NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | position | program | type |
5302 | 1h0z | 5551 | cing | recoord | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLU 1 1H GLU 1 0.971 9.951 2.561 2 H2 GLU 1 3H GLU 1 1.047 11.629 2.801 3 H3 GLU 1 2H GLU 1 1.883 10.918 1.504 4 HA GLU 1 HA GLU 1 3.499 9.971 2.881 5 1HB GLU 1 2HB GLU 1 2.607 12.671 3.945 6 2HB GLU 1 1HB GLU 1 4.211 11.979 4.186 7 1HG GLU 1 2HG GLU 1 4.520 11.882 1.725 8 2HG GLU 1 1HG GLU 1 2.935 12.625 1.510 9 H SER 2 HN SER 2 2.301 8.188 4.002 10 HA SER 2 HA SER 2 1.725 8.879 6.866 11 1HB SER 2 2HB SER 2 -0.275 8.330 5.490 12 2HB SER 2 1HB SER 2 0.451 6.774 5.086 13 HG SER 2 HG SER 2 -0.763 7.618 7.403 14 H GLY 3 HN GLY 3 2.652 7.496 8.403 15 1HA GLY 3 1HA GLY 3 3.942 4.993 7.508 16 2HA GLY 3 2HA GLY 3 3.757 5.518 9.181 17 H LYS 4 HN LYS 4 6.224 4.575 8.297 18 HA LYS 4 HA LYS 4 7.889 7.010 8.638 19 1HB LYS 4 2HB LYS 4 8.483 4.032 8.713 20 2HB LYS 4 1HB LYS 4 9.631 5.302 9.139 21 1HG LYS 4 2HG LYS 4 8.042 6.087 10.901 22 2HG LYS 4 1HG LYS 4 6.989 4.726 10.515 23 1HD LYS 4 2HD LYS 4 8.862 3.170 11.042 24 2HD LYS 4 1HD LYS 4 9.851 4.554 11.509 25 1HE LYS 4 2HE LYS 4 8.958 3.881 13.581 26 2HE LYS 4 1HE LYS 4 7.779 5.105 13.074 27 1HZ LYS 4 1HZ LYS 4 7.447 2.363 12.091 28 2HZ LYS 4 3HZ LYS 4 7.030 2.670 13.706 29 3HZ LYS 4 2HZ LYS 4 6.267 3.530 12.454 30 H ALA 5 HN ALA 5 9.871 7.216 7.276 31 HA ALA 5 HA ALA 5 9.371 7.194 4.494 32 1HB ALA 5 3HB ALA 5 11.908 7.158 6.150 33 2HB ALA 5 2HB ALA 5 11.905 7.447 4.410 34 3HB ALA 5 1HB ALA 5 11.080 8.569 5.492 35 H THR 6 HN THR 6 10.632 4.672 6.595 36 HA THR 6 HA THR 6 11.200 2.422 6.146 37 HB THR 6 HB THR 6 9.466 2.982 3.720 38 HG1 THR 6 1HG THR 6 8.596 3.581 5.828 39 1HG2 THR 6 3HG2 THR 6 10.561 0.550 5.019 40 2HG2 THR 6 2HG2 THR 6 8.871 0.470 4.522 41 3HG2 THR 6 1HG2 THR 6 10.123 0.828 3.332 42 H SER 7 HN SER 7 12.275 0.997 4.421 43 HA SER 7 HA SER 7 13.757 2.566 2.360 44 1HB SER 7 2HB SER 7 15.357 2.650 4.033 45 2HB SER 7 1HB SER 7 14.782 1.169 4.797 46 HG SER 7 HG SER 7 16.451 1.499 2.565 47 H TYR 8 HN TYR 8 13.866 1.403 0.469 48 HA TYR 8 HA TYR 8 12.535 -0.963 -0.089 49 1HB TYR 8 2HB TYR 8 15.181 -0.017 -1.239 50 2HB TYR 8 1HB TYR 8 14.022 -1.074 -2.048 51 HD1 TYR 8 HD1 TYR 8 11.489 0.297 -1.048 52 HD2 TYR 8 HD2 TYR 8 15.113 1.854 -2.749 53 HE1 TYR 8 HE1 TYR 8 10.250 2.282 -1.867 54 HE2 TYR 8 HE2 TYR 8 13.874 3.840 -3.569 55 HH TYR 8 HH TYR 8 10.659 3.997 -3.885 56 H ALA 9 HN ALA 9 16.078 -0.807 0.494 57 HA ALA 9 HA ALA 9 16.727 -3.490 0.565 58 1HB ALA 9 1HB ALA 9 18.393 -1.811 0.896 59 2HB ALA 9 2HB ALA 9 18.365 -2.730 2.400 60 3HB ALA 9 3HB ALA 9 17.563 -1.162 2.310 61 H GLU 10 HN GLU 10 14.786 -1.733 2.902 62 HA GLU 10 HA GLU 10 14.752 -4.084 4.743 63 1HB GLU 10 2HB GLU 10 13.774 -1.215 4.924 64 2HB GLU 10 1HB GLU 10 13.556 -2.403 6.208 65 1HG GLU 10 2HG GLU 10 16.096 -2.756 6.097 66 2HG GLU 10 1HG GLU 10 16.147 -1.286 5.124 67 H LEU 11 HN LEU 11 12.695 -2.095 2.669 68 HA LEU 11 HA LEU 11 10.195 -3.382 3.391 69 1HB LEU 11 2HB LEU 11 10.540 -1.078 2.417 70 2HB LEU 11 1HB LEU 11 10.979 -1.849 0.893 71 HG LEU 11 HG LEU 11 8.588 -3.093 1.624 72 1HD1 LEU 11 2HD1 LEU 11 8.717 -0.727 3.089 73 2HD1 LEU 11 1HD1 LEU 11 7.754 -0.294 1.677 74 3HD1 LEU 11 3HD1 LEU 11 7.249 -1.630 2.711 75 1HD2 LEU 11 1HD2 LEU 11 9.690 -1.657 -0.520 76 2HD2 LEU 11 3HD2 LEU 11 8.159 -2.533 -0.520 77 3HD2 LEU 11 2HD2 LEU 11 8.190 -0.812 -0.134 78 H CYS 12 HN CYS 12 12.118 -3.464 0.385 79 HA CYS 12 HA CYS 12 10.768 -5.729 -0.747 80 1HB CYS 12 2HB CYS 12 13.339 -4.230 -1.162 81 2HB CYS 12 1HB CYS 12 13.078 -5.735 -2.045 82 H ASN 13 HN ASN 13 13.008 -5.468 1.813 83 HA ASN 13 HA ASN 13 14.715 -7.623 1.769 84 1HB ASN 13 2HB ASN 13 14.239 -5.966 3.612 85 2HB ASN 13 1HB ASN 13 12.834 -6.933 4.046 86 1HD2 ASN 13 1HD2 ASN 13 14.072 -7.217 6.175 87 2HD2 ASN 13 2HD2 ASN 13 15.244 -8.443 6.258 88 H GLU 14 HN GLU 14 11.300 -7.823 2.801 89 HA GLU 14 HA GLU 14 11.080 -10.571 3.264 90 1HB GLU 14 2HB GLU 14 9.336 -8.894 3.679 91 2HB GLU 14 1HB GLU 14 9.124 -8.665 1.943 92 1HG GLU 14 2HG GLU 14 8.522 -11.095 1.757 93 2HG GLU 14 1HG GLU 14 8.586 -11.201 3.516 94 H TYR 15 HN TYR 15 11.599 -8.985 0.201 95 HA TYR 15 HA TYR 15 10.691 -11.364 -1.329 96 1HB TYR 15 2HB TYR 15 11.648 -8.573 -1.989 97 2HB TYR 15 1HB TYR 15 11.379 -9.785 -3.243 98 HD1 TYR 15 HD1 TYR 15 9.063 -11.133 -2.920 99 HD2 TYR 15 HD2 TYR 15 9.865 -7.169 -1.487 100 HE1 TYR 15 HE1 TYR 15 6.631 -10.678 -2.830 101 HE2 TYR 15 HE2 TYR 15 7.432 -6.705 -1.400 102 HH TYR 15 HH TYR 15 5.058 -9.247 -2.001 103 H ARG 16 HN ARG 16 13.475 -10.429 0.265 104 HA ARG 16 HA ARG 16 15.532 -11.081 -1.637 105 1HB ARG 16 2HB ARG 16 15.337 -11.115 1.388 106 2HB ARG 16 1HB ARG 16 16.851 -11.377 0.519 107 1HG ARG 16 2HG ARG 16 16.409 -9.177 -0.675 108 2HG ARG 16 1HG ARG 16 15.099 -8.908 0.472 109 1HD ARG 16 2HD ARG 16 16.794 -9.226 2.335 110 2HD ARG 16 1HD ARG 16 18.055 -9.203 1.087 111 HE ARG 16 HE ARG 16 16.178 -6.985 0.826 112 1HH1 ARG 16 1HH1 ARG 16 18.161 -7.815 3.381 113 2HH1 ARG 16 2HH1 ARG 16 19.168 -6.409 3.299 114 1HH2 ARG 16 1HH2 ARG 16 17.838 -5.306 0.293 115 2HH2 ARG 16 2HH2 ARG 16 18.985 -4.987 1.551 116 H LYS 17 HN LYS 17 13.462 -13.007 0.443 117 HA LYS 17 HA LYS 17 14.977 -15.464 0.327 118 1HB LYS 17 2HB LYS 17 11.973 -15.208 0.571 119 2HB LYS 17 1HB LYS 17 13.031 -16.389 1.339 120 1HG LYS 17 2HG LYS 17 14.118 -14.185 2.382 121 2HG LYS 17 1HG LYS 17 12.503 -13.544 2.081 122 1HD LYS 17 2HD LYS 17 12.664 -16.231 3.357 123 2HD LYS 17 1HD LYS 17 13.130 -14.850 4.350 124 1HE LYS 17 2HE LYS 17 10.989 -13.933 4.310 125 2HE LYS 17 1HE LYS 17 10.592 -14.675 2.749 126 1HZ LYS 17 1HZ LYS 17 11.092 -16.838 4.207 127 2HZ LYS 17 3HZ LYS 17 10.502 -15.821 5.430 128 3HZ LYS 17 2HZ LYS 17 9.539 -16.164 4.073 129 H LEU 18 HN LEU 18 13.000 -13.774 -1.943 130 HA LEU 18 HA LEU 18 12.476 -16.186 -3.592 131 1HB LEU 18 2HB LEU 18 11.872 -13.352 -4.388 132 2HB LEU 18 1HB LEU 18 10.935 -14.810 -4.700 133 HG LEU 18 HG LEU 18 11.162 -13.256 -2.115 134 1HD1 LEU 18 3HD1 LEU 18 9.453 -12.753 -4.004 135 2HD1 LEU 18 2HD1 LEU 18 8.681 -14.258 -3.506 136 3HD1 LEU 18 1HD1 LEU 18 8.838 -12.927 -2.360 137 1HD2 LEU 18 3HD2 LEU 18 10.696 -16.126 -2.547 138 2HD2 LEU 18 2HD2 LEU 18 11.087 -15.260 -1.061 139 3HD2 LEU 18 1HD2 LEU 18 9.418 -15.334 -1.624 140 H VAL 19 HN VAL 19 14.403 -13.212 -3.597 141 HA VAL 19 HA VAL 19 15.414 -13.446 -6.286 142 HB VAL 19 HB VAL 19 16.813 -12.161 -3.933 143 1HG1 VAL 19 2HG1 VAL 19 17.711 -12.220 -6.368 144 2HG1 VAL 19 1HG1 VAL 19 16.418 -11.073 -6.717 145 3HG1 VAL 19 3HG1 VAL 19 17.667 -10.662 -5.541 146 1HG2 VAL 19 1HG2 VAL 19 14.120 -11.649 -4.955 147 2HG2 VAL 19 3HG2 VAL 19 14.901 -11.032 -3.498 148 3HG2 VAL 19 2HG2 VAL 19 15.158 -10.225 -5.045 149 H ARG 20 HN ARG 20 16.614 -15.204 -6.925 150 HA ARG 20 HA ARG 20 18.227 -16.744 -5.015 151 1HB ARG 20 2HB ARG 20 17.617 -16.840 -7.975 152 2HB ARG 20 1HB ARG 20 18.774 -17.949 -7.238 153 1HG ARG 20 2HG ARG 20 16.908 -19.231 -6.906 154 2HG ARG 20 1HG ARG 20 16.707 -18.192 -5.495 155 1HD ARG 20 2HD ARG 20 15.345 -16.628 -6.976 156 2HD ARG 20 1HD ARG 20 15.369 -17.907 -8.203 157 HE ARG 20 HE ARG 20 13.760 -17.939 -5.812 158 1HH1 ARG 20 1HH1 ARG 20 13.225 -19.603 -8.248 159 2HH1 ARG 20 2HH1 ARG 20 13.536 -21.206 -7.668 160 1HH2 ARG 20 1HH2 ARG 20 15.265 -20.137 -4.859 161 2HH2 ARG 20 2HH2 ARG 20 14.691 -21.508 -5.749 162 H ASN 21 HN ASN 21 19.427 -15.993 -8.224 163 HA ASN 21 HA ASN 21 21.922 -14.911 -6.989 164 1HB ASN 21 2HB ASN 21 22.971 -15.691 -8.996 165 2HB ASN 21 1HB ASN 21 21.806 -16.939 -8.557 166 1HD2 ASN 21 1HD2 ASN 21 19.883 -17.169 -9.876 167 2HD2 ASN 21 2HD2 ASN 21 19.743 -16.408 -11.384 168 H GLY 22 HN GLY 22 19.716 -13.128 -7.089 169 1HA GLY 22 1HA GLY 22 20.731 -11.165 -9.088 170 2HA GLY 22 2HA GLY 22 19.861 -10.747 -7.612 171 H LYS 23 HN LYS 23 18.269 -13.373 -8.745 172 HA LYS 23 HA LYS 23 16.487 -11.769 -10.546 173 1HB LYS 23 2HB LYS 23 17.520 -13.690 -11.613 174 2HB LYS 23 1HB LYS 23 17.050 -14.738 -10.275 175 1HG LYS 23 2HG LYS 23 15.393 -15.175 -11.886 176 2HG LYS 23 1HG LYS 23 14.621 -13.980 -10.844 177 1HD LYS 23 2HD LYS 23 15.170 -12.194 -12.394 178 2HD LYS 23 1HD LYS 23 16.124 -13.296 -13.386 179 1HE LYS 23 2HE LYS 23 14.118 -14.576 -13.964 180 2HE LYS 23 1HE LYS 23 13.137 -13.570 -12.882 181 1HZ LYS 23 1HZ LYS 23 14.316 -11.675 -14.264 182 2HZ LYS 23 3HZ LYS 23 14.379 -12.888 -15.448 183 3HZ LYS 23 2HZ LYS 23 12.880 -12.402 -14.810 184 H LEU 24 HN LEU 24 14.781 -11.019 -9.330 185 HA LEU 24 HA LEU 24 13.740 -12.642 -7.075 186 1HB LEU 24 2HB LEU 24 14.010 -10.378 -6.516 187 2HB LEU 24 1HB LEU 24 13.484 -9.825 -8.103 188 HG LEU 24 HG LEU 24 11.180 -10.483 -7.601 189 1HD1 LEU 24 2HD1 LEU 24 12.432 -12.158 -5.713 190 2HD1 LEU 24 1HD1 LEU 24 11.483 -11.007 -4.772 191 3HD1 LEU 24 3HD1 LEU 24 10.701 -11.997 -6.005 192 1HD2 LEU 24 1HD2 LEU 24 12.222 -8.267 -6.752 193 2HD2 LEU 24 3HD2 LEU 24 10.676 -8.763 -6.063 194 3HD2 LEU 24 2HD2 LEU 24 12.168 -9.017 -5.157 195 H ALA 25 HN ALA 25 11.578 -13.418 -7.034 196 HA ALA 25 HA ALA 25 9.671 -12.865 -9.162 197 1HB ALA 25 2HB ALA 25 9.793 -15.266 -10.026 198 2HB ALA 25 1HB ALA 25 11.165 -14.240 -10.449 199 3HB ALA 25 3HB ALA 25 11.311 -15.412 -9.139 200 H CYS 26 HN CYS 26 7.647 -13.318 -8.338 201 HA CYS 26 HA CYS 26 7.392 -15.426 -6.235 202 1HB CYS 26 2HB CYS 26 6.286 -13.871 -4.766 203 2HB CYS 26 1HB CYS 26 7.767 -13.082 -5.308 204 H THR 27 HN THR 27 4.753 -15.203 -5.649 205 HA THR 27 HA THR 27 3.394 -16.361 -7.856 206 HB THR 27 HB THR 27 2.627 -16.698 -5.614 207 HG1 THR 27 1HG THR 27 0.519 -16.255 -5.883 208 1HG2 THR 27 3HG2 THR 27 3.264 -13.907 -5.374 209 2HG2 THR 27 2HG2 THR 27 1.609 -14.169 -4.823 210 3HG2 THR 27 1HG2 THR 27 2.936 -15.074 -4.093 211 H ARG 28 HN ARG 28 1.036 -15.107 -8.301 212 HA ARG 28 HA ARG 28 1.859 -12.603 -9.708 213 1HB ARG 28 2HB ARG 28 0.928 -14.554 -10.969 214 2HB ARG 28 1HB ARG 28 -0.564 -14.401 -10.041 215 1HG ARG 28 2HG ARG 28 -0.823 -12.077 -10.886 216 2HG ARG 28 1HG ARG 28 0.633 -12.286 -11.858 217 1HD ARG 28 2HD ARG 28 -0.510 -14.283 -12.950 218 2HD ARG 28 1HD ARG 28 -1.999 -13.773 -12.131 219 HE ARG 28 HE ARG 28 -2.135 -12.016 -13.707 220 1HH1 ARG 28 1HH1 ARG 28 0.235 -13.700 -15.021 221 2HH1 ARG 28 2HH1 ARG 28 1.266 -12.384 -15.477 222 1HH2 ARG 28 1HH2 ARG 28 -0.431 -10.043 -13.562 223 2HH2 ARG 28 2HH2 ARG 28 0.889 -10.314 -14.651 224 H GLU 29 HN GLU 29 1.594 -11.824 -7.225 225 HA GLU 29 HA GLU 29 -0.840 -11.485 -5.922 226 1HB GLU 29 2HB GLU 29 1.442 -9.531 -6.354 227 2HB GLU 29 1HB GLU 29 0.207 -9.346 -5.110 228 1HG GLU 29 2HG GLU 29 2.006 -11.772 -5.381 229 2HG GLU 29 1HG GLU 29 2.301 -10.438 -4.266 230 H ASN 30 HN ASN 30 -2.606 -10.058 -6.149 231 HA ASN 30 HA ASN 30 -2.836 -8.725 -8.811 232 1HB ASN 30 2HB ASN 30 -4.852 -9.565 -6.702 233 2HB ASN 30 1HB ASN 30 -5.274 -8.815 -8.241 234 1HD2 ASN 30 1HD2 ASN 30 -5.404 -11.748 -6.920 235 2HD2 ASN 30 2HD2 ASN 30 -4.961 -12.729 -8.233 236 H ASP 31 HN ASP 31 -1.282 -7.098 -7.473 237 HA ASP 31 HA ASP 31 -3.043 -4.859 -6.651 238 1HB ASP 31 2HB ASP 31 -2.521 -6.293 -4.642 239 2HB ASP 31 1HB ASP 31 -0.813 -5.932 -4.894 240 HA PRO 32 HA PRO 32 0.607 -3.663 -9.257 241 1HB PRO 32 2HB PRO 32 -1.088 -1.573 -10.274 242 2HB PRO 32 1HB PRO 32 -0.491 -3.000 -11.125 243 1HG PRO 32 2HG PRO 32 -3.167 -2.473 -10.236 244 2HG PRO 32 1HG PRO 32 -2.566 -3.910 -11.068 245 1HD PRO 32 2HD PRO 32 -3.359 -3.655 -8.296 246 2HD PRO 32 1HD PRO 32 -2.788 -5.111 -9.142 247 H ILE 33 HN ILE 33 2.037 -2.072 -8.604 248 HA ILE 33 HA ILE 33 0.986 0.256 -7.056 249 HB ILE 33 HB ILE 33 2.361 -0.210 -5.207 250 1HG1 ILE 33 2HG1 ILE 33 4.463 -0.514 -6.415 251 2HG1 ILE 33 1HG1 ILE 33 4.236 -1.843 -5.280 252 1HG2 ILE 33 1HG2 ILE 33 1.569 -2.907 -6.345 253 2HG2 ILE 33 3HG2 ILE 33 2.027 -2.618 -4.666 254 3HG2 ILE 33 2HG2 ILE 33 0.573 -1.869 -5.325 255 1HD1 ILE 33 1HD1 ILE 33 3.160 -3.107 -7.252 256 2HD1 ILE 33 3HD1 ILE 33 3.870 -1.857 -8.276 257 3HD1 ILE 33 2HD1 ILE 33 4.911 -2.893 -7.297 258 H GLN 34 HN GLN 34 3.370 1.455 -6.430 259 HA GLN 34 HA GLN 34 4.627 1.907 -9.118 260 1HB GLN 34 2HB GLN 34 4.164 3.806 -6.794 261 2HB GLN 34 1HB GLN 34 4.868 4.243 -8.350 262 1HG GLN 34 2HG GLN 34 2.796 3.652 -9.498 263 2HG GLN 34 1HG GLN 34 2.091 3.078 -7.987 264 1HE2 GLN 34 1HE2 GLN 34 0.776 5.140 -9.388 265 2HE2 GLN 34 2HE2 GLN 34 0.936 6.598 -8.532 266 H GLY 35 HN GLY 35 6.919 2.660 -8.991 267 1HA GLY 35 1HA GLY 35 8.944 1.370 -8.194 268 2HA GLY 35 2HA GLY 35 8.301 1.583 -6.565 269 HA PRO 36 HA PRO 36 10.675 5.234 -6.092 270 1HB PRO 36 2HB PRO 36 13.271 4.258 -6.852 271 2HB PRO 36 1HB PRO 36 12.620 4.462 -5.223 272 1HG PRO 36 2HG PRO 36 13.105 2.009 -6.638 273 2HG PRO 36 1HG PRO 36 12.461 2.212 -5.007 274 1HD PRO 36 2HD PRO 36 11.047 1.372 -7.381 275 2HD PRO 36 1HD PRO 36 10.396 1.577 -5.738 276 H ASP 37 HN ASP 37 10.924 3.561 -9.125 277 HA ASP 37 HA ASP 37 12.234 5.803 -10.524 278 1HB ASP 37 2HB ASP 37 12.004 4.275 -12.456 279 2HB ASP 37 1HB ASP 37 12.680 3.425 -11.067 280 H GLY 38 HN GLY 38 9.397 5.822 -9.218 281 1HA GLY 38 1HA GLY 38 8.189 7.674 -10.986 282 2HA GLY 38 2HA GLY 38 7.333 6.810 -9.711 283 H LYS 39 HN LYS 39 8.312 4.231 -11.105 284 HA LYS 39 HA LYS 39 6.402 4.273 -13.413 285 1HB LYS 39 2HB LYS 39 8.911 3.746 -13.653 286 2HB LYS 39 1HB LYS 39 8.559 2.240 -12.805 287 1HG LYS 39 2HG LYS 39 6.806 1.749 -14.536 288 2HG LYS 39 1HG LYS 39 7.338 3.180 -15.418 289 1HD LYS 39 2HD LYS 39 9.653 2.197 -15.477 290 2HD LYS 39 1HD LYS 39 8.994 0.725 -14.763 291 1HE LYS 39 2HE LYS 39 7.639 0.284 -16.683 292 2HE LYS 39 1HE LYS 39 7.883 1.921 -17.320 293 1HZ LYS 39 1HZ LYS 39 10.237 0.270 -16.725 294 2HZ LYS 39 3HZ LYS 39 9.366 -0.071 -18.139 295 3HZ LYS 39 2HZ LYS 39 10.036 1.472 -17.909 296 H VAL 40 HN VAL 40 4.902 2.501 -13.587 297 HA VAL 40 HA VAL 40 4.127 1.329 -10.984 298 HB VAL 40 HB VAL 40 2.881 1.202 -13.751 299 1HG1 VAL 40 3HG1 VAL 40 1.779 0.611 -10.987 300 2HG1 VAL 40 2HG1 VAL 40 0.816 0.664 -12.463 301 3HG1 VAL 40 1HG1 VAL 40 2.065 -0.566 -12.268 302 1HG2 VAL 40 2HG2 VAL 40 3.151 3.369 -11.904 303 2HG2 VAL 40 1HG2 VAL 40 2.250 3.337 -13.419 304 3HG2 VAL 40 3HG2 VAL 40 1.460 2.868 -11.914 305 H HIS 41 HN HIS 41 3.727 -1.008 -10.799 306 HA HIS 41 HA HIS 41 5.267 -2.673 -12.759 307 1HB HIS 41 2HB HIS 41 5.259 -2.923 -9.735 308 2HB HIS 41 1HB HIS 41 6.259 -3.838 -10.864 309 HD1 HIS 41 HD1 HIS 41 8.314 -2.661 -11.870 310 HD2 HIS 41 HD2 HIS 41 6.050 -0.179 -9.402 311 HE1 HIS 41 HE1 HIS 41 9.697 -0.572 -11.491 312 H GLY 42 HN GLY 42 4.727 -5.113 -12.243 313 1HA GLY 42 1HA GLY 42 3.024 -6.731 -12.422 314 2HA GLY 42 2HA GLY 42 1.851 -5.415 -12.467 315 H ASN 43 HN ASN 43 4.174 -6.741 -10.073 316 HA ASN 43 HA ASN 43 1.981 -6.541 -8.030 317 1HB ASN 43 2HB ASN 43 3.007 -8.667 -7.119 318 2HB ASN 43 1HB ASN 43 2.280 -8.846 -8.715 319 1HD2 ASN 43 1HD2 ASN 43 4.190 -10.727 -8.104 320 2HD2 ASN 43 2HD2 ASN 43 5.640 -10.410 -8.926 321 H THR 44 HN THR 44 3.396 -7.228 -5.805 322 HA THR 44 HA THR 44 4.966 -4.853 -5.260 323 HB THR 44 HB THR 44 4.451 -7.433 -3.749 324 HG1 THR 44 1HG THR 44 3.261 -4.882 -3.848 325 1HG2 THR 44 2HG2 THR 44 6.529 -6.187 -3.035 326 2HG2 THR 44 1HG2 THR 44 5.494 -4.809 -2.660 327 3HG2 THR 44 3HG2 THR 44 5.295 -6.327 -1.783 328 H CYS 45 HN CYS 45 5.712 -8.208 -6.066 329 HA CYS 45 HA CYS 45 8.512 -8.116 -5.359 330 1HB CYS 45 2HB CYS 45 7.238 -9.787 -7.538 331 2HB CYS 45 1HB CYS 45 8.609 -10.205 -6.511 332 H SER 46 HN SER 46 6.816 -7.786 -8.505 333 HA SER 46 HA SER 46 8.945 -7.277 -10.216 334 1HB SER 46 2HB SER 46 6.539 -7.346 -10.820 335 2HB SER 46 1HB SER 46 6.296 -5.797 -10.015 336 HG SER 46 HG SER 46 8.166 -5.191 -11.535 337 H MET 47 HN MET 47 7.375 -4.991 -7.971 338 HA MET 47 HA MET 47 8.988 -2.700 -8.648 339 1HB MET 47 2HB MET 47 6.769 -3.160 -7.197 340 2HB MET 47 1HB MET 47 7.945 -3.142 -5.884 341 1HG MET 47 2HG MET 47 7.933 -0.963 -7.965 342 2HG MET 47 1HG MET 47 6.853 -0.885 -6.573 343 1HE MET 47 3HE MET 47 7.504 -1.651 -4.469 344 2HE MET 47 2HE MET 47 9.138 -1.928 -3.870 345 3HE MET 47 1HE MET 47 8.391 -0.345 -3.671 346 H CYS 48 HN CYS 48 9.391 -5.447 -6.511 347 HA CYS 48 HA CYS 48 11.778 -4.360 -5.182 348 1HB CYS 48 2HB CYS 48 10.135 -6.883 -5.146 349 2HB CYS 48 1HB CYS 48 11.708 -6.863 -4.352 350 H GLU 49 HN GLU 49 11.026 -6.301 -7.981 351 HA GLU 49 HA GLU 49 13.519 -7.715 -8.249 352 1HB GLU 49 2HB GLU 49 11.420 -6.759 -10.226 353 2HB GLU 49 1HB GLU 49 12.721 -7.870 -10.646 354 1HG GLU 49 2HG GLU 49 11.918 -9.496 -9.024 355 2HG GLU 49 1HG GLU 49 10.694 -8.367 -8.447 356 H VAL 50 HN VAL 50 12.379 -4.578 -9.550 357 HA VAL 50 HA VAL 50 14.701 -3.973 -11.102 358 HB VAL 50 HB VAL 50 13.754 -1.774 -11.175 359 1HG1 VAL 50 3HG1 VAL 50 12.234 -4.038 -11.605 360 2HG1 VAL 50 2HG1 VAL 50 11.189 -3.064 -10.570 361 3HG1 VAL 50 1HG1 VAL 50 11.782 -2.405 -12.096 362 1HG2 VAL 50 3HG2 VAL 50 12.357 -2.509 -8.586 363 2HG2 VAL 50 2HG2 VAL 50 13.678 -1.355 -8.761 364 3HG2 VAL 50 1HG2 VAL 50 12.104 -1.011 -9.479 365 H PHE 51 HN PHE 51 13.860 -3.210 -7.719 366 HA PHE 51 HA PHE 51 16.276 -1.755 -7.126 367 1HB PHE 51 2HB PHE 51 14.395 -1.505 -5.687 368 2HB PHE 51 1HB PHE 51 14.180 -3.248 -5.539 369 HD1 PHE 51 HD1 PHE 51 17.106 -0.924 -5.136 370 HD2 PHE 51 HD2 PHE 51 14.661 -3.995 -3.390 371 HE1 PHE 51 HE1 PHE 51 18.555 -0.933 -3.123 372 HE2 PHE 51 HE2 PHE 51 16.109 -4.002 -1.376 373 HZ PHE 51 HZ PHE 51 18.056 -2.471 -1.242 374 H PHE 52 HN PHE 52 15.306 -5.148 -6.753 375 HA PHE 52 HA PHE 52 17.701 -6.117 -5.524 376 1HB PHE 52 2HB PHE 52 15.356 -7.170 -7.043 377 2HB PHE 52 1HB PHE 52 16.741 -8.246 -6.876 378 HD1 PHE 52 HD1 PHE 52 17.798 -7.456 -4.225 379 HD2 PHE 52 HD2 PHE 52 13.750 -8.014 -5.546 380 HE1 PHE 52 HE1 PHE 52 17.109 -7.958 -1.899 381 HE2 PHE 52 HE2 PHE 52 13.060 -8.519 -3.220 382 HZ PHE 52 HZ PHE 52 14.739 -8.491 -1.395 383 H GLN 53 HN GLN 53 16.735 -5.723 -8.928 384 HA GLN 53 HA GLN 53 18.923 -7.032 -10.178 385 1HB GLN 53 2HB GLN 53 16.744 -6.047 -11.123 386 2HB GLN 53 1HB GLN 53 17.576 -4.492 -11.122 387 1HG GLN 53 2HG GLN 53 19.433 -5.650 -12.449 388 2HG GLN 53 1HG GLN 53 18.305 -6.989 -12.664 389 1HE2 GLN 53 1HE2 GLN 53 16.009 -4.919 -12.658 390 2HE2 GLN 53 2HE2 GLN 53 16.046 -4.267 -14.226 391 H ALA 54 HN ALA 54 18.546 -3.545 -9.433 392 HA ALA 54 HA ALA 54 21.054 -2.603 -10.231 393 1HB ALA 54 2HB ALA 54 20.459 -1.289 -7.831 394 2HB ALA 54 1HB ALA 54 19.887 -0.830 -9.435 395 3HB ALA 54 3HB ALA 54 18.896 -1.866 -8.409 396 H GLU 55 HN GLU 55 20.193 -4.339 -7.252 397 HA GLU 55 HA GLU 55 22.743 -4.002 -5.936 398 1HB GLU 55 2HB GLU 55 20.418 -5.927 -5.714 399 2HB GLU 55 1HB GLU 55 21.809 -6.017 -4.635 400 1HG GLU 55 2HG GLU 55 21.431 -3.634 -4.006 401 2HG GLU 55 1HG GLU 55 19.988 -3.620 -5.021 402 H GLU 56 HN GLU 56 21.650 -6.032 -8.520 403 HA GLU 56 HA GLU 56 23.459 -8.248 -8.183 404 1HB GLU 56 2HB GLU 56 21.393 -8.153 -9.601 405 2HB GLU 56 1HB GLU 56 22.242 -7.066 -10.699 406 1HG GLU 56 2HG GLU 56 23.968 -8.804 -11.070 407 2HG GLU 56 1HG GLU 56 23.089 -9.893 -9.995 408 H GLU 57 HN GLU 57 23.765 -5.055 -9.661 409 HA GLU 57 HA GLU 57 26.168 -5.508 -11.155 410 1HB GLU 57 2HB GLU 57 25.049 -3.034 -9.792 411 2HB GLU 57 1HB GLU 57 26.295 -3.022 -11.041 412 1HG GLU 57 2HG GLU 57 23.495 -4.140 -11.376 413 2HG GLU 57 1HG GLU 57 24.047 -2.583 -11.992 414 H GLU 58 HN GLU 58 25.669 -4.206 -7.851 415 HA GLU 58 HA GLU 58 28.312 -3.689 -7.103 416 1HB GLU 58 2HB GLU 58 26.034 -4.941 -5.534 417 2HB GLU 58 1HB GLU 58 27.465 -4.211 -4.804 418 1HG GLU 58 2HG GLU 58 25.569 -2.754 -6.671 419 2HG GLU 58 1HG GLU 58 25.505 -2.649 -4.912 420 H LYS 59 HN LYS 59 26.648 -6.820 -7.288 421 HA LYS 59 HA LYS 59 28.811 -8.337 -6.069 422 1HB LYS 59 2HB LYS 59 26.400 -9.029 -7.774 423 2HB LYS 59 1HB LYS 59 27.441 -10.242 -7.029 424 1HG LYS 59 2HG LYS 59 26.976 -9.218 -4.802 425 2HG LYS 59 1HG LYS 59 25.860 -8.095 -5.579 426 1HD LYS 59 2HD LYS 59 24.568 -10.063 -6.441 427 2HD LYS 59 1HD LYS 59 25.630 -11.119 -5.511 428 1HE LYS 59 2HE LYS 59 24.156 -8.837 -4.179 429 2HE LYS 59 1HE LYS 59 23.399 -10.428 -4.390 430 1HZ LYS 59 3HZ LYS 59 25.799 -11.158 -3.542 431 2HZ LYS 59 2HZ LYS 59 25.693 -9.657 -2.754 432 3HZ LYS 59 1HZ LYS 59 24.518 -10.851 -2.473 433 H LYS 60 HN LYS 60 28.423 -6.867 -9.110 434 HA LYS 60 HA LYS 60 29.460 -8.603 -11.021 435 1HB LYS 60 2HB LYS 60 30.247 -6.571 -12.110 436 2HB LYS 60 1HB LYS 60 28.738 -6.205 -11.274 437 1HG LYS 60 2HG LYS 60 30.141 -5.429 -9.307 438 2HG LYS 60 1HG LYS 60 31.554 -5.575 -10.351 439 1HD LYS 60 2HD LYS 60 30.291 -4.069 -12.003 440 2HD LYS 60 1HD LYS 60 29.179 -3.733 -10.677 441 1HE LYS 60 2HE LYS 60 32.067 -3.483 -10.017 442 2HE LYS 60 1HE LYS 60 31.410 -2.254 -11.115 443 1HZ LYS 60 1HZ LYS 60 29.867 -3.075 -8.743 444 2HZ LYS 60 3HZ LYS 60 31.136 -1.967 -8.554 445 3HZ LYS 60 2HZ LYS 60 29.836 -1.599 -9.583 446 H LYS 61 HN LYS 61 31.249 -6.862 -8.484 447 HA LYS 61 HA LYS 61 33.888 -7.597 -9.381 448 1HB LYS 61 2HB LYS 61 32.766 -6.869 -6.654 449 2HB LYS 61 1HB LYS 61 34.480 -6.877 -7.068 450 1HG LYS 61 2HG LYS 61 33.985 -5.221 -8.891 451 2HG LYS 61 1HG LYS 61 32.324 -5.138 -8.303 452 1HD LYS 61 2HD LYS 61 33.185 -4.443 -6.069 453 2HD LYS 61 1HD LYS 61 34.822 -4.443 -6.727 454 1HE LYS 61 2HE LYS 61 33.860 -2.828 -8.536 455 2HE LYS 61 1HE LYS 61 32.527 -2.595 -7.388 456 1HZ LYS 61 3HZ LYS 61 34.239 -2.201 -5.653 457 2HZ LYS 61 2HZ LYS 61 35.434 -2.237 -6.861 458 3HZ LYS 61 1HZ LYS 61 34.246 -1.022 -6.872 459 H LYS 62 HN LYS 62 34.974 -9.519 -9.103 460 HA LYS 62 HA LYS 62 33.593 -11.704 -7.628 461 1HB LYS 62 2HB LYS 62 35.921 -11.593 -9.572 462 2HB LYS 62 1HB LYS 62 35.281 -13.083 -8.881 463 1HG LYS 62 2HG LYS 62 33.040 -12.508 -9.833 464 2HG LYS 62 1HG LYS 62 33.771 -11.104 -10.613 465 1HD LYS 62 2HD LYS 62 35.383 -12.668 -11.751 466 2HD LYS 62 1HD LYS 62 34.464 -14.018 -11.085 467 1HE LYS 62 2HE LYS 62 32.455 -12.525 -12.203 468 2HE LYS 62 1HE LYS 62 33.789 -12.216 -13.330 469 1HZ LYS 62 1HZ LYS 62 34.215 -14.720 -13.105 470 2HZ LYS 62 3HZ LYS 62 32.635 -14.810 -12.493 471 3HZ LYS 62 2HZ LYS 62 32.903 -14.229 -14.068 472 H GLU 63 HN GLU 63 34.667 -12.859 -5.952 473 HA GLU 63 HA GLU 63 36.438 -11.373 -4.255 474 1HB GLU 63 2HB GLU 63 35.751 -14.327 -4.415 475 2HB GLU 63 1HB GLU 63 36.522 -13.548 -3.033 476 1HG GLU 63 2HG GLU 63 34.562 -12.047 -2.806 477 2HG GLU 63 1HG GLU 63 33.789 -12.867 -4.162 478 H GLY 64 HN GLY 64 37.028 -13.327 -7.038 479 1HA GLY 64 1HA GLY 64 39.546 -14.457 -6.541 480 2HA GLY 64 2HA GLY 64 39.858 -12.780 -6.986 481 H GLU 65 HN GLU 65 40.865 -14.618 -8.689 482 HA GLU 65 HA GLU 65 39.283 -14.156 -11.136 483 1HB GLU 65 2HB GLU 65 41.822 -13.864 -10.758 484 2HB GLU 65 1HB GLU 65 41.911 -15.623 -10.842 485 1HG GLU 65 2HG GLU 65 40.794 -15.542 -13.067 486 2HG GLU 65 1HG GLU 65 40.806 -13.781 -12.985 487 H SER 66 HN SER 66 38.266 -15.789 -12.313 488 HA SER 66 HA SER 66 37.462 -18.205 -11.016 489 1HB SER 66 2HB SER 66 37.562 -17.514 -13.971 490 2HB SER 66 1HB SER 66 36.504 -18.705 -13.215 491 HG SER 66 HG SER 66 35.519 -16.629 -13.577 492 H ARG 67 HN ARG 67 40.352 -17.398 -12.735 493 HA ARG 67 HA ARG 67 41.026 -20.133 -13.542 494 1HB ARG 67 2HB ARG 67 42.548 -17.514 -13.370 495 2HB ARG 67 1HB ARG 67 43.211 -18.988 -14.076 496 1HG ARG 67 2HG ARG 67 41.310 -19.042 -15.681 497 2HG ARG 67 1HG ARG 67 40.720 -17.525 -15.002 498 1HD ARG 67 2HD ARG 67 42.988 -16.513 -15.577 499 2HD ARG 67 1HD ARG 67 43.321 -17.995 -16.492 500 HE ARG 67 HE ARG 67 40.761 -17.150 -17.295 501 1HH1 ARG 67 1HH1 ARG 67 43.299 -17.398 -19.019 502 2HH1 ARG 67 2HH1 ARG 67 43.396 -15.799 -19.676 503 1HH2 ARG 67 1HH2 ARG 67 41.170 -14.439 -17.391 504 2HH2 ARG 67 2HH2 ARG 67 42.192 -14.123 -18.754 505 H ASN 68 HN ASN 68 41.673 -18.015 -10.791 506 HA ASN 68 HA ASN 68 42.936 -18.389 -8.817 507 1HB ASN 68 2HB ASN 68 40.862 -19.978 -8.930 508 2HB ASN 68 1HB ASN 68 42.057 -21.246 -9.197 509 1HD2 ASN 68 1HD2 ASN 68 40.982 -21.848 -6.930 510 2HD2 ASN 68 2HD2 ASN 68 41.785 -21.237 -5.564 No H/Q in entry = 510 Start of MODEL 2 1 H1 GLU 1 3H GLU 1 7.467 7.651 -2.934 2 H2 GLU 1 2H GLU 1 7.263 9.170 -3.670 3 H3 GLU 1 1H GLU 1 7.465 9.058 -1.987 4 HA GLU 1 HA GLU 1 5.165 9.412 -2.304 5 1HB GLU 1 2HB GLU 1 5.323 8.963 -4.732 6 2HB GLU 1 1HB GLU 1 5.459 7.237 -4.399 7 1HG GLU 1 2HG GLU 1 3.234 7.290 -3.302 8 2HG GLU 1 1HG GLU 1 3.099 9.006 -3.686 9 H SER 2 HN SER 2 5.663 5.970 -3.043 10 HA SER 2 HA SER 2 4.492 5.307 -0.371 11 1HB SER 2 2HB SER 2 4.815 3.653 -2.897 12 2HB SER 2 1HB SER 2 3.885 3.200 -1.469 13 HG SER 2 HG SER 2 2.552 4.094 -3.077 14 H GLY 3 HN GLY 3 5.572 3.774 0.966 15 1HA GLY 3 1HA GLY 3 8.139 2.641 0.051 16 2HA GLY 3 2HA GLY 3 7.334 2.279 1.578 17 H LYS 4 HN LYS 4 7.376 5.607 1.001 18 HA LYS 4 HA LYS 4 9.983 6.426 1.738 19 1HB LYS 4 2HB LYS 4 8.235 7.916 0.900 20 2HB LYS 4 1HB LYS 4 7.248 7.608 2.329 21 1HG LYS 4 2HG LYS 4 9.265 8.488 3.680 22 2HG LYS 4 1HG LYS 4 9.859 9.115 2.142 23 1HD LYS 4 2HD LYS 4 7.642 10.280 1.851 24 2HD LYS 4 1HD LYS 4 7.228 9.782 3.492 25 1HE LYS 4 2HE LYS 4 8.156 12.068 3.519 26 2HE LYS 4 1HE LYS 4 9.289 10.961 4.317 27 1HZ LYS 4 3HZ LYS 4 9.433 11.400 1.402 28 2HZ LYS 4 2HZ LYS 4 10.160 12.516 2.457 29 3HZ LYS 4 1HZ LYS 4 10.653 10.891 2.463 30 H ALA 5 HN ALA 5 7.563 4.835 3.620 31 HA ALA 5 HA ALA 5 8.199 5.800 6.241 32 1HB ALA 5 1HB ALA 5 6.696 3.672 4.931 33 2HB ALA 5 3HB ALA 5 7.425 3.115 6.438 34 3HB ALA 5 2HB ALA 5 6.348 4.512 6.444 35 H THR 6 HN THR 6 9.863 3.602 4.095 36 HA THR 6 HA THR 6 12.048 3.334 6.082 37 HB THR 6 HB THR 6 10.467 1.491 6.542 38 HG1 THR 6 1HG THR 6 12.080 -0.230 5.736 39 1HG2 THR 6 2HG2 THR 6 10.359 1.446 3.656 40 2HG2 THR 6 1HG2 THR 6 10.797 -0.148 4.271 41 3HG2 THR 6 3HG2 THR 6 9.310 0.629 4.816 42 H SER 7 HN SER 7 13.584 1.477 4.832 43 HA SER 7 HA SER 7 14.229 2.789 2.239 44 1HB SER 7 2HB SER 7 16.412 2.229 2.769 45 2HB SER 7 1HB SER 7 15.737 2.290 4.393 46 HG SER 7 HG SER 7 15.442 0.060 4.308 47 H TYR 8 HN TYR 8 14.720 1.417 0.376 48 HA TYR 8 HA TYR 8 12.890 -0.747 -0.047 49 1HB TYR 8 2HB TYR 8 15.433 0.104 -1.470 50 2HB TYR 8 1HB TYR 8 14.240 -1.009 -2.140 51 HD1 TYR 8 HD1 TYR 8 11.749 0.328 -1.020 52 HD2 TYR 8 HD2 TYR 8 15.204 1.929 -3.008 53 HE1 TYR 8 HE1 TYR 8 10.401 2.250 -1.808 54 HE2 TYR 8 HE2 TYR 8 13.854 3.853 -3.800 55 HH TYR 8 HH TYR 8 10.680 3.929 -3.965 56 H ALA 9 HN ALA 9 16.433 -0.752 0.512 57 HA ALA 9 HA ALA 9 16.965 -3.491 0.372 58 1HB ALA 9 3HB ALA 9 18.460 -1.436 0.869 59 2HB ALA 9 2HB ALA 9 18.026 -1.692 2.558 60 3HB ALA 9 1HB ALA 9 18.884 -2.950 1.668 61 H GLU 10 HN GLU 10 15.077 -1.770 2.750 62 HA GLU 10 HA GLU 10 15.039 -4.144 4.563 63 1HB GLU 10 2HB GLU 10 14.045 -1.284 4.816 64 2HB GLU 10 1HB GLU 10 13.926 -2.496 6.091 65 1HG GLU 10 2HG GLU 10 16.425 -2.767 5.969 66 2HG GLU 10 1HG GLU 10 16.467 -1.411 4.843 67 H LEU 11 HN LEU 11 12.945 -2.075 2.575 68 HA LEU 11 HA LEU 11 10.467 -3.377 3.316 69 1HB LEU 11 2HB LEU 11 10.979 -1.055 2.241 70 2HB LEU 11 1HB LEU 11 11.015 -1.947 0.720 71 HG LEU 11 