 4.122 -21.339 1479 2HZ LYS 94 2HZ LYS 94 -14.238 2.967 -20.276 1480 3HZ LYS 94 3HZ LYS 94 -13.330 2.476 -21.617 1481 H ASP 95 H ASP 95 -11.275 6.664 -14.431 1482 HA ASP 95 HA ASP 95 -9.546 8.996 -14.446 1483 1HB ASP 95 1HB ASP 95 -11.323 10.557 -15.050 1484 2HB ASP 95 2HB ASP 95 -11.063 9.395 -16.348 1485 H TYR 96 H TYR 96 -10.806 6.852 -12.640 1486 HA TYR 96 HA TYR 96 -11.428 8.700 -10.463 1487 1HB TYR 96 1HB TYR 96 -13.330 7.229 -9.749 1488 2HB TYR 96 2HB TYR 96 -13.622 8.113 -11.242 1489 HD1 TYR 96 HD1 TYR 96 -13.425 6.897 -13.435 1490 HD2 TYR 96 HD2 TYR 96 -13.394 4.866 -9.697 1491 HE1 TYR 96 HE1 TYR 96 -13.965 4.790 -14.582 1492 HE2 TYR 96 HE2 TYR 96 -13.933 2.753 -10.833 1493 HH TYR 96 HH TYR 96 -14.735 2.653 -14.242 1494 H PHE 97 H PHE 97 -11.749 7.270 -8.365 1495 HA PHE 97 HA PHE 97 -9.611 5.242 -8.361 1496 1HB PHE 97 1HB PHE 97 -10.218 7.441 -6.405 1497 2HB PHE 97 2HB PHE 97 -9.353 5.996 -5.891 1498 HD1 PHE 97 HD1 PHE 97 -7.535 5.374 -7.970 1499 HD2 PHE 97 HD2 PHE 97 -8.778 9.209 -6.604 1500 HE1 PHE 97 HE1 PHE 97 -5.427 6.345 -8.788 1501 HE2 PHE 97 HE2 PHE 97 -6.673 10.186 -7.421 1502 HZ PHE 97 HZ PHE 97 -4.994 8.754 -8.515 1503 H LEU 98 H LEU 98 -10.184 3.284 -7.687 1504 HA LEU 98 HA LEU 98 -12.842 2.908 -6.554 1505 1HB LEU 98 1HB LEU 98 -11.410 1.515 -8.419 1506 2HB LEU 98 2HB LEU 98 -11.167 0.542 -6.970 1507 HG LEU 98 HG LEU 98 -13.013 -0.378 -8.148 1508 1HD1 LEU 98 1HD1 LEU 98 -14.401 -0.594 -6.388 1509 2HD1 LEU 98 2HD1 LEU 98 -14.590 1.148 -6.183 1510 3HD1 LEU 98 3HD1 LEU 98 -13.155 0.337 -5.557 1511 1HD2 LEU 98 1HD2 LEU 98 -14.915 1.756 -8.081 1512 2HD2 LEU 98 2HD2 LEU 98 -14.330 0.830 -9.463 1513 3HD2 LEU 98 3HD2 LEU 98 -13.472 2.282 -8.947 1514 H ILE 99 H ILE 99 -13.046 2.977 -4.421 1515 HA ILE 99 HA ILE 99 -10.837 1.969 -2.755 1516 HB ILE 99 HB ILE 99 -13.076 3.782 -1.862 1517 1HG1 ILE 99 1HG1 ILE 99 -10.908 5.384 -1.849 1518 2HG1 ILE 99 2HG1 ILE 99 -10.507 4.363 -3.226 1519 1HG2 ILE 99 1HG2 ILE 99 -11.965 2.468 -0.107 1520 2HG2 ILE 99 2HG2 ILE 99 -10.413 3.139 -0.603 1521 3HG2 ILE 99 3HG2 ILE 99 -11.658 4.196 0.063 1522 1HD1 ILE 99 1HD1 ILE 99 -12.637 4.950 -4.270 1523 2HD1 ILE 99 2HD1 ILE 99 -13.017 5.988 -2.895 1524 3HD1 ILE 99 3HD1 ILE 99 -11.648 6.373 -3.939 1525 H VAL 100 H VAL 100 -11.257 -0.132 -2.372 1526 HA VAL 100 HA VAL 100 -13.949 -0.840 -1.403 1527 HB VAL 100 HB VAL 100 -11.911 -2.733 -2.575 1528 1HG1 VAL 100 1HG1 VAL 100 -13.863 -4.241 -2.760 1529 2HG1 VAL 100 2HG1 VAL 100 -13.475 -3.818 -1.091 1530 3HG1 VAL 