HG LEU 11 8.723 -2.911 1.921 72 1HD1 LEU 11 3HD1 LEU 11 9.137 -1.004 3.621 73 2HD1 LEU 11 2HD1 LEU 11 8.666 0.081 2.313 74 3HD1 LEU 11 1HD1 LEU 11 7.527 -1.126 2.911 75 1HD2 LEU 11 2HD2 LEU 11 9.483 -1.260 -0.320 76 2HD2 LEU 11 1HD2 LEU 11 8.108 -2.356 -0.173 77 3HD2 LEU 11 3HD2 LEU 11 7.961 -0.679 0.355 78 H CYS 12 HN CYS 12 12.261 -3.432 0.227 79 HA CYS 12 HA CYS 12 10.897 -5.659 -0.900 80 1HB CYS 12 2HB CYS 12 13.506 -4.239 -1.274 81 2HB CYS 12 1HB CYS 12 13.274 -5.773 -2.112 82 H ASN 13 HN ASN 13 13.186 -5.489 1.654 83 HA ASN 13 HA ASN 13 14.726 -7.767 1.630 84 1HB ASN 13 2HB ASN 13 14.404 -6.041 3.447 85 2HB ASN 13 1HB ASN 13 12.948 -6.902 3.928 86 1HD2 ASN 13 1HD2 ASN 13 15.301 -6.624 5.631 87 2HD2 ASN 13 2HD2 ASN 13 15.928 -8.181 5.884 88 H GLU 14 HN GLU 14 11.319 -7.674 2.691 89 HA GLU 14 HA GLU 14 10.860 -10.363 3.254 90 1HB GLU 14 2HB GLU 14 9.298 -8.058 2.203 91 2HB GLU 14 1HB GLU 14 8.539 -9.644 2.062 92 1HG GLU 14 2HG GLU 14 8.787 -10.031 4.449 93 2HG GLU 14 1HG GLU 14 9.710 -8.539 4.632 94 H TYR 15 HN TYR 15 11.507 -8.941 0.124 95 HA TYR 15 HA TYR 15 10.490 -11.324 -1.317 96 1HB TYR 15 2HB TYR 15 11.644 -8.634 -2.073 97 2HB TYR 15 1HB TYR 15 11.304 -9.875 -3.281 98 HD1 TYR 15 HD1 TYR 15 8.905 -11.025 -3.001 99 HD2 TYR 15 HD2 TYR 15 9.950 -7.117 -1.571 100 HE1 TYR 15 HE1 TYR 15 6.509 -10.410 -2.944 101 HE2 TYR 15 HE2 TYR 15 7.552 -6.492 -1.524 102 HH TYR 15 HH TYR 15 5.232 -8.139 -1.295 103 H ARG 16 HN ARG 16 13.374 -10.343 0.182 104 HA ARG 16 HA ARG 16 15.376 -11.290 -1.619 105 1HB ARG 16 2HB ARG 16 15.177 -11.192 1.408 106 2HB ARG 16 1HB ARG 16 16.676 -11.517 0.535 107 1HG ARG 16 2HG ARG 16 16.401 -9.356 -0.670 108 2HG ARG 16 1HG ARG 16 14.967 -9.025 0.299 109 1HD ARG 16 2HD ARG 16 16.355 -9.148 2.362 110 2HD ARG 16 1HD ARG 16 17.792 -9.408 1.354 111 HE ARG 16 HE ARG 16 16.139 -7.053 0.667 112 1HH1 ARG 16 1HH1 ARG 16 18.455 -8.109 2.931 113 2HH1 ARG 16 2HH1 ARG 16 19.489 -6.733 2.743 114 1HH2 ARG 16 1HH2 ARG 16 17.652 -5.374 0.136 115 2HH2 ARG 16 2HH2 ARG 16 19.036 -5.184 1.162 116 H LYS 17 HN LYS 17 13.094 -12.962 0.430 117 HA LYS 17 HA LYS 17 14.453 -15.518 0.527 118 1HB LYS 17 2HB LYS 17 11.464 -15.068 0.613 119 2HB LYS 17 1HB LYS 17 12.418 -16.249 1.509 120 1HG LYS 17 2HG LYS 17 13.572 -14.053 2.477 121 2HG LYS 17 1HG LYS 17 12.025 -13.331 2.033 122 1HD LYS 17 2HD LYS 17 11.788 -15.922 3.418 123 2HD LYS 17 1HD LYS 17 12.509 -14.645 4.399 124 1HE LYS 17 2HE LYS 17 10.539 -13.489 4.533 125 2HE LYS 17 1HE LYS 17 10.140 -13.800 2.832 126 1HZ LYS 17 3HZ LYS 17 9.926 -16.232 3.657 127 2HZ LYS 17 2HZ LYS 17 9.726 -15.526 5.189 128 3HZ LYS 17 1HZ LYS 17 8.644 -15.157 3.932 129 H LEU 18 HN LEU 18 12.659 -13.809 -1.877 130 HA LEU 18 HA LEU 18 12.061 -16.248 -3.460 131 1HB LEU 18 2HB LEU 18 11.626 -13.408 -4.352 132 2HB LEU 18 1HB LEU 18 10.635 -14.829 -4.673 133 HG LEU 18 HG LEU 18 10.840 -13.248 -2.100 134 1HD1 LEU 18 2HD1 LEU 18 9.249 -12.584 -3.979 135 2HD1 LEU 18 1HD1 LEU 18 8.414 -14.110 -3.692 136 3HD1 LEU 18 3HD1 LEU 18 8.493 -12.895 -2.416 137 1HD2 LEU 18 3HD2 LEU 18 10.397 -16.084 -2.448 138 2HD2 LEU 18 2HD2 LEU 18 10.469 -15.148 -0.955 139 3HD2 LEU 18 1HD2 LEU 18 8.941 -15.312 -1.819 140 H VAL 19 HN VAL 19 14.109 -13.342 -3.547 141 HA VAL 19 HA VAL 19 15.201 -13.699 -6.166 142 HB VAL 19 HB VAL 19 16.617 -12.552 -3.747 143 1HG1 VAL 19 1HG1 VAL 19 17.707 -12.727 -6.070 144 2HG1 VAL 19 3HG1 VAL 19 16.523 -11.526 -6.588 145 3HG1 VAL 19 2HG1 VAL 19 17.687 -11.128 -5.324 146 1HG2 VAL 19 2HG2 VAL 19 14.043 -11.810 -4.855 147 2HG2 VAL 19 1HG2 VAL 19 14.882 -11.143 -3.454 148 3HG2 VAL 19 3HG2 VAL 19 15.207 -10.501 -5.065 149 H ARG 20 HN ARG 20 16.589 -15.273 -6.887 150 HA ARG 20 HA ARG 20 17.688 -17.243 -5.021 151 1HB ARG 20 2HB ARG 20 18.234 -16.910 -7.978 152 2HB ARG 20 1HB ARG 20 18.270 -18.400 -7.036 153 1HG ARG 20 2HG ARG 20 15.851 -16.741 -7.786 154 2HG ARG 20 1HG ARG 20 16.193 -18.412 -8.235 155 1HD ARG 20 2HD ARG 20 16.117 -18.992 -5.762 156 2HD ARG 20 1HD ARG 20 15.506 -17.350 -5.475 157 HE ARG 20 HE ARG 20 13.734 -18.021 -7.284 158 1HH1 ARG 20 1HH1 ARG 20 15.367 -20.770 -6.526 159 2HH1 ARG 20 2HH1 ARG 20 14.025 -21.635 -5.856 160 1HH2 ARG 20 1HH2 ARG 20 11.937 -18.867 -5.784 161 2HH2 ARG 20 2HH2 ARG 20 12.082 -20.558 -5.436 162 H ASN 21 HN ASN 21 19.345 -15.461 -7.628 163 HA ASN 21 HA ASN 21 21.542 -14.790 -5.716 164 1HB ASN 21 2HB ASN 21 21.880 -16.065 -8.450 165 2HB ASN 21 1HB ASN 21 23.163 -15.707 -7.296 166 1HD2 ASN 21 1HD2 ASN 21 20.681 -18.002 -8.156 167 2HD2 ASN 21 2HD2 ASN 21 20.964 -19.090 -6.885 168 H GLY 22 HN GLY 22 19.682 -12.925 -6.597 169 1HA GLY 22 1HA GLY 22 21.245 -11.372 -8.621 170 2HA GLY 22 2HA GLY 22 20.398 -10.623 -7.269 171 H LYS 23 HN LYS 23 18.659 -13.234 -8.538 172 HA LYS 23 HA LYS 23 17.035 -11.403 -10.275 173 1HB LYS 23 2HB LYS 23 16.507 -13.408 -11.553 174 2HB LYS 23 1HB LYS 23 18.257 -13.326 -11.346 175 1HG LYS 23 2HG LYS 23 17.928 -14.799 -9.274 176 2HG LYS 23 1HG LYS 23 16.286 -15.071 -9.857 177 1HD LYS 23 2HD LYS 23 17.500 -15.650 -12.123 178 2HD LYS 23 1HD LYS 23 18.895 -15.919 -11.078 179 1HE LYS 23 2HE LYS 23 17.176 -17.336 -9.649 180 2HE LYS 23 1HE LYS 23 16.294 -17.420 -11.186 181 1HZ LYS 23 1HZ LYS 23 19.191 -17.803 -11.266 182 2HZ LYS 23 3HZ LYS 23 18.275 -19.072 -10.613 183 3HZ LYS 23 2HZ LYS 23 17.977 -18.540 -12.199 184 H LEU 24 HN LEU 24 15.151 -10.853 -9.259 185 HA LEU 24 HA LEU 24 14.052 -12.586 -7.124 186 1HB LEU 24 2HB LEU 24 14.146 -10.282 -6.592 187 2HB LEU 24 1HB LEU 24 13.574 -9.804 -8.188 188 HG LEU 24 HG LEU 24 11.357 -10.733 -7.697 189 1HD1 LEU 24 3HD1 LEU 24 12.477 -12.464 -6.068 190 2HD1 LEU 24 2HD1 LEU 24 12.198 -11.215 -4.855 191 3HD1 LEU 24 1HD1 LEU 24 10.838 -11.900 -5.745 192 1HD2 LEU 24 2HD2 LEU 24 12.284 -8.401 -6.783 193 2HD2 LEU 24 1HD2 LEU 24 10.657 -8.957 -6.394 194 3HD2 LEU 24 3HD2 LEU 24 11.962 -9.164 -5.226 195 H ALA 25 HN ALA 25 12.218 -13.828 -7.400 196 HA ALA 25 HA ALA 25 10.730 -13.544 -9.992 197 1HB ALA 25 3HB ALA 25 11.827 -15.571 -10.236 198 2HB ALA 25 2HB ALA 25 11.886 -15.862 -8.498 199 3HB ALA 25 1HB ALA 25 10.387 -16.129 -9.386 200 H CYS 26 HN CYS 26 8.457 -13.725 -9.849 201 HA CYS 26 HA CYS 26 7.192 -14.407 -7.266 202 1HB CYS 26 2HB CYS 26 8.017 -11.866 -7.593 203 2HB CYS 26 1HB CYS 26 6.463 -11.752 -8.418 204 H THR 27 HN THR 27 4.655 -13.789 -7.633 205 HA THR 27 HA THR 27 3.949 -14.949 -10.303 206 HB THR 27 HB THR 27 1.766 -15.387 -8.890 207 HG1 THR 27 1HG THR 27 2.431 -14.101 -7.139 208 1HG2 THR 27 2HG2 THR 27 4.171 -16.820 -9.361 209 2HG2 THR 27 1HG2 THR 27 3.699 -17.140 -7.692 210 3HG2 THR 27 3HG2 THR 27 2.573 -17.480 -9.007 211 H ARG 28 HN ARG 28 1.665 -14.201 -11.028 212 HA ARG 28 HA ARG 28 1.599 -11.473 -11.640 213 1HB ARG 28 2HB ARG 28 -0.657 -13.458 -11.211 214 2HB ARG 28 1HB ARG 28 -0.833 -11.924 -12.065 215 1HG ARG 28 2HG ARG 28 0.874 -12.630 -13.697 216 2HG ARG 28 1HG ARG 28 1.072 -14.157 -12.838 217 1HD ARG 28 2HD ARG 28 -0.438 -14.630 -14.646 218 2HD ARG 28 1HD ARG 28 -1.467 -14.489 -13.208 219 HE ARG 28 HE ARG 28 -1.137 -11.887 -14.328 220 1HH1 ARG 28 1HH1 ARG 28 -1.530 -13.670 -16.790 221 2HH1 ARG 28 2HH1 ARG 28 -3.248 -13.572 -16.991 222 1HH2 ARG 28 1HH2 ARG 28 -3.813 -12.300 -13.815 223 2HH2 ARG 28 2HH2 ARG 28 -4.541 -12.795 -15.306 224 H GLU 29 HN GLU 29 0.687 -13.053 -8.656 225 HA GLU 29 HA GLU 29 -0.232 -12.190 -6.650 226 1HB GLU 29 2HB GLU 29 1.492 -10.023 -7.849 227 2HB GLU 29 1HB GLU 29 0.717 -9.798 -6.281 228 1HG GLU 29 2HG GLU 29 2.647 -12.007 -7.051 229 2HG GLU 29 1HG GLU 29 2.948 -10.692 -5.915 230 H ASN 30 HN ASN 30 -1.273 -9.807 -5.898 231 HA ASN 30 HA ASN 30 -3.151 -8.885 -8.018 232 1HB ASN 30 2HB ASN 30 -5.008 -9.287 -6.285 233 2HB ASN 30 1HB ASN 30 -4.327 -10.724 -7.047 234 1HD2 ASN 30 1HD2 ASN 30 -3.904 -12.334 -5.540 235 2HD2 ASN 30 2HD2 ASN 30 -3.410 -12.071 -3.937 236 H ASP 31 HN ASP 31 -1.228 -7.211 -7.205 237 HA ASP 31 HA ASP 31 -2.675 -5.126 -5.750 238 1HB ASP 31 2HB ASP 31 -1.633 -6.897 -4.107 239 2HB ASP 31 1HB ASP 31 -0.116 -6.078 -4.484 240 HA PRO 32 HA PRO 32 0.464 -3.737 -8.873 241 1HB PRO 32 2HB PRO 32 -1.357 -1.575 -9.409 242 2HB PRO 32 1HB PRO 32 -0.940 -2.931 -10.458 243 1HG PRO 32 2HG PRO 32 -3.410 -2.475 -9.078 244 2HG PRO 32 1HG PRO 32 -2.979 -3.851 -10.098 245 1HD PRO 32 2HD PRO 32 -3.264 -3.784 -7.217 246 2HD PRO 32 1HD PRO 32 -2.886 -5.181 -8.250 247 H ILE 33 HN ILE 33 1.912 -2.007 -8.567 248 HA ILE 33 HA ILE 33 1.233 0.158 -6.661 249 HB ILE 33 HB ILE 33 2.869 -0.436 -5.065 250 1HG1 ILE 33 2HG1 ILE 33 4.776 -0.834 -6.459 251 2HG1 ILE 33 1HG1 ILE 33 4.525 -2.311 -5.531 252 1HG2 ILE 33 3HG2 ILE 33 1.761 -3.053 -6.117 253 2HG2 ILE 33 2HG2 ILE 33 2.422 -2.797 -4.503 254 3HG2 ILE 33 1HG2 ILE 33 0.946 -1.967 -4.992 255 1HD1 ILE 33 2HD1 ILE 33 3.076 -3.059 -7.564 256 2HD1 ILE 33 1HD1 ILE 33 3.928 -1.782 -8.434 257 3HD1 ILE 33 3HD1 ILE 33 4.832 -3.115 -7.716 258 H GLN 34 HN GLN 34 3.653 1.326 -6.332 259 HA GLN 34 HA GLN 34 4.739 1.668 -9.108 260 1HB GLN 34 2HB GLN 34 4.269 3.791 -6.989 261 2HB GLN 34 1HB GLN 34 4.784 4.065 -8.653 262 1HG GLN 34 2HG GLN 34 2.673 3.284 -9.513 263 2HG GLN 34 1HG GLN 34 2.171 2.717 -7.919 264 1HE2 GLN 34 1HE2 GLN 34 0.550 4.586 -9.303 265 2HE2 GLN 34 2HE2 GLN 34 0.628 6.084 -8.509 266 H GLY 35 HN GLY 35 6.983 2.651 -9.062 267 1HA GLY 35 1HA GLY 35 9.139 1.677 -8.272 268 2HA GLY 35 2HA GLY 35 8.471 1.713 -6.641 269 HA PRO 36 HA PRO 36 10.496 5.559 -6.003 270 1HB PRO 36 2HB PRO 36 13.103 5.033 -7.099 271 2HB PRO 36 1HB PRO 36 12.606 4.988 -5.405 272 1HG PRO 36 2HG PRO 36 13.256 2.773 -7.113 273 2HG PRO 36 1HG PRO 36 12.754 2.727 -5.422 274 1HD PRO 36 2HD PRO 36 11.233 1.936 -7.747 275 2HD PRO 36 1HD PRO 36 10.730 1.880 -6.041 276 H ASP 37 HN ASP 37 10.691 4.246 -9.225 277 HA ASP 37 HA ASP 37 11.444 6.852 -10.423 278 1HB ASP 37 2HB ASP 37 10.765 4.158 -11.650 279 2HB ASP 37 1HB ASP 37 11.527 5.515 -12.482 280 H GLY 38 HN GLY 38 8.763 6.150 -9.030 281 1HA GLY 38 1HA GLY 38 7.070 7.772 -10.620 282 2HA GLY 38 2HA GLY 38 6.505 6.671 -9.365 283 H LYS 39 HN LYS 39 8.005 4.495 -11.036 284 HA LYS 39 HA LYS 39 6.092 4.256 -13.309 285 1HB LYS 39 2HB LYS 39 8.687 2.925 -12.500 286 2HB LYS 39 1HB LYS 39 7.718 2.342 -13.854 287 1HG LYS 39 2HG LYS 39 7.802 4.696 -14.792 288 2HG LYS 39 1HG LYS 39 8.984 5.077 -13.540 289 1HD LYS 39 2HD LYS 39 10.207 2.929 -14.444 290 2HD LYS 39 1HD LYS 39 9.244 3.224 -15.891 291 1HE LYS 39 2HE LYS 39 10.285 5.292 -16.314 292 2HE LYS 39 1HE LYS 39 10.814 5.474 -14.631 293 1HZ LYS 39 2HZ LYS 39 12.214 3.491 -14.938 294 2HZ LYS 39 1HZ LYS 39 11.770 3.434 -16.576 295 3HZ LYS 39 3HZ LYS 39 12.665 4.748 -15.988 296 H VAL 40 HN VAL 40 4.730 2.412 -13.496 297 HA VAL 40 HA VAL 40 4.175 1.016 -10.930 298 HB VAL 40 HB VAL 40 2.681 1.046 -13.572 299 1HG1 VAL 40 1HG1 VAL 40 2.254 -0.773 -11.777 300 2HG1 VAL 40 3HG1 VAL 40 1.570 0.536 -10.813 301 3HG1 VAL 40 2HG1 VAL 40 0.859 0.127 -12.376 302 1HG2 VAL 40 1HG2 VAL 40 3.145 3.207 -11.895 303 2HG2 VAL 40 3HG2 VAL 40 1.803 3.062 -13.030 304 3HG2 VAL 40 2HG2 VAL 40 1.585 2.598 -11.343 305 H HIS 41 HN HIS 41 4.084 -1.302 -10.842 306 HA HIS 41 HA HIS 41 5.330 -2.732 -13.165 307 1HB HIS 41 2HB HIS 41 5.901 -3.157 -10.215 308 2HB HIS 41 1HB HIS 41 6.735 -3.918 -11.570 309 HD1 HIS 41 HD1 HIS 41 8.215 -2.320 -13.096 310 HD2 HIS 41 HD2 HIS 41 6.814 -0.582 -9.575 311 HE1 HIS 41 HE1 HIS 41 9.567 -0.206 -12.753 312 H GLY 42 HN GLY 42 4.986 -5.188 -12.888 313 1HA GLY 42 1HA GLY 42 3.576 -7.029 -12.484 314 2HA GLY 42 2HA GLY 42 2.294 -5.881 -12.865 315 H ASN 43 HN ASN 43 4.441 -6.769 -10.139 316 HA ASN 43 HA ASN 43 2.214 -6.035 -8.273 317 1HB ASN 43 2HB ASN 43 2.745 -8.174 -7.076 318 2HB ASN 43 1HB ASN 43 2.133 -8.431 -8.709 319 1HD2 ASN 43 1HD2 ASN 43 3.392 -10.592 -8.297 320 2HD2 ASN 43 2HD2 ASN 43 5.030 -10.603 -8.738 321 H THR 44 HN THR 44 3.452 -6.768 -5.924 322 HA THR 44 HA THR 44 5.259 -4.603 -5.428 323 HB THR 44 HB THR 44 4.676 -7.151 -3.888 324 HG1 THR 44 1HG THR 44 3.015 -5.412 -4.528 325 1HG2 THR 44 1HG2 THR 44 6.750 -5.909 -3.189 326 2HG2 THR 44 3HG2 THR 44 5.736 -4.501 -2.876 327 3HG2 THR 44 2HG2 THR 44 5.505 -5.978 -1.942 328 H CYS 45 HN CYS 45 5.783 -8.045 -6.115 329 HA CYS 45 HA CYS 45 8.591 -8.104 -5.508 330 1HB CYS 45 2HB CYS 45 7.178 -9.700 -7.658 331 2HB CYS 45 1HB CYS 45 8.555 -10.190 -6.674 332 H SER 46 HN SER 46 6.886 -7.714 -8.643 333 HA SER 46 HA SER 46 9.018 -7.328 -10.377 334 1HB SER 46 2HB SER 46 6.443 -7.195 -10.697 335 2HB SER 46 1HB SER 46 6.623 -5.483 -10.317 336 HG SER 46 HG SER 46 6.774 -6.187 -12.614 337 H MET 47 HN MET 47 7.593 -4.927 -8.153 338 HA MET 47 HA MET 47 9.339 -2.748 -8.876 339 1HB MET 47 2HB MET 47 7.094 -3.071 -7.400 340 2HB MET 47 1HB MET 47 8.286 -3.037 -6.101 341 1HG MET 47 2HG MET 47 8.164 -0.947 -8.289 342 2HG MET 47 1HG MET 47 7.341 -0.769 -6.741 343 1HE MET 47 2HE MET 47 8.447 -1.525 -4.662 344 2HE MET 47 1HE MET 47 9.933 -2.437 -4.909 345 3HE MET 47 3HE MET 47 9.984 -0.856 -4.119 346 H CYS 48 HN CYS 48 9.575 -5.461 -6.659 347 HA CYS 48 HA CYS 48 12.012 -4.486 -5.346 348 1HB CYS 48 2HB CYS 48 10.242 -6.919 -5.295 349 2HB CYS 48 1HB CYS 48 11.817 -6.990 -4.509 350 H GLU 49 HN GLU 49 11.178 -6.477 -8.103 351 HA GLU 49 HA GLU 49 13.623 -7.955 -8.370 352 1HB GLU 49 2HB GLU 49 11.575 -6.926 -10.363 353 2HB GLU 49 1HB GLU 49 12.833 -8.093 -10.768 354 1HG GLU 49 2HG GLU 49 11.957 -9.653 -9.092 355 2HG GLU 49 1HG GLU 49 10.733 -8.477 -8.615 356 H VAL 50 HN VAL 50 12.600 -4.783 -9.659 357 HA VAL 50 HA VAL 50 14.925 -4.211 -11.211 358 HB VAL 50 HB VAL 50 13.117 -2.367 -9.613 359 1HG1 VAL 50 3HG1 VAL 50 14.939 -1.945 -11.992 360 2HG1 VAL 50 2HG1 VAL 50 13.678 -0.798 -11.535 361 3HG1 VAL 50 1HG1 VAL 50 15.007 -1.137 -10.425 362 1HG2 VAL 50 2HG2 VAL 50 12.825 -3.747 -12.274 363 2HG2 VAL 50 1HG2 VAL 50 11.674 -3.668 -10.940 364 3HG2 VAL 50 3HG2 VAL 50 11.970 -2.241 -11.932 365 H PHE 51 HN PHE 51 14.078 -3.283 -7.882 366 HA PHE 51 HA PHE 51 16.542 -2.027 -7.201 367 1HB PHE 51 2HB PHE 51 14.545 -1.787 -5.863 368 2HB PHE 51 1HB PHE 51 14.443 -3.531 -5.614 369 HD1 PHE 51 HD1 PHE 51 17.209 -1.009 -5.360 370 HD2 PHE 51 HD2 PHE 51 14.955 -4.110 -3.428 371 HE1 PHE 51 HE1 PHE 51 18.650 -0.800 -3.348 372 HE2 PHE 51 HE2 PHE 51 16.393 -3.902 -1.413 373 HZ PHE 51 HZ PHE 51 18.240 -2.247 -1.375 374 H PHE 52 HN PHE 52 15.440 -5.384 -6.815 375 HA PHE 52 HA PHE 52 17.788 -6.429 -5.573 376 1HB PHE 52 2HB PHE 52 15.445 -7.424 -7.139 377 2HB PHE 52 1HB PHE 52 16.793 -8.538 -6.912 378 HD1 PHE 52 HD1 PHE 52 17.798 -7.721 -4.252 379 HD2 PHE 52 HD2 PHE 52 13.773 -8.204 -5.671 380 HE1 PHE 52 HE1 PHE 52 17.034 -8.156 -1.937 381 HE2 PHE 52 HE2 PHE 52 13.009 -8.642 -3.354 382 HZ PHE 52 HZ PHE 52 14.639 -8.618 -1.486 383 H GLN 53 HN GLN 53 16.939 -5.822 -8.950 384 HA GLN 53 HA GLN 53 19.167 -7.235 -10.133 385 1HB GLN 53 2HB GLN 53 16.916 -6.373 -11.102 386 2HB GLN 53 1HB GLN 53 17.739 -4.824 -11.258 387 1HG GLN 53 2HG GLN 53 19.603 -6.182 -12.457 388 2HG GLN 53 1HG GLN 53 18.377 -7.440 -12.617 389 1HE2 GLN 53 1HE2 GLN 53 16.132 -5.504 -12.884 390 2HE2 GLN 53 2HE2 GLN 53 16.284 -4.816 -14.428 391 H ALA 54 HN ALA 54 18.586 -3.808 -9.324 392 HA ALA 54 HA ALA 54 21.258 -2.960 -10.139 393 1HB ALA 54 1HB ALA 54 19.201 -1.575 -8.389 394 2HB ALA 54 2HB ALA 54 19.127 -1.599 -10.152 395 3HB ALA 54 3HB ALA 54 20.476 -0.808 -9.337 396 H GLU 55 HN GLU 55 19.725 -3.989 -7.133 397 HA GLU 55 HA GLU 55 21.584 -2.981 -5.241 398 1HB GLU 55 2HB GLU 55 19.359 -4.107 -4.856 399 2HB GLU 55 1HB GLU 55 20.136 -5.648 -5.220 400 1HG GLU 55 2HG GLU 55 21.759 -5.231 -3.375 401 2HG GLU 55 1HG GLU 55 20.897 -3.742 -2.984 402 H GLU 56 HN GLU 56 22.005 -5.387 -7.674 403 HA GLU 56 HA GLU 56 23.928 -7.116 -6.495 404 1HB GLU 56 2HB GLU 56 23.523 -6.076 -9.315 405 2HB GLU 56 1HB GLU 56 24.607 -7.411 -8.917 406 1HG GLU 56 2HG GLU 56 22.654 -8.584 -7.848 407 2HG GLU 56 1HG GLU 56 21.611 -7.298 -8.458 408 H GLU 57 HN GLU 57 24.316 -3.944 -8.067 409 HA GLU 57 HA GLU 57 27.234 -3.985 -7.852 410 1HB GLU 57 2HB GLU 57 27.028 -1.790 -8.843 411 2HB GLU 57 1HB GLU 57 25.809 -2.817 -9.598 412 1HG GLU 57 2HG GLU 57 24.369 -1.898 -7.511 413 2HG GLU 57 1HG GLU 57 25.468 -0.534 -7.719 414 H GLU 58 HN GLU 58 24.541 -2.852 -5.901 415 HA GLU 58 HA GLU 58 26.034 -1.032 -4.222 416 1HB GLU 58 2HB GLU 58 23.458 -2.599 -3.876 417 2HB GLU 58 1HB GLU 58 23.994 -1.337 -2.767 418 1HG GLU 58 2HG GLU 58 24.079 0.249 -4.710 419 2HG GLU 58 1HG GLU 58 23.380 -1.015 -5.720 420 H LYS 59 HN LYS 59 25.186 -4.487 -3.964 421 HA LYS 59 HA LYS 59 26.443 -4.784 -1.338 422 1HB LYS 59 2HB LYS 59 25.819 -7.126 -1.674 423 2HB LYS 59 1HB LYS 59 24.488 -6.094 -2.195 424 1HG LYS 59 2HG LYS 59 25.230 -6.295 -4.532 425 2HG LYS 59 1HG LYS 59 26.592 -7.294 -4.023 426 1HD LYS 59 2HD LYS 59 24.700 -8.756 -2.899 427 2HD LYS 59 1HD LYS 59 23.666 -7.963 -4.089 428 1HE LYS 59 2HE LYS 59 25.494 -8.653 -5.816 429 2HE LYS 59 1HE LYS 59 26.020 -9.794 -4.564 430 1HZ LYS 59 3HZ LYS 59 23.606 -10.429 -4.371 431 2HZ LYS 59 2HZ LYS 59 23.329 -9.551 -5.800 432 3HZ LYS 59 1HZ LYS 59 24.359 -10.903 -5.815 433 H LYS 60 HN LYS 60 27.768 -4.264 -4.310 434 HA LYS 60 HA LYS 60 29.728 -6.272 -4.695 435 1HB LYS 60 2HB LYS 60 30.823 -4.567 -6.023 436 2HB LYS 60 1HB LYS 60 29.083 -4.326 -6.181 437 1HG LYS 60 2HG LYS 60 29.172 -2.591 -4.417 438 2HG LYS 60 1HG LYS 60 30.916 -2.819 -4.289 439 1HD LYS 60 2HD LYS 60 31.142 -2.199 -6.691 440 2HD LYS 60 1HD LYS 60 29.406 -1.896 -6.754 441 1HE LYS 60 2HE LYS 60 30.570 -0.504 -4.493 442 2HE LYS 60 1HE LYS 60 31.402 -0.054 -5.992 443 1HZ LYS 60 2HZ LYS 60 28.982 -0.060 -6.926 444 2HZ LYS 60 1HZ LYS 60 28.548 0.177 -5.300 445 3HZ LYS 60 3HZ LYS 60 29.553 1.298 -6.081 446 H LYS 61 HN LYS 61 29.614 -3.591 -2.404 447 HA LYS 61 HA LYS 61 32.375 -3.570 -1.634 448 1HB LYS 61 2HB LYS 61 29.803 -2.891 -0.172 449 2HB LYS 61 1HB LYS 61 31.412 -2.455 0.405 450 1HG LYS 61 2HG LYS 61 31.804 -1.216 -1.720 451 2HG LYS 61 1HG LYS 61 30.157 -1.597 -2.221 452 1HD LYS 61 2HD LYS 61 29.319 -0.453 -0.157 453 2HD LYS 61 1HD LYS 61 30.978 0.022 0.209 454 1HE LYS 61 2HE LYS 61 29.814 0.668 -2.495 455 2HE LYS 61 1HE LYS 61 29.453 1.706 -1.103 456 1HZ LYS 61 1HZ LYS 61 32.038 1.340 -0.729 457 2HZ LYS 61 3HZ LYS 61 32.013 1.173 -2.417 458 3HZ LYS 61 2HZ LYS 61 31.444 2.603 -1.698 459 H LYS 62 HN LYS 62 29.615 -5.539 -0.598 460 HA LYS 62 HA LYS 62 31.476 -7.090 1.176 461 1HB LYS 62 2HB LYS 62 28.464 -6.751 1.350 462 2HB LYS 62 1HB LYS 62 29.504 -7.521 2.547 463 1HG LYS 62 2HG LYS 62 29.687 -4.614 1.700 464 2HG LYS 62 1HG LYS 62 28.924 -5.187 3.183 465 1HD LYS 62 2HD LYS 62 31.107 -6.235 3.835 466 2HD LYS 62 1HD LYS 62 31.841 -5.496 2.413 467 1HE LYS 62 2HE LYS 62 30.967 -3.249 3.317 468 2HE LYS 62 1HE LYS 62 30.671 -4.111 4.839 469 1HZ LYS 62 2HZ LYS 62 33.087 -5.013 4.269 470 2HZ LYS 62 1HZ LYS 62 33.200 -3.499 3.504 471 3HZ LYS 62 3HZ LYS 62 32.849 -3.587 5.162 472 H GLU 63 HN GLU 63 31.457 -9.352 0.934 473 HA GLU 63 HA GLU 63 29.965 -10.383 -1.446 474 1HB GLU 63 2HB GLU 63 32.468 -10.450 -1.383 475 2HB GLU 63 1HB GLU 63 32.371 -11.484 0.042 476 1HG GLU 63 2HG GLU 63 31.013 -13.109 -1.306 477 2HG GLU 63 1HG GLU 63 31.303 -12.107 -2.728 478 H GLY 64 HN GLY 64 28.419 -11.956 -1.131 479 1HA GLY 64 1HA GLY 64 26.800 -12.995 0.332 480 2HA GLY 64 2HA GLY 64 27.967 -12.891 1.651 481 H GLU 65 HN GLU 65 27.659 -14.437 -1.569 482 HA GLU 65 HA GLU 65 28.939 -16.877 -0.375 483 1HB GLU 65 2HB GLU 65 26.770 -16.561 -2.476 484 2HB GLU 65 1HB GLU 65 27.460 -18.105 -1.977 485 1HG GLU 65 2HG GLU 65 26.015 -16.146 -0.167 486 2HG GLU 65 1HG GLU 65 25.358 -17.668 -0.769 487 H SER 66 HN SER 66 30.433 -17.998 -1.732 488 HA SER 66 HA SER 66 32.107 -16.506 -3.438 489 1HB SER 66 2HB SER 66 31.483 -19.478 -3.394 490 2HB SER 66 1HB SER 66 32.921 -18.758 -4.118 491 HG SER 66 HG SER 66 33.294 -17.828 -1.978 492 H ARG 67 HN ARG 67 32.226 -16.324 -5.730 493 HA ARG 67 HA ARG 67 29.746 -17.145 -7.209 494 1HB ARG 67 2HB ARG 67 31.514 -14.690 -7.462 495 2HB ARG 67 1HB ARG 67 30.144 -15.048 -8.513 496 1HG ARG 67 2HG ARG 67 28.663 -15.084 -6.502 497 2HG ARG 67 1HG ARG 67 30.043 -14.610 -5.514 498 1HD ARG 67 2HD ARG 67 30.295 -12.571 -7.006 499 2HD ARG 67 1HD ARG 67 28.743 -13.011 -7.743 500 HE ARG 67 HE ARG 67 28.014 -13.076 -5.172 501 1HH1 ARG 67 1HH1 ARG 67 28.368 -10.530 -7.128 502 2HH1 ARG 67 2HH1 ARG 67 28.811 -9.365 -5.926 503 1HH2 ARG 67 1HH2 ARG 67 29.352 -11.731 -3.449 504 2HH2 ARG 67 2HH2 ARG 67 29.369 -10.044 -3.844 505 H ASN 68 HN ASN 68 30.069 -17.981 -9.316 506 HA ASN 68 HA ASN 68 32.870 -18.809 -9.925 507 1HB ASN 68 2HB ASN 68 30.132 -19.728 -10.855 508 2HB ASN 68 1HB ASN 68 31.647 -20.419 -11.434 509 1HD2 ASN 68 1HD2 ASN 68 29.836 -22.084 -10.050 510 2HD2 ASN 68 2HD2 ASN 68 30.477 -22.469 -8.526 No H/Q in entry = 510 Start of MODEL 3 1 H1 GLU 1 3H GLU 1 -2.727 -3.394 5.648 2 H2 GLU 1 2H GLU 1 -2.039 -3.987 4.213 3 H3 GLU 1 1H GLU 1 -2.217 -5.009 5.560 4 HA GLU 1 HA GLU 1 -0.408 -4.168 6.638 5 1HB GLU 1 2HB GLU 1 0.006 -3.541 3.696 6 2HB GLU 1 1HB GLU 1 1.303 -3.748 4.872 7 1HG GLU 1 2HG GLU 1 0.486 -6.050 5.332 8 2HG GLU 1 1HG GLU 1 -0.759 -5.837 4.102 9 H SER 2 HN SER 2 1.094 -2.262 6.983 10 HA SER 2 HA SER 2 -0.429 0.197 7.273 11 1HB SER 2 2HB SER 2 1.347 -0.707 8.814 12 2HB SER 2 1HB SER 2 2.544 -0.330 7.574 13 HG SER 2 HG SER 2 2.301 1.346 9.128 14 H GLY 3 HN GLY 3 1.327 -1.153 4.690 15 1HA GLY 3 1HA GLY 3 0.862 0.794 2.805 16 2HA GLY 3 2HA GLY 3 2.293 -0.232 2.748 17 H LYS 4 HN LYS 4 3.598 0.706 5.080 18 HA LYS 4 HA LYS 4 3.845 3.624 4.951 19 1HB LYS 4 2HB LYS 4 4.080 2.223 7.012 20 2HB LYS 4 1HB LYS 4 5.539 1.510 6.322 21 1HG LYS 4 2HG LYS 4 6.379 3.249 7.671 22 2HG LYS 4 1HG LYS 4 6.346 3.970 6.061 23 1HD LYS 4 2HD LYS 4 4.217 5.057 6.549 24 2HD LYS 4 1HD LYS 4 4.132 4.255 8.117 25 1HE LYS 4 2HE LYS 4 4.969 6.500 8.505 26 2HE LYS 4 1HE LYS 4 6.350 5.401 8.681 27 1HZ LYS 4 2HZ LYS 4 5.624 6.538 6.049 28 2HZ LYS 4 1HZ LYS 4 6.604 7.414 7.124 29 3HZ LYS 4 3HZ LYS 4 7.116 5.901 6.554 30 H ALA 5 HN ALA 5 5.615 4.766 4.054 31 HA ALA 5 HA ALA 5 7.012 3.455 1.845 32 1HB ALA 5 3HB ALA 5 8.035 5.834 1.764 33 2HB ALA 5 2HB ALA 5 6.294 5.694 1.517 34 3HB ALA 5 1HB ALA 5 6.924 6.210 3.081 35 H THR 6 HN THR 6 7.807 2.092 4.106 36 HA THR 6 HA THR 6 10.071 3.101 5.513 37 HB THR 6 HB THR 6 8.880 1.140 6.244 38 HG1 THR 6 1HG THR 6 10.614 0.058 6.772 39 1HG2 THR 6 3HG2 THR 6 8.895 0.538 3.450 40 2HG2 THR 6 2HG2 THR 6 9.624 -0.819 4.309 41 3HG2 THR 6 1HG2 THR 6 8.003 -0.275 4.737 42 H SER 7 HN SER 7 12.196 1.460 5.124 43 HA SER 7 HA SER 7 13.387 2.492 2.664 44 1HB SER 7 2HB SER 7 14.247 0.711 4.952 45 2HB SER 7 1HB SER 7 15.316 1.042 3.588 46 HG SER 7 HG SER 7 15.308 3.177 4.087 47 H TYR 8 HN TYR 8 13.558 1.399 0.730 48 HA TYR 8 HA TYR 8 12.073 -0.888 0.067 49 1HB TYR 8 2HB TYR 8 14.696 0.119 -1.085 50 2HB TYR 8 1HB TYR 8 13.552 -0.930 -1.921 51 HD1 TYR 8 HD1 TYR 8 10.996 0.326 -0.866 52 HD2 TYR 8 HD2 TYR 8 14.575 2.062 -2.488 53 HE1 TYR 8 HE1 TYR 8 9.703 2.314 -1.590 54 HE2 TYR 8 HE2 TYR 8 13.282 4.050 -3.213 55 HH TYR 8 HH TYR 8 10.884 5.134 -2.243 56 H ALA 9 HN ALA 9 15.629 -0.825 0.581 57 HA ALA 9 HA ALA 9 16.242 -3.513 0.490 58 1HB ALA 9 1HB ALA 9 17.757 -1.568 0.963 59 2HB ALA 9 2HB ALA 9 18.058 -2.948 2.019 60 3HB ALA 9 3HB ALA 9 17.157 -1.556 2.622 61 H GLU 10 HN GLU 10 14.380 -1.866 2.975 62 HA GLU 10 HA GLU 10 14.363 -4.278 4.712 63 1HB GLU 10 2HB GLU 10 14.652 -1.913 5.560 64 2HB GLU 10 1HB GLU 10 13.003 -1.583 5.028 65 1HG GLU 10 2HG GLU 10 12.256 -3.532 6.465 66 2HG GLU 10 1HG GLU 10 13.892 -3.588 7.119 67 H LEU 11 HN LEU 11 12.261 -2.351 2.628 68 HA LEU 11 HA LEU 11 9.807 -3.760 3.257 69 1HB LEU 11 2HB LEU 11 10.220 -1.428 2.219 70 2HB LEU 11 1HB LEU 11 10.498 -2.290 0.706 71 HG LEU 11 HG LEU 11 8.223 -3.449 1.217 72 1HD1 LEU 11 1HD1 LEU 11 8.423 -2.069 3.557 73 2HD1 LEU 11 3HD1 LEU 11 7.451 -0.948 2.603 74 3HD1 LEU 11 2HD1 LEU 11 6.889 -2.599 2.865 75 1HD2 LEU 11 3HD2 LEU 11 8.778 -1.664 -0.542 76 2HD2 LEU 11 2HD2 LEU 11 7.088 -1.784 -0.053 77 3HD2 LEU 11 1HD2 LEU 11 8.103 -0.493 0.591 78 H CYS 12 HN CYS 12 11.891 -3.781 0.361 79 HA CYS 12 HA CYS 12 10.686 -6.099 -0.836 80 1HB CYS 12 2HB CYS 12 13.288 -4.591 -1.109 81 2HB CYS 12 1HB CYS 12 12.967 -6.027 -2.084 82 H ASN 13 HN ASN 13 12.740 -5.747 1.860 83 HA ASN 13 HA ASN 13 14.538 -7.833 1.926 84 1HB ASN 13 2HB ASN 13 13.931 -6.222 3.744 85 2HB ASN 13 1HB ASN 13 12.483 -7.170 4.058 86 1HD2 ASN 13 1HD2 ASN 13 14.360 -6.907 6.132 87 2HD2 ASN 13 2HD2 ASN 13 15.157 -8.386 6.372 88 H GLU 14 HN GLU 14 11.084 -8.157 2.763 89 HA GLU 14 HA GLU 14 10.895 -10.899 3.199 90 1HB GLU 14 2HB GLU 14 9.158 -8.952 3.191 91 2HB GLU 14 1HB GLU 14 8.892 -9.409 1.508 92 1HG GLU 14 2HG GLU 14 8.549 -11.793 2.341 93 2HG GLU 14 1HG GLU 14 8.518 -11.127 3.973 94 H TYR 15 HN TYR 15 11.565 -9.284 0.164 95 HA TYR 15 HA TYR 15 10.935 -11.707 -1.424 96 1HB TYR 15 2HB TYR 15 11.844 -8.881 -2.004 97 2HB TYR 15 1HB TYR 15 11.738 -10.104 -3.270 98 HD1 TYR 15 HD1 TYR 15 9.529 -11.283 -3.652 99 HD2 TYR 15 HD2 TYR 15 9.897 -7.790 -1.186 100 HE1 TYR 15 HE1 TYR 15 7.084 -10.925 -3.805 101 HE2 TYR 15 HE2 TYR 15 7.450 -7.423 -1.339 102 HH TYR 15 HH TYR 15 5.478 -9.099 -3.579 103 H ARG 16 HN ARG 16 13.664 -10.166 0.085 104 HA ARG 16 HA ARG 16 15.844 -10.932 -1.488 105 1HB ARG 16 2HB ARG 16 15.380 -10.899 1.503 106 2HB ARG 16 1HB ARG 16 16.976 -11.167 0.800 107 1HG ARG 16 2HG ARG 16 16.674 -9.021 -0.490 108 2HG ARG 16 1HG ARG 16 15.200 -8.738 0.432 109 1HD ARG 16 2HD ARG 16 16.707 -9.062 2.531 110 2HD ARG 16 1HD ARG 16 18.053 -8.780 1.409 111 HE ARG 16 HE ARG 16 15.877 -6.845 1.118 112 1HH1 ARG 16 1HH1 ARG 16 16.771 -6.689 3.998 113 2HH1 ARG 16 2HH1 ARG 16 18.037 -5.510 3.910 114 1HH2 ARG 16 1HH2 ARG 16 18.379 -5.747 0.467 115 2HH2 ARG 16 2HH2 ARG 16 18.946 -4.976 1.911 116 H LYS 17 HN LYS 17 13.760 -12.938 0.522 117 HA LYS 17 HA LYS 17 15.431 -15.322 0.363 118 1HB LYS 17 2HB LYS 17 13.345 -16.362 1.299 119 2HB LYS 17 1HB LYS 17 13.854 -14.929 2.193 120 1HG LYS 17 2HG LYS 17 12.156 -13.592 1.246 121 2HG LYS 17 1HG LYS 17 11.889 -14.717 -0.085 122 1HD LYS 17 2HD LYS 17 10.989 -16.381 1.503 123 2HD LYS 17 1HD LYS 17 11.254 -15.254 2.833 124 1HE LYS 17 2HE LYS 17 9.410 -14.007 2.296 125 2HE LYS 17 1HE LYS 17 9.702 -14.159 0.553 126 1HZ LYS 17 1HZ LYS 17 9.188 -16.660 1.061 127 2HZ LYS 17 3HZ LYS 17 8.348 -16.018 2.387 128 3HZ LYS 17 2HZ LYS 17 7.917 -15.561 0.808 129 H LEU 18 HN LEU 18 13.127 -13.752 -1.690 130 HA LEU 18 HA LEU 18 12.522 -16.179 -3.267 131 1HB LEU 18 2HB LEU 18 11.867 -13.302 -3.934 132 2HB LEU 18 1HB LEU 18 10.966 -14.753 -4.368 133 HG LEU 18 HG LEU 18 11.267 -13.581 -1.587 134 1HD1 LEU 18 3HD1 LEU 18 9.406 -13.137 -3.708 135 2HD1 LEU 18 2HD1 LEU 18 8.572 -14.025 -2.434 136 3HD1 LEU 18 1HD1 LEU 18 9.359 -12.491 -2.068 137 1HD2 LEU 18 3HD2 LEU 18 9.845 -16.084 -2.537 138 2HD2 LEU 18 2HD2 LEU 18 11.275 -16.034 -1.506 139 3HD2 LEU 18 1HD2 LEU 18 9.735 -15.411 -0.911 140 H VAL 19 HN VAL 19 14.513 -13.257 -3.458 141 HA VAL 19 HA VAL 19 15.275 -13.401 -6.202 142 HB VAL 19 HB VAL 19 16.949 -12.503 -3.836 143 1HG1 VAL 19 3HG1 VAL 19 16.862 -11.867 -6.781 144 2HG1 VAL 19 2HG1 VAL 19 17.539 -10.715 -5.631 145 3HG1 VAL 19 1HG1 VAL 19 18.250 -12.320 -5.792 146 1HG2 VAL 19 1HG2 VAL 19 14.343 -11.674 -4.458 147 2HG2 VAL 19 3HG2 VAL 19 15.498 -10.823 -3.430 148 3HG2 VAL 19 2HG2 VAL 19 15.386 -10.428 -5.146 149 H ARG 20 HN ARG 20 16.608 -14.844 -7.248 150 HA ARG 20 HA ARG 20 18.071 -16.851 -5.591 151 1HB ARG 20 2HB ARG 20 16.954 -16.703 -8.384 152 2HB ARG 20 1HB ARG 20 18.174 -17.913 -7.986 153 1HG ARG 20 2HG ARG 20 16.310 -17.984 -5.870 154 2HG ARG 20 1HG ARG 20 15.351 -17.900 -7.348 155 1HD ARG 20 2HD ARG 20 16.669 -19.808 -8.279 156 2HD ARG 20 1HD ARG 20 17.542 -19.920 -6.738 157 HE ARG 20 HE ARG 20 14.815 -20.809 -7.201 158 1HH1 ARG 20 1HH1 ARG 20 14.658 -18.566 -5.138 159 2HH1 ARG 20 2HH1 ARG 20 14.797 -19.462 -3.662 160 1HH2 ARG 20 1HH2 ARG 20 15.992 -22.329 -5.203 161 2HH2 ARG 20 2HH2 ARG 20 15.552 -21.592 -3.698 162 H ASN 21 HN ASN 21 18.917 -16.105 -8.907 163 HA ASN 21 HA ASN 21 21.582 -15.114 -7.947 164 1HB ASN 21 2HB ASN 21 20.709 -16.751 -10.344 165 2HB ASN 21 1HB ASN 21 22.340 -16.104 -10.163 166 1HD2 ASN 21 1HD2 ASN 21 20.117 -18.578 -9.061 167 2HD2 ASN 21 2HD2 ASN 21 21.206 -19.372 -8.031 168 H GLY 22 HN GLY 22 19.849 -13.084 -8.105 169 1HA GLY 22 1HA GLY 22 20.629 -11.708 -10.619 170 2HA GLY 22 2HA GLY 22 20.065 -10.914 -9.149 171 H LYS 23 HN LYS 23 17.934 -13.233 -9.176 172 HA LYS 23 HA LYS 23 16.021 -11.736 -10.924 173 1HB LYS 23 2HB LYS 23 15.247 -13.844 -11.842 174 2HB LYS 23 1HB LYS 23 17.002 -13.794 -12.017 175 1HG LYS 23 2HG LYS 23 17.236 -15.123 -9.939 176 2HG LYS 23 1HG LYS 23 15.480 -15.192 -9.794 177 1HD LYS 23 2HD LYS 23 15.504 -16.201 -12.167 178 2HD LYS 23 1HD LYS 23 17.232 -16.440 -11.914 179 1HE LYS 23 2HE LYS 23 15.577 -17.346 -9.647 180 2HE LYS 23 1HE LYS 23 15.298 -18.244 -11.151 181 1HZ LYS 23 1HZ LYS 23 17.744 -18.393 -11.396 182 2HZ LYS 23 3HZ LYS 23 17.923 -17.689 -9.864 183 3HZ LYS 23 2HZ LYS 23 17.172 -19.206 -10.017 184 H LEU 24 HN LEU 24 14.041 -11.428 -9.929 185 HA LEU 24 HA LEU 24 13.684 -12.578 -7.206 186 1HB LEU 24 2HB LEU 24 13.369 -10.068 -8.325 187 2HB LEU 24 1HB LEU 24 11.712 -10.666 -8.259 188 HG LEU 24 HG LEU 24 13.671 -10.359 -5.974 189 1HD1 LEU 24 2HD1 LEU 24 10.862 -9.341 -6.503 190 2HD1 LEU 24 1HD1 LEU 24 11.769 -9.063 -5.016 191 3HD1 LEU 24 3HD1 LEU 24 12.342 -8.382 -6.539 192 1HD2 LEU 24 2HD2 LEU 24 11.215 -12.074 -6.226 193 2HD2 LEU 24 1HD2 LEU 24 12.751 -12.442 -5.443 194 3HD2 LEU 24 3HD2 LEU 24 11.611 -11.338 -4.673 195 H ALA 25 HN ALA 25 11.976 -13.969 -6.732 196 HA ALA 25 HA ALA 25 10.196 -14.739 -9.024 197 1HB ALA 25 2HB ALA 25 11.651 -16.547 -8.554 198 2HB ALA 25 3HB ALA 25 10.179 -16.958 -7.676 199 3HB ALA 25 1HB ALA 25 11.559 -16.278 -6.814 200 H CYS 26 HN CYS 26 8.055 -14.327 -8.649 201 HA CYS 26 HA CYS 26 7.006 -14.478 -5.864 202 1HB CYS 26 2HB CYS 26 5.996 -12.249 -6.121 203 2HB CYS 26 1HB CYS 26 7.743 -12.148 -6.340 204 H THR 27 HN THR 27 4.445 -13.780 -6.207 205 HA THR 27 HA THR 27 3.476 -15.608 -8.373 206 HB THR 27 HB THR 27 1.421 -15.604 -6.803 207 HG1 THR 27 1HG THR 27 3.292 -14.728 -4.900 208 1HG2 THR 27 1HG2 THR 27 4.124 -16.696 -6.004 209 2HG2 THR 27 3HG2 THR 27 2.639 -17.117 -5.149 210 3HG2 THR 27 2HG2 THR 27 2.824 -17.535 -6.853 211 H ARG 28 HN ARG 28 0.957 -14.897 -8.777 212 HA ARG 28 HA ARG 28 1.137 -12.233 -10.011 213 1HB ARG 28 2HB ARG 28 -1.040 -14.346 -9.873 214 2HB ARG 28 1HB ARG 28 -1.082 -12.924 -10.916 215 1HG ARG 28 2HG ARG 28 1.006 -13.679 -12.012 216 2HG ARG 28 1HG ARG 28 1.021 -15.112 -10.983 217 1HD ARG 28 2HD ARG 28 -1.241 -15.725 -11.915 218 2HD ARG 28 1HD ARG 28 -1.078 -14.375 -13.055 219 HE ARG 28 HE ARG 28 0.376 -15.781 -14.273 220 1HH1 ARG 28 1HH1 ARG 28 2.537 -15.556 -12.210 221 2HH1 ARG 28 2HH1 ARG 28 2.819 -17.215 -11.799 222 1HH2 ARG 28 1HH2 ARG 28 -0.152 -18.341 -13.186 223 2HH2 ARG 28 2HH2 ARG 28 1.297 -18.792 -12.351 224 H GLU 29 HN GLU 29 1.275 -11.945 -7.228 225 HA GLU 29 HA GLU 29 -1.046 -11.662 -5.712 226 1HB GLU 29 2HB GLU 29 1.224 -11.237 -4.904 227 2HB GLU 29 1HB GLU 29 1.363 -9.829 -5.957 228 1HG GLU 29 2HG GLU 29 -0.660 -8.873 -4.742 229 2HG GLU 29 1HG GLU 29 -0.473 -10.182 -3.576 230 H ASN 30 HN ASN 30 -2.729 -10.150 -5.622 231 HA ASN 30 HA ASN 30 -3.029 -8.379 -7.989 232 1HB ASN 30 2HB ASN 30 -5.376 -8.289 -7.180 233 2HB ASN 30 1HB ASN 30 -4.815 -9.953 -7.343 234 1HD2 ASN 30 1HD2 ASN 30 -4.938 -11.254 -5.489 235 2HD2 ASN 30 2HD2 ASN 30 -5.262 -10.674 -3.929 236 H ASP 31 HN ASP 31 -1.090 -7.271 -6.466 237 HA ASP 31 HA ASP 31 -2.487 -4.993 -5.113 238 1HB ASP 31 2HB ASP 31 -1.615 -6.692 -3.495 239 2HB ASP 31 1HB ASP 31 0.001 -6.444 -4.155 240 HA PRO 32 HA PRO 32 0.540 -3.627 -8.384 241 1HB PRO 32 2HB PRO 32 -1.265 -1.431 -8.828 242 2HB PRO 32 1HB PRO 32 -0.906 -2.780 -9.909 243 1HG PRO 32 2HG PRO 32 -3.318 -2.305 -8.432 244 2HG PRO 32 1HG PRO 32 -2.949 -3.667 -9.492 245 1HD PRO 32 2HD PRO 32 -3.130 -3.654 -6.604 246 2HD PRO 32 1HD PRO 32 -2.803 -5.035 -7.674 247 H ILE 33 HN ILE 33 1.961 -1.829 -8.186 248 HA ILE 33 HA ILE 33 1.401 0.245 -6.147 249 HB ILE 33 HB ILE 33 3.177 -0.374 -4.715 250 1HG1 ILE 33 2HG1 ILE 33 4.943 -0.690 -6.323 251 2HG1 ILE 33 1HG1 ILE 33 4.827 -2.172 -5.376 252 1HG2 ILE 33 1HG2 ILE 33 1.266 -1.945 -4.576 253 2HG2 ILE 33 3HG2 ILE 33 2.054 -2.991 -5.757 254 3HG2 ILE 33 2HG2 ILE 33 2.791 -2.736 -4.175 255 1HD1 ILE 33 2HD1 ILE 33 3.227 -2.997 -7.237 256 2HD1 ILE 33 1HD1 ILE 33 3.879 -1.665 -8.193 257 3HD1 ILE 33 3HD1 ILE 33 4.951 -2.938 -7.608 258 H GLN 34 HN GLN 34 3.876 1.391 -5.966 259 HA GLN 34 HA GLN 34 4.672 1.910 -8.814 260 1HB GLN 34 2HB GLN 34 4.395 3.877 -6.516 261 2HB GLN 34 1HB GLN 34 4.811 4.279 -8.183 262 1HG GLN 34 2HG GLN 34 2.635 3.458 -8.953 263 2HG GLN 34 1HG GLN 34 2.221 2.962 -7.312 264 1HE2 GLN 34 1HE2 GLN 34 0.489 4.770 -8.477 265 2HE2 GLN 34 2HE2 GLN 34 0.703 6.319 -7.817 266 H GLY 35 HN GLY 35 6.919 2.771 -8.996 267 1HA GLY 35 1HA GLY 35 9.093 1.635 -8.389 268 2HA GLY 35 2HA GLY 35 8.631 1.885 -6.706 269 HA PRO 36 HA PRO 36 10.634 5.769 -6.565 270 1HB PRO 36 2HB PRO 36 13.308 4.842 -7.076 271 2HB PRO 36 1HB PRO 36 12.567 5.220 -5.519 272 1HG PRO 36 2HG PRO 36 13.238 2.633 -6.573 273 2HG PRO 36 1HG PRO 36 12.494 3.010 -5.018 274 1HD PRO 36 2HD PRO 36 11.255 1.802 -7.329 275 2HD PRO 36 1HD PRO 36 10.506 2.177 -5.759 276 H ASP 37 HN ASP 37 11.177 3.732 -9.341 277 HA ASP 37 HA ASP 37 12.581 5.651 -10.986 278 1HB ASP 37 2HB ASP 37 10.852 3.244 -11.637 279 2HB ASP 37 1HB ASP 37 11.930 4.045 -12.779 280 H GLY 38 HN GLY 38 9.205 5.060 -10.252 281 1HA GLY 38 1HA GLY 38 8.519 7.354 -12.038 282 2HA GLY 38 2HA GLY 38 7.681 6.992 -10.532 283 H LYS 39 HN LYS 39 8.599 4.351 -12.589 284 HA LYS 39 HA LYS 39 6.007 4.250 -13.991 285 1HB LYS 39 2HB LYS 39 8.225 3.653 -15.000 286 2HB LYS 39 1HB LYS 39 8.324 2.292 -13.883 287 1HG LYS 39 2HG LYS 39 6.104 1.499 -14.809 288 2HG LYS 39 1HG LYS 39 6.252 2.746 -16.047 289 1HD LYS 39 2HD LYS 39 8.532 1.743 -16.598 290 2HD LYS 39 1HD LYS 39 8.084 0.384 -15.567 291 1HE LYS 39 2HE LYS 39 6.064 0.003 -16.971 292 2HE LYS 39 1HE LYS 39 6.567 1.337 -18.027 293 1HZ LYS 39 3HZ LYS 39 8.594 -0.653 -17.374 294 2HZ LYS 39 2HZ LYS 39 7.352 -1.175 -18.409 295 3HZ LYS 39 1HZ LYS 39 8.311 0.161 -18.834 296 H VAL 40 HN VAL 40 4.581 2.364 -13.791 297 HA VAL 40 HA VAL 40 4.480 1.329 -11.002 298 HB VAL 40 HB VAL 40 2.536 1.413 -13.330 299 1HG1 VAL 40 3HG1 VAL 40 2.489 -0.069 -10.763 300 2HG1 VAL 40 2HG1 VAL 40 1.019 0.822 -11.153 301 3HG1 VAL 40 1HG1 VAL 40 1.632 -0.398 -12.268 302 1HG2 VAL 40 1HG2 VAL 40 3.271 3.276 -11.295 303 2HG2 VAL 40 3HG2 VAL 40 2.000 3.437 -12.507 304 3HG2 VAL 40 2HG2 VAL 40 1.639 2.710 -10.942 305 H HIS 41 HN HIS 41 4.120 -0.988 -10.658 306 HA HIS 41 HA HIS 41 5.107 -2.691 -12.925 307 1HB HIS 41 2HB HIS 41 5.551 -2.969 -9.934 308 2HB HIS 41 1HB HIS 41 6.240 -4.010 -11.181 309 HD1 HIS 41 HD1 HIS 41 7.984 -2.872 -12.837 310 HD2 HIS 41 HD2 HIS 41 6.919 -0.552 -9.542 311 HE1 HIS 41 HE1 HIS 41 9.695 -1.011 -12.689 312 H GLY 42 HN GLY 42 4.471 -5.093 -12.474 313 1HA GLY 42 1HA GLY 42 2.736 -6.661 -12.285 314 2HA GLY 42 2HA GLY 42 1.625 -5.295 -12.379 315 H ASN 43 HN ASN 43 4.023 -6.495 -9.991 316 HA ASN 43 HA ASN 43 2.000 -5.940 -7.853 317 1HB ASN 43 2HB ASN 43 2.790 -8.151 -6.866 318 2HB ASN 43 1HB ASN 43 1.842 -8.280 -8.346 319 1HD2 ASN 43 1HD2 ASN 43 3.104 -10.456 -8.408 320 2HD2 ASN 43 2HD2 ASN 43 4.615 -10.437 -9.174 321 H THR 44 HN THR 44 3.550 -6.888 -5.740 322 HA THR 44 HA THR 44 5.351 -4.672 -5.300 323 HB THR 44 HB THR 44 4.844 -7.274 -3.829 324 HG1 THR 44 1HG THR 44 3.035 -6.161 -3.652 325 1HG2 THR 44 1HG2 THR 44 7.045 -6.149 -3.297 326 2HG2 THR 44 3HG2 THR 44 6.121 -4.743 -2.768 327 3HG2 THR 44 2HG2 THR 44 5.940 -6.285 -1.929 328 H CYS 45 HN CYS 45 5.939 -8.179 -5.704 329 HA CYS 45 HA CYS 45 8.735 -8.182 -5.477 330 1HB CYS 45 2HB CYS 45 8.612 -10.275 -6.620 331 2HB CYS 45 1HB CYS 45 7.069 -10.103 -5.784 332 H SER 46 HN SER 46 6.749 -7.348 -8.322 333 HA SER 46 HA SER 46 8.841 -7.106 -10.237 334 1HB SER 46 2HB SER 46 6.277 -5.511 -9.866 335 2HB SER 46 1HB SER 46 7.204 -5.606 -11.365 336 HG SER 46 HG SER 46 6.884 -7.915 -11.238 337 H MET 47 HN MET 47 7.584 -4.813 -7.828 338 HA MET 47 HA MET 47 9.341 -2.629 -8.618 339 1HB MET 47 2HB MET 47 7.069 -2.947 -7.124 340 2HB MET 47 1HB MET 47 8.281 -2.804 -5.854 341 1HG MET 47 2HG MET 47 8.162 -0.869 -8.170 342 2HG MET 47 1HG MET 47 7.233 -0.610 -6.693 343 1HE MET 47 2HE MET 47 8.190 -1.013 -4.456 344 2HE MET 47 1HE MET 47 9.602 -2.061 -4.576 345 3HE MET 47 3HE MET 47 9.761 -0.429 -3.914 346 H CYS 48 HN CYS 48 9.535 -5.435 -6.590 347 HA CYS 48 HA CYS 48 11.921 -4.523 -5.117 348 1HB CYS 48 2HB CYS 48 10.157 -6.967 -5.221 349 2HB CYS 48 1HB CYS 48 11.676 -7.005 -4.326 350 H GLU 49 HN GLU 49 11.125 -6.522 -7.910 351 HA GLU 49 HA GLU 49 13.647 -7.906 -8.106 352 1HB GLU 49 2HB GLU 49 12.664 -8.788 -10.005 353 2HB GLU 49 1HB GLU 49 11.218 -8.121 -9.253 354 1HG GLU 49 2HG GLU 49 11.342 -6.135 -10.628 355 2HG GLU 49 1HG GLU 49 12.909 -6.620 -11.272 356 H VAL 50 HN VAL 50 12.408 -4.935 -9.684 357 HA VAL 50 HA VAL 50 14.762 -4.325 -11.182 358 HB VAL 50 HB VAL 50 13.728 -2.165 -11.404 359 1HG1 VAL 50 3HG1 VAL 50 12.328 -4.526 -11.773 360 2HG1 VAL 50 2HG1 VAL 50 11.193 -3.528 -10.864 361 3HG1 VAL 50 1HG1 VAL 50 11.849 -2.947 -12.395 362 1HG2 VAL 50 1HG2 VAL 50 12.245 -2.854 -8.847 363 2HG2 VAL 50 3HG2 VAL 50 13.517 -1.643 -9.015 364 3HG2 VAL 50 2HG2 VAL 50 11.964 -1.409 -9.819 365 H PHE 51 HN PHE 51 13.748 -3.452 -7.886 366 HA PHE 51 HA PHE 51 16.028 -1.825 -7.236 367 1HB PHE 51 2HB PHE 51 14.062 -1.693 -5.887 368 2HB PHE 51 1HB PHE 51 13.994 -3.443 -5.686 369 HD1 PHE 51 HD1 PHE 51 16.651 -0.825 -5.231 370 HD2 PHE 51 HD2 PHE 51 14.478 -4.106 -3.511 371 HE1 PHE 51 HE1 PHE 51 18.006 -0.636 -3.162 372 HE2 PHE 51 HE2 PHE 51 15.832 -3.914 -1.440 373 HZ PHE 51 HZ PHE 51 17.596 -2.180 -1.267 374 H PHE 52 HN PHE 52 15.303 -5.274 -6.848 375 HA PHE 52 HA PHE 52 17.704 -6.036 -5.486 376 1HB PHE 52 2HB PHE 52 15.493 -7.280 -7.047 377 2HB PHE 52 1HB PHE 52 16.950 -8.250 -6.855 378 HD1 PHE 52 HD1 PHE 52 17.889 -7.333 -4.180 379 HD2 PHE 52 HD2 PHE 52 13.944 -8.296 -5.582 380 HE1 PHE 52 HE1 PHE 52 17.200 -7.884 -1.866 381 HE2 PHE 52 HE2 PHE 52 13.257 -8.848 -3.268 382 HZ PHE 52 HZ PHE 52 14.882 -8.644 -1.409 383 H GLN 53 HN GLN 53 16.870 -5.728 -8.923 384 HA GLN 53 HA GLN 53 19.205 -6.924 -10.046 385 1HB GLN 53 2HB GLN 53 16.958 -6.116 -11.066 386 2HB GLN 53 1HB GLN 53 17.734 -4.537 -11.171 387 1HG GLN 53 2HG GLN 53 19.635 -5.662 -12.410 388 2HG GLN 53 1HG GLN 53 18.645 -7.120 -12.467 389 1HE2 GLN 53 1HE2 GLN 53 16.163 -5.264 -12.667 390 2HE2 GLN 53 2HE2 GLN 53 16.140 -4.804 -14.301 391 H ALA 54 HN ALA 54 18.504 -3.487 -9.317 392 HA ALA 54 HA ALA 54 20.973 -2.369 -10.118 393 1HB ALA 54 2HB ALA 54 18.881 -1.725 -8.047 394 2HB ALA 54 3HB ALA 54 19.212 -0.906 -9.573 395 3HB ALA 54 1HB ALA 54 20.311 -0.705 -8.208 396 H GLU 55 HN GLU 55 20.097 -4.042 -7.114 397 HA GLU 55 HA GLU 55 22.495 -3.374 -5.651 398 1HB GLU 55 2HB GLU 55 20.402 -5.555 -5.494 399 2HB GLU 55 1HB GLU 55 21.703 -5.414 -4.313 400 1HG GLU 55 2HG GLU 55 20.971 -3.003 -3.968 401 2HG GLU 55 1HG GLU 55 19.543 -3.383 -4.932 402 H GLU 56 HN GLU 56 21.734 -5.769 -8.088 403 HA GLU 56 HA GLU 56 23.892 -7.607 -7.530 404 1HB GLU 56 2HB GLU 56 22.253 -6.947 -9.996 405 2HB GLU 56 1HB GLU 56 23.352 -8.323 -9.895 406 1HG GLU 56 2HG GLU 56 20.994 -7.815 -8.052 407 2HG GLU 56 1HG GLU 56 21.032 -8.994 -9.363 408 H GLU 57 HN GLU 57 23.595 -4.692 -9.535 409 HA GLU 57 HA GLU 57 26.077 -4.943 -10.950 410 1HB GLU 57 2HB GLU 57 24.437 -2.540 -10.083 411 2HB GLU 57 1HB GLU 57 25.712 -2.494 -11.302 412 1HG GLU 57 2HG GLU 57 23.239 -4.245 -11.453 413 2HG GLU 57 1HG GLU 57 23.444 -2.719 -12.312 414 H GLU 58 HN GLU 58 25.243 -3.503 -7.806 415 HA GLU 58 HA GLU 58 27.706 -2.193 -7.253 416 1HB GLU 58 2HB GLU 58 25.732 -3.602 -5.426 417 2HB GLU 58 1HB GLU 58 26.922 -2.411 -4.904 418 1HG GLU 58 2HG GLU 58 25.887 -0.731 -6.395 419 2HG GLU 58 1HG GLU 58 24.691 -1.923 -6.902 420 H LYS 59 HN LYS 59 26.770 -5.588 -7.013 421 HA LYS 59 HA LYS 59 29.111 -6.407 -5.478 422 1HB LYS 59 2HB LYS 59 27.107 -7.927 -7.181 423 2HB LYS 59 1HB LYS 59 28.230 -8.663 -6.036 424 1HG LYS 59 2HG LYS 59 27.203 -7.293 -4.215 425 2HG LYS 59 1HG LYS 59 26.025 -6.685 -5.380 426 1HD LYS 59 2HD LYS 59 25.343 -9.058 -5.835 427 2HD LYS 59 1HD LYS 59 26.417 -9.570 -4.533 428 1HE LYS 59 2HE LYS 59 24.908 -7.515 -3.383 429 2HE LYS 59 1HE LYS 59 23.737 -8.426 -4.356 430 1HZ LYS 59 3HZ LYS 59 25.760 -9.783 -2.670 431 2HZ LYS 59 2HZ LYS 59 24.259 -9.310 -2.031 432 3HZ LYS 59 1HZ LYS 59 24.326 -10.422 -3.313 433 H LYS 60 HN LYS 60 28.689 -5.439 -8.686 434 HA LYS 60 HA LYS 60 30.240 -7.249 -10.210 435 1HB LYS 60 2HB LYS 60 30.426 -5.391 -11.738 436 2HB LYS 60 1HB LYS 60 28.864 -5.238 -10.934 437 1HG LYS 60 2HG LYS 60 29.953 -3.684 -9.277 438 2HG LYS 60 1HG LYS 60 31.412 -3.737 -10.268 439 1HD LYS 60 2HD LYS 60 29.990 -2.976 -12.222 440 2HD LYS 60 1HD LYS 60 28.677 -2.711 -11.075 441 1HE LYS 60 2HE LYS 60 30.317 -1.235 -9.759 442 2HE LYS 60 1HE LYS 60 31.358 -1.303 -11.195 443 1HZ LYS 60 2HZ LYS 60 28.471 -0.628 -11.339 444 2HZ LYS 60 1HZ LYS 60 29.666 0.563 -11.136 445 3HZ LYS 60 3HZ LYS 60 29.659 -0.400 -12.532 446 H LYS 61 HN LYS 61 31.267 -4.557 -8.118 447 HA LYS 61 HA LYS 61 34.025 -4.499 -8.796 448 1HB LYS 61 2HB LYS 61 32.540 -3.994 -6.197 449 2HB LYS 61 1HB LYS 61 34.211 -3.509 -6.488 450 1HG LYS 61 2HG LYS 61 33.442 -2.179 -8.455 451 2HG LYS 61 1HG LYS 61 31.776 -2.599 -8.053 452 1HD LYS 61 2HD LYS 61 32.092 -1.558 -5.810 453 2HD LYS 61 1HD LYS 61 33.716 -1.067 -6.293 454 1HE LYS 61 2HE LYS 61 32.797 0.811 -7.176 455 2HE LYS 61 1HE LYS 61 31.987 -0.215 -8.375 456 1HZ LYS 61 2HZ LYS 61 30.289 -0.686 -6.626 457 2HZ LYS 61 1HZ LYS 61 31.005 0.520 -5.667 458 3HZ LYS 61 3HZ LYS 61 30.301 0.929 -7.155 459 H LYS 62 HN LYS 62 32.219 -6.606 -6.584 460 HA LYS 62 HA LYS 62 34.755 -8.077 -5.966 461 1HB LYS 62 2HB LYS 62 32.041 -7.994 -4.605 462 2HB LYS 62 1HB LYS 62 33.438 -8.902 -4.023 463 1HG LYS 62 2HG LYS 62 34.722 -6.762 -3.898 464 2HG LYS 62 1HG LYS 62 33.260 -5.892 -4.362 465 1HD LYS 62 2HD LYS 62 32.109 -6.913 -2.369 466 2HD LYS 62 1HD LYS 62 33.665 -7.581 -1.875 467 1HE LYS 62 2HE LYS 62 32.972 -4.637 -2.193 468 2HE LYS 62 1HE LYS 62 33.370 -5.484 -0.686 469 1HZ LYS 62 3HZ LYS 62 35.453 -6.192 -2.106 470 2HZ LYS 62 2HZ LYS 62 35.113 -4.746 -2.931 471 3HZ LYS 62 1HZ LYS 62 35.436 -4.720 -1.263 472 H GLU 63 HN GLU 63 34.809 -10.346 -6.306 473 HA GLU 63 HA GLU 63 32.620 -11.409 -8.054 474 1HB GLU 63 2HB GLU 63 35.537 -12.180 -7.717 475 2HB GLU 63 1HB GLU 63 34.422 -12.921 -8.864 476 1HG GLU 63 2HG GLU 63 34.060 -10.681 -9.903 477 2HG GLU 63 1HG GLU 63 35.264 -10.007 -8.804 478 H GLY 64 HN GLY 64 31.808 -13.528 -7.604 479 1HA GLY 64 1HA GLY 64 32.794 -14.928 -5.196 480 2HA GLY 64 2HA GLY 64 31.611 -15.557 -6.343 481 H GLU 65 HN GLU 65 30.814 -15.936 -3.864 482 HA GLU 65 HA GLU 65 28.781 -13.788 -3.390 483 1HB GLU 65 2HB GLU 65 28.207 -16.222 -4.029 484 2HB GLU 65 1HB GLU 65 28.743 -16.647 -2.404 485 1HG GLU 65 2HG GLU 65 27.116 -14.985 -1.483 486 2HG GLU 65 1HG GLU 65 26.530 -14.702 -3.122 487 H SER 66 HN SER 66 28.623 -12.877 -1.327 488 HA SER 66 HA SER 66 30.898 -12.982 0.431 489 1HB SER 66 2HB SER 66 28.057 -12.027 0.917 490 2HB SER 66 1HB SER 66 29.489 -11.524 1.816 491 HG SER 66 HG SER 66 29.183 -9.987 0.290 492 H ARG 67 HN ARG 67 28.017 -14.915 0.185 493 HA ARG 67 HA ARG 67 28.594 -16.142 2.861 494 1HB ARG 67 2HB ARG 67 26.078 -16.018 1.165 495 2HB ARG 67 1HB ARG 67 26.197 -16.835 2.723 496 1HG ARG 67 2HG ARG 67 26.886 -14.660 3.755 497 2HG ARG 67 1HG ARG 67 26.611 -13.875 2.199 498 1HD ARG 67 2HD ARG 67 24.230 -14.877 2.314 499 2HD ARG 67 1HD ARG 67 24.578 -15.174 4.027 500 HE ARG 67 HE ARG 67 24.333 -12.521 2.740 501 1HH1 ARG 67 1HH1 ARG 67 25.812 -14.288 5.280 502 2HH1 ARG 67 2HH1 ARG 67 25.595 -13.042 6.464 503 1HH2 ARG 67 1HH2 ARG 67 23.827 -10.957 4.333 504 2HH2 ARG 67 2HH2 ARG 67 24.471 -11.157 5.928 505 H ASN 68 HN ASN 68 28.826 -18.412 2.950 506 HA ASN 68 HA ASN 68 29.942 -19.809 0.777 507 1HB ASN 68 2HB ASN 68 29.964 -20.377 3.235 508 2HB ASN 68 1HB ASN 68 28.306 -20.953 3.063 509 1HD2 ASN 68 1HD2 ASN 68 31.592 -21.469 1.671 510 2HD2 ASN 68 2HD2 ASN 68 31.346 -23.110 1.318 No H/Q in entry = 510 Start of MODEL 4 1 H1 GLU 1 1H GLU 1 18.471 9.555 12.695 2 H2 GLU 1 3H GLU 1 18.784 11.139 12.177 3 H3 GLU 1 2H GLU 1 17.486 10.832 13.228 4 HA GLU 1 HA GLU 1 16.267 9.687 11.546 5 1HB GLU 1 2HB GLU 1 17.604 12.250 10.620 6 2HB GLU 1 1HB GLU 1 16.115 11.601 9.933 7 1HG GLU 1 2HG GLU 1 15.067 11.705 12.191 8 2HG GLU 1 1HG GLU 1 16.543 12.440 12.818 9 H SER 2 HN SER 2 16.942 7.835 10.468 10 HA SER 2 HA SER 2 19.379 7.577 8.979 11 1HB SER 2 2HB SER 2 18.374 5.471 8.281 12 2HB SER 2 1HB SER 2 17.941 5.762 9.965 13 HG SER 2 HG SER 2 15.954 6.621 9.212 14 H GLY 3 HN GLY 3 16.266 8.921 8.169 15 1HA GLY 3 1HA GLY 3 17.014 8.972 5.279 16 2HA GLY 3 2HA GLY 3 16.571 10.468 6.101 17 H LYS 4 HN LYS 4 15.346 8.118 4.142 18 HA LYS 4 HA LYS 4 12.639 9.000 4.329 19 1HB LYS 4 2HB LYS 4 13.884 7.838 2.428 20 2HB LYS 4 1HB LYS 4 13.643 6.329 3.309 21 1HG LYS 4 2HG LYS 4 11.183 6.765 3.300 22 2HG LYS 4 1HG LYS 4 11.470 8.198 2.314 23 1HD LYS 4 2HD LYS 4 12.663 6.659 0.663 24 2HD LYS 4 1HD LYS 4 11.997 5.309 1.583 25 1HE LYS 4 2HE LYS 4 9.740 5.967 1.085 26 2HE LYS 4 1HE LYS 4 10.271 7.536 0.450 27 1HZ LYS 4 3HZ LYS 4 11.055 4.880 -0.647 28 2HZ LYS 4 2HZ LYS 4 9.886 5.906 -1.333 29 3HZ LYS 4 1HZ LYS 4 11.514 6.390 -1.269 30 H ALA 5 HN ALA 5 10.885 8.189 5.492 31 HA ALA 5 HA ALA 5 11.236 6.867 7.960 32 1HB ALA 5 1HB ALA 5 9.241 8.085 7.539 33 2HB ALA 5 2HB ALA 5 8.713 6.404 7.597 34 3HB ALA 5 3HB ALA 5 8.926 7.208 6.043 35 H THR 6 HN THR 6 11.074 5.541 4.740 36 HA THR 6 HA THR 6 11.184 2.784 5.914 37 HB THR 6 HB THR 6 9.769 3.631 3.368 38 HG1 THR 6 1HG THR 6 7.977 3.794 4.527 39 1HG2 THR 6 2HG2 THR 6 10.311 1.073 4.743 40 2HG2 THR 6 1HG2 THR 6 8.646 1.293 4.206 41 3HG2 THR 6 3HG2 THR 6 9.968 1.388 3.042 42 H SER 7 HN SER 7 12.134 1.208 4.256 43 HA SER 7 HA SER 7 13.966 2.503 2.293 44 1HB SER 7 2HB SER 7 15.307 2.412 4.259 45 2HB SER 7 1HB SER 7 14.687 0.821 4.700 46 HG SER 7 HG SER 7 16.573 1.540 2.768 47 H TYR 8 HN TYR 8 13.748 1.365 0.410 48 HA TYR 8 HA TYR 8 12.235 -0.897 -0.080 49 1HB TYR 8 2HB TYR 8 14.856 0.001 -1.316 50 2HB TYR 8 1HB TYR 8 13.779 -1.184 -2.054 51 HD1 TYR 8 HD1 TYR 8 11.118 -0.129 -1.466 52 HD2 TYR 8 HD2 TYR 8 14.695 1.954 -2.613 53 HE1 TYR 8 HE1 TYR 8 9.745 1.709 -2.407 54 HE2 TYR 8 HE2 TYR 8 13.322 3.792 -3.556 55 HH TYR 8 HH TYR 8 9.767 3.737 -3.321 56 H ALA 9 HN ALA 9 15.766 -0.934 0.579 57 HA ALA 9 HA ALA 9 16.333 -3.632 0.533 58 1HB ALA 9 2HB ALA 9 17.478 -1.302 1.501 59 2HB ALA 9 1HB ALA 9 17.327 -2.295 2.952 60 3HB ALA 9 3HB ALA 9 18.225 -2.899 1.560 61 H GLU 10 HN GLU 10 14.480 -1.911 3.003 62 HA GLU 10 HA GLU 10 14.271 -4.291 4.733 63 1HB GLU 10 2HB GLU 10 12.972 -1.544 4.774 64 2HB GLU 10 1HB GLU 10 12.880 -2.724 6.082 65 1HG GLU 10 2HG GLU 10 15.417 -2.705 6.133 66 2HG GLU 10 1HG GLU 10 15.356 -1.332 5.028 67 H LEU 11 HN LEU 11 12.165 -2.368 2.595 68 HA LEU 11 HA LEU 11 9.764 -3.885 3.019 69 1HB LEU 11 2HB LEU 11 10.402 -1.559 1.842 70 2HB LEU 11 1HB LEU 11 10.373 -2.578 0.403 71 HG LEU 11 HG LEU 11 8.090 -3.397 1.651 72 1HD1 LEU 11 1HD1 LEU 11 8.839 -1.098 3.063 73 2HD1 LEU 11 3HD1 LEU 11 7.591 -0.544 1.946 74 3HD1 LEU 11 2HD1 LEU 11 7.248 -1.859 3.072 75 1HD2 LEU 11 2HD2 LEU 11 8.483 -2.605 -0.729 76 2HD2 LEU 11 1HD2 LEU 11 6.926 -2.142 -0.041 77 3HD2 LEU 11 3HD2 LEU 11 8.233 -0.960 -0.143 78 H CYS 12 HN CYS 12 11.995 -3.887 0.233 79 HA CYS 12 HA CYS 12 10.922 -6.258 -0.980 80 1HB CYS 12 2HB CYS 12 13.576 -4.798 -1.134 81 2HB CYS 12 1HB CYS 12 13.156 -6.138 -2.201 82 H ASN 13 HN ASN 13 12.884 -5.791 1.781 83 HA ASN 13 HA ASN 13 14.701 -7.853 1.944 84 1HB ASN 13 2HB ASN 13 14.016 -6.183 3.698 85 2HB ASN 13 1HB ASN 13 12.601 -7.176 4.029 86 1HD2 ASN 13 1HD2 ASN 13 14.213 -6.913 6.194 87 2HD2 ASN 13 2HD2 ASN 13 15.164 -8.294 6.450 88 H GLU 14 HN GLU 14 11.234 -8.197 2.746 89 HA GLU 14 HA GLU 14 11.055 -10.923 3.250 90 1HB GLU 14 2HB GLU 14 9.300 -8.991 3.119 91 2HB GLU 14 1HB GLU 14 9.090 -9.515 1.448 92 1HG GLU 14 2HG GLU 14 8.735 -11.866 2.351 93 2HG GLU 14 1HG GLU 14 8.667 -11.151 3.962 94 H TYR 15 HN TYR 15 11.434 -9.342 0.093 95 HA TYR 15 HA TYR 15 11.000 -11.797 -1.427 96 1HB TYR 15 2HB TYR 15 12.017 -9.010 -2.002 97 2HB TYR 15 1HB TYR 15 11.921 -10.246 -3.259 98 HD1 TYR 15 HD1 TYR 15 9.702 -11.289 -3.806 99 HD2 TYR 15 HD2 TYR 15 10.063 -7.915 -1.174 100 HE1 TYR 15 HE1 TYR 15 7.277 -10.838 -4.053 101 HE2 TYR 15 HE2 TYR 15 7.639 -7.461 -1.422 102 HH TYR 15 HH TYR 15 5.701 -8.223 -2.227 103 H ARG 16 HN ARG 16 13.659 -10.445 0.299 104 HA ARG 16 HA ARG 16 15.942 -11.153 -1.128 105 1HB ARG 16 2HB ARG 16 15.294 -11.596 1.806 106 2HB ARG 16 1HB ARG 16 16.924 -11.554 1.134 107 1HG ARG 16 2HG ARG 16 15.081 -9.258 0.577 108 2HG ARG 16 1HG ARG 16 15.837 -9.368 2.166 109 1HD ARG 16 2HD ARG 16 18.010 -9.151 1.283 110 2HD ARG 16 1HD ARG 16 17.501 -9.659 -0.338 111 HE ARG 16 HE ARG 16 16.056 -7.466 -0.217 112 1HH1 ARG 16 1HH1 ARG 16 17.624 -6.920 2.438 113 2HH1 ARG 16 2HH1 ARG 16 18.739 -5.720 1.875 114 1HH2 ARG 16 1HH2 ARG 16 18.146 -6.364 -1.481 115 2HH2 ARG 16 2HH2 ARG 16 19.036 -5.405 -0.344 116 H LYS 17 HN LYS 17 13.735 -13.270 0.647 117 HA LYS 17 HA LYS 17 15.307 -15.691 0.143 118 1HB LYS 17 2HB LYS 17 13.222 -16.728 1.148 119 2HB LYS 17 1HB LYS 17 13.969 -15.486 2.152 120 1HG LYS 17 2HG LYS 17 12.239 -14.012 1.848 121 2HG LYS 17 1HG LYS 17 11.940 -14.546 0.194 122 1HD LYS 17 2HD LYS 17 10.761 -16.493 0.945 123 2HD LYS 17 1HD LYS 17 11.284 -16.244 2.611 124 1HE LYS 17 2HE LYS 17 10.037 -13.840 1.983 125 2HE LYS 17 1HE LYS 17 9.016 -15.053 1.190 126 1HZ LYS 17 3HZ LYS 17 9.339 -16.359 3.359 127 2HZ LYS 17 2HZ LYS 17 9.816 -14.874 4.033 128 3HZ LYS 17 1HZ LYS 17 8.256 -15.053 3.381 129 H LEU 18 HN LEU 18 12.837 -13.876 -1.494 130 HA LEU 18 HA LEU 18 11.940 -16.113 -3.184 131 1HB LEU 18 2HB LEU 18 11.485 -13.142 -3.549 132 2HB LEU 18 1HB LEU 18 10.445 -14.467 -4.070 133 HG LEU 18 HG LEU 18 11.014 -13.638 -1.209 134 1HD1 LEU 18 2HD1 LEU 18 9.014 -12.902 -3.150 135 2HD1 LEU 18 1HD1 LEU 18 8.250 -13.768 -1.817 136 3HD1 LEU 18 3HD1 LEU 18 9.208 -12.323 -1.496 137 1HD2 LEU 18 2HD2 LEU 18 9.569 -16.008 -2.395 138 2HD2 LEU 18 1HD2 LEU 18 10.826 -16.001 -1.157 139 3HD2 LEU 18 3HD2 LEU 18 9.207 -15.418 -0.773 140 H VAL 19 HN VAL 19 14.391 -13.649 -3.232 141 HA VAL 19 HA VAL 19 14.799 -13.655 -6.127 142 HB VAL 19 HB VAL 19 16.238 -12.590 -3.693 143 1HG1 VAL 19 3HG1 VAL 19 17.086 -12.403 -6.599 144 2HG1 VAL 19 2HG1 VAL 19 17.769 -11.431 -5.294 145 3HG1 VAL 19 1HG1 VAL 19 17.980 -13.183 -5.294 146 1HG2 VAL 19 1HG2 VAL 19 14.104 -11.670 -5.232 147 2HG2 VAL 19 3HG2 VAL 19 15.078 -10.700 -4.127 148 3HG2 VAL 19 2HG2 VAL 19 15.488 -10.761 -5.842 149 H ARG 20 HN ARG 20 16.191 -14.988 -7.258 150 HA ARG 20 HA ARG 20 17.645 -17.085 -5.702 151 1HB ARG 20 2HB ARG 20 16.673 -16.836 -8.565 152 2HB ARG 20 1HB ARG 20 17.626 -18.201 -7.982 153 1HG ARG 20 2HG ARG 20 15.643 -17.990 -6.068 154 2HG ARG 20 1HG ARG 20 14.786 -17.585 -7.555 155 1HD ARG 20 2HD ARG 20 15.584 -19.668 -8.605 156 2HD ARG 20 1HD ARG 20 16.493 -20.069 -7.134 157 HE ARG 20 HE ARG 20 14.065 -19.731 -6.056 158 1HH1 ARG 20 1HH1 ARG 20 12.972 -19.855 -8.924 159 2HH1 ARG 20 2HH1 ARG 20 12.494 -21.518 -9.013 160 1HH2 ARG 20 1HH2 ARG 20 14.302 -22.466 -6.211 161 2HH2 ARG 20 2HH2 ARG 20 13.246 -22.995 -7.478 162 H ASN 21 HN ASN 21 18.425 -16.214 -9.001 163 HA ASN 21 HA ASN 21 21.090 -15.189 -8.070 164 1HB ASN 21 2HB ASN 21 22.023 -16.344 -9.981 165 2HB ASN 21 1HB ASN 21 20.947 -17.480 -9.167 166 1HD2 ASN 21 1HD2 ASN 21 18.832 -17.904 -10.168 167 2HD2 ASN 21 2HD2 ASN 21 18.571 -17.558 -11.807 168 H GLY 22 HN GLY 22 19.174 -13.285 -8.290 169 1HA GLY 22 1HA GLY 22 19.848 -11.941 -10.867 170 2HA GLY 22 2HA GLY 22 19.387 -11.103 -9.384 171 H LYS 23 HN LYS 23 17.524 -13.881 -9.831 172 HA LYS 23 HA LYS 23 15.400 -12.430 -11.351 173 1HB LYS 23 2HB LYS 23 15.858 -14.510 -12.344 174 2HB LYS 23 1HB LYS 23 16.146 -15.294 -10.792 175 1HG LYS 23 2HG LYS 23 13.794 -15.298 -10.271 176 2HG LYS 23 1HG LYS 23 13.429 -14.269 -11.655 177 1HD LYS 23 2HD LYS 23 14.670 -16.284 -12.940 178 2HD LYS 23 1HD LYS 23 14.035 -17.183 -11.562 179 1HE LYS 23 2HE LYS 23 11.767 -16.452 -12.058 180 2HE LYS 23 1HE LYS 23 12.356 -15.371 -13.336 181 1HZ LYS 23 1HZ LYS 23 12.876 -18.298 -13.272 182 2HZ LYS 23 3HZ LYS 23 11.593 -17.603 -14.136 183 3HZ LYS 23 2HZ LYS 23 13.198 -17.224 -14.549 184 H LEU 24 HN LEU 24 13.445 -11.953 -10.347 185 HA LEU 24 HA LEU 24 13.218 -12.652 -7.442 186 1HB LEU 24 2HB LEU 24 13.210 -10.233 -8.735 187 2HB LEU 24 1HB LEU 24 11.484 -10.574 -8.636 188 HG LEU 24 HG LEU 24 13.476 -10.290 -6.385 189 1HD1 LEU 24 2HD1 LEU 24 11.040 -8.908 -7.381 190 2HD1 LEU 24 1HD1 LEU 24 11.212 -9.022 -5.630 191 3HD1 LEU 24 3HD1 LEU 24 12.468 -8.241 -6.591 192 1HD2 LEU 24 3HD2 LEU 24 10.846 -11.770 -6.414 193 2HD2 LEU 24 2HD2 LEU 24 12.389 -12.283 -5.729 194 3HD2 LEU 24 1HD2 LEU 24 11.451 -11.016 -4.939 195 H ALA 25 HN ALA 25 11.296 -13.637 -6.716 196 HA ALA 25 HA ALA 25 9.572 -14.810 -8.828 197 1HB ALA 25 3HB ALA 25 10.481 -16.294 -7.153 198 2HB ALA 25 1HB ALA 25 8.755 -16.133 -6.828 199 3HB ALA 25 2HB ALA 25 9.924 -15.246 -5.850 200 H CYS 26 HN CYS 26 8.061 -13.238 -9.424 201 HA CYS 26 HA CYS 26 6.697 -11.622 -7.359 202 1HB CYS 26 2HB CYS 26 6.355 -11.822 -10.369 203 2HB CYS 26 1HB CYS 26 5.694 -10.554 -9.339 204 H THR 27 HN THR 27 4.647 -12.084 -6.596 205 HA THR 27 HA THR 27 3.364 -14.596 -7.533 