100 3HG1 VAL 100 -14.835 -3.044 -1.906 1531 1HG2 VAL 100 1HG2 VAL 100 -13.277 -2.728 -4.601 1532 2HG2 VAL 100 2HG2 VAL 100 -14.316 -1.484 -3.904 1533 3HG2 VAL 100 3HG2 VAL 100 -12.628 -1.122 -4.267 1534 H ILE 101 H ILE 101 -13.997 -1.010 0.735 1535 HA ILE 101 HA ILE 101 -11.598 -1.935 2.153 1536 HB ILE 101 HB ILE 101 -14.062 -0.615 3.297 1537 1HG1 ILE 101 1HG1 ILE 101 -11.656 0.952 3.481 1538 2HG1 ILE 101 2HG1 ILE 101 -11.950 0.519 1.800 1539 1HG2 ILE 101 1HG2 ILE 101 -11.996 -0.232 5.054 1540 2HG2 ILE 101 2HG2 ILE 101 -13.254 -1.458 5.203 1541 3HG2 ILE 101 3HG2 ILE 101 -11.704 -1.870 4.470 1542 1HD1 ILE 101 1HD1 ILE 101 -14.427 1.317 2.747 1543 2HD1 ILE 101 2HD1 ILE 101 -13.286 2.451 3.470 1544 3HD1 ILE 101 3HD1 ILE 101 -13.334 2.243 1.719 1545 H GLN 102 H GLN 102 -11.601 -3.729 3.423 1546 HA GLN 102 HA GLN 102 -13.952 -5.065 4.287 1547 1HB GLN 102 1HB GLN 102 -13.859 -7.046 2.918 1548 2HB GLN 102 2HB GLN 102 -14.003 -5.642 1.868 1549 1HG GLN 102 1HG GLN 102 -11.564 -5.735 1.480 1550 2HG GLN 102 2HG GLN 102 -11.501 -7.211 2.441 1551 1HE2 GLN 102 1HE2 GLN 102 -11.271 -6.280 -0.558 1552 2HE2 GLN 102 2HE2 GLN 102 -12.077 -7.561 -1.392 1553 H ASN 103 H ASN 103 -13.388 -7.293 5.192 1554 HA ASN 103 HA ASN 103 -11.381 -7.072 7.079 1555 1HB ASN 103 1HB ASN 103 -13.058 -9.277 6.039 1556 2HB ASN 103 2HB ASN 103 -11.591 -9.765 6.884 1557 1HD2 ASN 103 1HD2 ASN 103 -14.783 -8.992 7.240 1558 2HD2 ASN 103 2HD2 ASN 103 -14.801 -8.653 8.934 1559 HA PRO 104 HA PRO 104 -7.556 -8.088 5.187 1560 1HB PRO 104 1HB PRO 104 -6.360 -9.638 7.068 1561 2HB PRO 104 2HB PRO 104 -6.584 -7.895 7.260 1562 1HG PRO 104 1HG PRO 104 -8.209 -10.149 8.376 1563 2HG PRO 104 2HG PRO 104 -7.671 -8.657 9.170 1564 1HD PRO 104 1HD PRO 104 -10.182 -8.971 8.207 1565 2HD PRO 104 2HD PRO 104 -9.358 -7.399 8.229 1566 H THR 105 H THR 105 -6.483 -9.651 3.995 1567 HA THR 105 HA THR 105 -7.855 -12.250 3.813 1568 HB THR 105 HB THR 105 -6.829 -12.378 1.517 1569 HG1 THR 105 HG1 THR 105 -5.196 -10.805 1.793 1570 1HG2 THR 105 1HG2 THR 105 -8.493 -10.996 0.483 1571 2HG2 THR 105 2HG2 THR 105 -8.613 -9.978 1.918 1572 3HG2 THR 105 3HG2 THR 105 -9.180 -11.647 1.970 1573 H GLU 106 H GLU 106 -4.725 -10.674 4.049 1574 HA GLU 106 HA GLU 106 -3.046 -12.853 3.638 1575 1HB GLU 106 1HB GLU 106 -2.834 -10.205 4.834 1576 2HB GLU 106 2HB GLU 106 -1.795 -11.379 5.630 1577 1HG GLU 106 1HG GLU 106 -0.328 -10.892 4.030 1578 2HG GLU 106 2HG GLU 106 -1.328 -11.913 2.998
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