206 HB THR 27 HB THR 27 1.979 -14.128 -5.438 207 HG1 THR 27 1HG THR 27 2.736 -11.790 -5.664 208 1HG2 THR 27 2HG2 THR 27 4.989 -14.378 -5.342 209 2HG2 THR 27 1HG2 THR 27 3.979 -14.538 -3.905 210 3HG2 THR 27 3HG2 THR 27 3.789 -15.668 -5.245 211 H ARG 28 HN ARG 28 0.735 -14.167 -7.020 212 HA ARG 28 HA ARG 28 -0.014 -12.050 -9.003 213 1HB ARG 28 2HB ARG 28 -1.173 -14.713 -8.163 214 2HB ARG 28 1HB ARG 28 -2.107 -13.559 -9.115 215 1HG ARG 28 2HG ARG 28 -0.233 -13.522 -10.788 216 2HG ARG 28 1HG ARG 28 0.549 -14.810 -9.872 217 1HD ARG 28 2HD ARG 28 -2.160 -14.938 -11.244 218 2HD ARG 28 1HD ARG 28 -0.709 -15.875 -11.646 219 HE ARG 28 HE ARG 28 -2.463 -16.314 -9.310 220 1HH1 ARG 28 1HH1 ARG 28 -0.447 -17.809 -11.458 221 2HH1 ARG 28 2HH1 ARG 28 0.376 -18.804 -10.304 222 1HH2 ARG 28 1HH2 ARG 28 -0.971 -17.186 -7.549 223 2HH2 ARG 28 2HH2 ARG 28 0.079 -18.452 -8.091 224 H GLU 29 HN GLU 29 0.359 -11.893 -5.930 225 HA GLU 29 HA GLU 29 -2.089 -11.659 -4.562 226 1HB GLU 29 2HB GLU 29 -0.820 -10.131 -3.110 227 2HB GLU 29 1HB GLU 29 0.210 -11.468 -3.622 228 1HG GLU 29 2HG GLU 29 1.070 -10.011 -5.479 229 2HG GLU 29 1HG GLU 29 0.147 -8.672 -4.795 230 H ASN 30 HN ASN 30 -3.212 -9.565 -3.968 231 HA ASN 30 HA ASN 30 -3.560 -7.881 -6.415 232 1HB ASN 30 2HB ASN 30 -5.360 -8.014 -3.991 233 2HB ASN 30 1HB ASN 30 -5.783 -7.576 -5.645 234 1HD2 ASN 30 1HD2 ASN 30 -5.621 -9.388 -7.295 235 2HD2 ASN 30 2HD2 ASN 30 -5.958 -10.966 -6.777 236 H ASP 31 HN ASP 31 -1.340 -6.997 -5.291 237 HA ASP 31 HA ASP 31 -2.178 -4.583 -3.732 238 1HB ASP 31 2HB ASP 31 -0.728 -6.841 -2.815 239 2HB ASP 31 1HB ASP 31 0.439 -5.527 -2.965 240 HA PRO 32 HA PRO 32 0.562 -3.793 -7.500 241 1HB PRO 32 2HB PRO 32 -1.279 -1.685 -8.163 242 2HB PRO 32 1HB PRO 32 -0.964 -3.174 -9.056 243 1HG PRO 32 2HG PRO 32 -3.302 -2.494 -7.536 244 2HG PRO 32 1HG PRO 32 -2.980 -3.988 -8.420 245 1HD PRO 32 2HD PRO 32 -3.022 -3.588 -5.557 246 2HD PRO 32 1HD PRO 32 -2.721 -5.098 -6.446 247 H ILE 33 HN ILE 33 1.925 -1.920 -7.687 248 HA ILE 33 HA ILE 33 1.463 0.369 -5.862 249 HB ILE 33 HB ILE 33 3.378 -0.028 -4.531 250 1HG1 ILE 33 2HG1 ILE 33 5.022 -0.486 -6.221 251 2HG1 ILE 33 1HG1 ILE 33 5.021 -1.866 -5.123 252 1HG2 ILE 33 1HG2 ILE 33 1.526 -1.628 -4.072 253 2HG2 ILE 33 3HG2 ILE 33 2.300 -2.793 -5.147 254 3HG2 ILE 33 2HG2 ILE 33 3.107 -2.291 -3.662 255 1HD1 ILE 33 2HD1 ILE 33 3.265 -2.864 -6.783 256 2HD1 ILE 33 1HD1 ILE 33 3.907 -1.670 -7.910 257 3HD1 ILE 33 3HD1 ILE 33 4.972 -2.898 -7.227 258 H GLN 34 HN GLN 34 3.878 1.612 -6.027 259 HA GLN 34 HA GLN 34 4.388 1.848 -8.977 260 1HB GLN 34 2HB GLN 34 4.232 3.953 -6.794 261 2HB GLN 34 1HB GLN 34 4.692 4.284 -8.465 262 1HG GLN 34 2HG GLN 34 2.504 3.377 -9.221 263 2HG GLN 34 1HG GLN 34 2.044 3.129 -7.536 264 1HE2 GLN 34 1HE2 GLN 34 0.712 4.958 -9.445 265 2HE2 GLN 34 2HE2 GLN 34 0.863 6.520 -8.799 266 H GLY 35 HN GLY 35 6.593 2.691 -9.477 267 1HA GLY 35 1HA GLY 35 8.875 1.866 -9.204 268 2HA GLY 35 2HA GLY 35 8.567 1.704 -7.474 269 HA PRO 36 HA PRO 36 10.127 5.682 -6.544 270 1HB PRO 36 2HB PRO 36 12.884 5.004 -7.006 271 2HB PRO 36 1HB PRO 36 12.029 5.089 -5.464 272 1HG PRO 36 2HG PRO 36 12.930 2.743 -6.860 273 2HG PRO 36 1HG PRO 36 12.086 2.828 -5.313 274 1HD PRO 36 2HD PRO 36 11.046 1.915 -7.842 275 2HD PRO 36 1HD PRO 36 10.191 2.021 -6.286 276 H ASP 37 HN ASP 37 10.937 4.145 -9.559 277 HA ASP 37 HA ASP 37 12.233 6.476 -10.761 278 1HB ASP 37 2HB ASP 37 11.052 3.930 -11.919 279 2HB ASP 37 1HB ASP 37 12.106 5.046 -12.786 280 H GLY 38 HN GLY 38 8.968 5.309 -10.393 281 1HA GLY 38 1HA GLY 38 8.044 7.536 -12.164 282 2HA GLY 38 2HA GLY 38 7.209 7.063 -10.686 283 H LYS 39 HN LYS 39 8.560 4.594 -12.730 284 HA LYS 39 HA LYS 39 6.122 4.135 -14.285 285 1HB LYS 39 2HB LYS 39 8.496 3.683 -15.006 286 2HB LYS 39 1HB LYS 39 8.550 2.374 -13.825 287 1HG LYS 39 2HG LYS 39 6.528 1.377 -14.960 288 2HG LYS 39 1HG LYS 39 6.702 2.602 -16.218 289 1HD LYS 39 2HD LYS 39 9.106 1.782 -16.493 290 2HD LYS 39 1HD LYS 39 8.657 0.413 -15.478 291 1HE LYS 39 2HE LYS 39 7.882 -0.599 -17.358 292 2HE LYS 39 1HE LYS 39 6.603 0.628 -17.409 293 1HZ LYS 39 2HZ LYS 39 9.348 1.160 -18.394 294 2HZ LYS 39 1HZ LYS 39 8.147 0.515 -19.409 295 3HZ LYS 39 3HZ LYS 39 7.931 2.045 -18.707 296 H VAL 40 HN VAL 40 4.818 2.172 -14.087 297 HA VAL 40 HA VAL 40 4.613 1.223 -11.262 298 HB VAL 40 HB VAL 40 2.726 1.164 -13.640 299 1HG1 VAL 40 1HG1 VAL 40 2.357 -0.741 -12.102 300 2HG1 VAL 40 3HG1 VAL 40 2.256 0.382 -10.746 301 3HG1 VAL 40 2HG1 VAL 40 1.031 0.419 -12.014 302 1HG2 VAL 40 2HG2 VAL 40 3.359 3.362 -12.342 303 2HG2 VAL 40 1HG2 VAL 40 1.666 3.018 -12.694 304 3HG2 VAL 40 3HG2 VAL 40 2.316 2.694 -11.087 305 H HIS 41 HN HIS 41 4.324 -1.087 -10.886 306 HA HIS 41 HA HIS 41 5.261 -2.834 -13.137 307 1HB HIS 41 2HB HIS 41 6.019 -3.025 -10.205 308 2HB HIS 41 1HB HIS 41 6.704 -3.958 -11.535 309 HD1 HIS 41 HD1 HIS 41 8.620 -2.920 -12.808 310 HD2 HIS 41 HD2 HIS 41 6.688 -0.162 -10.351 311 HE1 HIS 41 HE1 HIS 41 10.008 -0.802 -12.880 312 H GLY 42 HN GLY 42 4.740 -5.207 -12.629 313 1HA GLY 42 1HA GLY 42 3.227 -6.884 -11.965 314 2HA GLY 42 2HA GLY 42 2.009 -5.653 -12.299 315 H ASN 43 HN ASN 43 4.212 -6.824 -9.754 316 HA ASN 43 HA ASN 43 2.359 -5.609 -7.731 317 1HB ASN 43 2HB ASN 43 2.733 -7.752 -6.451 318 2HB ASN 43 1HB ASN 43 1.860 -7.968 -7.966 319 1HD2 ASN 43 1HD2 ASN 43 3.257 -10.161 -6.849 320 2HD2 ASN 43 2HD2 ASN 43 4.603 -10.518 -7.819 321 H THR 44 HN THR 44 3.672 -6.310 -5.451 322 HA THR 44 HA THR 44 5.732 -4.430 -5.148 323 HB THR 44 HB THR 44 5.292 -7.048 -3.686 324 HG1 THR 44 1HG THR 44 4.318 -4.480 -3.033 325 1HG2 THR 44 1HG2 THR 44 6.851 -4.551 -3.072 326 2HG2 THR 44 3HG2 THR 44 6.177 -5.522 -1.762 327 3HG2 THR 44 2HG2 THR 44 7.338 -6.236 -2.882 328 H CYS 45 HN CYS 45 6.083 -7.945 -5.694 329 HA CYS 45 HA CYS 45 8.888 -8.129 -5.668 330 1HB CYS 45 2HB CYS 45 7.577 -10.090 -5.769 331 2HB CYS 45 1HB CYS 45 6.702 -9.540 -7.199 332 H SER 46 HN SER 46 6.920 -7.816 -8.674 333 HA SER 46 HA SER 46 8.978 -7.335 -10.493 334 1HB SER 46 2HB SER 46 6.470 -7.495 -10.877 335 2HB SER 46 1HB SER 46 6.351 -5.814 -10.358 336 HG SER 46 HG SER 46 6.871 -6.666 -12.754 337 H MET 47 HN MET 47 7.705 -5.195 -8.018 338 HA MET 47 HA MET 47 9.260 -2.871 -8.988 339 1HB MET 47 2HB MET 47 6.900 -3.163 -7.676 340 2HB MET 47 1HB MET 47 7.981 -2.962 -6.298 341 1HG MET 47 2HG MET 47 7.870 -1.090 -8.677 342 2HG MET 47 1HG MET 47 7.064 -0.790 -7.138 343 1HE MET 47 3HE MET 47 8.300 -1.337 -4.974 344 2HE MET 47 2HE MET 47 9.690 -2.356 -5.340 345 3HE MET 47 1HE MET 47 9.936 -0.774 -4.603 346 H CYS 48 HN CYS 48 9.380 -5.444 -6.649 347 HA CYS 48 HA CYS 48 11.655 -4.341 -5.147 348 1HB CYS 48 2HB CYS 48 9.749 -6.611 -5.057 349 2HB CYS 48 1HB CYS 48 11.331 -6.943 -4.363 350 H GLU 49 HN GLU 49 11.156 -6.188 -8.000 351 HA GLU 49 HA GLU 49 13.674 -7.686 -7.894 352 1HB GLU 49 2HB GLU 49 12.844 -8.657 -9.840 353 2HB GLU 49 1HB GLU 49 11.336 -8.054 -9.155 354 1HG GLU 49 2HG GLU 49 11.405 -6.090 -10.562 355 2HG GLU 49 1HG GLU 49 13.018 -6.501 -11.142 356 H VAL 50 HN VAL 50 12.464 -4.786 -9.609 357 HA VAL 50 HA VAL 50 14.821 -4.189 -11.084 358 HB VAL 50 HB VAL 50 12.791 -3.036 -11.572 359 1HG1 VAL 50 3HG1 VAL 50 12.766 -2.498 -8.610 360 2HG1 VAL 50 2HG1 VAL 50 11.846 -1.473 -9.709 361 3HG1 VAL 50 1HG1 VAL 50 11.500 -3.199 -9.616 362 1HG2 VAL 50 2HG2 VAL 50 14.704 -1.187 -10.121 363 2HG2 VAL 50 1HG2 VAL 50 14.695 -1.570 -11.843 364 3HG2 VAL 50 3HG2 VAL 50 13.382 -0.621 -11.143 365 H PHE 51 HN PHE 51 13.951 -3.589 -7.711 366 HA PHE 51 HA PHE 51 16.220 -1.845 -7.146 367 1HB PHE 51 2HB PHE 51 14.295 -1.654 -5.758 368 2HB PHE 51 1HB PHE 51 14.168 -3.402 -5.561 369 HD1 PHE 51 HD1 PHE 51 16.818 -0.781 -5.065 370 HD2 PHE 51 HD2 PHE 51 14.757 -4.193 -3.461 371 HE1 PHE 51 HE1 PHE 51 18.200 -0.649 -3.009 372 HE2 PHE 51 HE2 PHE 51 16.139 -4.058 -1.404 373 HZ PHE 51 HZ PHE 51 17.861 -2.287 -1.179 374 H PHE 52 HN PHE 52 15.460 -5.277 -6.828 375 HA PHE 52 HA PHE 52 17.834 -6.105 -5.442 376 1HB PHE 52 2HB PHE 52 15.601 -7.267 -7.029 377 2HB PHE 52 1HB PHE 52 17.042 -8.269 -6.885 378 HD1 PHE 52 HD1 PHE 52 18.044 -7.518 -4.209 379 HD2 PHE 52 HD2 PHE 52 14.035 -8.234 -5.571 380 HE1 PHE 52 HE1 PHE 52 17.371 -8.135 -1.902 381 HE2 PHE 52 HE2 PHE 52 13.361 -8.849 -3.268 382 HZ PHE 52 HZ PHE 52 15.025 -8.799 -1.431 383 H GLN 53 HN GLN 53 17.040 -5.586 -8.839 384 HA GLN 53 HA GLN 53 19.382 -6.802 -9.992 385 1HB GLN 53 2HB GLN 53 17.075 -5.998 -10.954 386 2HB GLN 53 1HB GLN 53 17.892 -4.448 -11.135 387 1HG GLN 53 2HG GLN 53 19.732 -5.693 -12.371 388 2HG GLN 53 1HG GLN 53 18.667 -7.099 -12.375 389 1HE2 GLN 53 1HE2 GLN 53 16.302 -5.043 -12.556 390 2HE2 GLN 53 2HE2 GLN 53 16.263 -4.653 -14.206 391 H ALA 54 HN ALA 54 18.590 -3.439 -9.082 392 HA ALA 54 HA ALA 54 21.068 -2.268 -9.929 393 1HB ALA 54 1HB ALA 54 18.699 -1.603 -8.284 394 2HB ALA 54 2HB ALA 54 19.507 -0.645 -9.526 395 3HB ALA 54 3HB ALA 54 20.155 -0.691 -7.886 396 H GLU 55 HN GLU 55 20.041 -3.779 -6.882 397 HA GLU 55 HA GLU 55 22.151 -3.012 -5.181 398 1HB GLU 55 2HB GLU 55 20.470 -5.499 -5.505 399 2HB GLU 55 1HB GLU 55 21.659 -5.373 -4.208 400 1HG GLU 55 2HG GLU 55 19.331 -3.495 -4.714 401 2HG GLU 55 1HG GLU 55 19.494 -4.626 -3.370 402 H GLU 56 HN GLU 56 22.133 -5.296 -7.848 403 HA GLU 56 HA GLU 56 24.582 -6.678 -7.195 404 1HB GLU 56 2HB GLU 56 23.142 -6.144 -9.816 405 2HB GLU 56 1HB GLU 56 24.410 -7.351 -9.593 406 1HG GLU 56 2HG GLU 56 23.029 -8.484 -7.887 407 2HG GLU 56 1HG GLU 56 21.761 -7.280 -8.113 408 H GLU 57 HN GLU 57 23.852 -3.619 -8.759 409 HA GLU 57 HA GLU 57 26.380 -3.219 -10.079 410 1HB GLU 57 2HB GLU 57 24.279 -1.319 -8.985 411 2HB GLU 57 1HB GLU 57 25.578 -0.842 -10.079 412 1HG GLU 57 2HG GLU 57 23.522 -2.986 -10.694 413 2HG GLU 57 1HG GLU 57 23.426 -1.321 -11.267 414 H GLU 58 HN GLU 58 25.153 -2.300 -6.853 415 HA GLU 58 HA GLU 58 27.349 -0.743 -5.970 416 1HB GLU 58 2HB GLU 58 25.127 -1.056 -4.863 417 2HB GLU 58 1HB GLU 58 25.622 -2.684 -4.400 418 1HG GLU 58 2HG GLU 58 27.576 -1.695 -3.190 419 2HG GLU 58 1HG GLU 58 26.954 -0.089 -3.569 420 H LYS 59 HN LYS 59 26.884 -4.272 -5.967 421 HA LYS 59 HA LYS 59 29.390 -4.802 -4.556 422 1HB LYS 59 2HB LYS 59 27.420 -6.497 -6.121 423 2HB LYS 59 1HB LYS 59 28.771 -7.160 -5.203 424 1HG LYS 59 2HG LYS 59 27.872 -6.030 -3.159 425 2HG LYS 59 1HG LYS 59 26.473 -5.515 -4.101 426 1HD LYS 59 2HD LYS 59 25.939 -7.880 -4.591 427 2HD LYS 59 1HD LYS 59 27.328 -8.388 -3.630 428 1HE LYS 59 2HE LYS 59 25.372 -6.550 -2.315 429 2HE LYS 59 1HE LYS 59 24.880 -8.237 -2.550 430 1HZ LYS 59 1HZ LYS 59 27.297 -8.695 -1.738 431 2HZ LYS 59 3HZ LYS 59 27.166 -7.156 -1.039 432 3HZ LYS 59 2HZ LYS 59 26.075 -8.382 -0.600 433 H LYS 60 HN LYS 60 28.770 -3.709 -7.637 434 HA LYS 60 HA LYS 60 30.289 -5.297 -9.400 435 1HB LYS 60 2HB LYS 60 30.376 -3.290 -10.730 436 2HB LYS 60 1HB LYS 60 28.860 -3.232 -9.831 437 1HG LYS 60 2HG LYS 60 29.952 -1.807 -8.117 438 2HG LYS 60 1HG LYS 60 31.441 -1.834 -9.061 439 1HD LYS 60 2HD LYS 60 30.064 -0.905 -11.003 440 2HD LYS 60 1HD LYS 60 28.778 -0.621 -9.830 441 1HE LYS 60 2HE LYS 60 29.838 1.408 -9.579 442 2HE LYS 60 1HE LYS 60 30.919 0.481 -8.522 443 1HZ LYS 60 3HZ LYS 60 32.281 -0.049 -10.458 444 2HZ LYS 60 2HZ LYS 60 31.252 0.863 -11.457 445 3HZ LYS 60 1HZ LYS 60 32.174 1.631 -10.253 446 H LYS 61 HN LYS 61 31.365 -3.125 -6.853 447 HA LYS 61 HA LYS 61 34.042 -2.644 -7.636 448 1HB LYS 61 2HB LYS 61 32.754 -3.107 -4.928 449 2HB LYS 61 1HB LYS 61 34.371 -2.434 -5.144 450 1HG LYS 61 2HG LYS 61 33.354 -0.627 -6.567 451 2HG LYS 61 1HG LYS 61 31.762 -1.254 -6.141 452 1HD LYS 61 2HD LYS 61 32.355 -0.938 -3.720 453 2HD LYS 61 1HD LYS 61 33.850 -0.157 -4.235 454 1HE LYS 61 2HE LYS 61 32.710 1.696 -5.149 455 2HE LYS 61 1HE LYS 61 31.179 0.807 -5.271 456 1HZ LYS 61 3HZ LYS 61 31.383 0.564 -2.758 457 2HZ LYS 61 2HZ LYS 61 32.553 1.793 -2.835 458 3HZ LYS 61 1HZ LYS 61 30.960 2.099 -3.340 459 H LYS 62 HN LYS 62 32.595 -5.471 -6.034 460 HA LYS 62 HA LYS 62 35.196 -6.811 -5.723 461 1HB LYS 62 2HB LYS 62 33.083 -6.911 -4.228 462 2HB LYS 62 1HB LYS 62 32.435 -8.008 -5.447 463 1HG LYS 62 2HG LYS 62 34.423 -9.467 -5.168 464 2HG LYS 62 1HG LYS 62 35.026 -8.385 -3.913 465 1HD LYS 62 2HD LYS 62 32.973 -8.800 -2.587 466 2HD LYS 62 1HD LYS 62 32.404 -9.911 -3.833 467 1HE LYS 62 2HE LYS 62 35.128 -10.341 -2.626 468 2HE LYS 62 1HE LYS 62 33.685 -10.883 -1.748 469 1HZ LYS 62 3HZ LYS 62 32.992 -11.774 -4.063 470 2HZ LYS 62 2HZ LYS 62 34.651 -11.688 -4.418 471 3HZ LYS 62 1HZ LYS 62 34.103 -12.667 -3.142 472 H GLU 63 HN GLU 63 36.024 -8.341 -7.135 473 HA GLU 63 HA GLU 63 35.031 -8.546 -9.819 474 1HB GLU 63 2HB GLU 63 37.384 -8.852 -9.036 475 2HB GLU 63 1HB GLU 63 36.902 -10.364 -8.267 476 1HG GLU 63 2HG GLU 63 36.114 -11.176 -10.514 477 2HG GLU 63 1HG GLU 63 36.797 -9.714 -11.227 478 H GLY 64 HN GLY 64 34.144 -10.175 -6.909 479 1HA GLY 64 1HA GLY 64 31.894 -11.476 -7.847 480 2HA GLY 64 2HA GLY 64 32.855 -12.115 -6.513 481 H GLU 65 HN GLU 65 31.533 -13.108 -9.275 482 HA GLU 65 HA GLU 65 33.000 -15.505 -9.540 483 1HB GLU 65 2HB GLU 65 31.349 -13.911 -11.527 484 2HB GLU 65 1HB GLU 65 31.824 -15.594 -11.762 485 1HG GLU 65 2HG GLU 65 30.636 -16.238 -9.714 486 2HG GLU 65 1HG GLU 65 30.206 -14.554 -9.415 487 H SER 66 HN SER 66 34.462 -16.167 -11.311 488 HA SER 66 HA SER 66 36.549 -14.191 -11.820 489 1HB SER 66 2HB SER 66 36.086 -17.032 -12.787 490 2HB SER 66 1HB SER 66 37.600 -16.144 -12.952 491 HG SER 66 HG SER 66 37.787 -17.308 -11.106 492 H ARG 67 HN ARG 67 37.363 -13.855 -14.112 493 HA ARG 67 HA ARG 67 35.317 -12.782 -15.806 494 1HB ARG 67 2HB ARG 67 38.189 -13.598 -16.363 495 2HB ARG 67 1HB ARG 67 37.227 -12.518 -17.373 496 1HG ARG 67 2HG ARG 67 37.831 -12.015 -14.445 497 2HG ARG 67 1HG ARG 67 38.744 -11.308 -15.778 498 1HD ARG 67 2HD ARG 67 35.741 -10.981 -15.432 499 2HD ARG 67 1HD ARG 67 36.939 -9.780 -14.912 500 HE ARG 67 HE ARG 67 36.504 -10.639 -17.746 501 1HH1 ARG 67 1HH1 ARG 67 39.245 -9.573 -16.640 502 2HH1 ARG 67 2HH1 ARG 67 39.163 -7.937 -17.205 503 1HH2 ARG 67 1HH2 ARG 67 35.775 -8.078 -17.930 504 2HH2 ARG 67 2HH2 ARG 67 37.198 -7.091 -17.935 505 H ASN 68 HN ASN 68 37.016 -15.898 -15.790 506 HA ASN 68 HA ASN 68 35.795 -16.764 -18.320 507 1HB ASN 68 2HB ASN 68 37.116 -18.751 -17.922 508 2HB ASN 68 1HB ASN 68 38.097 -17.365 -17.446 509 1HD2 ASN 68 1HD2 ASN 68 38.536 -19.997 -16.349 510 2HD2 ASN 68 2HD2 ASN 68 38.154 -19.947 -14.696 No H/Q in entry = 510 Start of MODEL 5 1 H1 GLU 1 1H GLU 1 12.914 5.884 9.653 2 H2 GLU 1 3H GLU 1 13.696 5.175 10.981 3 H3 GLU 1 2H GLU 1 12.108 4.717 10.590 4 HA GLU 1 HA GLU 1 11.178 6.535 11.553 5 1HB GLU 1 2HB GLU 1 13.935 6.308 12.805 6 2HB GLU 1 1HB GLU 1 12.536 7.056 13.575 7 1HG GLU 1 2HG GLU 1 11.311 4.902 13.395 8 2HG GLU 1 1HG GLU 1 12.746 4.163 12.682 9 H SER 2 HN SER 2 14.248 7.176 10.021 10 HA SER 2 HA SER 2 13.653 10.118 10.098 11 1HB SER 2 2HB SER 2 16.095 10.393 9.937 12 2HB SER 2 1HB SER 2 15.693 9.355 11.306 13 HG SER 2 HG SER 2 16.995 8.002 10.385 14 H GLY 3 HN GLY 3 13.961 11.272 8.106 15 1HA GLY 3 1HA GLY 3 14.969 10.138 5.697 16 2HA GLY 3 2HA GLY 3 13.896 11.535 5.775 17 H LYS 4 HN LYS 4 14.091 8.601 4.400 18 HA LYS 4 HA LYS 4 11.305 8.460 3.706 19 1HB LYS 4 2HB LYS 4 13.375 7.638 2.452 20 2HB LYS 4 1HB LYS 4 13.381 6.259 3.552 21 1HG LYS 4 2HG LYS 4 12.173 5.634 1.536 22 2HG LYS 4 1HG LYS 4 11.017 5.775 2.860 23 1HD LYS 4 2HD LYS 4 10.395 8.024 2.116 24 2HD LYS 4 1HD LYS 4 11.605 7.956 0.834 25 1HE LYS 4 2HE LYS 4 9.505 7.382 -0.200 26 2HE LYS 4 1HE LYS 4 10.373 5.849 0.004 27 1HZ LYS 4 2HZ LYS 4 9.262 5.643 2.201 28 2HZ LYS 4 1HZ LYS 4 8.321 7.007 1.823 29 3HZ LYS 4 3HZ LYS 4 8.174 5.593 0.896 30 H ALA 5 HN ALA 5 9.657 7.601 4.907 31 HA ALA 5 HA ALA 5 9.972 6.458 7.492 32 1HB ALA 5 2HB ALA 5 7.764 6.323 5.416 33 2HB ALA 5 1HB ALA 5 7.563 5.794 7.087 34 3HB ALA 5 3HB ALA 5 7.913 7.486 6.734 35 H THR 6 HN THR 6 10.116 5.013 4.308 36 HA THR 6 HA THR 6 10.540 2.340 5.597 37 HB THR 6 HB THR 6 9.084 2.889 2.992 38 HG1 THR 6 1HG THR 6 7.649 3.588 4.391 39 1HG2 THR 6 2HG2 THR 6 9.939 0.493 4.473 40 2HG2 THR 6 1HG2 THR 6 8.246 0.469 3.981 41 3HG2 THR 6 3HG2 THR 6 9.513 0.673 2.771 42 H SER 7 HN SER 7 11.727 0.837 4.034 43 HA SER 7 HA SER 7 13.422 2.282 2.050 44 1HB SER 7 2HB SER 7 14.627 2.366 4.159 45 2HB SER 7 1HB SER 7 14.350 0.646 4.432 46 HG SER 7 HG SER 7 15.512 0.353 2.381 47 H TYR 8 HN TYR 8 13.409 1.070 0.199 48 HA TYR 8 HA TYR 8 12.167 -1.347 -0.280 49 1HB TYR 8 2HB TYR 8 14.801 -0.374 -1.438 50 2HB TYR 8 1HB TYR 8 13.691 -1.503 -2.215 51 HD1 TYR 8 HD1 TYR 8 11.065 -0.388 -1.667 52 HD2 TYR 8 HD2 TYR 8 14.724 1.633 -2.657 53 HE1 TYR 8 HE1 TYR 8 9.764 1.517 -2.579 54 HE2 TYR 8 HE2 TYR 8 13.424 3.539 -3.569 55 HH TYR 8 HH TYR 8 10.059 3.888 -3.039 56 H ALA 9 HN ALA 9 15.635 -1.000 0.583 57 HA ALA 9 HA ALA 9 16.404 -3.678 0.671 58 1HB ALA 9 3HB ALA 9 17.517 -1.310 1.288 59 2HB ALA 9 2HB ALA 9 17.209 -1.891 2.924 60 3HB ALA 9 1HB ALA 9 18.219 -2.834 1.828 61 H GLU 10 HN GLU 10 14.248 -1.970 2.837 62 HA GLU 10 HA GLU 10 14.211 -4.275 4.735 63 1HB GLU 10 2HB GLU 10 13.042 -1.472 4.824 64 2HB GLU 10 1HB GLU 10 12.952 -2.640 6.142 65 1HG GLU 10 2HG GLU 10 15.513 -2.754 6.004 66 2HG GLU 10 1HG GLU 10 15.414 -1.315 4.989 67 H LEU 11 HN LEU 11 12.178 -2.406 2.518 68 HA LEU 11 HA LEU 11 9.726 -3.856 3.145 69 1HB LEU 11 2HB LEU 11 10.129 -1.468 2.183 70 2HB LEU 11 1HB LEU 11 10.326 -2.291 0.637 71 HG LEU 11 HG LEU 11 8.037 -3.462 1.586 72 1HD1 LEU 11 1HD1 LEU 11 8.425 -1.258 3.261 73 2HD1 LEU 11 3HD1 LEU 11 7.245 -0.701 2.075 74 3HD1 LEU 11 2HD1 LEU 11 6.917 -2.143 3.036 75 1HD2 LEU 11 1HD2 LEU 11 8.344 -0.940 -0.072 76 2HD2 LEU 11 3HD2 LEU 11 8.343 -2.598 -0.673 77 3HD2 LEU 11 2HD2 LEU 11 6.871 -1.906 0.008 78 H CYS 12 HN CYS 12 11.911 -3.772 0.325 79 HA CYS 12 HA CYS 12 10.691 -6.031 -1.003 80 1HB CYS 12 2HB CYS 12 13.219 -4.414 -1.216 81 2HB CYS 12 1HB CYS 12 13.045 -5.880 -2.182 82 H ASN 13 HN ASN 13 12.945 -5.712 1.598 83 HA ASN 13 HA ASN 13 14.641 -7.885 1.517 84 1HB ASN 13 2HB ASN 13 14.211 -6.190 3.364 85 2HB ASN 13 1HB ASN 13 12.854 -7.193 3.868 86 1HD2 ASN 13 1HD2 ASN 13 14.902 -6.884 5.718 87 2HD2 ASN 13 2HD2 ASN 13 15.813 -8.312 5.837 88 H GLU 14 HN GLU 14 11.254 -8.025 2.662 89 HA GLU 14 HA GLU 14 10.945 -10.722 3.194 90 1HB GLU 14 2HB GLU 14 9.213 -8.959 3.381 91 2HB GLU 14 1HB GLU 14 9.081 -8.911 1.624 92 1HG GLU 14 2HG GLU 14 8.380 -11.274 1.604 93 2HG GLU 14 1HG GLU 14 8.528 -11.336 3.361 94 H TYR 15 HN TYR 15 11.460 -9.234 0.056 95 HA TYR 15 HA TYR 15 10.810 -11.757 -1.365 96 1HB TYR 15 2HB TYR 15 11.592 -8.958 -2.231 97 2HB TYR 15 1HB TYR 15 11.243 -10.271 -3.358 98 HD1 TYR 15 HD1 TYR 15 9.009 -11.653 -2.583 99 HD2 TYR 15 HD2 TYR 15 9.809 -7.502 -1.856 100 HE1 TYR 15 HE1 TYR 15 6.586 -11.241 -2.317 101 HE2 TYR 15 HE2 TYR 15 7.379 -7.079 -1.597 102 HH TYR 15 HH TYR 15 5.110 -8.696 -2.663 103 H ARG 16 HN ARG 16 13.539 -10.134 -0.033 104 HA ARG 16 HA ARG 16 15.647 -10.797 -1.782 105 1HB ARG 16 2HB ARG 16 15.292 -10.502 1.184 106 2HB ARG 16 1HB ARG 16 16.840 -11.086 0.574 107 1HG ARG 16 2HG ARG 16 17.100 -9.112 -0.814 108 2HG ARG 16 1HG ARG 16 15.479 -8.555 -0.393 109 1HD ARG 16 2HD ARG 16 16.435 -8.747 2.090 110 2HD ARG 16 1HD ARG 16 17.981 -8.520 1.253 111 HE ARG 16 HE ARG 16 15.738 -6.685 0.572 112 1HH1 ARG 16 1HH1 ARG 16 17.366 -6.521 3.295 113 2HH1 ARG 16 2HH1 ARG 16 18.415 -5.201 2.900 114 1HH2 ARG 16 1HH2 ARG 16 17.706 -5.309 -0.494 115 2HH2 ARG 16 2HH2 ARG 16 18.606 -4.513 0.753 116 H LYS 17 HN LYS 17 13.687 -12.848 0.261 117 HA LYS 17 HA LYS 17 15.488 -15.155 0.165 118 1HB LYS 17 2HB LYS 17 12.531 -15.215 0.758 119 2HB LYS 17 1HB LYS 17 13.818 -16.170 1.491 120 1HG LYS 17 2HG LYS 17 14.701 -13.821 2.297 121 2HG LYS 17 1HG LYS 17 13.031 -13.323 2.025 122 1HD LYS 17 2HD LYS 17 13.089 -15.853 3.417 123 2HD LYS 17 1HD LYS 17 14.063 -14.667 4.285 124 1HE LYS 17 2HE LYS 17 11.490 -13.614 3.276 125 2HE LYS 17 1HE LYS 17 11.339 -14.863 4.527 126 1HZ LYS 17 3HZ LYS 17 13.301 -13.539 5.590 127 2HZ LYS 17 2HZ LYS 17 12.707 -12.257 4.645 128 3HZ LYS 17 1HZ LYS 17 11.708 -12.997 5.803 129 H LEU 18 HN LEU 18 12.871 -13.852 -1.763 130 HA LEU 18 HA LEU 18 12.498 -16.353 -3.286 131 1HB LEU 18 2HB LEU 18 11.415 -13.661 -4.062 132 2HB LEU 18 1HB LEU 18 10.648 -15.237 -4.197 133 HG LEU 18 HG LEU 18 11.042 -13.574 -1.700 134 1HD1 LEU 18 3HD1 LEU 18 9.050 -13.345 -3.381 135 2HD1 LEU 18 2HD1 LEU 18 8.505 -14.864 -2.669 136 3HD1 LEU 18 1HD1 LEU 18 8.706 -13.436 -1.654 137 1HD2 LEU 18 3HD2 LEU 18 10.945 -16.463 -1.994 138 2HD2 LEU 18 2HD2 LEU 18 11.224 -15.498 -0.543 139 3HD2 LEU 18 1HD2 LEU 18 9.576 -15.867 -1.054 140 H VAL 19 HN VAL 19 13.896 -13.110 -3.743 141 HA VAL 19 HA VAL 19 14.839 -13.837 -6.461 142 HB VAL 19 HB VAL 19 13.843 -11.659 -6.155 143 1HG1 VAL 19 1HG1 VAL 19 15.376 -11.759 -3.661 144 2HG1 VAL 19 3HG1 VAL 19 15.498 -10.205 -4.487 145 3HG1 VAL 19 2HG1 VAL 19 13.916 -10.849 -4.045 146 1HG2 VAL 19 1HG2 VAL 19 16.729 -11.906 -6.718 147 2HG2 VAL 19 3HG2 VAL 19 15.457 -11.134 -7.667 148 3HG2 VAL 19 2HG2 VAL 19 16.196 -10.272 -6.316 149 H ARG 20 HN ARG 20 16.714 -15.038 -6.446 150 HA ARG 20 HA ARG 20 18.709 -14.700 -4.300 151 1HB ARG 20 2HB ARG 20 18.228 -16.523 -6.642 152 2HB ARG 20 1HB ARG 20 19.811 -16.507 -5.864 153 1HG ARG 20 2HG ARG 20 18.875 -18.033 -4.454 154 2HG ARG 20 1HG ARG 20 18.154 -16.616 -3.689 155 1HD ARG 20 2HD ARG 20 16.109 -16.884 -4.959 156 2HD ARG 20 1HD ARG 20 16.839 -18.157 -5.955 157 HE ARG 20 HE ARG 20 16.171 -18.413 -3.054 158 1HH1 ARG 20 1HH1 ARG 20 18.169 -19.736 -5.421 159 2HH1 ARG 20 2HH1 ARG 20 17.635 -21.369 -5.201 160 1HH2 ARG 20 1HH2 ARG 20 15.070 -20.519 -3.029 161 2HH2 ARG 20 2HH2 ARG 20 15.881 -21.813 -3.847 162 H ASN 21 HN ASN 21 19.438 -15.149 -7.728 163 HA ASN 21 HA ASN 21 21.149 -12.685 -7.611 164 1HB ASN 21 2HB ASN 21 21.501 -15.303 -9.110 165 2HB ASN 21 1HB ASN 21 22.624 -13.944 -9.162 166 1HD2 ASN 21 1HD2 ASN 21 21.890 -16.828 -7.495 167 2HD2 ASN 21 2HD2 ASN 21 22.852 -16.562 -6.122 168 H GLY 22 HN GLY 22 18.373 -12.646 -8.456 169 1HA GLY 22 1HA GLY 22 18.730 -12.131 -11.383 170 2HA GLY 22 2HA GLY 22 17.768 -11.084 -10.342 171 H LYS 23 HN LYS 23 16.885 -13.707 -8.933 172 HA LYS 23 HA LYS 23 14.718 -14.335 -10.906 173 1HB LYS 23 2HB LYS 23 16.365 -16.113 -10.990 174 2HB LYS 23 1HB LYS 23 16.414 -16.211 -9.230 175 1HG LYS 23 2HG LYS 23 15.002 -18.003 -9.887 176 2HG LYS 23 1HG LYS 23 13.893 -16.733 -9.369 177 1HD LYS 23 2HD LYS 23 13.288 -16.187 -11.569 178 2HD LYS 23 1HD LYS 23 14.745 -16.909 -12.250 179 1HE LYS 23 2HE LYS 23 13.618 -19.096 -11.057 180 2HE LYS 23 1HE LYS 23 12.171 -18.190 -11.536 181 1HZ LYS 23 2HZ LYS 23 13.128 -17.919 -13.747 182 2HZ LYS 23 1HZ LYS 23 14.498 -18.811 -13.287 183 3HZ LYS 23 3HZ LYS 23 12.983 -19.567 -13.365 184 H LEU 24 HN LEU 24 13.434 -12.829 -9.536 185 HA LEU 24 HA LEU 24 13.005 -13.454 -6.717 186 1HB LEU 24 2HB LEU 24 12.872 -11.176 -7.651 187 2HB LEU 24 1HB LEU 24 11.554 -11.678 -8.708 188 HG LEU 24 HG LEU 24 10.187 -12.234 -6.705 189 1HD1 LEU 24 3HD1 LEU 24 12.318 -12.573 -5.275 190 2HD1 LEU 24 2HD1 LEU 24 12.289 -10.823 -5.067 191 3HD1 LEU 24 1HD1 LEU 24 10.933 -11.801 -4.507 192 1HD2 LEU 24 3HD2 LEU 24 11.335 -9.447 -6.939 193 2HD2 LEU 24 2HD2 LEU 24 9.820 -10.054 -7.607 194 3HD2 LEU 24 1HD2 LEU 24 9.988 -9.826 -5.866 195 H ALA 25 HN ALA 25 11.450 -14.818 -5.898 196 HA ALA 25 HA ALA 25 9.589 -16.119 -7.842 197 1HB ALA 25 2HB ALA 25 11.236 -17.480 -6.546 198 2HB ALA 25 1HB ALA 25 10.478 -16.925 -5.054 199 3HB ALA 25 3HB ALA 25 9.569 -17.925 -6.186 200 H CYS 26 HN CYS 26 7.616 -15.099 -7.818 201 HA CYS 26 HA CYS 26 6.261 -14.730 -5.197 202 1HB CYS 26 2HB CYS 26 7.472 -12.666 -6.735 203 2HB CYS 26 1HB CYS 26 5.726 -12.477 -6.903 204 H THR 27 HN THR 27 3.962 -13.525 -6.099 205 HA THR 27 HA THR 27 2.837 -15.634 -7.880 206 HB THR 27 HB THR 27 0.683 -14.712 -6.929 207 HG1 THR 27 1HG THR 27 1.005 -13.313 -5.111 208 1HG2 THR 27 1HG2 THR 27 2.920 -15.867 -5.321 209 2HG2 THR 27 3HG2 THR 27 1.454 -15.373 -4.471 210 3HG2 THR 27 2HG2 THR 27 1.365 -16.579 -5.754 211 H ARG 28 HN ARG 28 0.634 -14.373 -8.878 212 HA ARG 28 HA ARG 28 1.817 -12.573 -10.908 213 1HB ARG 28 2HB ARG 28 0.394 -14.522 -11.487 214 2HB ARG 28 1HB ARG 28 -0.941 -13.800 -10.588 215 1HG ARG 28 2HG ARG 28 -0.682 -11.761 -12.104 216 2HG ARG 28 1HG ARG 28 0.384 -12.753 -13.099 217 1HD ARG 28 2HD ARG 28 -2.519 -13.358 -12.422 218 2HD ARG 28 1HD ARG 28 -1.875 -12.907 -14.013 219 HE ARG 28 HE ARG 28 -0.329 -15.049 -13.477 220 1HH1 ARG 28 1HH1 ARG 28 -2.520 -15.651 -11.357 221 2HH1 ARG 28 2HH1 ARG 28 -3.462 -16.821 -12.218 222 1HH2 ARG 28 1HH2 ARG 28 -2.047 -16.084 -15.297 223 2HH2 ARG 28 2HH2 ARG 28 -3.195 -17.067 -14.449 224 H GLU 29 HN GLU 29 0.168 -12.230 -7.946 225 HA GLU 29 HA GLU 29 -0.321 -9.361 -8.520 226 1HB GLU 29 2HB GLU 29 -2.335 -10.761 -9.192 227 2HB GLU 29 1HB GLU 29 -2.507 -11.189 -7.489 228 1HG GLU 29 2HG GLU 29 -2.633 -8.752 -6.938 229 2HG GLU 29 1HG GLU 29 -2.589 -8.393 -8.664 230 H ASN 30 HN ASN 30 0.315 -8.219 -6.738 231 HA ASN 30 HA ASN 30 -0.183 -9.267 -4.018 232 1HB ASN 30 2HB ASN 30 2.598 -8.710 -5.107 233 2HB ASN 30 1HB ASN 30 2.219 -9.178 -3.449 234 1HD2 ASN 30 1HD2 ASN 30 3.285 -10.460 -6.333 235 2HD2 ASN 30 2HD2 ASN 30 2.755 -12.060 -6.140 236 H ASP 31 HN ASP 31 -1.448 -7.084 -4.830 237 HA ASP 31 HA ASP 31 -1.788 -4.815 -4.249 238 1HB ASP 31 2HB ASP 31 -0.165 -5.977 -2.308 239 2HB ASP 31 1HB ASP 31 0.722 -4.525 -2.772 240 HA PRO 32 HA PRO 32 1.106 -3.723 -7.667 241 1HB PRO 32 2HB PRO 32 -0.958 -1.919 -8.540 242 2HB PRO 32 1HB PRO 32 -0.426 -3.419 -9.308 243 1HG PRO 32 2HG PRO 32 -2.887 -2.931 -7.918 244 2HG PRO 32 1HG PRO 32 -2.343 -4.439 -8.659 245 1HD PRO 32 2HD PRO 32 -2.542 -3.805 -5.841 246 2HD PRO 32 1HD PRO 32 -2.040 -5.340 -6.587 247 H ILE 33 HN ILE 33 2.359 -1.834 -7.804 248 HA ILE 33 HA ILE 33 1.510 0.616 -6.371 249 HB ILE 33 HB ILE 33 3.249 0.542 -4.767 250 1HG1 ILE 33 2HG1 ILE 33 5.114 -0.009 -6.199 251 2HG1 ILE 33 1HG1 ILE 33 5.076 -1.190 -4.889 252 1HG2 ILE 33 1HG2 ILE 33 1.455 -1.122 -4.319 253 2HG2 ILE 33 3HG2 ILE 33 2.418 -2.350 -5.142 254 3HG2 ILE 33 2HG2 ILE 33 3.009 -1.621 -3.649 255 1HD1 ILE 33 3HD1 ILE 33 3.575 -2.563 -6.562 256 2HD1 ILE 33 2HD1 ILE 33 4.342 -1.540 -7.778 257 3HD1 ILE 33 1HD1 ILE 33 5.329 -2.575 -6.746 258 H GLN 34 HN GLN 34 3.890 1.980 -6.389 259 HA GLN 34 HA GLN 34 4.660 1.961 -9.291 260 1HB GLN 34 2HB GLN 34 3.264 3.870 -8.488 261 2HB GLN 34 1HB GLN 34 4.522 4.261 -7.316 262 1HG GLN 34 2HG GLN 34 6.140 4.544 -9.185 263 2HG GLN 34 1HG GLN 34 4.839 4.226 -10.334 264 1HE2 GLN 34 1HE2 GLN 34 4.061 6.157 -11.185 265 2HE2 GLN 34 2HE2 GLN 34 3.894 7.609 -10.324 266 H GLY 35 HN GLY 35 6.835 1.761 -9.710 267 1HA GLY 35 1HA GLY 35 9.129 1.481 -9.302 268 2HA GLY 35 2HA GLY 35 8.698 1.141 -7.626 269 HA PRO 36 HA PRO 36 10.217 4.987 -6.208 270 1HB PRO 36 2HB PRO 36 12.995 4.437 -6.716 271 2HB PRO 36 1HB PRO 36 12.123 4.306 -5.187 272 1HG PRO 36 2HG PRO 36 13.096 2.177 -6.855 273 2HG PRO 36 1HG PRO 36 12.233 2.046 -5.321 274 1HD PRO 36 2HD PRO 36 11.245 1.439 -7.962 275 2HD PRO 36 1HD PRO 36 10.370 1.323 -6.417 276 H ASP 37 HN ASP 37 11.086 3.855 -9.377 277 HA ASP 37 HA ASP 37 12.319 6.360 -10.267 278 1HB ASP 37 2HB ASP 37 11.294 3.894 -11.711 279 2HB ASP 37 1HB ASP 37 12.265 5.163 -12.456 280 H GLY 38 HN GLY 38 9.154 5.425 -9.645 281 1HA GLY 38 1HA GLY 38 8.141 7.630 -11.364 282 2HA GLY 38 2HA GLY 38 7.316 6.978 -9.950 283 H LYS 39 HN LYS 39 8.718 4.677 -12.102 284 HA LYS 39 HA LYS 39 6.353 4.361 -13.803 285 1HB LYS 39 2HB LYS 39 8.702 3.943 -14.517 286 2HB LYS 39 1HB LYS 39 8.798 2.616 -13.359 287 1HG LYS 39 2HG LYS 39 6.822 1.565 -14.527 288 2HG LYS 39 1HG LYS 39 6.960 2.817 -15.761 289 1HD LYS 39 2HD LYS 39 9.384 2.094 -16.052 290 2HD LYS 39 1HD LYS 39 9.004 0.704 -15.036 291 1HE LYS 39 2HE LYS 39 7.344 1.364 -17.482 292 2HE LYS 39 1HE LYS 39 8.793 0.344 -17.581 293 1HZ LYS 39 2HZ LYS 39 6.961 -0.212 -15.386 294 2HZ LYS 39 1HZ LYS 39 6.392 -0.611 -16.936 295 3HZ LYS 39 3HZ LYS 39 7.837 -1.290 -16.364 296 H VAL 40 HN VAL 40 5.007 2.428 -13.791 297 HA VAL 40 HA VAL 40 4.590 1.342 -11.058 298 HB VAL 40 HB VAL 40 2.990 1.085 -13.626 299 1HG1 VAL 40 1HG1 VAL 40 2.314 0.554 -10.717 300 2HG1 VAL 40 3HG1 VAL 40 1.136 0.555 -12.030 301 3HG1 VAL 40 2HG1 VAL 40 2.428 -0.646 -12.004 302 1HG2 VAL 40 3HG2 VAL 40 3.287 3.439 -12.860 303 2HG2 VAL 40 2HG2 VAL 40 1.614 2.898 -12.729 304 3HG2 VAL 40 1HG2 VAL 40 2.629 2.985 -11.289 305 H HIS 41 HN HIS 41 4.110 -1.046 -10.901 306 HA HIS 41 HA HIS 41 5.614 -2.656 -12.934 307 1HB HIS 41 2HB HIS 41 5.737 -2.820 -9.905 308 2HB HIS 41 1HB HIS 41 6.590 -3.893 -11.015 309 HD1 HIS 41 HD1 HIS 41 8.602 -2.903 -12.334 310 HD2 HIS 41 HD2 HIS 41 6.829 -0.196 -9.705 311 HE1 HIS 41 HE1 HIS 41 10.187 -0.936 -12.156 312 H GLY 42 HN GLY 42 5.193 -5.156 -12.081 313 1HA GLY 42 1HA GLY 42 3.551 -6.841 -12.151 314 2HA GLY 42 2HA GLY 42 2.368 -5.587 -12.527 315 H ASN 43 HN ASN 43 4.428 -6.462 -9.723 316 HA ASN 43 HA ASN 43 2.148 -5.764 -7.928 317 1HB ASN 43 2HB ASN 43 2.412 -7.947 -6.805 318 2HB ASN 43 1HB ASN 43 2.018 -8.166 -8.509 319 1HD2 ASN 43 1HD2 ASN 43 3.101 -10.301 -8.477 320 2HD2 ASN 43 2HD2 ASN 43 4.795 -10.405 -8.476 321 H THR 44 HN THR 44 3.265 -6.655 -5.571 322 HA THR 44 HA THR 44 5.170 -4.602 -4.943 323 HB THR 44 HB THR 44 4.325 -7.148 -3.527 324 HG1 THR 44 1HG THR 44 2.826 -5.872 -2.606 325 1HG2 THR 44 3HG2 THR 44 6.553 -5.957 -2.847 326 2HG2 THR 44 2HG2 THR 44 5.481 -4.730 -2.172 327 3HG2 THR 44 1HG2 THR 44 5.393 -6.393 -1.592 328 H CYS 45 HN CYS 45 5.526 -7.997 -5.850 329 HA CYS 45 HA CYS 45 8.347 -8.152 -5.122 330 1HB CYS 45 2HB CYS 45 6.922 -9.902 -7.126 331 2HB CYS 45 1HB CYS 45 8.200 -10.342 -5.999 332 H SER 46 HN SER 46 6.644 -8.048 -8.289 333 HA SER 46 HA SER 46 8.797 -7.858 -10.034 334 1HB SER 46 2HB SER 46 6.247 -6.203 -10.021 335 2HB SER 46 1HB SER 46 7.244 -6.534 -11.438 336 HG SER 46 HG SER 46 5.458 -8.153 -10.105 337 H MET 47 HN MET 47 7.331 -5.204 -8.146 338 HA MET 47 HA MET 47 9.076 -3.114 -9.042 339 1HB MET 47 2HB MET 47 6.850 -3.309 -7.533 340 2HB MET 47 1HB MET 47 8.044 -3.181 -6.242 341 1HG MET 47 2HG MET 47 8.791 -1.246 -8.145 342 2HG MET 47 1HG MET 47 7.038 -1.112 -8.004 343 1HE MET 47 1HE MET 47 10.449 -1.141 -6.235 344 2HE MET 47 3HE MET 47 10.044 -0.947 -4.523 345 3HE MET 47 2HE MET 47 9.602 -2.424 -5.375 346 H CYS 48 HN CYS 48 9.345 -5.606 -6.583 347 HA CYS 48 HA CYS 48 11.742 -4.532 -5.314 348 1HB CYS 48 2HB CYS 48 10.100 -7.056 -5.261 349 2HB CYS 48 1HB CYS 48 11.659 -7.020 -4.442 350 H GLU 49 HN GLU 49 11.033 -6.652 -8.021 351 HA GLU 49 HA GLU 49 13.565 -7.981 -8.237 352 1HB GLU 49 2HB GLU 49 11.457 -7.163 -10.264 353 2HB GLU 49 1HB GLU 49 12.781 -8.273 -10.617 354 1HG GLU 49 2HG GLU 49 11.981 -9.689 -8.677 355 2HG GLU 49 1HG GLU 49 10.559 -8.648 -8.594 356 H VAL 50 HN VAL 50 12.382 -4.850 -9.433 357 HA VAL 50 HA VAL 50 14.608 -4.187 -11.114 358 HB VAL 50 HB VAL 50 12.766 -2.459 -9.427 359 1HG1 VAL 50 3HG1 VAL 50 14.481 -1.845 -11.850 360 2HG1 VAL 50 2HG1 VAL 50 13.251 -0.756 -11.207 361 3HG1 VAL 50 1HG1 VAL 50 14.662 -1.173 -10.229 362 1HG2 VAL 50 2HG2 VAL 50 11.811 -4.186 -11.118 363 2HG2 VAL 50 1HG2 VAL 50 11.231 -2.523 -11.198 364 3HG2 VAL 50 3HG2 VAL 50 12.440 -3.091 -12.350 365 H PHE 51 HN PHE 51 13.845 -3.211 -7.779 366 HA PHE 51 HA PHE 51 16.301 -1.921 -7.172 367 1HB PHE 51 2HB PHE 51 14.417 -1.686 -5.724 368 2HB PHE 51 1HB PHE 51 14.230 -3.434 -5.569 369 HD1 PHE 51 HD1 PHE 51 17.231 -1.212 -5.310 370 HD2 PHE 51 HD2 PHE 51 14.647 -4.024 -3.355 371 HE1 PHE 51 HE1 PHE 51 18.719 -1.192 -3.323 372 HE2 PHE 51 HE2 PHE 51 16.129 -4.002 -1.360 373 HZ PHE 51 HZ PHE 51 18.166 -2.587 -1.347 374 H PHE 52 HN PHE 52 15.289 -5.300 -6.770 375 HA PHE 52 HA PHE 52 17.665 -6.339 -5.600 376 1HB PHE 52 2HB PHE 52 15.458 -7.399 -7.366 377 2HB PHE 52 1HB PHE 52 16.784 -8.452 -6.877 378 HD1 PHE 52 HD1 PHE 52 17.329 -7.385 -4.134 379 HD2 PHE 52 HD2 PHE 52 13.627 -8.242 -6.138 380 HE1 PHE 52 HE1 PHE 52 16.225 -7.747 -1.945 381 HE2 PHE 52 HE2 PHE 52 12.525 -8.605 -3.948 382 HZ PHE 52 HZ PHE 52 13.822 -8.360 -1.852 383 H GLN 53 HN GLN 53 16.704 -5.931 -9.003 384 HA GLN 53 HA GLN 53 18.997 -7.100 -10.228 385 1HB GLN 53 2HB GLN 53 16.714 -6.272 -11.149 386 2HB GLN 53 1HB GLN 53 17.486 -4.692 -11.251 387 1HG GLN 53 2HG GLN 53 19.387 -5.970 -12.502 388 2HG GLN 53 1HG GLN 53 18.171 -7.228 -12.728 389 1HE2 GLN 53 1HE2 GLN 53 15.993 -6.357 -13.670 390 2HE2 GLN 53 2HE2 GLN 53 16.107 -5.143 -14.851 391 H ALA 54 HN ALA 54 18.315 -3.730 -9.278 392 HA ALA 54 HA ALA 54 20.710 -2.520 -10.181 393 1HB ALA 54 2HB ALA 54 18.843 -2.011 -7.852 394 2HB ALA 54 3HB ALA 54 18.851 -1.211 -9.423 395 3HB ALA 54 1HB ALA 54 20.150 -0.905 -8.272 396 H GLU 55 HN GLU 55 20.015 -4.209 -7.106 397 HA GLU 55 HA GLU 55 22.349 -3.645 -5.663 398 1HB GLU 55 2HB GLU 55 20.779 -6.225 -5.970 399 2HB GLU 55 1HB GLU 55 21.929 -5.917 -4.670 400 1HG GLU 55 2HG GLU 55 20.603 -3.973 -3.943 401 2HG GLU 55 1HG GLU 55 19.461 -4.254 -5.256 402 H GLU 56 HN GLU 56 21.881 -6.000 -8.273 403 HA GLU 56 HA GLU 56 24.569 -7.100 -8.103 404 1HB GLU 56 2HB GLU 56 22.342 -7.134 -10.159 405 2HB GLU 56 1HB GLU 56 23.845 -8.033 -10.367 406 1HG GLU 56 2HG GLU 56 21.907 -8.329 -8.050 407 2HG GLU 56 1HG GLU 56 22.106 -9.472 -9.377 408 H GLU 57 HN GLU 57 23.111 -4.324 -9.617 409 HA GLU 57 HA GLU 57 25.224 -3.917 -11.602 410 1HB GLU 57 2HB GLU 57 23.040 -3.112 -12.112 411 2HB GLU 57 1HB GLU 57 22.870 -2.346 -10.533 412 1HG GLU 57 2HG GLU 57 23.335 -0.600 -12.134 413 2HG GLU 57 1HG GLU 57 24.793 -0.827 -11.166 414 H GLU 58 HN GLU 58 24.511 -2.817 -8.317 415 HA GLU 58 HA GLU 58 26.302 -0.608 -8.166 416 1HB GLU 58 2HB GLU 58 24.563 -1.223 -6.510 417 2HB GLU 58 1HB GLU 58 25.498 -2.653 -6.069 418 1HG GLU 58 2HG GLU 58 27.401 -1.153 -5.439 419 2HG GLU 58 1HG GLU 58 26.364 0.238 -5.762 420 H LYS 59 HN LYS 59 26.857 -4.094 -7.793 421 HA LYS 59 HA LYS 59 29.624 -3.795 -6.915 422 1HB LYS 59 2HB LYS 59 27.995 -6.114 -8.005 423 2HB LYS 59 1HB LYS 59 29.595 -6.274 -7.277 424 1HG LYS 59 2HG LYS 59 28.742 -5.313 -5.174 425 2HG LYS 59 1HG LYS 59 27.145 -5.129 -5.901 426 1HD LYS 59 2HD LYS 59 27.032 -7.578 -6.250 427 2HD LYS 59 1HD LYS 59 28.615 -7.752 -5.493 428 1HE LYS 59 2HE LYS 59 27.405 -6.368 -3.536 429 2HE LYS 59 1HE LYS 59 25.972 -7.146 -4.237 430 1HZ LYS 59 2HZ LYS 59 28.377 -8.780 -3.942 431 2HZ LYS 59 1HZ LYS 59 27.551 -8.386 -2.510 432 3HZ LYS 59 3HZ LYS 59 26.745 -9.213 -3.753 433 H LYS 60 HN LYS 60 28.087 -3.431 -9.910 434 HA LYS 60 HA LYS 60 29.660 -4.634 -11.852 435 1HB LYS 60 2HB LYS 60 28.985 -2.780 -13.245 436 2HB LYS 60 1HB LYS 60 27.690 -3.048 -12.078 437 1HG LYS 60 2HG LYS 60 28.726 -1.274 -10.627 438 2HG LYS 60 1HG LYS 60 29.863 -0.939 -11.932 439 1HD LYS 60 2HD LYS 60 27.801 -0.623 -13.431 440 2HD LYS 60 1HD LYS 60 26.860 -0.591 -11.940 441 1HE LYS 60 2HE LYS 60 27.333 1.693 -12.260 442 2HE LYS 60 1HE LYS 60 28.671 1.203 -11.203 443 1HZ LYS 60 3HZ LYS 60 29.737 0.515 -13.469 444 2HZ LYS 60 2HZ LYS 60 28.661 1.663 -14.110 445 3HZ LYS 60 1HZ LYS 60 29.815 2.128 -12.954 446 H LYS 61 HN LYS 61 30.602 -2.094 -9.628 447 HA LYS 61 HA LYS 61 32.972 -1.235 -11.072 448 1HB LYS 61 2HB LYS 61 32.135 -1.048 -8.159 449 2HB LYS 61 1HB LYS 61 33.446 -0.125 -8.894 450 1HG LYS 61 2HG LYS 61 31.744 0.764 -10.554 451 2HG LYS 61 1HG LYS 61 30.493 0.017 -9.560 452 1HD LYS 61 2HD LYS 61 32.513 2.058 -8.579 453 2HD LYS 61 1HD LYS 61 30.831 2.407 -8.975 454 1HE LYS 61 2HE LYS 61 30.651 0.228 -7.240 455 2HE LYS 61 1HE LYS 61 31.940 1.226 -6.541 456 1HZ LYS 61 2HZ LYS 61 29.386 2.359 -7.545 457 2HZ LYS 61 1HZ LYS 61 29.595 1.884 -5.927 458 3HZ LYS 61 3HZ LYS 61 30.554 3.123 -6.575 459 H LYS 62 HN LYS 62 35.052 -2.071 -10.928 460 HA LYS 62 HA LYS 62 35.379 -4.653 -9.504 461 1HB LYS 62 2HB LYS 62 37.050 -3.086 -11.494 462 2HB LYS 62 1HB LYS 62 37.496 -4.673 -10.866 463 1HG LYS 62 2HG LYS 62 35.324 -5.570 -11.728 464 2HG LYS 62 1HG LYS 62 35.002 -3.995 -12.452 465 1HD LYS 62 2HD LYS 62 37.117 -4.195 -13.754 466 2HD LYS 62 1HD LYS 62 37.354 -5.806 -13.077 467 1HE LYS 62 2HE LYS 62 36.245 -6.395 -15.031 468 2HE LYS 62 1HE LYS 62 34.829 -6.099 -14.003 469 1HZ LYS 62 2HZ LYS 62 35.226 -3.651 -14.709 470 2HZ LYS 62 1HZ LYS 62 36.072 -4.334 -16.014 471 3HZ LYS 62 3HZ LYS 62 34.432 -4.699 -15.784 472 H GLU 63 HN GLU 63 36.968 -4.957 -7.882 473 HA GLU 63 HA GLU 63 38.154 -2.436 -6.766 474 1HB GLU 63 2HB GLU 63 37.335 -5.035 -5.423 475 2HB GLU 63 1HB GLU 63 37.960 -3.607 -4.596 476 1HG GLU 63 2HG GLU 63 35.421 -3.700 -6.258 477 2HG GLU 63 1HG GLU 63 35.486 -3.700 -4.495 478 H GLY 64 HN GLY 64 40.339 -2.570 -5.997 479 1HA GLY 64 1HA GLY 64 42.584 -3.213 -6.410 480 2HA GLY 64 2HA GLY 64 41.987 -4.541 -7.406 481 H GLU 65 HN GLU 65 43.853 -5.552 -6.019 482 HA GLU 65 HA GLU 65 42.650 -7.319 -4.077 483 1HB GLU 65 2HB GLU 65 45.519 -6.688 -4.839 484 2HB GLU 65 1HB GLU 65 45.037 -8.059 -3.841 485 1HG GLU 65 2HG GLU 65 43.607 -8.883 -5.692 486 2HG GLU 65 1HG GLU 65 44.139 -7.531 -6.691 487 H SER 66 HN SER 66 44.185 -4.204 -3.853 488 HA SER 66 HA SER 66 44.885 -4.438 -1.014 489 1HB SER 66 2HB SER 66 45.640 -2.171 -1.325 490 2HB SER 66 1HB SER 66 46.036 -3.043 -2.806 491 HG SER 66 HG SER 66 44.925 -1.546 -3.747 492 H ARG 67 HN ARG 67 43.844 -3.112 0.657 493 HA ARG 67 HA ARG 67 41.028 -3.282 0.784 494 1HB ARG 67 2HB ARG 67 41.299 -1.891 2.754 495 2HB ARG 67 1HB ARG 67 42.710 -2.942 2.639 496 1HG ARG 67 2HG ARG 67 43.900 -1.067 1.436 497 2HG ARG 67 1HG ARG 67 42.524 -0.031 1.812 498 1HD ARG 67 2HD ARG 67 42.874 -0.562 4.254 499 2HD ARG 67 1HD ARG 67 44.363 -1.411 3.797 500 HE ARG 67 HE ARG 67 43.881 1.482 3.152 501 1HH1 ARG 67 1HH1 ARG 67 45.525 -0.095 5.456 502 2HH1 ARG 67 2HH1 ARG 67 47.121 0.356 4.955 503 1HH2 ARG 67 1HH2 ARG 67 46.091 1.606 1.890 504 2HH2 ARG 67 2HH2 ARG 67 47.442 1.318 2.935 505 H ASN 68 HN ASN 68 43.094 -0.607 -0.331 506 HA ASN 68 HA ASN 68 40.926 1.287 -0.674 507 1HB ASN 68 2HB ASN 68 43.490 1.610 -0.411 508 2HB ASN 68 1HB ASN 68 43.565 1.272 -2.140 509 1HD2 ASN 68 1HD2 ASN 68 44.392 3.757 -1.703 510 2HD2 ASN 68 2HD2 ASN 68 43.190 4.923 -1.979 No H/Q in entry = 510 Start of MODEL 6 1 H1 GLU 1 3H GLU 1 10.543 -3.318 9.088 2 H2 GLU 1 2H GLU 1 9.889 -4.885 9.054 3 H3 GLU 1 1H GLU 1 11.046 -4.420 7.901 4 HA GLU 1 HA GLU 1 9.558 -3.058 6.749 5 1HB GLU 1 2HB GLU 1 9.248 -5.609 6.762 6 2HB GLU 1 1HB GLU 1 7.868 -5.327 7.823 7 1HG GLU 1 2HG GLU 1 6.868 -3.841 6.115 8 2HG GLU 1 1HG GLU 1 8.240 -4.149 5.051 9 H SER 2 HN SER 2 9.336 -1.190 8.319 10 HA SER 2 HA SER 2 7.149 -1.190 10.244 11 1HB SER 2 2HB SER 2 9.238 0.164 10.393 12 2HB SER 2 1HB SER 2 8.726 1.071 8.970 13 HG SER 2 HG SER 2 7.896 2.278 10.512 14 H GLY 3 HN GLY 3 7.312 -0.851 6.847 15 1HA GLY 3 1HA GLY 3 4.878 0.839 6.716 16 2HA GLY 3 2HA GLY 3 4.766 -0.801 6.078 17 H LYS 4 HN LYS 4 4.272 0.658 4.084 18 HA LYS 4 HA LYS 4 6.332 0.434 2.174 19 1HB LYS 4 2HB LYS 4 3.971 0.694 1.632 20 2HB LYS 4 1HB LYS 4 3.944 2.298 2.363 21 1HG LYS 4 2HG LYS 4 4.130 2.587 -0.031 22 2HG LYS 4 1HG LYS 4 5.690 3.003 0.681 23 1HD LYS 4 2HD LYS 4 6.565 0.782 0.131 24 2HD LYS 4 1HD LYS 4 4.992 0.299 -0.507 25 1HE LYS 4 2HE LYS 4 5.251 1.539 -2.443 26 2HE LYS 4 1HE LYS 4 6.225 2.783 -1.635 27 1HZ LYS 4 1HZ LYS 4 7.828 0.757 -1.282 28 2HZ LYS 4 3HZ LYS 4 7.036 0.147 -2.651 29 3HZ LYS 4 2HZ LYS 4 7.856 1.632 -2.738 30 H ALA 5 HN ALA 5 5.914 2.816 4.651 31 HA ALA 5 HA ALA 5 7.453 4.930 3.335 32 1HB ALA 5 3HB ALA 5 7.294 5.077 6.226 33 2HB ALA 5 1HB ALA 5 5.736 4.602 5.548 34 3HB ALA 5 2HB ALA 5 6.508 6.098 5.023 35 H THR 6 HN THR 6 8.251 2.011 4.922 36 HA THR 6 HA THR 6 10.715 2.821 6.215 37 HB THR 6 HB THR 6 9.358 0.778 6.708 38 HG1 THR 6 1HG THR 6 11.140 -0.073 7.385 39 1HG2 THR 6 1HG2 THR 6 9.424 0.456 3.950 40 2HG2 THR 6 3HG2 THR 6 10.521 -0.794 4.540 41 3HG2 THR 6 2HG2 THR 6 8.854 -0.740 5.114 42 H SER 7 HN SER 7 12.592 1.053 5.264 43 HA SER 7 HA SER 7 13.435 2.366 2.756 44 1HB SER 7 2HB SER 7 15.524 1.819 3.513 45 2HB SER 7 1HB SER 7 14.688 1.537 5.040 46 HG SER 7 HG SER 7 15.986 -0.210 3.544 47 H TYR 8 HN TYR 8 14.026 1.126 0.851 48 HA TYR 8 HA TYR 8 12.204 -1.034 0.220 49 1HB TYR 8 2HB TYR 8 14.651 0.129 -1.146 50 2HB TYR 8 1HB TYR 8 13.545 -1.014 -1.910 51 HD1 TYR 8 HD1 TYR 8 10.943 -0.101 -0.803 52 HD2 TYR 8 HD2 TYR 8 14.268 2.152 -2.326 53 HE1 TYR 8 HE1 TYR 8 9.414 1.762 -1.381 54 HE2 TYR 8 HE2 TYR 8 12.738 4.017 -2.905 55 HH TYR 8 HH TYR 8 10.584 4.625 -3.119 56 H ALA 9 HN ALA 9 15.737 -0.887 0.788 57 HA ALA 9 HA ALA 9 16.337 -3.624 0.347 58 1HB ALA 9 2HB ALA 9 17.939 -1.734 0.670 59 2HB ALA 9 3HB ALA 9 18.318 -3.108 1.708 60 3HB ALA 9 1HB ALA 9 17.508 -1.692 2.379 61 H GLU 10 HN GLU 10 14.695 -2.052 3.000 62 HA GLU 10 HA GLU 10 14.921 -4.454 4.738 63 1HB GLU 10 2HB GLU 10 13.755 -1.671 5.057 64 2HB GLU 10 1HB GLU 10 13.702 -2.896 6.324 65 1HG GLU 10 2HG GLU 10 16.243 -3.069 6.055 66 2HG GLU 10 1HG GLU 10 16.140 -1.594 5.094 67 H LEU 11 HN LEU 11 12.637 -2.720 2.713 68 HA LEU 11 HA LEU 11 10.285 -4.198 3.651 69 1HB LEU 11 2HB LEU 11 10.500 -1.805 2.660 70 2HB LEU 11 1HB LEU 11 10.580 -2.616 1.096 71 HG LEU 11 HG LEU 11 8.434 -3.868 1.942 72 1HD1 LEU 11 1HD1 LEU 11 8.934 -2.367 4.189 73 2HD1 LEU 11 3HD1 LEU 11 7.735 -1.378 3.354 74 3HD1 LEU 11 2HD1 LEU 11 7.362 -3.050 3.772 75 1HD2 LEU 11 2HD2 LEU 11 8.827 -1.889 0.184 76 2HD2 LEU 11 1HD2 LEU 11 7.206 -2.427 0.621 77 3HD2 LEU 11 3HD2 LEU 11 7.890 -0.986 1.374 78 H CYS 12 HN CYS 12 11.832 -3.952 0.446 79 HA CYS 12 HA CYS 12 10.648 -6.304 -0.656 80 1HB CYS 12 2HB CYS 12 13.109 -4.639 -1.199 81 2HB CYS 12 1HB CYS 12 12.749 -6.057 -2.182 82 H ASN 13 HN ASN 13 13.138 -5.897 1.676 83 HA ASN 13 HA ASN 13 14.939 -7.978 1.349 84 1HB ASN 13 2HB ASN 13 14.494 -6.233 3.248 85 2HB ASN 13 1HB ASN 13 13.527 -7.515 3.970 86 1HD2 ASN 13 1HD2 ASN 13 14.735 -8.706 5.446 87 2HD2 ASN 13 2HD2 ASN 13 16.388 -9.062 5.299 88 H GLU 14 HN GLU 14 11.634 -8.231 2.674 89 HA GLU 14 HA GLU 14 11.603 -10.975 3.334 90 1HB GLU 14 2HB GLU 14 9.852 -9.289 3.834 91 2HB GLU 14 1HB GLU 14 9.418 -9.248 2.125 92 1HG GLU 14 2HG GLU 14 8.877 -11.668 2.222 93 2HG GLU 14 1HG GLU 14 9.266 -11.674 3.942 94 H TYR 15 HN TYR 15 11.817 -9.486 0.224 95 HA TYR 15 HA TYR 15 10.910 -11.957 -1.176 96 1HB TYR 15 2HB TYR 15 11.557 -9.116 -2.009 97 2HB TYR 15 1HB TYR 15 11.174 -10.388 -3.171 98 HD1 TYR 15 HD1 TYR 15 9.081 -11.927 -2.054 99 HD2 TYR 15 HD2 TYR 15 9.732 -7.702 -1.695 100 HE1 TYR 15 HE1 TYR 15 6.666 -11.601 -1.618 101 HE2 TYR 15 HE2 TYR 15 7.316 -7.365 -1.260 102 HH TYR 15 HH TYR 15 5.312 -9.510 -0.256 103 H ARG 16 HN ARG 16 13.742 -10.123 -0.341 104 HA ARG 16 HA ARG 16 15.649 -10.787 -2.243 105 1HB ARG 16 2HB ARG 16 16.301 -9.436 -0.439 106 2HB ARG 16 1HB ARG 16 15.607 -10.534 0.751 107 1HG ARG 16 2HG ARG 16 17.379 -12.182 0.254 108 2HG ARG 16 1HG ARG 16 18.083 -11.067 -0.915 109 1HD ARG 16 2HD ARG 16 19.086 -11.077 1.490 110 2HD ARG 16 1HD ARG 16 18.686 -9.500 0.786 111 HE ARG 16 HE ARG 16 16.523 -9.613 2.053 112 1HH1 ARG 16 1HH1 ARG 16 19.194 -10.021 3.761 113 2HH1 ARG 16 2HH1 ARG 16 18.567 -11.098 4.964 114 1HH2 ARG 16 1HH2 ARG 16 15.645 -11.768 3.222 115 2HH2 ARG 16 2HH2 ARG 16 16.558 -12.088 4.659 116 H LYS 17 HN LYS 17 14.083 -12.898 0.087 117 HA LYS 17 HA LYS 17 15.917 -15.138 -0.225 118 1HB LYS 17 2HB LYS 17 13.022 -15.293 0.618 119 2HB LYS 17 1HB LYS 17 14.387 -16.233 1.214 120 1HG LYS 17 2HG LYS 17 15.276 -13.836 1.943 121 2HG LYS 17 1HG LYS 17 13.557 -13.444 1.905 122 1HD LYS 17 2HD LYS 17 14.411 -15.961 3.285 123 2HD LYS 17 1HD LYS 17 14.678 -14.422 4.107 124 1HE LYS 17 2HE LYS 17 12.263 -13.866 3.785 125 2HE LYS 17 1HE LYS 17 12.020 -15.468 3.061 126 1HZ LYS 17 1HZ LYS 17 13.105 -16.382 5.118 127 2HZ LYS 17 3HZ LYS 17 12.976 -14.836 5.803 128 3HZ LYS 17 2HZ LYS 17 11.573 -15.690 5.370 129 H LEU 18 HN LEU 18 13.083 -13.943 -1.903 130 HA LEU 18 HA LEU 18 12.669 -16.443 -3.412 131 1HB LEU 18 2HB LEU 18 11.453 -13.771 -4.068 132 2HB LEU 18 1HB LEU 18 10.725 -15.369 -4.172 133 HG LEU 18 HG LEU 18 11.244 -13.718 -1.693 134 1HD1 LEU 18 2HD1 LEU 18 9.121 -13.488 -3.104 135 2HD1 LEU 18 1HD1 LEU 18 8.734 -15.136 -2.607 136 3HD1 LEU 18 3HD1 LEU 18 8.880 -13.862 -1.397 137 1HD2 LEU 18 1HD2 LEU 18 11.358 -16.588 -1.988 138 2HD2 LEU 18 3HD2 LEU 18 11.591 -15.614 -0.536 139 3HD2 LEU 18 2HD2 LEU 18 9.970 -16.137 -0.997 140 H VAL 19 HN VAL 19 13.867 -13.135 -4.012 141 HA VAL 19 HA VAL 19 14.545 -13.785 -6.806 142 HB VAL 19 HB VAL 19 13.657 -11.604 -6.291 143 1HG1 VAL 19 1HG1 VAL 19 15.514 -11.824 -4.016 144 2HG1 VAL 19 3HG1 VAL 19 15.478 -10.230 -4.772 145 3HG1 VAL 19 2HG1 VAL 19 13.991 -10.943 -4.148 146 1HG2 VAL 19 3HG2 VAL 19 16.606 -11.655 -6.910 147 2HG2 VAL 19 2HG2 VAL 19 15.257 -11.413 -8.019 148 3HG2 VAL 19 1HG2 VAL 19 15.702 -10.142 -6.880 149 H ARG 20 HN ARG 20 16.405 -14.911 -7.185 150 HA ARG 20 HA ARG 20 18.645 -14.813 -5.256 151 1HB ARG 20 2HB ARG 20 17.963 -16.372 -7.759 152 2HB ARG 20 1HB ARG 20 19.523 -16.538 -6.955 153 1HG ARG 20 2HG ARG 20 18.344 -18.211 -5.871 154 2HG ARG 20 1HG ARG 20 17.985 -16.853 -4.805 155 1HD ARG 20 2HD ARG 20 15.853 -16.467 -5.968 156 2HD ARG 20 1HD ARG 20 16.222 -17.776 -7.107 157 HE ARG 20 HE ARG 20 16.266 -18.430 -4.208 158 1HH1 ARG 20 1HH1 ARG 20 16.149 -20.367 -6.593 159 2HH1 ARG 20 2HH1 ARG 20 14.505 -20.903 -6.491 160 1HH2 ARG 20 1HH2 ARG 20 13.526 -18.345 -4.365 161 2HH2 ARG 20 2HH2 ARG 20 13.019 -19.757 -5.229 162 H ASN 21 HN ASN 21 19.168 -15.105 -8.709 163 HA ASN 21 HA ASN 21 20.859 -12.634 -8.613 164 1HB ASN 21 2HB ASN 21 20.887 -15.165 -10.282 165 2HB ASN 21 1HB ASN 21 21.933 -13.785 -10.615 166 1HD2 ASN 21 1HD2 ASN 21 21.772 -16.693 -8.888 167 2HD2 ASN 21 2HD2 ASN 21 23.007 -16.388 -7.765 168 H GLY 22 HN GLY 22 17.949 -12.572 -9.054 169 1HA GLY 22 1HA GLY 22 17.913 -11.634 -11.896 170 2HA GLY 22 2HA GLY 22 17.070 -10.784 -10.600 171 H LYS 23 HN LYS 23 16.321 -13.441 -9.373 172 HA LYS 23 HA LYS 23 14.029 -14.028 -11.212 173 1HB LYS 23 2HB LYS 23 15.500 -16.126 -9.608 174 2HB LYS 23 1HB LYS 23 14.425 -16.363 -10.985 175 1HG LYS 23 2HG LYS 23 16.068 -15.286 -12.468 176 2HG LYS 23 1HG LYS 23 17.137 -15.005 -11.095 177 1HD LYS 23 2HD LYS 23 17.457 -17.365 -10.761 178 2HD LYS 23 1HD LYS 23 16.183 -17.760 -11.915 179 1HE LYS 23 2HE LYS 23 18.400 -16.058 -12.949 180 2HE LYS 23 1HE LYS 23 18.794 -17.755 -12.610 181 1HZ LYS 23 1HZ LYS 23 16.587 -18.245 -13.773 182 2HZ LYS 23 3HZ LYS 23 16.685 -16.666 -14.382 183 3HZ LYS 23 2HZ LYS 23 17.897 -17.796 -14.756 184 H LEU 24 HN LEU 24 12.880 -12.583 -9.634 185 HA LEU 24 HA LEU 24 12.662 -13.427 -6.844 186 1HB LEU 24 2HB LEU 24 12.511 -11.079 -7.625 187 2HB LEU 24 1HB LEU 24 11.062 -11.482 -8.542 188 HG LEU 24 HG LEU 24 9.949 -12.165 -6.416 189 1HD1 LEU 24 1HD1 LEU 24 12.236 -12.593 -5.285 190 2HD1 LEU 24 3HD1 LEU 24 12.260 -10.856 -4.988 191 3HD1 LEU 24 2HD1 LEU 24 10.972 -11.851 -4.309 192 1HD2 LEU 24 2HD2 LEU 24 11.039 -9.387 -6.789 193 2HD2 LEU 24 1HD2 LEU 24 9.393 -9.971 -7.031 194 3HD2 LEU 24 3HD2 LEU 24 10.022 -9.755 -5.396 195 H ALA 25 HN ALA 25 10.926 -14.565 -5.915 196 HA ALA 25 HA ALA 25 8.986 -15.778 -7.854 197 1HB ALA 25 2HB ALA 25 10.338 -17.496 -6.998 198 2HB ALA 25 3HB ALA 25 8.947 -17.539 -5.915 199 3HB ALA 25 1HB ALA 25 10.438 -16.749 -5.403 200 H CYS 26 HN CYS 26 7.149 -14.510 -7.623 201 HA CYS 26 HA CYS 26 5.966 -14.356 -4.883 202 1HB CYS 26 2HB CYS 26 5.383 -12.018 -5.313 203 2HB CYS 26 1HB CYS 26 7.120 -12.229 -5.527 204 H THR 27 HN THR 27 3.558 -13.290 -5.390 205 HA THR 27 HA THR 27 2.380 -15.155 -7.408 206 HB THR 27 HB THR 27 0.285 -14.548 -6.014 207 HG1 THR 27 1HG THR 27 1.526 -12.696 -5.100 208 1HG2 THR 27 1HG2 THR 27 2.665 -16.147 -5.215 209 2HG2 THR 27 3HG2 THR 27 1.419 -15.903 -3.990 210 3HG2 THR 27 2HG2 THR 27 1.008 -16.670 -5.525 211 H ARG 28 HN ARG 28 0.211 -14.180 -8.324 212 HA ARG 28 HA ARG 28 0.900 -11.550 -9.525 213 1HB ARG 28 2HB ARG 28 -1.200 -13.659 -10.120 214 2HB ARG 28 1HB ARG 28 -0.936 -12.211 -11.091 215 1HG ARG 28 2HG ARG 28 1.411 -12.929 -11.482 216 2HG ARG 28 1HG ARG 28 1.097 -14.401 -10.563 217 1HD ARG 28 2HD ARG 28 -0.764 -14.928 -12.200 218 2HD ARG 28 1HD ARG 28 -0.200 -13.559 -13.177 219 HE ARG 28 HE ARG 28 1.591 -14.939 -13.858 220 1HH1 ARG 28 1HH1 ARG 28 0.299 -17.448 -13.007 221 2HH1 ARG 28 2HH1 ARG 28 1.422 -18.096 -11.859 222 1HH2 ARG 28 1HH2 ARG 28 3.096 -15.094 -11.405 223 2HH2 ARG 28 2HH2 ARG 28 3.005 -16.763 -10.951 224 H GLU 29 HN GLU 29 0.129 -11.306 -6.835 225 HA GLU 29 HA GLU 29 -2.567 -11.003 -6.175 226 1HB GLU 29 2HB GLU 29 -0.845 -10.648 -4.554 227 2HB GLU 29 1HB GLU 29 -0.090 -9.387 -5.530 228 1HG GLU 29 2HG GLU 29 -2.135 -7.986 -5.232 229 2HG GLU 29 1HG GLU 29 -2.800 -9.230 -4.173 230 H ASN 30 HN ASN 30 -4.013 -9.150 -6.283 231 HA ASN 30 HA ASN 30 -3.668 -7.577 -8.780 232 1HB ASN 30 2HB ASN 30 -6.051 -7.618 -6.921 233 2HB ASN 30 1HB ASN 30 -6.025 -7.325 -8.659 234 1HD2 ASN 30 1HD2 ASN 30 -5.271 -9.261 -10.022 235 2HD2 ASN 30 2HD2 ASN 30 -5.736 -10.802 -9.495 236 H ASP 31 HN ASP 31 -1.860 -6.550 -7.107 237 HA ASP 31 HA ASP 31 -3.146 -4.050 -6.071 238 1HB ASP 31 2HB ASP 31 -2.565 -5.806 -4.316 239 2HB ASP 31 1HB ASP 31 -0.874 -5.557 -4.747 240 HA PRO 32 HA PRO 32 0.421 -3.315 -9.031 241 1HB PRO 32 2HB PRO 32 -1.171 -1.166 -10.091 242 2HB PRO 32 1HB PRO 32 -0.704 -2.669 -10.890 243 1HG PRO 32 2HG PRO 32 -3.303 -1.919 -9.938 244 2HG PRO 32 1HG PRO 32 -2.830 -3.432 -10.713 245 1HD PRO 32 2HD PRO 32 -3.496 -2.985 -7.932 246 2HD PRO 32 1HD PRO 32 -3.062 -4.518 -8.722 247 H ILE 33 HN ILE 33 1.970 -1.769 -8.528 248 HA ILE 33 HA ILE 33 1.120 0.685 -7.059 249 HB ILE 33 HB ILE 33 2.507 0.218 -5.219 250 1HG1 ILE 33 2HG1 ILE 33 4.556 -0.291 -6.433 251 2HG1 ILE 33 1HG1 ILE 33 4.252 -1.566 -5.255 252 1HG2 ILE 33 3HG2 ILE 33 1.528 -2.485 -6.184 253 2HG2 ILE 33 2HG2 ILE 33 2.001 -2.106 -4.529 254 3HG2 ILE 33 1HG2 ILE 33 0.595 -1.320 -5.245 255 1HD1 ILE 33 2HD1 ILE 33 3.003 -2.744 -7.224 256 2HD1 ILE 33 1HD1 ILE 33 3.925 -1.640 -8.244 257 3HD1 ILE 33 3HD1 ILE 33 4.766 -2.780 -7.194 258 H GLN 34 HN GLN 34 3.574 1.772 -6.554 259 HA GLN 34 HA GLN 34 4.856 1.930 -9.264 260 1HB GLN 34 2HB GLN 34 4.379 4.081 -7.175 261 2HB GLN 34 1HB GLN 34 5.159 4.332 -8.736 262 1HG GLN 34 2HG GLN 34 3.100 3.607 -9.886 263 2HG GLN 34 1HG GLN 34 2.320 3.343 -8.327 264 1HE2 GLN 34 1HE2 GLN 34 1.257 5.226 -10.204 265 2HE2 GLN 34 2HE2 GLN 34 1.446 6.787 -9.564 266 H GLY 35 HN GLY 35 7.172 2.619 -9.168 267 1HA GLY 35 1HA GLY 35 9.123 1.345 -8.160 268 2HA GLY 35 2HA GLY 35 8.466 1.815 -6.593 269 HA PRO 36 HA PRO 36 10.894 5.453 -6.564 270 1HB PRO 36 2HB PRO 36 13.496 4.256 -6.838 271 2HB PRO 36 1HB PRO 36 12.699 4.799 -5.360 272 1HG PRO 36 2HG PRO 36 13.186 2.101 -6.209 273 2HG PRO 36 1HG PRO 36 12.382 2.644 -4.736 274 1HD PRO 36 2HD PRO 36 11.187 1.407 -7.057 275 2HD PRO 36 1HD PRO 36 10.379 1.941 -5.565 276 H ASP 37 HN ASP 37 11.486 3.180 -9.157 277 HA ASP 37 HA ASP 37 13.150 4.823 -10.822 278 1HB ASP 37 2HB ASP 37 11.163 2.615 -11.431 279 2HB ASP 37 1HB ASP 37 12.362 3.220 -12.575 280 H GLY 38 HN GLY 38 9.629 4.309 -10.770 281 1HA GLY 38 1HA GLY 38 9.361 6.740 -12.486 282 2HA GLY 38 2HA GLY 38 8.367 6.528 -11.046 283 H LYS 39 HN LYS 39 8.993 3.567 -12.551 284 HA LYS 39 HA LYS 39 6.610 3.721 -14.330 285 1HB LYS 39 2HB LYS 39 8.549 1.435 -13.907 286 2HB LYS 39 1HB LYS 39 7.530 1.739 -15.313 287 1HG LYS 39 2HG LYS 39 8.825 3.671 -15.932 288 2HG LYS 39 1HG LYS 39 9.714 3.634 -14.409 289 1HD LYS 39 2HD LYS 39 10.723 1.488 -15.018 290 2HD LYS 39 1HD LYS 39 9.788 1.449 -16.513 291 1HE LYS 39 2HE LYS 39 11.021 3.936 -16.626 292 2HE LYS 39 1HE LYS 39 12.272 2.893 -15.922 293 1HZ LYS 39 3HZ LYS 39 10.618 1.989 -18.203 294 2HZ LYS 39 2HZ LYS 39 12.022 2.911 -18.463 295 3HZ LYS 39 1HZ LYS 39 12.124 1.401 -17.692 296 H VAL 40 HN VAL 40 5.021 1.920 -14.195 297 HA VAL 40 HA VAL 40 4.497 1.166 -11.363 298 HB VAL 40 HB VAL 40 2.794 0.943 -13.868 299 1HG1 VAL 40 2HG1 VAL 40 2.214 -0.473 -11.825 300 2HG1 VAL 40 1HG1 VAL 40 1.931 1.042 -10.969 301 3HG1 VAL 40 3HG1 VAL 40 0.949 0.626 -12.375 302 1HG2 VAL 40 1HG2 VAL 40 3.554 3.285 -13.258 303 2HG2 VAL 40 3HG2 VAL 40 1.806 3.047 -13.240 304 3HG2 VAL 40 2HG2 VAL 40 2.706 3.082 -11.724 305 H HIS 41 HN HIS 41 4.183 -1.046 -10.779 306 HA HIS 41 HA HIS 41 5.081 -3.037 -12.838 307 1HB HIS 41 2HB HIS 41 5.510 -3.121 -9.839 308 2HB HIS 41 1HB HIS 41 6.285 -4.135 -11.058 309 HD1 HIS 41 HD1 HIS 41 7.965 -2.884 -12.724 310 HD2 HIS 41 HD2 HIS 41 6.762 -0.656 -9.412 311 HE1 HIS 41 HE1 HIS 41 9.567 -0.930 -12.556 312 H GLY 42 HN GLY 42 4.334 -5.325 -12.193 313 1HA GLY 42 1HA GLY 42 2.569 -6.810 -11.768 314 2HA GLY 42 2HA GLY 42 1.503 -5.435 -12.054 315 H ASN 43 HN ASN 43 3.763 -6.571 -9.505 316 HA ASN 43 HA ASN 43 1.806 -5.553 -7.477 317 1HB ASN 43 2HB ASN 43 2.364 -7.719 -6.244 318 2HB ASN 43 1HB ASN 43 1.393 -7.898 -7.703 319 1HD2 ASN 43 1HD2 ASN 43 2.509 -10.198 -7.357 320 2HD2 ASN 43 2HD2 ASN 43 3.968 -10.421 -8.194 321 H THR 44 HN THR 44 3.215 -6.409 -5.241 322 HA THR 44 HA THR 44 5.222 -4.371 -4.968 323 HB THR 44 HB THR 44 4.598 -6.821 -3.294 324 HG1 THR 44 1HG THR 44 3.660 -4.157 -3.078 325 1HG2 THR 44 3HG2 THR 44 6.065 -4.243 -2.694 326 2HG2 THR 44 2HG2 THR 44 5.488 -5.346 -1.444 327 3HG2 THR 44 1HG2 THR 44 6.705 -5.883 -2.602 328 H CYS 45 HN CYS 45 5.514 -7.939 -5.087 329 HA CYS 45 HA CYS 45 8.299 -8.160 -4.876 330 1HB CYS 45 2HB CYS 45 7.994 -10.316 -5.828 331 2HB CYS 45 1HB CYS 45 6.450 -9.945 -5.065 332 H SER 46 HN SER 46 6.365 -7.379 -7.769 333 HA SER 46 HA SER 46 8.444 -7.413 -9.707 334 1HB SER 46 2HB SER 46 5.851 -7.057 -9.842 335 2HB SER 46 1HB SER 46 6.243 -5.350 -9.629 336 HG SER 46 HG SER 46 7.580 -6.912 -11.547 337 H MET 47 HN MET 47 7.244 -4.704 -7.693 338 HA MET 47 HA MET 47 9.185 -2.771 -8.530 339 1HB MET 47 2HB MET 47 6.960 -2.866 -6.938 340 2HB MET 47 1HB MET 47 8.230 -2.731 -5.724 341 1HG MET 47 2HG MET 47 8.214 -0.921 -8.133 342 2HG MET 47 1HG MET 47 7.236 -0.538 -6.716 343 1HE MET 47 3HE MET 47 8.004 -0.909 -4.498 344 2HE MET 47 2HE MET 47 9.532 -1.749 -4.247 345 3HE MET 47 1HE MET 47 9.407 -0.032 -3.871 346 H CYS 48 HN CYS 48 9.290 -5.463 -6.330 347 HA CYS 48 HA CYS 48 11.720 -4.630 -4.926 348 1HB CYS 48 2HB CYS 48 10.012 -7.118 -5.124 349 2HB CYS 48 1HB CYS 48 11.501 -7.105 -4.179 350 H GLU 49 HN GLU 49 10.906 -6.504 -7.783 351 HA GLU 49 HA GLU 49 13.406 -7.910 -8.081 352 1HB GLU 49 2HB GLU 49 11.171 -7.033 -9.929 353 2HB GLU 49 1HB GLU 49 12.533 -7.999 -10.499 354 1HG GLU 49 2HG GLU 49 11.956 -9.554 -8.492 355 2HG GLU 49 1HG GLU 49 10.396 -8.736 -8.510 356 H VAL 50 HN VAL 50 12.165 -4.912 -9.618 357 HA VAL 50 HA VAL 50 14.553 -4.252 -11.036 358 HB VAL 50 HB VAL 50 13.506 -2.101 -11.268 359 1HG1 VAL 50 1HG1 VAL 50 12.215 -4.348 -11.911 360 2HG1 VAL 50 3HG1 VAL 50 11.061 -3.728 -10.731 361 3HG1 VAL 50 2HG1 VAL 50 11.477 -2.764 -12.148 362 1HG2 VAL 50 2HG2 VAL 50 11.947 -2.810 -8.765 363 2HG2 VAL 50 1HG2 VAL 50 13.243 -1.618 -8.870 364 3HG2 VAL 50 3HG2 VAL 50 11.724 -1.346 -9.723 365 H PHE 51 HN PHE 51 13.453 -3.444 -7.747 366 HA PHE 51 HA PHE 51 15.704 -1.805 -7.023 367 1HB PHE 51 2HB PHE 51 13.738 -1.689 -5.697 368 2HB PHE 51 1HB PHE 51 13.616 -3.444 -5.578 369 HD1 PHE 51 HD1 PHE 51 16.053 -0.702 -4.756 370 HD2 PHE 51 HD2 PHE 51 14.289 -4.441 -3.590 371 HE1 PHE 51 HE1 PHE 51 17.343 -0.651 -2.637 372 HE2 PHE 51 HE2 PHE 51 15.579 -4.390 -1.472 373 HZ PHE 51 HZ PHE 51 17.105 -2.495 -0.996 374 H PHE 52 HN PHE 52 15.067 -5.272 -6.979 375 HA PHE 52 HA PHE 52 17.384 -6.079 -5.465 376 1HB PHE 52 2HB PHE 52 15.320 -7.268 -7.272 377 2HB PHE 52 1HB PHE 52 16.770 -8.224 -6.974 378 HD1 PHE 52 HD1 PHE 52 17.449 -7.453 -4.204 379 HD2 PHE 52 HD2 PHE 52 13.635 -8.297 -5.990 380 HE1 PHE 52 HE1 PHE 52 16.554 -8.100 -1.986 381 HE2 PHE 52 HE2 PHE 52 12.740 -8.946 -3.771 382 HZ PHE 52 HZ PHE 52 14.200 -8.845 -1.772 383 H GLN 53 HN GLN 53 16.745 -5.477 -8.892 384 HA GLN 53 HA GLN 53 19.205 -6.538 -9.941 385 1HB GLN 53 2HB GLN 53 16.919 -5.769 -11.004 386 2HB GLN 53 1HB GLN 53 17.713 -4.200 -11.105 387 1HG GLN 53 2HG GLN 53 19.684 -5.547 -12.172 388 2HG GLN 53 1HG GLN 53 18.458 -6.784 -12.456 389 1HE2 GLN 53 1HE2 GLN 53 16.389 -4.470 -12.677 390 2HE2 GLN 53 2HE2 GLN 53 16.613 -3.889 -14.256 391 H ALA 54 HN ALA 54 18.219 -3.282 -8.876 392 HA ALA 54 HA ALA 54 20.640 -1.917 -9.563 393 1HB ALA 54 1HB ALA 54 18.706 -1.365 -7.291 394 2HB ALA 54 2HB ALA 54 18.380 -0.957 -8.976 395 3HB ALA 54 3HB ALA 54 19.720 -0.188 -8.126 396 H GLU 55 HN GLU 55 19.628 -3.629 -6.604 397 HA GLU 55 HA GLU 55 21.694 -2.909 -4.846 398 1HB GLU 55 2HB GLU 55 20.106 -5.425 -5.345 399 2HB GLU 55 1HB GLU 55 21.301 -5.366 -4.050 400 1HG GLU 55 2HG GLU 55 20.160 -3.316 -3.166 401 2HG GLU 55 1HG GLU 55 18.911 -3.529 -4.393 402 H GLU 56 HN GLU 56 21.793 -5.080 -7.618 403 HA GLU 56 HA GLU 56 24.339 -6.311 -7.004 404 1HB GLU 56 2HB GLU 56 22.725 -7.308 -8.527 405 2HB GLU 56 1HB GLU 56 22.765 -5.882 -9.562 406 1HG GLU 56 2HG GLU 56 25.256 -6.321 -9.863 407 2HG GLU 56 1HG GLU 56 24.988 -7.878 -9.080 408 H GLU 57 HN GLU 57 23.386 -3.251 -8.373 409 HA GLU 57 HA GLU 57 25.843 -2.674 -9.796 410 1HB GLU 57 2HB GLU 57 23.586 -0.996 -8.661 411 2HB GLU 57 1HB GLU 57 24.869 -0.336 -9.676 412 1HG GLU 57 2HG GLU 57 23.076 -2.639 -10.497 413 2HG GLU 57 1HG GLU 57 22.790 -0.959 -10.950 414 H GLU 58 HN GLU 58 24.640 -1.971 -6.516 415 HA GLU 58 HA GLU 58 26.727 -0.240 -5.657 416 1HB GLU 58 2HB GLU 58 25.029 -2.294 -4.205 417 2HB GLU 58 1HB GLU 58 25.995 -1.063 -3.391 418 1HG GLU 58 2HG GLU 58 24.742 0.701 -4.601 419 2HG GLU 58 1HG GLU 58 23.760 -0.542 -5.377 420 H LYS 59 HN LYS 59 26.533 -3.786 -5.766 421 HA LYS 59 HA LYS 59 29.079 -4.178 -4.379 422 1HB LYS 59 2HB LYS 59 27.420 -6.056 -6.093 423 2HB LYS 59 1HB LYS 59 28.620 -6.521 -4.887 424 1HG LYS 59 2HG LYS 59 26.092 -4.950 -4.294 425 2HG LYS 59 1HG LYS 59 26.288 -6.680 -4.015 426 1HD LYS 59 2HD LYS 59 28.260 -6.142 -2.542 427 2HD LYS 59 1HD LYS 59 27.857 -4.434 -2.717 428 1HE LYS 59 2HE LYS 59 26.304 -4.630 -1.079 429 2HE LYS 59 1HE LYS 59 25.471 -5.893 -2.006 430 1HZ LYS 59 1HZ LYS 59 27.458 -7.338 -1.237 431 2HZ LYS 59 3HZ LYS 59 27.644 -6.165 -0.026 432 3HZ LYS 59 2HZ LYS 59 26.193 -7.041 -0.143 433 H LYS 60 HN LYS 60 28.420 -2.944 -7.366 434 HA LYS 60 HA LYS 60 30.008 -4.364 -9.223 435 1HB LYS 60 2HB LYS 60 30.013 -2.251 -10.425 436 2HB LYS 60 1HB LYS 60 28.462 -2.404 -9.599 437 1HG LYS 60 2HG LYS 60 29.362 -1.027 -7.727 438 2HG LYS 60 1HG LYS 60 30.861 -0.818 -8.631 439 1HD LYS 60 2HD LYS 60 29.445 0.126 -10.525 440 2HD LYS 60 1HD LYS 60 28.094 0.147 -9.391 441 1HE LYS 60 2HE LYS 60 30.683 1.401 -8.532 442 2HE LYS 60 1HE LYS 60 29.637 2.292 -9.654 443 1HZ LYS 60 1HZ LYS 60 27.822 1.374 -7.967 444 2HZ LYS 60 3HZ LYS 60 29.133 1.463 -6.896 445 3HZ LYS 60 2HZ LYS 60 28.614 2.856 -7.717 446 H LYS 61 HN LYS 61 30.966 -1.920 -6.812 447 HA LYS 61 HA LYS 61 33.666 -1.548 -7.583 448 1HB LYS 61 2HB LYS 61 32.327 -1.602 -4.860 449 2HB LYS 61 1HB LYS 61 33.921 -0.914 -5.171 450 1HG LYS 61 2HG LYS 61 32.853 0.596 -6.880 451 2HG LYS 61 1HG LYS 61 31.281 -0.007 -6.356 452 1HD LYS 61 2HD LYS 61 31.834 0.733 -4.027 453 2HD LYS 61 1HD LYS 61 33.321 1.449 -4.647 454 1HE LYS 61 2HE LYS 61 32.210 3.216 -5.607 455 2HE LYS 61 1HE LYS 61 30.830 2.211 -6.086 456 1HZ LYS 61 3HZ LYS 61 30.223 2.059 -3.718 457 2HZ LYS 61 2HZ LYS 61 31.487 3.126 -3.329 458 3HZ LYS 61 1HZ LYS 61 30.183 3.660 -4.279 459 H LYS 62 HN LYS 62 32.151 -4.137 -5.693 460 HA LYS 62 HA LYS 62 33.020 -6.207 -4.954 461 1HB LYS 62 2HB LYS 62 33.516 -6.087 -7.481 462 2HB LYS 62 1HB LYS 62 35.169 -5.685 -7.017 463 1HG LYS 62 2HG LYS 62 35.251 -7.771 -5.649 464 2HG LYS 62 1HG LYS 62 33.641 -8.187 -6.236 465 1HD LYS 62 2HD LYS 62 34.437 -8.294 -8.522 466 2HD LYS 62 1HD LYS 62 36.019 -7.678 -8.047 467 1HE LYS 62 2HE LYS 62 36.665 -9.699 -7.093 468 2HE LYS 62 1HE LYS 62 34.997 -10.165 -6.706 469 1HZ LYS 62 2HZ LYS 62 34.728 -10.043 -9.279 470 2HZ LYS 62 1HZ LYS 62 36.411 -10.269 -9.289 471 3HZ LYS 62 3HZ LYS 62 35.405 -11.432 -8.573 472 H GLU 63 HN GLU 63 34.194 -3.486 -3.991 473 HA GLU 63 HA GLU 63 36.967 -3.830 -3.386 474 1HB GLU 63 2HB GLU 63 34.658 -2.290 -2.195 475 2HB GLU 63 1HB GLU 63 36.278 -2.181 -1.504 476 1HG GLU 63 2HG GLU 63 37.169 -1.469 -3.689 477 2HG GLU 63 1HG GLU 63 35.557 -1.596 -4.394 478 H GLY 64 HN GLY 64 34.135 -5.335 -2.081 479 1HA GLY 64 1HA GLY 64 33.904 -6.301 0.162 480 2HA GLY 64 2HA GLY 64 35.660 -6.251 0.315 481 H GLU 65 HN GLU 65 34.616 -8.642 0.890 482 HA GLU 65 HA GLU 65 35.227 -10.290 -1.538 483 1HB GLU 65 2HB GLU 65 35.467 -10.867 1.434 484 2HB GLU 65 1HB GLU 65 35.951 -11.967 0.143 485 1HG GLU 65 2HG GLU 65 37.513 -10.182 -0.696 486 2HG GLU 65 1HG GLU 65 37.112 -9.228 0.731 487 H SER 66 HN SER 66 33.747 -11.883 -2.147 488 HA SER 66 HA SER 66 31.182 -11.971 -0.597 489 1HB SER 66 2HB SER 66 30.183 -12.518 -2.772 490 2HB SER 66 1HB SER 66 31.158 -11.056 -2.919 491 HG SER 66 HG SER 66 31.486 -12.702 -4.573 492 H ARG 67 HN ARG 67 30.227 -14.048 -0.229 493 HA ARG 67 HA ARG 67 31.952 -16.211 0.383 494 1HB ARG 67 2HB ARG 67 29.611 -15.750 1.199 495 2HB ARG 67 1HB ARG 67 29.013 -16.308 -0.363 496 1HG ARG 67 2HG ARG 67 30.088 -18.498 0.005 497 2HG ARG 67 1HG ARG 67 30.693 -17.941 1.565 498 1HD ARG 67 2HD ARG 67 27.742 -18.019 0.843 499 2HD ARG 67 1HD ARG 67 28.574 -19.295 1.753 500 HE ARG 67 HE ARG 67 28.920 -16.533 2.762 501 1HH1 ARG 67 1HH1 ARG 67 28.524 -19.734 3.587 502 2HH1 ARG 67 2HH1 ARG 67 27.462 -19.456 4.927 503 1HH2 ARG 67 1HH2 ARG 67 27.026 -16.088 4.221 504 2HH2 ARG 67 2HH2 ARG 67 26.614 -17.391 5.286 505 H ASN 68 HN ASN 68 30.090 -15.520 -2.568 506 HA ASN 68 HA ASN 68 30.893 -18.049 -3.840 507 1HB ASN 68 2HB ASN 68 29.504 -15.567 -4.906 508 2HB ASN 68 1HB ASN 68 29.550 -17.145 -5.693 509 1HD2 ASN 68 1HD2 ASN 68 29.088 -18.851 -3.481 510 2HD2 ASN 68 2HD2 ASN 68 27.542 -18.545 -2.854 No H/Q in entry = 510 Start of MODEL 7 1 H1 GLU 1 2H GLU 1 4.994 -4.643 9.083 2 H2 GLU 1 1H GLU 1 4.061 -3.873 10.276 3 H3 GLU 1 3H GLU 1 3.603 -3.771 8.646 4 HA GLU 1 HA GLU 1 4.628 -1.696 9.296 5 1HB GLU 1 2HB GLU 1 5.819 -2.832 11.193 6 2HB GLU 1 1HB GLU 1 6.961 -3.496 10.026 7 1HG GLU 1 2HG GLU 1 7.499 -1.157 9.303 8 2HG GLU 1 1HG GLU 1 6.458 -0.559 10.595 9 H SER 2 HN SER 2 4.129 -2.614 6.844 10 HA SER 2 HA SER 2 6.739 -2.350 5.389 11 1HB SER 2 2HB SER 2 5.825 -4.686 5.475 12 2HB SER 2 1HB SER 2 4.371 -4.105 4.662 13 HG SER 2 HG SER 2 6.687 -4.824 3.588 14 H GLY 3 HN GLY 3 6.689 -0.750 3.846 15 1HA GLY 3 1HA GLY 3 4.314 0.872 3.510 16 2HA GLY 3 2HA GLY 3 4.659 -0.099 2.080 17 H LYS 4 HN LYS 4 4.787 2.599 1.752 18 HA LYS 4 HA LYS 4 7.509 3.019 0.872 19 1HB LYS 4 2HB LYS 4 5.122 4.870 1.186 20 2HB LYS 4 1HB LYS 4 6.578 5.254 0.266 21 1HG LYS 4 2HG LYS 4 4.716 2.920 -0.272 22 2HG LYS 4 1HG LYS 4 4.794 4.406 -1.217 23 1HD LYS 4 2HD LYS 4 7.250 3.895 -1.614 24 2HD LYS 4 1HD LYS 4 6.959 2.311 -0.895 25 1HE LYS 4 2HE LYS 4 5.292 1.795 -2.615 26 2HE LYS 4 1HE LYS 4 5.465 3.421 -3.302 27 1HZ LYS 4 3HZ LYS 4 7.822 2.978 -3.647 28 2HZ LYS 4 2HZ LYS 4 7.647 1.417 -3.000 29 3HZ LYS 4 1HZ LYS 4 6.883 1.824 -4.463 30 H ALA 5 HN ALA 5 6.140 3.252 3.937 31 HA ALA 5 HA ALA 5 7.559 5.633 4.878 32 1HB ALA 5 2HB ALA 5 6.705 3.690 6.884 33 2HB ALA 5 3HB ALA 5 5.443 3.994 5.690 34 3HB ALA 5 1HB ALA 5 6.127 5.334 6.610 35 H THR 6 HN THR 6 8.467 2.420 4.205 36 HA THR 6 HA THR 6 10.725 2.509 6.173 37 HB THR 6 HB THR 6 9.150 0.576 6.187 38 HG1 THR 6 1HG THR 6 10.755 -0.876 6.349 39 1HG2 THR 6 3HG2 THR 6 9.358 0.854 3.397 40 2HG2 THR 6 2HG2 THR 6 10.150 -0.676 3.776 41 3HG2 THR 6 1HG2 THR 6 8.480 -0.401 4.273 42 H SER 7 HN SER 7 12.444 0.777 4.902 43 HA SER 7 HA SER 7 13.360 2.412 2.573 44 1HB SER 7 2HB SER 7 14.570 0.962 4.832 45 2HB SER 7 1HB SER 7 15.399 0.700 3.299 46 HG SER 7 HG SER 7 15.802 2.822 3.125 47 H TYR 8 HN TYR 8 13.894 1.366 0.599 48 HA TYR 8 HA TYR 8 12.356 -0.851 -0.239 49 1HB TYR 8 2HB TYR 8 15.021 0.204 -1.244 50 2HB TYR 8 1HB TYR 8 13.918 -0.815 -2.172 51 HD1 TYR 8 HD1 TYR 8 11.305 0.344 -1.222 52 HD2 TYR 8 HD2 TYR 8 14.943 2.236 -2.499 53 HE1 TYR 8 HE1 TYR 8 10.019 2.351 -1.899 54 HE2 TYR 8 HE2 TYR 8 13.657 4.246 -3.177 55 HH TYR 8 HH TYR 8 10.510 4.316 -3.724 56 H ALA 9 HN ALA 9 15.903 -0.872 0.359 57 HA ALA 9 HA ALA 9 16.357 -3.626 0.198 58 1HB ALA 9 1HB ALA 9 17.746 -1.359 0.904 59 2HB ALA 9 3HB ALA 9 17.707 -2.241 2.431 60 3HB ALA 9 2HB ALA 9 18.402 -2.994 0.995 61 H GLU 10 HN GLU 10 14.641 -1.849 2.660 62 HA GLU 10 HA GLU 10 14.656 -4.176 4.521 63 1HB GLU 10 2HB GLU 10 13.531 -1.359 4.724 64 2HB GLU 10 1HB GLU 10 13.601 -2.527 6.045 65 1HG GLU 10 2HG GLU 10 16.179 -2.599 5.343 66 2HG GLU 10 1HG GLU 10 15.809 -0.977 4.759 67 H LEU 11 HN LEU 11 12.651 -2.470 2.239 68 HA LEU 11 HA LEU 11 10.123 -3.662 3.129 69 1HB LEU 11 2HB LEU 11 10.420 -1.399 2.062 70 2HB LEU 11 1HB LEU 11 10.876 -2.218 0.569 71 HG LEU 11 HG LEU 11 8.589 -3.516 1.015 72 1HD1 LEU 11 1HD1 LEU 11 8.199 -0.816 2.342 73 2HD1 LEU 11 3HD1 LEU 11 6.911 -1.962 1.966 74 3HD1 LEU 11 2HD1 LEU 11 8.146 -2.380 3.154 75 1HD2 LEU 11 3HD2 LEU 11 9.429 -1.262 -0.551 76 2HD2 LEU 11 2HD2 LEU 11 8.201 -2.468 -0.938 77 3HD2 LEU 11 1HD2 LEU 11 7.756 -1.010 -0.050 78 H CYS 12 HN CYS 12 11.934 -3.826 0.060 79 HA CYS 12 HA CYS 12 10.627 -6.212 -0.880 80 1HB CYS 12 2HB CYS 12 13.082 -4.606 -1.539 81 2HB CYS 12 1HB CYS 12 12.839 -6.163 -2.331 82 H ASN 13 HN ASN 13 12.942 -5.715 1.558 83 HA ASN 13 HA ASN 13 14.760 -7.805 1.468 84 1HB ASN 13 2HB ASN 13 14.189 -5.990 3.245 85 2HB ASN 13 1HB ASN 13 13.110 -7.204 3.921 86 1HD2 ASN 13 1HD2 ASN 13 15.366 -6.318 5.413 87 2HD2 ASN 13 2HD2 ASN 13 16.489 -7.586 5.517 88 H GLU 14 HN GLU 14 11.345 -7.979 2.439 89 HA GLU 14 HA GLU 14 11.243 -10.706 3.220 90 1HB GLU 14 2HB GLU 14 9.482 -9.036 3.601 91 2HB GLU 14 1HB GLU 14 9.189 -8.927 1.866 92 1HG GLU 14 2HG GLU 14 8.609 -11.360 1.857 93 2HG GLU 14 1HG GLU 14 8.791 -11.376 3.612 94 H TYR 15 HN TYR 15 11.771 -9.363 0.091 95 HA TYR 15 HA TYR 15 10.725 -11.755 -1.321 96 1HB TYR 15 2HB TYR 15 11.784 -9.038 -2.054 97 2HB TYR 15 1HB TYR 15 11.698 -10.298 -3.281 98 HD1 TYR 15 HD1 TYR 15 9.484 -11.451 -3.704 99 HD2 TYR 15 HD2 TYR 15 9.834 -7.887 -1.336 100 HE1 TYR 15 HE1 TYR 15 7.052 -11.045 -3.960 101 HE2 TYR 15 HE2 TYR 15 7.404 -7.474 -1.595 102 HH TYR 15 HH TYR 15 5.249 -9.623 -2.372 103 H ARG 16 HN ARG 16 13.681 -10.578 0.007 104 HA ARG 16 HA ARG 16 15.671 -11.577 -1.696 105 1HB ARG 16 2HB ARG 16 15.462 -11.655 1.332 106 2HB ARG 16 1HB ARG 16 16.966 -11.816 0.424 107 1HG ARG 16 2HG ARG 16 16.335 -9.575 -0.677 108 2HG ARG 16 1HG ARG 16 15.145 -9.415 0.615 109 1HD ARG 16 2HD ARG 16 16.990 -9.708 2.290 110 2HD ARG 16 1HD ARG 16 18.151 -9.710 0.948 111 HE ARG 16 HE ARG 16 16.395 -7.457 0.681 112 1HH1 ARG 16 1HH1 ARG 16 17.541 -7.922 3.643 113 2HH1 ARG 16 2HH1 ARG 16 18.773 -6.704 3.627 114 1HH2 ARG 16 1HH2 ARG 16 18.608 -6.205 0.200 115 2HH2 ARG 16 2HH2 ARG 16 19.377 -5.733 1.677 116 H LYS 17 HN LYS 17 13.459 -13.323 0.409 117 HA LYS 17 HA LYS 17 14.807 -15.878 0.344 118 1HB LYS 17 2HB LYS 17 11.825 -15.419 0.563 119 2HB LYS 17 1HB LYS 17 12.798 -16.651 1.362 120 1HG LYS 17 2HG LYS 17 14.017 -14.481 2.356 121 2HG LYS 17 1HG LYS 17 12.430 -13.773 2.054 122 1HD LYS 17 2HD LYS 17 12.592 -16.436 3.426 123 2HD LYS 17 1HD LYS 17 12.934 -14.977 4.355 124 1HE LYS 17 2HE LYS 17 10.753 -14.081 3.936 125 2HE LYS 17 1HE LYS 17 10.431 -15.277 2.667 126 1HZ LYS 17 2HZ LYS 17 11.073 -16.887 4.663 127 2HZ LYS 17 1HZ LYS 17 10.440 -15.600 5.572 128 3HZ LYS 17 3HZ LYS 17 9.477 -16.365 4.405 129 H LEU 18 HN LEU 18 13.007 -14.088 -1.976 130 HA LEU 18 HA LEU 18 12.338 -16.495 -3.592 131 1HB LEU 18 2HB LEU 18 11.829 -13.627 -4.356 132 2HB LEU 18 1HB LEU 18 10.861 -15.051 -4.723 133 HG LEU 18 HG LEU 18 11.082 -13.567 -2.100 134 1HD1 LEU 18 3HD1 LEU 18 9.345 -13.267 -4.162 135 2HD1 LEU 18 2HD1 LEU 18 8.512 -14.517 -3.238 136 3HD1 LEU 18 1HD1 LEU 18 8.905 -12.974 -2.479 137 1HD2 LEU 18 2HD2 LEU 18 10.807 -16.405 -2.494 138 2HD2 LEU 18 1HD2 LEU 18 10.808 -15.497 -0.982 139 3HD2 LEU 18 3HD2 LEU 18 9.297 -15.754 -1.854 140 H VAL 19 HN VAL 19 14.137 -13.415 -3.861 141 HA VAL 19 HA VAL 19 15.503 -14.444 -6.300 142 HB VAL 19 HB VAL 19 14.498 -12.232 -6.407 143 1HG1 VAL 19 3HG1 VAL 19 16.118 -11.742 -3.907 144 2HG1 VAL 19 2HG1 VAL 19 15.465 -10.427 -4.883 145 3HG1 VAL 19 1HG1 VAL 19 14.374 -11.581 -4.117 146 1HG2 VAL 19 1HG2 VAL 19 17.260 -12.766 -6.825 147 2HG2 VAL 19 3HG2 VAL 19 16.251 -11.578 -7.651 148 3HG2 VAL 19 2HG2 VAL 19 17.130 -11.126 -6.191 149 H ARG 20 HN ARG 20 17.594 -15.136 -6.185 150 HA ARG 20 HA ARG 20 19.039 -14.801 -3.590 151 1HB ARG 20 2HB ARG 20 19.745 -16.701 -5.823 152 2HB ARG 20 1HB ARG 20 20.059 -16.871 -4.097 153 1HG ARG 20 2HG ARG 20 17.300 -16.911 -5.355 154 2HG ARG 20 1HG ARG 20 18.207 -18.347 -4.888 155 1HD ARG 20 2HD ARG 20 18.361 -17.072 -2.550 156 2HD ARG 20 1HD ARG 20 16.885 -16.294 -3.152 157 HE ARG 20 HE ARG 20 16.389 -18.918 -3.718 158 1HH1 ARG 20 1HH1 ARG 20 15.839 -17.076 -1.102 159 2HH1 ARG 20 2HH1 ARG 20 15.956 -18.327 0.091 160 1HH2 ARG 20 1HH2 ARG 20 17.297 -20.656 -2.101 161 2HH2 ARG 20 2HH2 ARG 20 16.781 -20.354 -0.476 162 H ASN 21 HN ASN 21 19.336 -14.320 -7.081 163 HA ASN 21 HA ASN 21 21.534 -12.408 -6.645 164 1HB ASN 21 2HB ASN 21 23.189 -13.684 -7.807 165 2HB ASN 21 1HB ASN 21 22.439 -14.808 -6.674 166 1HD2 ASN 21 1HD2 ASN 21 21.538 -16.689 -7.552 167 2HD2 ASN 21 2HD2 ASN 21 21.275 -16.945 -9.209 168 H GLY 22 HN GLY 22 18.791 -12.457 -7.850 169 1HA GLY 22 1HA GLY 22 19.532 -11.699 -10.648 170 2HA GLY 22 2HA GLY 22 18.389 -10.760 -9.688 171 H LYS 23 HN LYS 23 18.006 -14.005 -8.947 172 HA LYS 23 HA LYS 23 16.050 -14.494 -11.149 173 1HB LYS 23 2HB LYS 23 16.212 -16.810 -10.409 174 2HB LYS 23 1HB LYS 23 17.843 -16.154 -10.542 175 1HG LYS 23 2HG LYS 23 17.445 -15.518 -8.003 176 2HG LYS 23 1HG LYS 23 16.259 -16.819 -8.085 177 1HD LYS 23 2HD LYS 23 19.032 -17.255 -9.166 178 2HD LYS 23 1HD LYS 23 18.736 -17.386 -7.432 179 1HE LYS 23 2HE LYS 23 17.362 -18.976 -9.629 180 2HE LYS 23 1HE LYS 23 18.459 -19.603 -8.385 181 1HZ LYS 23 3HZ LYS 23 16.763 -18.346 -6.834 182 2HZ LYS 23 2HZ LYS 23 15.700 -18.634 -8.128 183 3HZ LYS 23 1HZ LYS 23 16.463 -19.935 -7.345 184 H LEU 24 HN LEU 24 14.839 -12.644 -9.811 185 HA LEU 24 HA LEU 24 13.530 -13.521 -7.350 186 1HB LEU 24 2HB LEU 24 14.122 -11.171 -7.867 187 2HB LEU 24 1HB LEU 24 13.032 -11.206 -9.249 188 HG LEU 24 HG LEU 24 11.107 -11.323 -7.885 189 1HD1 LEU 24 3HD1 LEU 24 11.971 -13.154 -6.427 190 2HD1 LEU 24 2HD1 LEU 24 12.906 -11.957 -5.530 191 3HD1 LEU 24 1HD1 LEU 24 11.145 -11.892 -5.516 192 1HD2 LEU 24 2HD2 LEU 24 13.134 -9.378 -7.243 193 2HD2 LEU 24 1HD2 LEU 24 11.384 -9.173 -7.279 194 3HD2 LEU 24 3HD2 LEU 24 12.176 -9.728 -5.805 195 H ALA 25 HN ALA 25 11.785 -14.880 -7.345 196 HA ALA 25 HA ALA 25 10.259 -15.324 -9.848 197 1HB ALA 25 2HB ALA 25 10.671 -17.367 -8.876 198 2HB ALA 25 3HB ALA 25 9.192 -16.989 -7.994 199 3HB ALA 25 1HB ALA 25 10.762 -16.686 -7.252 200 H CYS 26 HN CYS 26 8.602 -13.872 -10.168 201 HA CYS 26 HA CYS 26 7.216 -12.632 -7.875 202 1HB CYS 26 2HB CYS 26 7.530 -12.254 -10.794 203 2HB CYS 26 1HB CYS 26 5.955 -11.789 -10.150 204 H THR 27 HN THR 27 4.720 -12.558 -8.070 205 HA THR 27 HA THR 27 3.687 -15.255 -8.892 206 HB THR 27 HB THR 27 2.108 -14.812 -6.888 207 HG1 THR 27 1HG THR 27 2.935 -13.340 -5.398 208 1HG2 THR 27 3HG2 THR 27 4.500 -16.120 -7.103 209 2HG2 THR 27 2HG2 THR 27 4.832 -15.010 -5.774 210 3HG2 THR 27 1HG2 THR 27 3.484 -16.141 -5.662 211 H ARG 28 HN ARG 28 1.045 -14.950 -8.713 212 HA ARG 28 HA ARG 28 0.430 -12.873 -10.738 213 1HB ARG 28 2HB ARG 28 -1.152 -15.163 -9.523 214 2HB ARG 28 1HB ARG 28 -1.696 -14.170 -10.875 215 1HG ARG 28 2HG ARG 28 0.273 -14.881 -12.187 216 2HG ARG 28 1HG ARG 28 0.812 -15.877 -10.835 217 1HD ARG 28 2HD ARG 28 -1.292 -17.197 -10.983 218 2HD ARG 28 1HD ARG 28 -1.788 -16.218 -12.376 219 HE ARG 28 HE ARG 28 0.402 -18.204 -12.345 220 1HH1 ARG 28 1HH1 ARG 28 -1.902 -17.347 -14.375 221 2HH1 ARG 28 2HH1 ARG 28 -0.908 -16.876 -15.712 222 1HH2 ARG 28 1HH2 ARG 28 2.023 -16.822 -13.861 223 2HH2 ARG 28 2HH2 ARG 28 1.314 -16.579 -15.421 224 H GLU 29 HN GLU 29 0.809 -12.504 -7.637 225 HA GLU 29 HA GLU 29 -1.541 -11.838 -6.304 226 1HB GLU 29 2HB GLU 29 0.706 -11.699 -5.353 227 2HB GLU 29 1HB GLU 29 1.112 -10.369 -6.439 228 1HG GLU 29 2HG GLU 29 -0.691 -9.005 -5.403 229 2HG GLU 29 1HG GLU 29 -1.025 -10.327 -4.285 230 H ASN 30 HN ASN 30 -3.061 -10.195 -6.473 231 HA ASN 30 HA ASN 30 -2.846 -8.387 -8.829 232 1HB ASN 30 2HB ASN 30 -5.113 -9.106 -6.941 233 2HB ASN 30 1HB ASN 30 -5.279 -8.096 -8.377 234 1HD2 ASN 30 1HD2 ASN 30 -6.031 -11.100 -7.464 235 2HD2 ASN 30 2HD2 ASN 30 -5.713 -11.969 -8.887 236 H ASP 31 HN ASP 31 -1.086 -7.431 -7.053 237 HA ASP 31 HA ASP 31 -2.510 -5.124 -5.778 238 1HB ASP 31 2HB ASP 31 -0.883 -7.267 -4.616 239 2HB ASP 31 1HB ASP 31 -0.297 -5.662 -4.182 240 HA PRO 32 HA PRO 32 0.979 -3.887 -8.656 241 1HB PRO 32 2HB PRO 32 -0.730 -1.720 -9.467 242 2HB PRO 32 1HB PRO 32 -0.201 -3.106 -10.425 243 1HG PRO 32 2HG PRO 32 -2.820 -2.591 -9.378 244 2HG PRO 32 1HG PRO 32 -2.283 -3.992 -10.310 245 1HD PRO 32 2HD PRO 32 -2.932 -3.863 -7.491 246 2HD PRO 32 1HD PRO 32 -2.442 -5.285 -8.440 247 H ILE 33 HN ILE 33 2.229 -1.890 -8.474 248 HA ILE 33 HA ILE 33 1.382 0.107 -6.459 249 HB ILE 33 HB ILE 33 3.111 -0.385 -4.921 250 1HG1 ILE 33 2HG1 ILE 33 4.988 -0.551 -6.424 251 2HG1 ILE 33 1HG1 ILE 33 4.933 -2.041 -5.484 252 1HG2 ILE 33 1HG2 ILE 33 1.322 -2.102 -4.910 253 2HG2 ILE 33 3HG2 ILE 33 2.264 -3.073 -6.040 254 3HG2 ILE 33 2HG2 ILE 33 2.874 -2.773 -4.412 255 1HD1 ILE 33 1HD1 ILE 33 3.541 -3.008 -7.421 256 2HD1 ILE 33 3HD1 ILE 33 4.074 -1.604 -8.346 257 3HD1 ILE 33 2HD1 ILE 33 5.259 -2.753 -7.726 258 H GLN 34 HN GLN 34 3.750 1.433 -6.112 259 HA GLN 34 HA GLN 34 4.609 2.102 -8.911 260 1HB GLN 34 2HB GLN 34 4.202 3.891 -6.491 261 2HB GLN 34 1HB GLN 34 4.718 4.436 -8.087 262 1HG GLN 34 2HG GLN 34 2.616 3.663 -9.067 263 2HG GLN 34 1HG GLN 34 2.106 3.002 -7.514 264 1HE2 GLN 34 1HE2 GLN 34 0.733 5.142 -9.046 265 2HE2 GLN 34 2HE2 GLN 34 0.729 6.514 -8.047 266 H GLY 35 HN GLY 35 6.832 2.901 -9.084 267 1HA GLY 35 1HA GLY 35 9.047 1.908 -8.546 268 2HA GLY 35 2HA GLY 35 8.566 1.929 -6.849 269 HA PRO 36 HA PRO 36 10.338 5.874 -6.214 270 1HB PRO 36 2HB PRO 36 13.072 5.133 -6.715 271 2HB PRO 36 1HB PRO 36 12.260 5.307 -5.158 272 1HG PRO 36 2HG PRO 36 13.097 2.882 -6.445 273 2HG PRO 36 1HG PRO 36 12.273 3.055 -4.894 274 1HD PRO 36 2HD PRO 36 11.189 2.051 -7.378 275 2HD PRO 36 1HD PRO 36 10.365 2.210 -5.809 276 H ASP 37 HN ASP 37 11.080 4.179 -9.169 277 HA ASP 37 HA ASP 37 12.392 6.393 -10.526 278 1HB ASP 37 2HB ASP 37 11.064 3.822 -11.423 279 2HB ASP 37 1HB ASP 37 11.945 4.891 -12.514 280 H GLY 38 HN GLY 38 9.075 5.174 -10.321 281 1HA GLY 38 1HA GLY 38 8.205 7.532 -11.941 282 2HA GLY 38 2HA GLY 38 7.381 7.081 -10.452 283 H LYS 39 HN LYS 39 8.590 4.574 -12.540 284 HA LYS 39 HA LYS 39 6.106 4.232 -14.048 285 1HB LYS 39 2HB LYS 39 8.377 3.677 -14.892 286 2HB LYS 39 1HB LYS 39 8.523 2.439 -13.645 287 1HG LYS 39 2HG LYS 39 6.432 1.373 -14.587 288 2HG LYS 39 1HG LYS 39 6.532 2.515 -15.927 289 1HD LYS 39 2HD LYS 39 8.904 1.678 -16.309 290 2HD LYS 39 1HD LYS 39 8.547 0.391 -15.157 291 1HE LYS 39 2HE LYS 39 7.296 -0.754 -16.681 292 2HE LYS 39 1HE LYS 39 6.473 0.720 -17.227 293 1HZ LYS 39 1HZ LYS 39 9.299 0.049 -17.867 294 2HZ LYS 39 3HZ LYS 39 8.000 -0.257 -18.914 295 3HZ LYS 39 2HZ LYS 39 8.390 1.341 -18.490 296 H VAL 40 HN VAL 40 4.703 2.349 -13.830 297 HA VAL 40 HA VAL 40 4.486 1.407 -11.010 298 HB VAL 40 HB VAL 40 2.581 1.191 -13.364 299 1HG1 VAL 40 2HG1 VAL 40 2.432 -0.285 -11.169 300 2HG1 VAL 40 1HG1 VAL 40 1.783 1.200 -10.476 301 3HG1 VAL 40 3HG1 VAL 40 0.980 0.446 -11.854 302 1HG2 VAL 40 2HG2 VAL 40 3.377 3.461 -11.776 303 2HG2 VAL 40 1HG2 VAL 40 2.209 3.395 -13.096 304 3HG2 VAL 40 3HG2 VAL 40 1.689 3.072 -11.442 305 H HIS 41 HN HIS 41 4.122 -0.895 -10.612 306 HA HIS 41 HA HIS 41 5.196 -2.667 -12.786 307 1HB HIS 41 2HB HIS 41 5.528 -2.878 -9.775 308 2HB HIS 41 1HB HIS 41 6.295 -3.911 -10.982 309 HD1 HIS 41 HD1 HIS 41 8.189 -2.846 -12.443 310 HD2 HIS 41 HD2 HIS 41 6.716 -0.325 -9.467 311 HE1 HIS 41 HE1 HIS 41 9.826 -0.923 -12.259 312 H GLY 42 HN GLY 42 4.532 -5.039 -12.343 313 1HA GLY 42 1HA GLY 42 2.817 -6.622 -12.112 314 2HA GLY 42 2HA GLY 42 1.700 -5.272 -12.321 315 H ASN 43 HN ASN 43 4.084 -5.924 -9.743 316 HA ASN 43 HA ASN 43 2.038 -5.302 -7.710 317 1HB ASN 43 2HB ASN 43 2.468 -7.570 -6.635 318 2HB ASN 43 1HB ASN 43 1.544 -7.611 -8.136 319 1HD2 ASN 43 1HD2 ASN 43 2.533 -9.965 -7.971 320 2HD2 ASN 43 2HD2 ASN 43 4.024 -10.188 -8.748 321 H THR 44 HN THR 44 3.373 -6.372 -5.521 322 HA THR 44 HA THR 44 5.438 -4.437 -5.053 323 HB THR 44 HB THR 44 4.566 -6.976 -3.655 324 HG1 THR 44 1HG THR 44 3.009 -5.589 -3.303 325 1HG2 THR 44 3HG2 THR 44 6.911 -6.429 -3.078 326 2HG2 THR 44 2HG2 THR 44 6.411 -4.794 -2.646 327 3HG2 THR 44 1HG2 THR 44 5.828 -6.170 -1.710 328 H CYS 45 HN CYS 45 5.655 -7.986 -5.488 329 HA CYS 45 HA CYS 45 8.447 -8.248 -5.294 330 1HB CYS 45 2HB CYS 45 8.116 -10.339 -6.396 331 2HB CYS 45 1HB CYS 45 6.608 -10.014 -5.542 332 H SER 46 HN SER 46 6.504 -7.300 -8.140 333 HA SER 46 HA SER 46 8.571 -7.265 -10.084 334 1HB SER 46 2HB SER 46 6.211 -5.391 -9.669 335 2HB SER 46 1HB SER 46 7.082 -5.608 -11.187 336 HG SER 46 HG SER 46 6.119 -7.889 -9.926 337 H MET 47 HN MET 47 7.516 -4.749 -7.787 338 HA MET 47 HA MET 47 9.452 -2.762 -8.528 339 1HB MET 47 2HB MET 47 7.271 -2.987 -6.880 340 2HB MET 47 1HB MET 47 8.582 -2.961 -5.702 341 1HG MET 47 2HG MET 47 8.513 -0.954 -7.948 342 2HG MET 47 1HG MET 47 7.561 -0.688 -6.486 343 1HE MET 47 2HE MET 47 8.446 -1.072 -4.202 344 2HE MET 47 1HE MET 47 9.704 -2.295 -4.357 345 3HE MET 47 3HE MET 47 10.081 -0.719 -3.648 346 H CYS 48 HN CYS 48 9.577 -5.666 -6.629 347 HA CYS 48 HA CYS 48 12.080 -5.007 -5.244 348 1HB CYS 48 2HB CYS 48 10.362 -7.486 -5.564 349 2HB CYS 48 1HB CYS 48 11.801 -7.440 -4.550 350 H GLU 49 HN GLU 49 11.063 -6.823 -8.111 351 HA GLU 49 HA GLU 49 13.509 -8.216 -8.628 352 1HB GLU 49 2HB GLU 49 11.320 -7.105 -10.422 353 2HB GLU 49 1HB GLU 49 12.567 -8.222 -10.975 354 1HG GLU 49 2HG GLU 49 11.817 -9.820 -9.187 355 2HG GLU 49 1HG GLU 49 10.475 -8.731 -8.847 356 H VAL 50 HN VAL 50 12.323 -5.040 -9.779 357 HA VAL 50 HA VAL 50 14.687 -4.373 -11.280 358 HB VAL 50 HB VAL 50 13.655 -2.216 -11.413 359 1HG1 VAL 50 1HG1 VAL 50 12.278 -4.484 -11.990 360 2HG1 VAL 50 3HG1 VAL 50 11.155 -3.713 -10.869 361 3HG1 VAL 50 2HG1 VAL 50 11.665 -2.865 -12.330 362 1HG2 VAL 50 1HG2 VAL 50 12.172 -2.985 -8.880 363 2HG2 VAL 50 3HG2 VAL 50 13.467 -1.793 -9.000 364 3HG2 VAL 50 2HG2 VAL 50 11.919 -1.496 -9.790 365 H PHE 51 HN PHE 51 13.653 -3.651 -7.943 366 HA PHE 51 HA PHE 51 15.960 -2.097 -7.211 367 1HB PHE 51 2HB PHE 51 13.991 -1.958 -5.879 368 2HB PHE 51 1HB PHE 51 13.856 -3.711 -5.759 369 HD1 PHE 51 HD1 PHE 51 16.444 -1.077 -5.045 370 HD2 PHE 51 HD2 PHE 51 14.432 -4.629 -3.710 371 HE1 PHE 51 HE1 PHE 51 17.760 -1.031 -2.942 372 HE2 PHE 51 HE2 PHE 51 15.749 -4.584 -1.608 373 HZ PHE 51 HZ PHE 51 17.413 -2.785 -1.225 374 H PHE 52 HN PHE 52 15.183 -5.545 -7.102 375 HA PHE 52 HA PHE 52 17.525 -6.422 -5.678 376 1HB PHE 52 2HB PHE 52 15.323 -7.535 -7.344 377 2HB PHE 52 1HB PHE 52 16.756 -8.546 -7.178 378 HD1 PHE 52 HD1 PHE 52 17.743 -8.108 -4.533 379 HD2 PHE 52 HD2 PHE 52 13.666 -8.242 -5.871 380 HE1 PHE 52 HE1 PHE 52 17.014 -8.750 -2.250 381 HE2 PHE 52 HE2 PHE 52 12.937 -8.881 -3.594 382 HZ PHE 52 HZ PHE 52 14.609 -9.137 -1.781 383 H GLN 53 HN GLN 53 16.796 -5.820 -9.087 384 HA GLN 53 HA GLN 53 19.165 -7.012 -10.205 385 1HB GLN 53 2HB GLN 53 16.893 -6.171 -11.215 386 2HB GLN 53 1HB GLN 53 17.724 -4.621 -11.333 387 1HG GLN 53 2HG GLN 53 19.616 -5.920 -12.500 388 2HG GLN 53 1HG GLN 53 18.454 -7.238 -12.655 389 1HE2 GLN 53 1HE2 GLN 53 16.247 -5.040 -12.852 390 2HE2 GLN 53 2HE2 GLN 53 16.344 -4.534 -14.469 391 H ALA 54 HN ALA 54 18.367 -3.688 -9.188 392 HA ALA 54 HA ALA 54 20.856 -2.484 -9.954 393 1HB ALA 54 3HB ALA 54 18.807 -1.806 -7.818 394 2HB ALA 54 1HB ALA 54 18.795 -1.245 -9.490 395 3HB ALA 54 2HB ALA 54 20.060 -0.703 -8.387 396 H GLU 55 HN GLU 55 19.796 -4.134 -6.992 397 HA GLU 55 HA GLU 55 21.883 -3.416 -5.233 398 1HB GLU 55 2HB GLU 55 20.175 -5.864 -5.656 399 2HB GLU 55 1HB GLU 55 21.374 -5.825 -4.363 400 1HG GLU 55 2HG GLU 55 20.316 -3.614 -3.637 401 2HG GLU 55 1HG GLU 55 18.999 -3.990 -4.748 402 H GLU 56 HN GLU 56 21.886 -5.643 -7.954 403 HA GLU 56 HA GLU 56 24.371 -6.982 -7.282 404 1HB GLU 56 2HB GLU 56 22.948 -6.595 -9.936 405 2HB GLU 56 1HB GLU 56 24.132 -7.849 -9.566 406 1HG GLU 56 2HG GLU 56 22.649 -8.807 -7.881 407 2HG GLU 56 1HG GLU 56 21.490 -7.499 -8.118 408 H GLU 57 HN GLU 57 23.530 -3.999 -8.929 409 HA GLU 57 HA GLU 57 26.099 -3.641 -10.254 410 1HB GLU 57 2HB GLU 57 23.826 -1.764 -9.533 411 2HB GLU 57 1HB GLU 57 25.156 -1.350 -10.615 412 1HG GLU 57 2HG GLU 57 23.273 -3.691 -11.039 413 2HG GLU 57 1HG GLU 57 23.102 -2.122 -11.829 414 H GLU 58 HN GLU 58 24.634 -2.498 -7.213 415 HA GLU 58 HA GLU 58 26.575 -0.622 -6.400 416 1HB GLU 58 2HB GLU 58 24.406 -1.117 -5.299 417 2HB GLU 58 1HB GLU 58 25.049 -2.665 -4.751 418 1HG GLU 58 2HG GLU 58 26.868 -1.417 -3.553 419 2HG GLU 58 1HG GLU 58 26.068 0.090 -3.997 420 H LYS 59 HN LYS 59 26.687 -4.153 -6.348 421 HA LYS 59 HA LYS 59 29.077 -4.320 -4.685 422 1HB LYS 59 2HB LYS 59 27.699 -6.268 -6.564 423 2HB LYS 59 1HB LYS 59 28.945 -6.705 -5.393 424 1HG LYS 59 2HG LYS 59 27.493 -5.827 -3.569 425 2HG LYS 59 1HG LYS 59 26.237 -5.489 -4.761 426 1HD LYS 59 2HD LYS 59 26.251 -7.913 -5.387 427 2HD LYS 59 1HD LYS 59 27.401 -8.207 -4.082 428 1HE LYS 59 2HE LYS 59 25.811 -7.701 -2.407 429 2HE LYS 59 1HE LYS 59 24.767 -6.823 -3.542 430 1HZ LYS 59 1HZ LYS 59 25.420 -9.632 -4.099 431 2HZ LYS 59 3HZ LYS 59 24.259 -9.306 -2.906 432 3HZ LYS 59 2HZ LYS 59 24.021 -8.752 -4.494 433 H LYS 60 HN LYS 60 28.552 -3.380 -7.895 434 HA LYS 60 HA LYS 60 30.670 -4.563 -9.350 435 1HB LYS 60 2HB LYS 60 30.359 -2.679 -10.824 436 2HB LYS 60 1HB LYS 60 28.783 -3.043 -10.121 437 1HG LYS 60 2HG LYS 60 29.270 -1.299 -8.355 438 2HG LYS 60 1HG LYS 60 30.703 -0.854 -9.281 439 1HD LYS 60 2HD LYS 60 29.049 -0.645 -11.288 440 2HD LYS 60 1HD LYS 60 27.803 -0.570 -10.042 441 1HE LYS 60 2HE LYS 60 28.696 1.429 -9.113 442 2HE LYS 60 1HE LYS 60 30.247 1.217 -9.949 443 1HZ LYS 60 3HZ LYS 60 27.725 1.369 -11.477 444 2HZ LYS 60 2HZ LYS 60 28.494 2.797 -10.971 445 3HZ LYS 60 1HZ LYS 60 29.304 1.709 -11.996 446 H LYS 61 HN LYS 61 30.710 -1.932 -6.988 447 HA LYS 61 HA LYS 61 33.279 -0.842 -7.502 448 1HB LYS 61 2HB LYS 61 31.778 -1.271 -4.897 449 2HB LYS 61 1HB LYS 61 33.101 -0.127 -5.128 450 1HG LYS 61 2HG LYS 61 30.475 -0.098 -6.648 451 2HG LYS 61 1HG LYS 61 30.894 0.985 -5.321 452 1HD LYS 61 2HD LYS 61 32.866 1.769 -6.648 453 2HD LYS 61 1HD LYS 61 32.314 0.771 -7.993 454 1HE LYS 61 2HE LYS 61 30.096 2.032 -7.865 455 2HE LYS 61 1HE LYS 61 30.907 3.159 -6.760 456 1HZ LYS 61 2HZ LYS 61 32.252 2.383 -9.258 457 2HZ LYS 61 1HZ LYS 61 31.007 3.537 -9.336 458 3HZ LYS 61 3HZ LYS 61 32.374 3.830 -8.375 459 H LYS 62 HN LYS 62 32.315 -3.785 -5.800 460 HA LYS 62 HA LYS 62 35.221 -4.420 -5.388 461 1HB LYS 62 2HB LYS 62 32.783 -5.158 -3.736 462 2HB LYS 62 1HB LYS 62 34.438 -5.647 -3.376 463 1HG LYS 62 2HG LYS 62 35.082 -3.246 -3.223 464 2HG LYS 62 1HG LYS 62 33.398 -2.799 -3.496 465 1HD LYS 62 2HD LYS 62 33.759 -2.770 -1.114 466 2HD LYS 62 1HD LYS 62 32.803 -4.208 -1.474 467 1HE LYS 62 2HE LYS 62 34.872 -5.583 -1.448 468 2HE LYS 62 1HE LYS 62 35.815 -4.134 -1.051 469 1HZ LYS 62 1HZ LYS 62 33.443 -4.982 0.517 470 2HZ LYS 62 3HZ LYS 62 35.010 -5.505 0.903 471 3HZ LYS 62 2HZ LYS 62 34.632 -3.849 0.952 472 H GLU 63 HN GLU 63 35.773 -6.689 -5.666 473 HA GLU 63 HA GLU 63 34.391 -8.004 -7.833 474 1HB GLU 63 2HB GLU 63 36.482 -8.955 -5.847 475 2HB GLU 63 1HB GLU 63 36.077 -9.771 -7.358 476 1HG GLU 63 2HG GLU 63 36.702 -7.698 -8.599 477 2HG GLU 63 1HG GLU 63 37.198 -6.965 -7.074 478 H GLY 64 HN GLY 64 33.909 -7.980 -4.422 479 1HA GLY 64 1HA GLY 64 31.669 -9.823 -4.644 480 2HA GLY 64 2HA GLY 64 32.231 -9.056 -3.159 481 H GLU 65 HN GLU 65 31.614 -11.532 -2.658 482 HA GLU 65 HA GLU 65 34.156 -12.866 -2.118 483 1HB GLU 65 2HB GLU 65 31.236 -13.558 -1.676 484 2HB GLU 65 1HB GLU 65 32.571 -14.532 -1.062 485 1HG GLU 65 2HG GLU 65 33.423 -12.563 0.176 486 2HG GLU 65 1HG GLU 65 32.063 -11.611 -0.418 487 H SER 66 HN SER 66 31.680 -13.085 -4.566 488 HA SER 66 HA SER 66 32.198 -15.802 -5.417 489 1HB SER 66 2HB SER 66 30.813 -15.142 -7.305 490 2HB SER 66 1HB SER 66 30.151 -14.396 -5.849 491 HG SER 66 HG SER 66 31.002 -13.212 -8.058 492 H ARG 67 HN ARG 67 33.951 -12.867 -5.767 493 HA ARG 67 HA ARG 67 35.571 -14.078 -7.987 494 1HB ARG 67 2HB ARG 67 34.836 -11.212 -7.327 495 2HB ARG 67 1HB ARG 67 36.044 -11.644 -8.536 496 1HG ARG 67 2HG ARG 67 34.344 -12.968 -9.752 497 2HG ARG 67 1HG ARG 67 33.136 -12.511 -8.551 498 1HD ARG 67 2HD ARG 67 33.680 -10.072 -9.131 499 2HD ARG 67 1HD ARG 67 34.559 -10.713 -10.533 500 HE ARG 67 HE ARG 67 31.771 -11.657 -10.095 501 1HH1 ARG 67 1HH1 ARG 67 33.182 -8.890 -11.297 502 2HH1 ARG 67 2HH1 ARG 67 32.564 -9.046 -12.907 503 1HH2 ARG 67 1HH2 ARG 67 31.346 -12.254 -12.413 504 2HH2 ARG 67 2HH2 ARG 67 31.525 -10.951 -13.539 505 H ASN 68 HN ASN 68 37.854 -13.913 -7.761 506 HA ASN 68 HA ASN 68 38.844 -12.834 -5.143 507 1HB ASN 68 2HB ASN 68 38.505 -15.433 -5.564 508 2HB ASN 68 1HB ASN 68 40.035 -15.270 -6.426 509 1HD2 ASN 68 1HD2 ASN 68 40.360 -16.822 -4.280 510 2HD2 ASN 68 2HD2 ASN 68 41.029 -15.994 -2.959 No H/Q in entry = 510 Start of MODEL 8 1 H1 GLU 1 1H GLU 1 14.407 16.146 5.583 2 H2 GLU 1 3H GLU 1 14.132 16.732 4.016 3 H3 GLU 1 2H GLU 1 12.921 16.876 5.198 4 HA GLU 1 HA GLU 1 12.550 14.530 5.236 5 1HB GLU 1 2HB GLU 1 12.849 15.708 2.453 6 2HB GLU 1 1HB GLU 1 11.852 14.309 2.849 7 1HG GLU 1 2HG GLU 1 10.555 15.713 4.440 8 2HG GLU 1 1HG GLU 1 11.520 17.110 3.966 9 H SER 2 HN SER 2 13.890 12.797 5.594 10 HA SER 2 HA SER 2 16.067 12.276 3.593 11 1HB SER 2 2HB SER 2 17.405 11.488 5.479 12 2HB SER 2 1HB SER 2 16.811 13.108 5.839 13 HG SER 2 HG SER 2 14.951 11.787 6.787 14 H GLY 3 HN GLY 3 16.497 9.994 3.208 15 1HA GLY 3 1HA GLY 3 15.466 7.942 2.522 16 2HA GLY 3 2HA GLY 3 14.091 8.314 3.561 17 H LYS 4 HN LYS 4 16.002 8.987 5.807 18 HA LYS 4 HA LYS 4 17.415 6.502 6.424 19 1HB LYS 4 2HB LYS 4 18.154 8.758 7.135 20 2HB LYS 4 1HB LYS 4 16.686 8.930 8.097 21 1HG LYS 4 2HG LYS 4 17.412 6.748 9.265 22 2HG LYS 4 1HG LYS 4 18.988 7.019 8.520 23 1HD LYS 4 2HD LYS 4 19.028 9.299 9.555 24 2HD LYS 4 1HD LYS 4 17.523 8.909 10.386 25 1HE LYS 4 2HE LYS 4 18.758 6.854 11.327 26 2HE LYS 4 1HE LYS 4 20.245 7.638 10.762 27 1HZ LYS 4 1HZ LYS 4 18.185 8.986 12.431 28 2HZ LYS 4 3HZ LYS 4 19.578 8.262 13.073 29 3HZ LYS 4 2HZ LYS 4 19.718 9.585 12.015 30 H ALA 5 HN ALA 5 14.269 7.911 7.151 31 HA ALA 5 HA ALA 5 13.578 6.209 9.369 32 1HB ALA 5 3HB ALA 5 12.444 8.311 8.853 33 2HB ALA 5 1HB ALA 5 11.273 6.994 8.770 34 3HB ALA 5 2HB ALA 5 11.934 7.683 7.287 35 H THR 6 HN THR 6 13.679 5.699 5.924 36 HA THR 6 HA THR 6 12.706 2.917 6.330 37 HB THR 6 HB THR 6 11.645 4.633 4.087 38 HG1 THR 6 1HG THR 6 10.839 5.754 5.711 39 1HG2 THR 6 3HG2 THR 6 11.281 1.929 5.078 40 2HG2 THR 6 2HG2 THR 6 9.746 2.796 5.022 41 3HG2 THR 6 1HG2 THR 6 10.728 2.644 3.565 42 H SER 7 HN SER 7 13.248 1.539 4.435 43 HA SER 7 HA SER 7 15.143 2.675 2.458 44 1HB SER 7 2HB SER 7 15.899 1.371 4.909 45 2HB SER 7 1HB SER 7 16.381 0.357 3.549 46 HG SER 7 HG SER 7 17.213 2.420 2.644 47 H TYR 8 HN TYR 8 14.503 1.765 0.548 48 HA TYR 8 HA TYR 8 12.634 -0.206 0.079 49 1HB TYR 8 2HB TYR 8 15.212 0.441 -1.378 50 2HB TYR 8 1HB TYR 8 13.935 -0.559 -2.071 51 HD1 TYR 8 HD1 TYR 8 11.482 0.717 -1.182 52 HD2 TYR 8 HD2 TYR 8 15.160 2.511 -2.486 53 HE1 TYR 8 HE1 TYR 8 10.247 2.759 -1.855 54 HE2 TYR 8 HE2 TYR 8 13.925 4.554 -3.158 55 HH TYR 8 HH TYR 8 10.555 4.655 -3.436 56 H ALA 9 HN ALA 9 16.155 -0.786 0.441 57 HA ALA 9 HA ALA 9 16.270 -3.549 0.099 58 1HB ALA 9 3HB ALA 9 18.250 -2.269 0.492 59 2HB ALA 9 1HB ALA 9 18.116 -3.349 1.881 60 3HB ALA 9 2HB ALA 9 17.636 -1.659 2.029 61 H GLU 10 HN GLU 10 14.804 -1.759 2.730 62 HA GLU 10 HA GLU 10 14.541 -4.154 4.448 63 1HB GLU 10 2HB GLU 10 13.478 -1.319 4.691 64 2HB GLU 10 1HB GLU 10 13.517 -2.520 5.982 65 1HG GLU 10 2HG GLU 10 16.086 -2.621 5.416 66 2HG GLU 10 1HG GLU 10 15.795 -1.034 4.705 67 H LEU 11 HN LEU 11 12.560 -2.105 2.352 68 HA LEU 11 HA LEU 11 10.000 -3.237 3.038 69 1HB LEU 11 2HB LEU 11 10.928 -1.111 1.619 70 2HB LEU 11 1HB LEU 11 10.515 -2.206 0.300 71 HG LEU 11 HG LEU 11 8.322 -2.484 1.903 72 1HD1 LEU 11 3HD1 LEU 11 9.667 -0.237 2.937 73 2HD1 LEU 11 2HD1 LEU 11 8.342 0.415 1.974 74 3HD1 LEU 11 1HD1 LEU 11 8.007 -0.724 3.279 75 1HD2 LEU 11 2HD2 LEU 11 8.434 -2.006 -0.555 76 2HD2 LEU 11 1HD2 LEU 11 7.181 -1.082 0.273 77 3HD2 LEU 11 3HD2 LEU 11 8.699 -0.305 -0.173 78 H CYS 12 HN CYS 12 11.797 -3.601 -0.019 79 HA CYS 12 HA CYS 12 10.425 -5.993 -0.828 80 1HB CYS 12 2HB CYS 12 12.876 -4.451 -1.599 81 2HB CYS 12 1HB CYS 12 12.642 -6.056 -2.292 82 H ASN 13 HN ASN 13 12.792 -5.450 1.547 83 HA ASN 13 HA ASN 13 14.589 -7.528 1.574 84 1HB ASN 13 2HB ASN 13 13.951 -5.692 3.299 85 2HB ASN 13 1HB ASN 13 12.856 -6.896 3.965 86 1HD2 ASN 13 1HD2 ASN 13 13.777 -8.306 5.474 87 2HD2 ASN 13 2HD2 ASN 13 15.442 -8.584 5.654 88 H GLU 14 HN GLU 14 11.163 -7.772 2.581 89 HA GLU 14 HA GLU 14 11.085 -10.466 3.376 90 1HB GLU 14 2HB GLU 14 9.239 -8.794 3.494 91 2HB GLU 14 1HB GLU 14 9.046 -8.911 1.745 92 1HG GLU 14 2HG GLU 14 8.572 -11.340 1.982 93 2HG GLU 14 1HG GLU 14 8.704 -11.178 3.733 94 H TYR 15 HN TYR 15 11.338 -9.110 0.137 95 HA TYR 15 HA TYR 15 10.760 -11.649 -1.213 96 1HB TYR 15 2HB TYR 15 11.879 -8.974 -2.111 97 2HB TYR 15 1HB TYR 15 11.410 -10.276 -3.205 98 HD1 TYR 15 HD1 TYR 15 10.182 -7.830 -0.714 99 HD2 TYR 15 HD2 TYR 15 9.083 -10.794 -3.622 100 HE1 TYR 15 HE1 TYR 15 7.822 -7.082 -0.583 101 HE2 TYR 15 HE2 TYR 15 6.723 -10.051 -3.481 102 HH TYR 15 HH TYR 15 5.268 -8.738 -2.433 103 H ARG 16 HN ARG 16 13.403 -10.440 0.487 104 HA ARG 16 HA ARG 16 15.659 -11.171 -1.081 105 1HB ARG 16 2HB ARG 16 15.138 -11.300 1.910 106 2HB ARG 16 1HB ARG 16 16.738 -11.377 1.174 107 1HG ARG 16 2HG ARG 16 14.874 -9.093 0.551 108 2HG ARG 16 1HG ARG 16 15.871 -9.066 2.006 109 1HD ARG 16 2HD ARG 16 17.906 -9.267 0.679 110 2HD ARG 16 1HD ARG 16 16.955 -9.475 -0.805 111 HE ARG 16 HE ARG 16 15.946 -7.141 -0.023 112 1HH1 ARG 16 1HH1 ARG 16 19.093 -8.167 -0.735 113 2HH1 ARG 16 2HH1 ARG 16 19.844 -6.648 -0.377 114 1HH2 ARG 16 1HH2 ARG 16 16.947 -5.209 0.871 115 2HH2 ARG 16 2HH2 ARG 16 18.630 -4.972 0.532 116 H LYS 17 HN LYS 17 13.266 -13.097 0.555 117 HA LYS 17 HA LYS 17 14.874 -15.566 0.539 118 1HB LYS 17 2HB LYS 17 11.893 -15.301 0.964 119 2HB LYS 17 1HB LYS 17 13.000 -16.467 1.686 120 1HG LYS 17 2HG LYS 17 14.141 -14.411 2.774 121 2HG LYS 17 1HG LYS 17 12.670 -13.537 2.341 122 1HD LYS 17 2HD LYS 17 12.469 -16.170 3.779 123 2HD LYS 17 1HD LYS 17 12.830 -14.702 4.689 124 1HE LYS 17 2HE LYS 17 10.681 -13.975 4.517 125 2HE LYS 17 1HE LYS 17 10.630 -14.327 2.779 126 1HZ LYS 17 2HZ LYS 17 10.498 -16.377 4.935 127 2HZ LYS 17 1HZ LYS 17 9.146 -15.781 4.096 128 3HZ LYS 17 3HZ LYS 17 10.340 -16.654 3.266 129 H LEU 18 HN LEU 18 13.533 -13.812 -1.859 130 HA LEU 18 HA LEU 18 12.530 -16.191 -3.384 131 1HB LEU 18 2HB LEU 18 11.982 -13.209 -3.571 132 2HB LEU 18 1HB LEU 18 11.340 -14.397 -4.704 133 HG LEU 18 HG LEU 18 10.343 -15.597 -2.689 134 1HD1 LEU 18 2HD1 LEU 18 11.732 -13.383 -1.381 135 2HD1 LEU 18 1HD1 LEU 18 10.034 -13.479 -0.918 136 3HD1 LEU 18 3HD1 LEU 18 11.092 -14.870 -0.683 137 1HD2 LEU 18 2HD2 LEU 18 9.530 -12.988 -3.839 138 2HD2 LEU 18 1HD2 LEU 18 8.647 -14.512 -3.778 139 3HD2 LEU 18 3HD2 LEU 18 8.693 -13.462 -2.362 140 H VAL 19 HN VAL 19 14.739 -13.449 -3.357 141 HA VAL 19 HA VAL 19 15.594 -13.789 -6.138 142 HB VAL 19 HB VAL 19 16.935 -12.285 -3.876 143 1HG1 VAL 19 1HG1 VAL 19 16.765 -11.817 -6.870 144 2HG1 VAL 19 3HG1 VAL 19 17.605 -10.777 -5.720 145 3HG1 VAL 19 2HG1 VAL 19 18.175 -12.422 -6.001 146 1HG2 VAL 19 2HG2 VAL 19 14.273 -11.967 -4.885 147 2HG2 VAL 19 1HG2 VAL 19 15.121 -10.963 -3.708 148 3HG2 VAL 19 3HG2 VAL 19 15.238 -10.596 -5.429 149 H ARG 20 HN ARG 20 16.661 -15.731 -6.530 150 HA ARG 20 HA ARG 20 18.462 -16.923 -4.543 151 1HB ARG 20 2HB ARG 20 17.728 -17.566 -7.412 152 2HB ARG 20 1HB ARG 20 18.740 -18.595 -6.401 153 1HG ARG 20 2HG ARG 20 15.823 -17.901 -6.038 154 2HG ARG 20 1HG ARG 20 16.562 -19.493 -6.163 155 1HD ARG 20 2HD ARG 20 17.723 -19.093 -3.982 156 2HD ARG 20 1HD ARG 20 16.845 -17.557 -3.842 157 HE ARG 20 HE ARG 20 14.906 -19.514 -4.423 158 1HH1 ARG 20 1HH1 ARG 20 17.458 -20.021 -2.310 159 2HH1 ARG 20 2HH1 ARG 20 16.478 -20.263 -0.902 160 1HH2 ARG 20 1HH2 ARG 20 13.531 -19.320 -2.466 161 2HH2 ARG 20 2HH2 ARG 20 14.255 -19.866 -0.990 162 H ASN 21 HN ASN 21 19.356 -16.805 -7.928 163 HA ASN 21 HA ASN 21 21.833 -15.289 -7.171 164 1HB ASN 21 2HB ASN 21 21.417 -17.328 -9.379 165 2HB ASN 21 1HB ASN 21 22.956 -16.677 -8.816 166 1HD2 ASN 21 1HD2 ASN 21 20.969 -19.355 -8.523 167 2HD2 ASN 21 2HD2 ASN 21 21.494 -19.918 -7.011 168 H GLY 22 HN GLY 22 19.794 -13.645 -7.817 169 1HA GLY 22 1HA GLY 22 20.523 -12.727 -10.547 170 2HA GLY 22 2HA GLY 22 19.760 -11.734 -9.305 171 H LYS 23 HN LYS 23 17.933 -14.166 -8.772 172 HA LYS 23 HA LYS 23 16.017 -13.556 -10.992 173 1HB LYS 23 2HB LYS 23 15.546 -15.896 -11.213 174 2HB LYS 23 1HB LYS 23 17.304 -15.760 -11.179 175 1HG LYS 23 2HG LYS 23 17.119 -16.140 -8.642 176 2HG LYS 23 1HG LYS 23 15.457 -16.638 -8.953 177 1HD LYS 23 2HD LYS 23 16.550 -18.181 -10.776 178 2HD LYS 23 1HD LYS 23 18.019 -17.945 -9.829 179 1HE LYS 23 2HE LYS 23 17.289 -19.539 -8.391 180 2HE LYS 23 1HE LYS 23 15.906 -18.503 -7.988 181 1HZ LYS 23 2HZ LYS 23 16.080 -20.286 -10.367 182 2HZ LYS 23 1HZ LYS 23 15.211 -20.645 -8.951 183 3HZ LYS 23 3HZ LYS 23 14.744 -19.335 -9.922 184 H LEU 24 HN LEU 24 14.234 -12.652 -10.049 185 HA LEU 24 HA LEU 24 13.613 -13.231 -7.204 186 1HB LEU 24 2HB LEU 24 13.618 -10.972 -8.750 187 2HB LEU 24 1HB LEU 24 11.914 -11.420 -8.815 188 HG LEU 24 HG LEU 24 13.589 -10.881 -6.352 189 1HD1 LEU 24 2HD1 LEU 24 11.066 -9.668 -7.513 190 2HD1 LEU 24 1HD1 LEU 24 11.703 -9.273 -5.917 191 3HD1 LEU 24 3HD1 LEU 24 12.640 -8.890 -7.361 192 1HD2 LEU 24 3HD2 LEU 24 12.151 -12.918 -6.082 193 2HD2 LEU 24 2HD2 LEU 24 11.684 -11.586 -5.023 194 3HD2 LEU 24 1HD2 LEU 24 10.749 -11.924 -6.479 195 H ALA 25 HN ALA 25 12.029 -14.695 -6.680 196 HA ALA 25 HA ALA 25 10.201 -15.626 -8.862 197 1HB ALA 25 1HB ALA 25 11.857 -17.154 -7.627 198 2HB ALA 25 3HB ALA 25 10.815 -16.960 -6.217 199 3HB ALA 25 2HB ALA 25 10.183 -17.705 -7.685 200 H CYS 26 HN CYS 26 8.038 -15.196 -8.650 201 HA CYS 26 HA CYS 26 6.874 -14.737 -5.955 202 1HB CYS 26 2HB CYS 26 7.683 -12.686 -7.787 203 2HB CYS 26 1HB CYS 26 5.922 -12.677 -7.691 204 H THR 27 HN THR 27 4.367 -13.963 -6.607 205 HA THR 27 HA THR 27 3.420 -16.114 -8.470 206 HB THR 27 HB THR 27 1.298 -15.771 -7.004 207 HG1 THR 27 1HG THR 27 2.037 -14.991 -4.872 208 1HG2 THR 27 1HG2 THR 27 3.105 -17.629 -6.901 209 2HG2 THR 27 3HG2 THR 27 3.694 -16.770 -5.478 210 3HG2 THR 27 2HG2 THR 27 2.053 -17.417 -5.501 211 H ARG 28 HN ARG 28 1.152 -15.517 -9.392 212 HA ARG 28 HA ARG 28 1.394 -12.966 -10.806 213 1HB ARG 28 2HB ARG 28 -0.754 -15.112 -10.735 214 2HB ARG 28 1HB ARG 28 -0.651 -13.818 -11.929 215 1HG ARG 28 2HG ARG 28 1.642 -14.658 -12.537 216 2HG ARG 28 1HG ARG 28 1.368 -16.031 -11.466 217 1HD ARG 28 2HD ARG 28 -0.337 -15.299 -13.877 218 2HD ARG 28 1HD ARG 28 0.787 -16.667 -13.770 219 HE ARG 28 HE ARG 28 -0.866 -16.938 -11.540 220 1HH1 ARG 28 1HH1 ARG 28 -3.083 -15.746 -13.036 221 2HH1 ARG 28 2HH1 ARG 28 -3.743 -17.087 -13.911 222 1HH2 ARG 28 1HH2 ARG 28 -0.940 -19.084 -13.494 223 2HH2 ARG 28 2HH2 ARG 28 -2.531 -18.976 -14.171 224 H GLU 29 HN GLU 29 1.200 -12.267 -8.160 225 HA GLU 29 HA GLU 29 -1.433 -11.941 -7.094 226 1HB GLU 29 2HB GLU 29 0.662 -11.705 -5.824 227 2HB GLU 29 1HB GLU 29 1.099 -10.292 -6.786 228 1HG GLU 29 2HG GLU 29 -1.048 -9.210 -5.991 229 2HG GLU 29 1HG GLU 29 -1.238 -10.562 -4.877 230 H ASN 30 HN ASN 30 -2.941 -10.263 -7.350 231 HA ASN 30 HA ASN 30 -2.505 -8.475 -9.696 232 1HB ASN 30 2HB ASN 30 -5.006 -8.217 -9.455 233 2HB ASN 30 1HB ASN 30 -4.485 -9.883 -9.711 234 1HD2 ASN 30 1HD2 ASN 30 -5.691 -11.239 -8.384 235 2HD2 ASN 30 2HD2 ASN 30 -6.119 -10.904 -6.777 236 H ASP 31 HN ASP 31 -0.991 -7.454 -7.758 237 HA ASP 31 HA ASP 31 -2.635 -5.230 -6.598 238 1HB ASP 31 2HB ASP 31 -0.604 -7.084 -5.390 239 2HB ASP 31 1HB ASP 31 -0.754 -5.448 -4.748 240 HA PRO 32 HA PRO 32 0.789 -3.629 -9.314 241 1HB PRO 32 2HB PRO 32 -0.984 -1.438 -9.887 242 2HB PRO 32 1HB PRO 32 -0.449 -2.719 -10.978 243 1HG PRO 32 2HG PRO 32 -3.053 -2.362 -9.834 244 2HG PRO 32 1HG PRO 32 -2.508 -3.662 -10.896 245 1HD PRO 32 2HD PRO 32 -3.090 -3.795 -8.062 246 2HD PRO 32 1HD PRO 32 -2.595 -5.117 -9.145 247 H ILE 33 HN ILE 33 2.118 -1.808 -8.847 248 HA ILE 33 HA ILE 33 1.249 0.139 -6.790 249 HB ILE 33 HB ILE 33 2.855 -0.519 -5.180 250 1HG1 ILE 33 2HG1 ILE 33 4.792 -0.735 -6.622 251 2HG1 ILE 33 1HG1 ILE 33 4.621 -2.228 -5.698 252 1HG2 ILE 33 1HG2 ILE 33 0.959 -2.119 -5.379 253 2HG2 ILE 33 3HG2 ILE 33 1.937 -3.109 -6.462 254 3HG2 ILE 33 2HG2 ILE 33 2.428 -2.891 -4.782 255 1HD1 ILE 33 1HD1 ILE 33 3.243 -3.074 -7.726 256 2HD1 ILE 33 3HD1 ILE 33 3.971 -1.725 -8.598 257 3HD1 ILE 33 2HD1 ILE 33 4.995 -2.981 -7.902 258 H GLN 34 HN GLN 34 3.702 1.258 -6.225 259 HA GLN 34 HA GLN 34 4.825 1.978 -8.913 260 1HB GLN 34 2HB GLN 34 3.210 3.649 -8.041 261 2HB GLN 34 1HB GLN 34 4.169 3.792 -6.567 262 1HG GLN 34 2HG GLN 34 6.132 4.459 -8.005 263 2HG GLN 34 1HG GLN 34 5.036 4.497 -9.386 264 1HE2 GLN 34 1HE2 GLN 34 3.863 6.419 -9.696 265 2HE2 GLN 34 2HE2 GLN 34 3.758 7.673 -8.557 266 H GLY 35 HN GLY 35 7.067 2.103 -8.964 267 1HA GLY 35 1HA GLY 35 9.172 1.315 -8.096 268 2HA GLY 35 2HA GLY 35 8.498 1.385 -6.468 269 HA PRO 36 HA PRO 36 10.471 5.222 -5.730 270 1HB PRO 36 2HB PRO 36 13.186 4.445 -6.277 271 2HB PRO 36 1HB PRO 36 12.389 4.583 -4.709 272 1HG PRO 36 2HG PRO 36 13.170 2.188 -6.086 273 2HG PRO 36 1HG PRO 36 12.359 2.323 -4.525 274 1HD PRO 36 2HD PRO 36 11.242 1.426 -7.035 275 2HD PRO 36 1HD PRO 36 10.430 1.545 -5.456 276 H ASP 37 HN ASP 37 11.186 3.623 -8.750 277 HA ASP 37 HA ASP 37 12.540 5.858 -10.020 278 1HB ASP 37 2HB ASP 37 11.114 3.393 -11.065 279 2HB ASP 37 1HB ASP 37 12.115 4.456 -12.056 280 H GLY 38 HN GLY 38 9.208 4.933 -9.540 281 1HA GLY 38 1HA GLY 38 8.407 7.344 -11.113 282 2HA GLY 38 2HA GLY 38 7.532 6.742 -9.708 283 H LYS 39 HN LYS 39 8.735 4.328 -11.833 284 HA LYS 39 HA LYS 39 6.405 4.233 -13.601 285 1HB LYS 39 2HB LYS 39 8.584 2.196 -13.046 286 2HB LYS 39 1HB LYS 39 7.557 2.269 -14.479 287 1HG LYS 39 2HG LYS 39 8.538 4.364 -15.162 288 2HG LYS 39 1HG LYS 39 9.408 4.516 -13.635 289 1HD LYS 39 2HD LYS 39 10.750 2.543 -14.163 290 2HD LYS 39 1HD LYS 39 9.830 2.282 -15.645 291 1HE LYS 39 2HE LYS 39 11.723 3.438 -16.442 292 2HE LYS 39 1HE LYS 39 10.577 4.767 -16.184 293 1HZ LYS 39 3HZ LYS 39 11.465 4.833 -13.838 294 2HZ LYS 39 2HZ LYS 39 12.724 3.821 -14.364 295 3HZ LYS 39 1HZ LYS 39 12.538 5.371 -15.035 296 H VAL 40 HN VAL 40 4.982 2.291 -13.675 297 HA VAL 40 HA VAL 40 4.341 1.325 -10.921 298 HB VAL 40 HB VAL 40 2.749 1.387 -13.507 299 1HG1 VAL 40 2HG1 VAL 40 2.146 -0.387 -11.778 300 2HG1 VAL 40 1HG1 VAL 40 1.749 0.939 -10.685 301 3HG1 VAL 40 3HG1 VAL 40 0.854 0.738 -12.192 302 1HG2 VAL 40 3HG2 VAL 40 3.368 3.408 -11.539 303 2HG2 VAL 40 2HG2 VAL 40 2.425 3.562 -13.023 304 3HG2 VAL 40 1HG2 VAL 40 1.638 3.067 -11.524 305 H HIS 41 HN HIS 41 3.960 -0.954 -10.603 306 HA HIS 41 HA HIS 41 4.963 -2.721 -12.811 307 1HB HIS 41 2HB HIS 41 5.455 -3.062 -9.841 308 2HB HIS 41 1HB HIS 41 6.246 -3.919 -11.164 309 HD1 HIS 41 HD1 HIS 41 7.818 -2.417 -12.747 310 HD2 HIS 41 HD2 HIS 41 6.652 -0.633 -9.164 311 HE1 HIS 41 HE1 HIS 41 9.361 -0.439 -12.397 312 H GLY 42 HN GLY 42 4.250 -5.047 -12.450 313 1HA GLY 42 1HA GLY 42 2.517 -6.602 -12.162 314 2HA GLY 42 2HA GLY 42 1.425 -5.218 -12.145 315 H ASN 43 HN ASN 43 4.029 -6.245 -9.911 316 HA ASN 43 HA ASN 43 2.116 -5.853 -7.654 317 1HB ASN 43 2HB ASN 43 2.938 -8.073 -6.764 318 2HB ASN 43 1HB ASN 43 1.979 -8.196 -8.238 319 1HD2 ASN 43 1HD2 ASN 43 3.726 -10.298 -7.685 320 2HD2 ASN 43 2HD2 ASN 43 5.051 -10.250 -8.746 321 H THR 44 HN THR 44 3.696 -6.652 -5.587 322 HA THR 44 HA THR 44 5.650 -4.524 -5.374 323 HB THR 44 HB THR 44 4.801 -6.902 -3.717 324 HG1 THR 44 1HG THR 44 3.387 -5.307 -3.486 325 1HG2 THR 44 2HG2 THR 44 6.909 -4.839 -3.015 326 2HG2 THR 44 1HG2 THR 44 6.252 -6.049 -1.911 327 3HG2 THR 44 3HG2 THR 44 7.204 -6.554 -3.307 328 H CYS 45 HN CYS 45 5.799 -7.898 -6.330 329 HA CYS 45 HA CYS 45 8.614 -8.309 -5.856 330 1HB CYS 45 2HB CYS 45 6.985 -9.556 -8.077 331 2HB CYS 45 1HB CYS 45 8.311 -10.269 -7.160 332 H SER 46 HN SER 46 6.842 -7.547 -8.891 333 HA SER 46 HA SER 46 8.984 -7.123 -10.623 334 1HB SER 46 2HB SER 46 6.401 -5.575 -10.222 335 2HB SER 46 1HB SER 46 7.433 -5.382 -11.639 336 HG SER 46 HG SER 46 5.970 -7.632 -10.793 337 H MET 47 HN MET 47 7.675 -4.940 -8.145 338 HA MET 47 HA MET 47 9.482 -2.736 -8.663 339 1HB MET 47 2HB MET 47 7.213 -2.993 -7.324 340 2HB MET 47 1HB MET 47 8.280 -3.398 -5.983 341 1HG MET 47 2HG MET 47 9.423 -1.289 -6.152 342 2HG MET 47 1HG MET 47 8.600 -0.899 -7.662 343 1HE MET 47 2HE MET 47 8.356 -2.068 -4.273 344 2HE MET 47 1HE MET 47 7.486 -0.805 -3.405 345 3HE MET 47 3HE MET 47 6.615 -2.208 -4.041 346 H CYS 48 HN CYS 48 9.504 -5.606 -6.631 347 HA CYS 48 HA CYS 48 11.959 -4.968 -5.205 348 1HB CYS 48 2HB CYS 48 10.256 -7.438 -5.635 349 2HB CYS 48 1HB CYS 48 11.675 -7.449 -4.594 350 H GLU 49 HN GLU 49 11.134 -6.569 -8.222 351 HA GLU 49 HA GLU 49 13.645 -7.955 -8.612 352 1HB GLU 49 2HB GLU 49 11.518 -6.891 -10.507 353 2HB GLU 49 1HB GLU 49 12.813 -7.985 -10.989 354 1HG GLU 49 2HG GLU 49 11.999 -9.597 -9.244 355 2HG GLU 49 1HG GLU 49 10.619 -8.536 -8.977 356 H VAL 50 HN VAL 50 12.367 -4.881 -9.958 357 HA VAL 50 HA VAL 50 14.724 -4.036 -11.293 358 HB VAL 50 HB VAL 50 12.550 -2.951 -11.564 359 1HG1 VAL 50 2HG1 VAL 50 11.761 -3.311 -9.230 360 2HG1 VAL 50 1HG1 VAL 50 12.882 -2.066 -8.679 361 3HG1 VAL 50 3HG1 VAL 50 11.546 -1.640 -9.748 362 1HG2 VAL 50 1HG2 VAL 50 14.715 -1.609 -11.770 363 2HG2 VAL 50 3HG2 VAL 50 13.252 -0.662 -11.503 364 3HG2 VAL 50 2HG2 VAL 50 14.361 -0.968 -10.165 365 H PHE 51 HN PHE 51 13.666 -3.584 -7.931 366 HA PHE 51 HA PHE 51 15.922 -1.987 -7.101 367 1HB PHE 51 2HB PHE 51 13.908 -1.974 -5.806 368 2HB PHE 51 1HB PHE 51 13.870 -3.736 -5.726 369 HD1 PHE 51 HD1 PHE 51 16.419 -1.069 -5.028 370 HD2 PHE 51 HD2 PHE 51 14.384 -4.580 -3.625 371 HE1 PHE 51 HE1 PHE 51 17.748 -1.001 -2.933 372 HE2 PHE 51 HE2 PHE 51 15.711 -4.514 -1.531 373 HZ PHE 51 HZ PHE 51 17.393 -2.724 -1.185 374 H PHE 52 HN PHE 52 15.180 -5.450 -7.038 375 HA PHE 52 HA PHE 52 17.603 -6.298 -5.719 376 1HB PHE 52 2HB PHE 52 15.367 -7.483 -7.327 377 2HB PHE 52 1HB PHE 52 16.801 -8.471 -7.066 378 HD1 PHE 52 HD1 PHE 52 17.639 -7.550 -4.358 379 HD2 PHE 52 HD2 PHE 52 13.741 -8.453 -5.923 380 HE1 PHE 52 HE1 PHE 52 16.840 -8.074 -2.071 381 HE2 PHE 52 HE2 PHE 52 12.944 -8.976 -3.639 382 HZ PHE 52 HZ PHE 52 14.491 -8.786 -1.709 383 H GLN 53 HN GLN 53 16.651 -5.779 -9.082 384 HA GLN 53 HA GLN 53 19.018 -6.912 -10.297 385 1HB GLN 53 2HB GLN 53 16.607 -6.252 -11.170 386 2HB GLN 53 1HB GLN 53 17.373 -4.697 -11.487 387 1HG GLN 53 2HG GLN 53 19.229 -6.099 -12.650 388 2HG GLN 53 1HG GLN 53 18.032 -7.394 -12.660 389 1HE2 GLN 53 1HE2 GLN 53 15.860 -5.166 -12.868 390 2HE2 GLN 53 2HE2 GLN 53 15.878 -4.755 -14.514 391 H ALA 54 HN ALA 54 18.050 -3.635 -9.307 392 HA ALA 54 HA ALA 54 20.358 -2.265 -10.339 393 1HB ALA 54 1HB ALA 54 18.494 -1.633 -8.026 394 2HB ALA 54 2HB ALA 54 18.200 -1.221 -9.715 395 3HB ALA 54 3HB ALA 54 19.537 -0.470 -8.844 396 H GLU 55 HN GLU 55 19.693 -3.936 -7.281 397 HA GLU 55 HA GLU 55 21.832 -2.971 -5.703 398 1HB GLU 55 2HB GLU 55 20.298 -5.549 -5.937 399 2HB GLU 55 1HB GLU 55 21.629 -5.426 -4.785 400 1HG GLU 55 2HG GLU 55 20.558 -3.412 -3.799 401 2HG GLU 55 1HG GLU 55 19.208 -3.601 -4.918 402 H GLU 56 HN GLU 56 21.804 -5.374 -8.289 403 HA GLU 56 HA GLU 56 24.508 -6.334 -7.835 404 1HB GLU 56 2HB GLU 56 22.637 -6.391 -10.225 405 2HB GLU 56 1HB GLU 56 24.120 -7.339 -10.095 406 1HG GLU 56 2HG GLU 56 23.221 -8.400 -8.027 407 2HG GLU 56 1HG GLU 56 21.718 -7.503 -8.246 408 H GLU 57 HN GLU 57 23.046 -3.758 -9.765 409 HA GLU 57 HA GLU 57 25.501 -3.157 -11.241 410 1HB GLU 57 2HB GLU 57 22.880 -1.678 -10.836 411 2HB GLU 57 1HB GLU 57 24.105 -1.246 -12.028 412 1HG GLU 57 2HG GLU 57 22.804 -3.978 -11.904 413 2HG GLU 57 1HG GLU 57 22.205 -2.670 -12.923 414 H GLU 58 HN GLU 58 23.818 -1.879 -8.384 415 HA GLU 58 HA GLU 58 25.213 0.530 -7.974 416 1HB GLU 58 2HB GLU 58 23.289 -0.292 -6.663 417 2HB GLU 58 1HB GLU 58 24.298 -1.564 -5.973 418 1HG GLU 58 2HG GLU 58 25.814 0.241 -5.072 419 2HG GLU 58 1HG GLU 58 24.624 1.428 -5.609 420 H LYS 59 HN LYS 59 26.366 -2.746 -7.726 421 HA LYS 59 HA LYS 59 28.677 -2.126 -6.042 422 1HB LYS 59 2HB LYS 59 28.031 -4.501 -7.820 423 2HB LYS 59 1HB LYS 59 29.226 -4.472 -6.524 424 1HG LYS 59 2HG LYS 59 26.313 -3.831 -6.035 425 2HG LYS 59 1HG LYS 59 26.936 -5.477 -5.944 426 1HD LYS 59 2HD LYS 59 28.695 -4.568 -4.323 427 2HD LYS 59 1HD LYS 59 27.728 -3.095 -4.257 428 1HE LYS 59 2HE LYS 59 25.754 -4.844 -3.795 429 2HE LYS 59 1HE LYS 59 27.106 -5.818 -3.184 430 1HZ LYS 59 3HZ LYS 59 26.872 -2.953 -2.496 431 2HZ LYS 59 2HZ LYS 59 26.011 -4.117 -1.605 432 3HZ LYS 59 1HZ LYS 59 27.708 -4.178 -1.672 433 H LYS 60 HN LYS 60 27.935 -1.447 -9.246 434 HA LYS 60 HA LYS 60 30.308 -2.087 -10.678 435 1HB LYS 60 2HB LYS 60 29.517 -0.310 -12.189 436 2HB LYS 60 1HB LYS 60 28.156 -1.278 -11.621 437 1HG LYS 60 2HG LYS 60 27.837 0.455 -9.787 438 2HG LYS 60 1HG LYS 60 29.013 1.456 -10.639 439 1HD LYS 60 2HD LYS 60 27.517 1.092 -12.720 440 2HD LYS 60 1HD LYS 60 26.290 0.549 -11.576 441 1HE LYS 60 2HE LYS 60 27.500 3.013 -10.637 442 2HE LYS 60 1HE LYS 60 26.858 3.220 -12.279 443 1HZ LYS 60 1HZ LYS 60 25.346 1.780 -10.176 444 2HZ LYS 60 3HZ LYS 60 25.221 3.463 -10.352 445 3HZ LYS 60 2HZ LYS 60 24.763 2.440 -11.630 446 H LYS 61 HN LYS 61 29.558 0.620 -8.510 447 HA LYS 61 HA LYS 61 31.911 2.182 -9.127 448 1HB LYS 61 2HB LYS 61 30.160 2.056 -6.648 449 2HB LYS 61 1HB LYS 61 31.231 3.388 -7.085 450 1HG LYS 61 2HG LYS 61 29.937 3.732 -9.169 451 2HG LYS 61 1HG LYS 61 28.855 2.417 -8.705 452 1HD LYS 61 2HD LYS 61 28.289 3.671 -6.621 453 2HD LYS 61 1HD LYS 61 29.292 5.008 -7.186 454 1HE LYS 61 2HE LYS 61 27.188 3.965 -9.049 455 2HE LYS 61 1HE LYS 61 26.672 4.976 -7.686 456 1HZ LYS 61 2HZ LYS 61 28.815 6.313 -8.461 457 2HZ LYS 61 1HZ LYS 61 28.381 5.646 -9.962 458 3HZ LYS 61 3HZ LYS 61 27.278 6.620 -9.118 459 H LYS 62 HN LYS 62 33.988 1.871 -8.398 460 HA LYS 62 HA LYS 62 34.754 -0.483 -6.938 461 1HB LYS 62 2HB LYS 62 36.182 2.136 -7.507 462 2HB LYS 62 1HB LYS 62 36.973 0.657 -6.962 463 1HG LYS 62 2HG LYS 62 36.133 -0.517 -8.979 464 2HG LYS 62 1HG LYS 62 35.390 0.985 -9.530 465 1HD LYS 62 2HD LYS 62 37.625 2.065 -9.544 466 2HD LYS 62 1HD LYS 62 38.352 0.537 -9.046 467 1HE LYS 62 2HE LYS 62 36.662 0.040 -11.319 468 2HE LYS 62 1HE LYS 62 37.761 1.380 -11.701 469 1HZ LYS 62 3HZ LYS 62 39.597 0.061 -10.818 470 2HZ LYS 62 2HZ LYS 62 38.539 -1.226 -10.485 471 3HZ LYS 62 1HZ LYS 62 38.836 -0.760 -12.092 472 H GLU 63 HN GLU 63 33.829 2.742 -5.933 473 HA GLU 63 HA GLU 63 33.753 3.745 -3.788 474 1HB GLU 63 2HB GLU 63 33.282 0.796 -3.255 475 2HB GLU 63 1HB GLU 63 32.955 2.069 -2.079 476 1HG GLU 63 2HG GLU 63 31.704 1.819 -4.833 477 2HG GLU 63 1HG GLU 63 30.900 1.500 -3.297 478 H GLY 64 HN GLY 64 35.918 4.452 -3.464 479 1HA GLY 64 1HA GLY 64 38.310 3.617 -3.082 480 2HA GLY 64 2HA GLY 64 37.601 2.590 -1.837 481 H GLU 65 HN GLU 65 39.622 4.556 -1.324 482 HA GLU 65 HA GLU 65 38.144 6.235 0.637 483 1HB GLU 65 2HB GLU 65 41.081 5.568 0.249 484 2HB GLU 65 1HB GLU 65 40.420 6.469 1.613 485 1HG GLU 65 2HG GLU 65 39.651 3.634 0.854 486 2HG GLU 65 1HG GLU 65 40.742 4.072 2.169 487 H SER 66 HN SER 66 38.678 8.532 0.820 488 HA SER 66 HA SER 66 38.839 9.917 -1.698 489 1HB SER 66 2HB SER 66 38.778 11.884 -0.271 490 2HB SER 66 1HB SER 66 37.729 10.658 0.444 491 HG SER 66 HG SER 66 39.138 11.619 1.977 492 H ARG 67 HN ARG 67 41.248 8.846 0.604 493 HA ARG 67 HA ARG 67 43.359 10.213 -1.036 494 1HB ARG 67 2HB ARG 67 43.193 9.676 1.947 495 2HB ARG 67 1HB ARG 67 44.610 10.344 1.136 496 1HG ARG 67 2HG ARG 67 43.206 12.229 0.308 497 2HG ARG 67 1HG ARG 67 41.840 11.579 1.213 498 1HD ARG 67 2HD ARG 67 44.488 12.466 2.421 499 2HD ARG 67 1HD ARG 67 42.950 13.345 2.530 500 HE ARG 67 HE ARG 67 43.645 10.923 4.017 501 1HH1 ARG 67 1HH1 ARG 67 41.788 13.346 4.678 502 2HH1 ARG 67 2HH1 ARG 67 40.271 12.522 4.824 503 1HH2 ARG 67 1HH2 ARG 67 41.402 9.614 3.314 504 2HH2 ARG 67 2HH2 ARG 67 40.053 10.409 4.053 505 H ASN 68 HN ASN 68 45.264 8.963 -1.414 506 HA ASN 68 HA ASN 68 45.027 6.054 -0.704 507 1HB ASN 68 2HB ASN 68 46.089 7.469 -3.171 508 2HB ASN 68 1HB ASN 68 46.224 5.731 -2.900 509 1HD2 ASN 68 1HD2 ASN 68 44.741 6.682 -5.121 510 2HD2 ASN 68 2HD2 ASN 68 43.092 6.376 -4.861 No H/Q in entry = 510 Start of MODEL 9 1 H1 GLU 1 1H GLU 1 12.370 12.367 7.354 2 H2 GLU 1 3H GLU 1 12.331 13.427 8.677 3 H3 GLU 1 2H GLU 1 11.559 13.855 7.226 4 HA GLU 1 HA GLU 1 13.505 14.397 6.163 5 1HB GLU 1 2HB GLU 1 14.021 14.763 9.134 6 2HB GLU 1 1HB GLU 1 14.780 15.695 7.841 7 1HG GLU 1 2HG GLU 1 12.639 16.608 7.163 8 2HG GLU 1 1HG GLU 1 11.784 15.554 8.290 9 H SER 2 HN SER 2 13.816 11.817 8.455 10 HA SER 2 HA SER 2 16.694 11.397 7.861 11 1HB SER 2 2HB SER 2 16.535 9.784 9.651 12 2HB SER 2 1HB SER 2 15.611 11.199 10.151 13 HG SER 2 HG SER 2 13.835 9.903 8.968 14 H GLY 3 HN GLY 3 14.136 10.895 6.035 15 1HA GLY 3 1HA GLY 3 14.799 8.065 5.342 16 2HA GLY 3 2HA GLY 3 14.742 9.306 4.090 17 H LYS 4 HN LYS 4 13.054 7.336 3.587 18 HA LYS 4 HA LYS 4 10.409 8.565 3.897 19 1HB LYS 4 2HB LYS 4 11.323 5.964 2.624 20 2HB LYS 4 1HB LYS 4 9.771 6.756 2.354 21 1HG LYS 4 2HG LYS 4 10.991 8.755 1.484 22 2HG LYS 4 1HG LYS 4 12.506 7.870 1.660 23 1HD LYS 4 2HD LYS 4 11.692 6.145 0.105 24 2HD LYS 4 1HD LYS 4 10.156 6.997 -0.050 25 1HE LYS 4 2HE LYS 4 12.296 8.858 -0.552 26 2HE LYS 4 1HE LYS 4 12.517 7.425 -1.574 27 1HZ LYS 4 1HZ LYS 4 9.881 8.734 -1.198 28 2HZ LYS 4 3HZ LYS 4 10.935 9.178 -2.450 29 3HZ LYS 4 2HZ LYS 4 10.322 7.594 -2.379 30 H ALA 5 HN ALA 5 8.536 7.238 4.674 31 HA ALA 5 HA ALA 5 8.902 6.199 7.294 32 1HB ALA 5 3HB ALA 5 6.796 6.394 5.229 33 2HB ALA 5 2HB ALA 5 6.556 5.092 6.395 34 3HB ALA 5 1HB ALA 5 6.713 6.757 6.953 35 H THR 6 HN THR 6 9.366 4.713 4.196 36 HA THR 6 HA THR 6 9.873 2.096 5.558 37 HB THR 6 HB THR 6 8.544 2.394 2.856 38 HG1 THR 6 1HG THR 6 7.072 1.742 5.122 39 1HG2 THR 6 3HG2 THR 6 9.404 0.203 4.570 40 2HG2 THR 6 2HG2 THR 6 7.691 0.087 4.170 41 3HG2 THR 6 1HG2 THR 6 8.893 0.168 2.883 42 H SER 7 HN SER 7 11.297 0.675 4.181 43 HA SER 7 HA SER 7 12.997 2.248 2.278 44 1HB SER 7 2HB SER 7 14.233 2.216 4.292 45 2HB SER 7 1HB SER 7 13.710 0.578 4.687 46 HG SER 7 HG SER 7 14.976 -0.192 3.000 47 H TYR 8 HN TYR 8 13.865 1.003 0.550 48 HA TYR 8 HA TYR 8 12.375 -1.336 -0.248 49 1HB TYR 8 2HB TYR 8 14.994 -0.162 -1.240 50 2HB TYR 8 1HB TYR 8 13.974 -1.289 -2.134 51 HD1 TYR 8 HD1 TYR 8 11.272 -0.237 -1.365 52 HD2 TYR 8 HD2 TYR 8 14.852 1.806 -2.573 53 HE1 TYR 8 HE1 TYR 8 9.908 1.658 -2.198 54 HE2 TYR 8 HE2 TYR 8 13.489 3.703 -3.406 55 HH TYR 8 HH TYR 8 10.478 4.312 -2.561 56 H ALA 9 HN ALA 9 15.806 -0.925 0.727 57 HA ALA 9 HA ALA 9 16.617 -3.614 0.655 58 1HB ALA 9 2HB ALA 9 17.949 -1.499 1.123 59 2HB ALA 9 3HB ALA 9 18.361 -2.871 2.151 60 3HB ALA 9 1HB ALA 9 17.344 -1.574 2.778 61 H GLU 10 HN GLU 10 14.483 -2.006 2.914 62 HA GLU 10 HA GLU 10 14.548 -4.339 4.772 63 1HB GLU 10 2HB GLU 10 14.727 -1.902 5.503 64 2HB GLU 10 1HB GLU 10 13.051 -1.710 4.986 65 1HG GLU 10 2HG GLU 10 12.457 -3.639 6.512 66 2HG GLU 10 1HG GLU 10 14.105 -3.569 7.134 67 H LEU 11 HN LEU 11 12.282 -2.392 2.825 68 HA LEU 11 HA LEU 11 9.938 -3.963 3.355 69 1HB LEU 11 2HB LEU 11 10.259 -1.598 2.348 70 2HB LEU 11 1HB LEU 11 10.549 -2.433 0.823 71 HG LEU 11 HG LEU 11 8.311 -3.695 1.462 72 1HD1 LEU 11 3HD1 LEU 11 8.536 -1.824 3.562 73 2HD1 LEU 11 2HD1 LEU 11 7.261 -1.210 2.509 74 3HD1 LEU 11 1HD1 LEU 11 7.140 -2.835 3.184 75 1HD2 LEU 11 3HD2 LEU 11 8.956 -1.277 -0.020 76 2HD2 LEU 11 2HD2 LEU 11 7.844 -2.579 -0.443 77 3HD2 LEU 11 1HD2 LEU 11 7.293 -1.241 0.565 78 H CYS 12 HN CYS 12 11.929 -3.822 0.395 79 HA CYS 12 HA CYS 12 10.848 -6.167 -0.824 80 1HB CYS 12 2HB CYS 12 13.402 -4.573 -1.042 81 2HB CYS 12 1HB CYS 12 13.144 -6.004 -2.042 82 H ASN 13 HN ASN 13 12.947 -5.774 1.853 83 HA ASN 13 HA ASN 13 14.752 -7.858 1.880 84 1HB ASN 13 2HB ASN 13 14.132 -6.193 3.688 85 2HB ASN 13 1HB ASN 13 12.779 -7.240 4.097 86 1HD2 ASN 13 1HD2 ASN 13 13.401 -8.287 6.011 87 2HD2 ASN 13 2HD2 ASN 13 14.886 -9.077 6.237 88 H GLU 14 HN GLU 14 11.301 -8.146 2.740 89 HA GLU 14 HA GLU 14 11.121 -10.881 3.266 90 1HB GLU 14 2HB GLU 14 9.337 -8.790 2.076 91 2HB GLU 14 1HB GLU 14 8.774 -10.461 2.082 92 1HG GLU 14 2HG GLU 14 9.029 -10.605 4.486 93 2HG GLU 14 1HG GLU 14 9.807 -9.023 4.542 94 H TYR 15 HN TYR 15 11.773 -9.352 0.189 95 HA TYR 15 HA TYR 15 11.046 -11.784 -1.339 96 1HB TYR 15 2HB TYR 15 12.014 -8.993 -1.958 97 2HB TYR 15 1HB TYR 15 11.953 -10.231 -3.211 98 HD1 TYR 15 HD1 TYR 15 9.718 -11.527 -3.470 99 HD2 TYR 15 HD2 TYR 15 10.080 -7.774 -1.418 100 HE1 TYR 15 HE1 TYR 15 7.281 -11.161 -3.719 101 HE2 TYR 15 HE2 TYR 15 7.643 -7.398 -1.672 102 HH TYR 15 HH TYR 15 5.508 -9.414 -2.082 103 H ARG 16 HN ARG 16 13.864 -10.275 0.065 104 HA ARG 16 HA ARG 16 15.983 -11.194 -1.499 105 1HB ARG 16 2HB ARG 16 15.604 -11.097 1.507 106 2HB ARG 16 1HB ARG 16 17.174 -11.333 0.734 107 1HG ARG 16 2HG ARG 16 16.722 -9.202 -0.571 108 2HG ARG 16 1HG ARG 16 15.335 -8.941 0.483 109 1HD ARG 16 2HD ARG 16 16.975 -9.172 2.449 110 2HD ARG 16 1HD ARG 16 18.265 -9.015 1.240 111 HE ARG 16 HE ARG 16 16.146 -6.991 1.016 112 1HH1 ARG 16 1HH1 ARG 16 17.230 -6.534 3.725 113 2HH1 ARG 16 2HH1 ARG 16 18.595 -5.510 3.428 114 1HH2 ARG 16 1HH2 ARG 16 18.750 -6.248 0.045 115 2HH2 ARG 16 2HH2 ARG 16 19.456 -5.348 1.344 116 H LYS 17 HN LYS 17 14.028 -13.031 0.822 117 HA LYS 17 HA LYS 17 15.537 -15.481 0.664 118 1HB LYS 17 2HB LYS 17 13.398 -16.411 1.619 119 2HB LYS 17 1HB LYS 17 13.980 -14.983 2.476 120 1HG LYS 17 2HG LYS 17 12.360 -13.580 1.460 121 2HG LYS 17 1HG LYS 17 12.000 -14.766 0.206 122 1HD LYS 17 2HD LYS 17 10.943 -16.236 1.810 123 2HD LYS 17 1HD LYS 17 11.467 -15.222 3.154 124 1HE LYS 17 2HE LYS 17 10.000 -13.431 2.484 125 2HE LYS 17 1HE LYS 17 9.649 -14.223 0.935 126 1HZ LYS 17 3HZ LYS 17 9.060 -16.192 2.591 127 2HZ LYS 17 2HZ LYS 17 8.717 -14.890 3.628 128 3HZ LYS 17 1HZ LYS 17 7.909 -15.031 2.140 129 H LEU 18 HN LEU 18 13.226 -13.935 -1.418 130 HA LEU 18 HA LEU 18 12.605 -16.398 -2.933 131 1HB LEU 18 2HB LEU 18 11.946 -13.551 -3.701 132 2HB LEU 18 1HB LEU 18 11.024 -15.016 -4.033 133 HG LEU 18 HG LEU 18 11.384 -13.674 -1.337 134 1HD1 LEU 18 2HD1 LEU 18 9.474 -13.391 -3.443 135 2HD1 LEU 18 1HD1 LEU 18 8.675 -14.189 -2.089 136 3HD1 LEU 18 3HD1 LEU 18 9.461 -12.628 -1.854 137 1HD2 LEU 18 1HD2 LEU 18 11.311 -16.313 -1.544 138 2HD2 LEU 18 3HD2 LEU 18 10.354 -15.486 -0.316 139 3HD2 LEU 18 2HD2 LEU 18 9.592 -16.026 -1.813 140 H VAL 19 HN VAL 19 14.574 -13.472 -3.205 141 HA VAL 19 HA VAL 19 15.323 -13.578 -5.926 142 HB VAL 19 HB VAL 19 16.770 -12.753 -3.395 143 1HG1 VAL 19 1HG1 VAL 19 17.636 -12.719 -6.257 144 2HG1 VAL 19 3HG1 VAL 19 18.048 -11.331 -5.250 145 3HG1 VAL 19 2HG1 VAL 19 18.600 -12.944 -4.797 146 1HG2 VAL 19 1HG2 VAL 19 14.598 -11.645 -4.652 147 2HG2 VAL 19 3HG2 VAL 19 15.740 -10.741 -3.657 148 3HG2 VAL 19 2HG2 VAL 19 15.927 -10.770 -5.411 149 H ARG 20 HN ARG 20 16.223 -15.304 -6.988 150 HA ARG 20 HA ARG 20 17.623 -17.437 -5.549 151 1HB ARG 20 2HB ARG 20 17.080 -16.838 -8.473 152 2HB ARG 20 1HB ARG 20 17.789 -18.344 -7.890 153 1HG ARG 20 2HG ARG 20 15.568 -18.059 -6.271 154 2HG ARG 20 1HG ARG 20 14.995 -17.439 -7.820 155 1HD ARG 20 2HD ARG 20 15.648 -19.499 -8.946 156 2HD ARG 20 1HD ARG 20 16.404 -20.109 -7.462 157 HE ARG 20 HE ARG 20 13.497 -19.875 -7.960 158 1HH1 ARG 20 1HH1 ARG 20 15.391 -22.043 -6.622 159 2HH1 ARG 20 2HH1 ARG 20 14.729 -22.026 -5.022 160 1HH2 ARG 20 1HH2 ARG 20 12.933 -19.100 -5.510 161 2HH2 ARG 20 2HH2 ARG 20 13.338 -20.359 -4.391 162 H ASN 21 HN ASN 21 18.870 -16.325 -8.620 163 HA ASN 21 HA ASN 21 21.447 -15.588 -7.270 164 1HB ASN 21 2HB ASN 21 22.546 -16.625 -9.154 165 2HB ASN 21 1HB ASN 21 21.295 -17.743 -8.614 166 1HD2 ASN 21 1HD2 ASN 21 19.289 -17.855 -9.905 167 2HD2 ASN 21 2HD2 ASN 21 19.289 -17.350 -11.523 168 H GLY 22 HN GLY 22 19.798 -13.494 -7.468 169 1HA GLY 22 1HA GLY 22 20.821 -12.000 -9.840 170 2HA GLY 22 2HA GLY 22 20.322 -11.256 -8.320 171 H LYS 23 HN LYS 23 18.274 -13.790 -9.294 172 HA LYS 23 HA LYS 23 16.408 -11.921 -10.698 173 1HB LYS 23 2HB LYS 23 16.981 -13.910 -11.936 174 2HB LYS 23 1HB LYS 23 16.692 -14.935 -10.530 175 1HG LYS 23 2HG LYS 23 14.580 -15.199 -11.278 176 2HG LYS 23 1HG LYS 23 14.304 -13.505 -10.873 177 1HD LYS 23 2HD LYS 23 14.923 -12.798 -13.095 178 2HD LYS 23 1HD LYS 23 15.477 -14.419 -13.513 179 1HE LYS 23 2HE LYS 23 13.169 -15.277 -13.283 180 2HE LYS 23 1HE LYS 23 12.608 -13.650 -12.853 181 1HZ LYS 23 3HZ LYS 23 14.089 -14.318 -15.346 182 2HZ LYS 23 2HZ LYS 23 12.400 -14.153 -15.261 183 3HZ LYS 23 1HZ LYS 23 13.405 -12.819 -14.946 184 H LEU 24 HN LEU 24 14.266 -11.683 -9.904 185 HA LEU 24 HA LEU 24 13.868 -12.581 -7.081 186 1HB LEU 24 2HB LEU 24 13.742 -10.124 -8.231 187 2HB LEU 24 1HB LEU 24 12.059 -10.623 -8.391 188 HG LEU 24 HG LEU 24 13.693 -10.336 -5.865 189 1HD1 LEU 24 2HD1 LEU 24 12.154 -8.527 -7.078 190 2HD1 LEU 24 1HD1 LEU 24 10.877 -9.407 -6.240 191 3HD1 LEU 24 3HD1 LEU 24 12.187 -8.667 -5.320 192 1HD2 LEU 24 3HD2 LEU 24 11.222 -11.978 -6.385 193 2HD2 LEU 24 2HD2 LEU 24 12.653 -12.401 -5.445 194 3HD2 LEU 24 1HD2 LEU 24 11.487 -11.243 -4.804 195 H ALA 25 HN ALA 25 12.100 -13.871 -6.552 196 HA ALA 25 HA ALA 25 10.636 -15.148 -8.770 197 1HB ALA 25 2HB ALA 25 11.659 -16.147 -6.568 198 2HB ALA 25 1HB ALA 25 10.167 -15.573 -5.825 199 3HB ALA 25 3HB ALA 25 10.102 -16.752 -7.134 200 H CYS 26 HN CYS 26 8.852 -14.072 -9.548 201 HA CYS 26 HA CYS 26 7.272 -12.353 -7.697 202 1HB CYS 26 2HB CYS 26 7.815 -12.563 -10.617 203 2HB CYS 26 1HB CYS 26 6.229 -11.946 -10.153 204 H THR 27 HN THR 27 4.866 -12.498 -7.881 205 HA THR 27 HA THR 27 3.945 -15.286 -8.511 206 HB THR 27 HB THR 27 2.301 -14.680 -6.559 207 HG1 THR 27 1HG THR 27 3.001 -13.099 -5.238 208 1HG2 THR 27 1HG2 THR 27 5.254 -15.194 -6.105 209 2HG2 THR 27 3HG2 THR 27 3.990 -15.458 -4.903 210 3HG2 THR 27 2HG2 THR 27 4.012 -16.415 -6.385 211 H ARG 28 HN ARG 28 1.263 -14.993 -8.277 212 HA ARG 28 HA ARG 28 0.611 -13.089 -10.472 213 1HB ARG 28 2HB ARG 28 -0.820 -15.439 -9.190 214 2HB ARG 28 1HB ARG 28 -1.483 -14.493 -10.523 215 1HG ARG 28 2HG ARG 28 0.615 -15.031 -11.828 216 2HG ARG 28 1HG ARG 28 1.058 -16.143 -10.534 217 1HD ARG 28 2HD ARG 28 -1.181 -17.293 -10.883 218 2HD ARG 28 1HD ARG 28 -1.379 -16.295 -12.336 219 HE ARG 28 HE ARG 28 1.199 -17.388 -12.519 220 1HH1 ARG 28 1HH1 ARG 28 -1.889 -17.979 -13.578 221 2HH1 ARG 28 2HH1 ARG 28 -1.672 -19.672 -13.878 222 1HH2 ARG 28 1HH2 ARG 28 1.430 -19.819 -12.336 223 2HH2 ARG 28 2HH2 ARG 28 0.207 -20.712 -13.175 224 H GLU 29 HN GLU 29 1.007 -12.227 -7.608 225 HA GLU 29 HA GLU 29 -1.488 -11.729 -6.314 226 1HB GLU 29 2HB GLU 29 0.709 -11.507 -5.252 227 2HB GLU 29 1HB GLU 29 1.132 -10.196 -6.355 228 1HG GLU 29 2HG GLU 29 -0.865 -8.926 -5.459 229 2HG GLU 29 1HG GLU 29 -1.032 -10.183 -4.234 230 H ASN 30 HN ASN 30 -2.894 -9.920 -6.432 231 HA ASN 30 HA ASN 30 -2.631 -8.284 -8.924 232 1HB ASN 30 2HB ASN 30 -4.966 -9.014 -7.127 233 2HB ASN 30 1HB ASN 30 -5.098 -7.980 -8.551 234 1HD2 ASN 30 1HD2 ASN 30 -5.787 -11.036 -7.696 235 2HD2 ASN 30 2HD2 ASN 30 -5.421 -11.862 -9.133 236 H ASP 31 HN ASP 31 -0.968 -7.188 -7.191 237 HA ASP 31 HA ASP 31 -2.491 -4.911 -5.973 238 1HB ASP 31 2HB ASP 31 -1.061 -6.971 -4.680 239 2HB ASP 31 1HB ASP 31 -0.025 -5.547 -4.589 240 HA PRO 32 HA PRO 32 0.899 -3.632 -8.979 241 1HB PRO 32 2HB PRO 32 -0.972 -1.670 -9.938 242 2HB PRO 32 1HB PRO 32 -0.326 -3.068 -10.800 243 1HG PRO 32 2HG PRO 32 -2.985 -2.698 -9.782 244 2HG PRO 32 1HG PRO 32 -2.337 -4.099 -10.638 245 1HD PRO 32 2HD PRO 32 -3.011 -3.885 -7.837 246 2HD PRO 32 1HD PRO 32 -2.370 -5.301 -8.701 247 H ILE 33 HN ILE 33 2.200 -1.832 -8.566 248 HA ILE 33 HA ILE 33 1.096 0.396 -6.927 249 HB ILE 33 HB ILE 33 2.624 0.062 -5.165 250 1HG1 ILE 33 2HG1 ILE 33 4.660 -0.150 -6.482 251 2HG1 ILE 33 1HG1 ILE 33 4.570 -1.495 -5.346 252 1HG2 ILE 33 1HG2 ILE 33 0.871 -1.838 -5.569 253 2HG2 ILE 33 3HG2 ILE 33 2.285 -2.818 -5.959 254 3HG2 ILE 33 2HG2 ILE 33 2.135 -2.080 -4.364 255 1HD1 ILE 33 3HD1 ILE 33 3.435 -2.797 -7.259 256 2HD1 ILE 33 2HD1 ILE 33 4.024 -1.512 -8.313 257 3HD1 ILE 33 1HD1 ILE 33 5.168 -2.502 -7.406 258 H GLN 34 HN GLN 34 3.423 1.767 -6.456 259 HA GLN 34 HA GLN 34 4.470 2.277 -9.222 260 1HB GLN 34 2HB GLN 34 4.058 4.151 -6.870 261 2HB GLN 34 1HB GLN 34 4.618 4.625 -8.473 262 1HG GLN 34 2HG GLN 34 2.505 3.861 -9.460 263 2HG GLN 34 1HG GLN 34 1.947 3.315 -7.879 264 1HE2 GLN 34 1HE2 GLN 34 0.482 5.289 -9.330 265 2HE2 GLN 34 2HE2 GLN 34 0.605 6.770 -8.510 266 H GLY 35 HN GLY 35 6.722 2.676 -9.422 267 1HA GLY 35 1HA GLY 35 8.891 1.796 -8.776 268 2HA GLY 35 2HA GLY 35 8.342 1.763 -7.100 269 HA PRO 36 HA PRO 36 10.232 5.618 -6.264 270 1HB PRO 36 2HB PRO 36 12.949 4.872 -6.844 271 2HB PRO 36 1HB PRO 36 12.159 4.963 -5.269 272 1HG PRO 36 2HG PRO 36 12.945 2.610 -6.713 273 2HG PRO 36 1HG PRO 36 12.148 2.701 -5.141 274 1HD PRO 36 2HD PRO 36 11.013 1.859 -7.662 275 2HD PRO 36 1HD PRO 36 10.212 1.938 -6.075 276 H ASP 37 HN ASP 37 10.916 4.093 -9.324 277 HA ASP 37 HA ASP 37 12.216 6.396 -10.554 278 1HB ASP 37 2HB ASP 37 10.940 3.849 -11.591 279 2HB ASP 37 1HB ASP 37 11.804 4.992 -12.621 280 H GLY 38 HN GLY 38 8.926 5.106 -10.407 281 1HA GLY 38 1HA GLY 38 8.004 7.512 -11.922 282 2HA GLY 38 2HA GLY 38 7.197 6.989 -10.446 283 H LYS 39 HN LYS 39 8.420 4.515 -12.527 284 HA LYS 39 HA LYS 39 5.984 4.210 -14.121 285 1HB LYS 39 2HB LYS 39 8.321 3.636 -14.837 286 2HB LYS 39 1HB LYS 39 8.322 2.333 -13.649 287 1HG LYS 39 2HG LYS 39 6.249 1.426 -14.782 288 2HG LYS 39 1HG LYS 39 6.501 2.622 -16.053 289 1HD LYS 39 2HD LYS 39 8.848 1.676 -16.315 290 2HD LYS 39 1HD LYS 39 8.348 0.359 -15.256 291 1HE LYS 39 2HE LYS 39 7.005 -0.594 -16.865 292 2HE LYS 39 1HE LYS 39 6.535 0.977 -17.542 293 1HZ LYS 39 1HZ LYS 39 9.359 0.281 -17.702 294 2HZ LYS 39 3HZ LYS 39 8.325 -0.620 -18.698 295 3HZ LYS 39 2HZ LYS 39 8.373 1.072 -18.837 296 H VAL 40 HN VAL 40 4.532 2.375 -13.939 297 HA VAL 40 HA VAL 40 4.216 1.419 -11.137 298 HB VAL 40 HB VAL 40 2.430 1.351 -13.593 299 1HG1 VAL 40 2HG1 VAL 40 2.288 -0.083 -11.113 300 2HG1 VAL 40 1HG1 VAL 40 0.991 1.111 -11.144 301 3HG1 VAL 40 3HG1 VAL 40 1.126 -0.076 -12.441 302 1HG2 VAL 40 3HG2 VAL 40 3.100 3.425 -11.740 303 2HG2 VAL 40 2HG2 VAL 40 1.925 3.476 -13.054 304 3HG2 VAL 40 1HG2 VAL 40 1.429 2.948 -11.447 305 H HIS 41 HN HIS 41 3.986 -0.850 -10.695 306 HA HIS 41 HA HIS 41 5.015 -2.649 -12.867 307 1HB HIS 41 2HB HIS 41 5.352 -2.871 -9.860 308 2HB HIS 41 1HB HIS 41 6.157 -3.853 -11.084 309 HD1 HIS 41 HD1 HIS 41 8.126 -2.793 -12.367 310 HD2 HIS 41 HD2 HIS 41 6.349 -0.191 -9.638 311 HE1 HIS 41 HE1 HIS 41 9.666 -0.791 -12.179 312 H GLY 42 HN GLY 42 4.345 -5.010 -12.423 313 1HA GLY 42 1HA GLY 42 2.600 -6.569 -12.241 314 2HA GLY 42 2HA GLY 42 1.492 -5.199 -12.306 315 H ASN 43 HN ASN 43 3.969 -6.248 -9.936 316 HA ASN 43 HA ASN 43 1.960 -5.780 -7.775 317 1HB ASN 43 2HB ASN 43 2.803 -8.001 -6.816 318 2HB ASN 43 1HB ASN 43 1.777 -8.111 -8.244 319 1HD2 ASN 43 1HD2 ASN 43 3.084 -10.304 -8.287 320 2HD2 ASN 43 2HD2 ASN 43 4.527 -10.281 -9.176 321 H THR 44 HN THR 44 3.552 -6.739 -5.692 322 HA THR 44 HA THR 44 5.367 -4.519 -5.294 323 HB THR 44 HB THR 44 4.745 -7.075 -3.801 324 HG1 THR 44 1HG THR 44 4.069 -4.343 -3.478 325 1HG2 THR 44 1HG2 THR 44 7.048 -6.328 -3.286 326 2HG2 THR 44 3HG2 THR 44 6.428 -4.724 -2.891 327 3HG2 THR 44 2HG2 THR 44 5.972 -6.115 -1.905 328 H CYS 45 HN CYS 45 5.915 -8.036 -5.659 329 HA CYS 45 HA CYS 45 8.704 -8.092 -5.446 330 1HB CYS 45 2HB CYS 45 8.551 -10.150 -6.675 331 2HB CYS 45 1HB CYS 45 7.044 -9.991 -5.773 332 H SER 46 HN SER 46 6.743 -7.166 -8.282 333 HA SER 46 HA SER 46 8.871 -6.924 -10.170 334 1HB SER 46 2HB SER 46 6.301 -5.333 -9.828 335 2HB SER 46 1HB SER 46 7.253 -5.413 -11.311 336 HG SER 46 HG SER 46 5.385 -6.924 -11.008 337 H MET 47 HN MET 47 7.634 -4.759 -7.667 338 HA MET 47 HA MET 47 9.353 -2.511 -8.395 339 1HB MET 47 2HB MET 47 7.094 -3.006 -6.835 340 2HB MET 47 1HB MET 47 8.347 -2.672 -5.642 341 1HG MET 47 2HG MET 47 8.912 -0.678 -7.313 342 2HG MET 47 1HG MET 47 7.219 -0.886 -7.761 343 1HE MET 47 3HE MET 47 9.667 -0.963 -5.098 344 2HE MET 47 2HE MET 47 9.205 0.257 -3.913 345 3HE MET 47 1HE MET 47 8.574 -1.382 -3.771 346 H CYS 48 HN CYS 48 9.639 -5.443 -6.601 347 HA CYS 48 HA CYS 48 11.998 -4.529 -5.058 348 1HB CYS 48 2HB CYS 48 10.217 -6.958 -5.177 349 2HB CYS 48 1HB CYS 48 11.753 -7.037 -4.315 350 H GLU 49 HN GLU 49 11.196 -6.371 -7.932 351 HA GLU 49 HA GLU 49 13.698 -7.803 -8.167 352 1HB GLU 49 2HB GLU 49 12.741 -8.553 -10.147 353 2HB GLU 49 1HB GLU 49 11.292 -7.974 -9.329 354 1HG GLU 49 2HG GLU 49 11.350 -5.892 -10.553 355 2HG GLU 49 1HG GLU 49 12.924 -6.284 -11.245 356 H VAL 50 HN VAL 50 12.498 -4.755 -9.619 357 HA VAL 50 HA VAL 50 14.805 -4.047 -11.108 358 HB VAL 50 HB VAL 50 12.902 -2.301 -9.508 359 1HG1 VAL 50 2HG1 VAL 50 14.695 -1.762 -11.888 360 2HG1 VAL 50 1HG1 VAL 50 13.406 -0.672 -11.379 361 3HG1 VAL 50 3HG1 VAL 50 14.764 -0.995 -10.299 362 1HG2 VAL 50 2HG2 VAL 50 12.663 -3.795 -12.083 363 2HG2 VAL 50 1HG2 VAL 50 11.452 -3.511 -10.834 364 3HG2 VAL 50 3HG2 VAL 50 11.880 -2.219 -11.955 365 H PHE 51 HN PHE 51 13.907 -3.367 -7.750 366 HA PHE 51 HA PHE 51 16.247 -1.907 -6.995 367 1HB PHE 51 2HB PHE 51 14.212 -1.947 -5.666 368 2HB PHE 51 1HB PHE 51 14.317 -3.698 -5.487 369 HD1 PHE 51 HD1 PHE 51 16.845 -0.952 -5.177 370 HD2 PHE 51 HD2 PHE 51 14.826 -4.231 -3.276 371 HE1 PHE 51 HE1 PHE 51 18.264 -0.655 -3.160 372 HE2 PHE 51 HE2 PHE 51 16.243 -3.936 -1.259 373 HZ PHE 51 HZ PHE 51 17.962 -2.148 -1.203 374 H PHE 52 HN PHE 52 15.426 -5.352 -6.703 375 HA PHE 52 HA PHE 52 17.878 -6.257 -5.568 376 1HB PHE 52 2HB PHE 52 15.558 -7.363 -7.089 377 2HB PHE 52 1HB PHE 52 16.985 -8.387 -6.957 378 HD1 PHE 52 HD1 PHE 52 18.039 -7.617 -4.304 379 HD2 PHE 52 HD2 PHE 52 13.998 -8.292 -5.592 380 HE1 PHE 52 HE1 PHE 52 17.394 -8.187 -1.980 381 HE2 PHE 52 HE2 PHE 52 13.355 -8.861 -3.270 382 HZ PHE 52 HZ PHE 52 15.049 -8.809 -1.463 383 H GLN 53 HN GLN 53 16.884 -5.685 -8.925 384 HA GLN 53 HA GLN 53 19.122 -6.913 -10.226 385 1HB GLN 53 2HB GLN 53 16.873 -6.046 -11.132 386 2HB GLN 53 1HB GLN 53 17.617 -4.449 -11.131 387 1HG GLN 53 2HG GLN 53 19.478 -5.386 -12.537 388 2HG GLN 53 1HG GLN 53 18.577 -6.900 -12.637 389 1HE2 GLN 53 1HE2 GLN 53 17.962 -3.370 -13.143 390 2HE2 GLN 53 2HE2 GLN 53 17.000 -3.590 -14.525 391 H ALA 54 HN ALA 54 18.534 -3.476 -9.396 392 HA ALA 54 HA ALA 54 21.060 -2.458 -10.196 393 1HB ALA 54 1HB ALA 54 19.137 -1.640 -7.993 394 2HB ALA 54 2HB ALA 54 19.116 -1.079 -9.665 395 3HB ALA 54 3HB ALA 54 20.444 -0.621 -8.598 396 H GLU 55 HN GLU 55 20.027 -3.965 -7.145 397 HA GLU 55 HA GLU 55 22.455 -3.394 -5.682 398 1HB GLU 55 2HB GLU 55 20.278 -5.493 -5.408 399 2HB GLU 55 1HB GLU 55 21.506 -5.176 -4.181 400 1HG GLU 55 2HG GLU 55 19.618 -3.064 -5.264 401 2HG GLU 55 1HG GLU 55 19.326 -3.972 -3.781 402 H GLU 56 HN GLU 56 21.518 -5.861 -7.985 403 HA GLU 56 HA GLU 56 23.338 -7.939 -7.372 404 1HB GLU 56 2HB GLU 56 21.455 -7.837 -9.080 405 2HB GLU 56 1HB GLU 56 22.559 -6.946 -10.127 406 1HG GLU 56 2HG GLU 56 24.155 -8.823 -10.054 407 2HG GLU 56 1HG GLU 56 23.065 -9.713 -8.991 408 H GLU 57 HN GLU 57 23.854 -4.854 -9.025 409 HA GLU 57 HA GLU 57 26.489 -5.447 -10.051 410 1HB GLU 57 2HB GLU 57 25.173 -2.816 -9.301 411 2HB GLU 57 1HB GLU 57 26.536 -3.014 -10.401 412 1HG GLU 57 2HG GLU 57 23.806 -4.266 -10.817 413 2HG GLU 57 1HG GLU 57 24.347 -2.778 -11.592 414 H GLU 58 HN GLU 58 25.305 -3.926 -7.051 415 HA GLU 58 HA GLU 58 27.727 -3.018 -5.947 416 1HB GLU 58 2HB GLU 58 25.492 -2.633 -5.006 417 2HB GLU 58 1HB GLU 58 25.334 -4.351 -4.635 418 1HG GLU 58 2HG GLU 58 27.409 -4.129 -3.198 419 2HG GLU 58 1HG GLU 58 27.300 -2.384 -3.432 420 H LYS 59 HN LYS 59 26.486 -6.309 -6.216 421 HA LYS 59 HA LYS 59 28.430 -7.486 -4.389 422 1HB LYS 59 2HB LYS 59 26.655 -8.639 -6.567 423 2HB LYS 59 1HB LYS 59 27.492 -9.587 -5.338 424 1HG LYS 59 2HG LYS 59 26.261 -8.368 -3.571 425 2HG LYS 59 1HG LYS 59 25.410 -7.444 -4.809 426 1HD LYS 59 2HD LYS 59 24.510 -9.571 -5.738 427 2HD LYS 59 1HD LYS 59 25.309 -10.455 -4.438 428 1HE LYS 59 2HE LYS 59 22.864 -9.934 -3.986 429 2HE LYS 59 1HE LYS 59 23.970 -9.290 -2.758 430 1HZ LYS 59 1HZ LYS 59 23.312 -7.705 -5.160 431 2HZ LYS 59 3HZ LYS 59 22.249 -7.708 -3.839 432 3HZ LYS 59 2HZ LYS 59 23.847 -7.167 -3.640 433 H LYS 60 HN LYS 60 28.571 -6.331 -7.608 434 HA LYS 60 HA LYS 60 30.256 -8.077 -8.989 435 1HB LYS 60 2HB LYS 60 30.901 -6.106 -10.226 436 2HB LYS 60 1HB LYS 60 29.235 -5.864 -9.700 437 1HG LYS 60 2HG LYS 60 30.138 -4.624 -7.694 438 2HG LYS 60 1HG LYS 60 31.739 -4.723 -8.429 439 1HD LYS 60 2HD LYS 60 30.686 -3.645 -10.502 440 2HD LYS 60 1HD LYS 60 29.293 -3.290 -9.482 441 1HE LYS 60 2HE LYS 60 30.371 -1.543 -8.511 442 2HE LYS 60 1HE LYS 60 31.797 -2.543 -8.174 443 1HZ LYS 60 1HZ LYS 60 31.225 -1.811 -10.957 444 2HZ LYS 60 3HZ LYS 60 31.884 -0.617 -9.949 445 3HZ LYS 60 2HZ LYS 60 32.722 -2.074 -10.197 446 H LYS 61 HN LYS 61 31.151 -5.702 -6.485 447 HA LYS 61 HA LYS 61 34.003 -6.137 -6.686 448 1HB LYS 61 2HB LYS 61 32.204 -5.073 -4.484 449 2HB LYS 61 1HB LYS 61 33.960 -4.914 -4.502 450 1HG LYS 61 2HG LYS 61 33.777 -3.727 -6.701 451 2HG LYS 61 1HG LYS 61 32.022 -3.787 -6.545 452 1HD LYS 61 2HD LYS 61 32.196 -2.546 -4.396 453 2HD LYS 61 1HD LYS 61 33.942 -2.439 -4.621 454 1HE LYS 61 2HE LYS 61 33.279 -1.400 -6.963 455 2HE LYS 61 1HE LYS 61 31.750 -1.047 -6.135 456 1HZ LYS 61 2HZ LYS 61 33.253 -0.251 -4.238 457 2HZ LYS 61 1HZ LYS 61 34.491 -0.202 -5.401 458 3HZ LYS 61 3HZ LYS 61 33.108 0.760 -5.596 459 H LYS 62 HN LYS 62 35.323 -7.497 -5.408 460 HA LYS 62 HA LYS 62 33.880 -9.508 -3.709 461 1HB LYS 62 2HB LYS 62 34.603 -10.376 -5.914 462 2HB LYS 62 1HB LYS 62 36.257 -9.876 -5.562 463 1HG LYS 62 2HG LYS 62 36.263 -11.370 -3.576 464 2HG LYS 62 1HG LYS 62 34.632 -11.899 -3.989 465 1HD LYS 62 2HD LYS 62 35.449 -12.739 -6.160 466 2HD LYS 62 1HD LYS 62 37.079 -12.204 -5.756 467 1HE LYS 62 2HE LYS 62 35.564 -14.105 -3.953 468 2HE LYS 62 1HE LYS 62 36.548 -14.690 -5.309 469 1HZ LYS 62 3HZ LYS 62 37.584 -12.702 -3.373 470 2HZ LYS 62 2HZ LYS 62 37.713 -14.370 -3.072 471 3HZ LYS 62 1HZ LYS 62 38.461 -13.691 -4.438 472 H GLU 63 HN GLU 63 34.688 -9.643 -1.645 473 HA GLU 63 HA GLU 63 36.716 -7.903 -0.651 474 1HB GLU 63 2HB GLU 63 35.604 -10.522 0.406 475 2HB GLU 63 1HB GLU 63 36.494 -9.343 1.369 476 1HG GLU 63 2HG GLU 63 34.769 -7.637 0.837 477 2HG GLU 63 1HG GLU 63 33.868 -8.852 -0.071 478 H GLY 64 HN GLY 64 38.925 -8.245 -0.262 479 1HA GLY 64 1HA GLY 64 41.040 -9.108 -0.883 480 2HA GLY 64 2HA GLY 64 40.218 -10.345 -1.834 481 H GLU 65 HN GLU 65 41.615 -11.985 -0.926 482 HA GLU 65 HA GLU 65 40.563 -13.281 1.422 483 1HB GLU 65 2HB GLU 65 43.099 -13.622 -0.208 484 2HB GLU 65 1HB GLU 65 42.556 -14.769 1.017 485 1HG GLU 65 2HG GLU 65 40.424 -15.054 -0.229 486 2HG GLU 65 1HG GLU 65 41.021 -13.954 -1.471 487 H SER 66 HN SER 66 43.034 -10.875 0.939 488 HA SER 66 HA SER 66 44.545 -11.379 3.362 489 1HB SER 66 2HB SER 66 45.553 -9.228 2.794 490 2HB SER 66 1HB SER 66 45.311 -10.149 1.311 491 HG SER 66 HG SER 66 44.197 -7.797 2.108 492 H ARG 67 HN ARG 67 41.529 -9.800 2.671 493 HA ARG 67 HA ARG 67 41.395 -8.884 5.520 494 1HB ARG 67 2HB ARG 67 41.897 -7.015 3.964 495 2HB ARG 67 1HB ARG 67 40.454 -7.416 3.033 496 1HG ARG 67 2HG ARG 67 39.030 -6.940 4.953 497 2HG ARG 67 1HG ARG 67 40.442 -6.669 5.972 498 1HD ARG 67 2HD ARG 67 39.560 -4.500 5.240 499 2HD ARG 67 1HD ARG 67 41.107 -4.786 4.421 500 HE ARG 67 HE ARG 67 38.440 -5.335 3.155 501 1HH1 ARG 67 1HH1 ARG 67 40.262 -2.856 2.661 502 2HH1 ARG 67 2HH1 ARG 67 40.956 -3.295 1.136 503 1HH2 ARG 67 1HH2 ARG 67 39.985 -6.617 1.352 504 2HH2 ARG 67 2HH2 ARG 67 40.800 -5.424 0.395 505 H ASN 68 HN ASN 68 39.408 -9.308 6.502 506 HA ASN 68 HA ASN 68 37.560 -11.106 5.118 507 1HB ASN 68 2HB ASN 68 38.323 -11.136 7.561 508 2HB ASN 68 1HB ASN 68 37.256 -9.754 7.811 509 1HD2 ASN 68 1HD2 ASN 68 36.572 -11.986 9.252 510 2HD2 ASN 68 2HD2 ASN 68 35.227 -12.766 8.573 No H/Q in entry = 510 Start of MODEL 10 1 H1 GLU 1 3H GLU 1 11.510 15.969 4.404 2 H2 GLU 1 2H GLU 1 10.477 14.642 4.167 3 H3 GLU 1 1H GLU 1 10.082 15.836 5.309 4 HA GLU 1 HA GLU 1 11.531 15.050 6.871 5 1HB GLU 1 2HB GLU 1 10.918 12.711 5.034 6 2HB GLU 1 1HB GLU 1 11.382 12.566 6.729 7 1HG GLU 1 2HG GLU 1 9.397 13.922 7.364 8 2HG GLU 1 1HG GLU 1 8.923 13.994 5.667 9 H SER 2 HN SER 2 13.574 13.761 7.335 10 HA SER 2 HA SER 2 15.754 14.647 5.685 11 1HB SER 2 2HB SER 2 17.074 13.329 7.271 12 2HB SER 2 1HB SER 2 15.790 14.169 8.141 13 HG SER 2 HG SER 2 16.238 11.687 8.313 14 H GLY 3 HN GLY 3 13.801 11.737 5.702 15 1HA GLY 3 1HA GLY 3 15.308 9.776 4.554 16 2HA GLY 3 2HA GLY 3 15.051 10.871 3.196 17 H LYS 4 HN LYS 4 13.989 8.443 2.824 18 HA LYS 4 HA LYS 4 11.129 8.958 2.657 19 1HB LYS 4 2HB LYS 4 12.668 7.704 1.038 20 2HB LYS 4 1HB LYS 4 12.620 6.365 2.186 21 1HG LYS 4 2HG LYS 4 10.117 6.400 2.032 22 2HG LYS 4 1HG LYS 4 10.251 7.625 0.770 23 1HD LYS 4 2HD LYS 4 11.682 6.028 -0.539 24 2HD LYS 4 1HD LYS 4 11.349 4.800 0.682 25 1HE LYS 4 2HE LYS 4 9.688 4.375 -0.947 26 2HE LYS 4 1HE LYS 4 8.827 5.409 0.208 27 1HZ LYS 4 2HZ LYS 4 9.603 7.343 -1.117 28 2HZ LYS 4 1HZ LYS 4 10.216 6.267 -2.280 29 3HZ LYS 4 3HZ LYS 4 8.549 6.327 -1.978 30 H ALA 5 HN ALA 5 9.500 8.088 3.948 31 HA ALA 5 HA ALA 5 10.041 7.271 6.617 32 1HB ALA 5 1HB ALA 5 7.648 6.882 4.792 33 2HB ALA 5 3HB ALA 5 7.608 6.625 6.535 34 3HB ALA 5 2HB ALA 5 7.928 8.234 5.889 35 H THR 6 HN THR 6 9.893 5.434 3.640 36 HA THR 6 HA THR 6 10.276 2.915 5.230 37 HB THR 6 HB THR 6 8.990 3.189 2.500 38 HG1 THR 6 1HG THR 6 7.432 4.071 3.591 39 1HG2 THR 6 3HG2 THR 6 9.464 1.002 4.465 40 2HG2 THR 6 2HG2 THR 6 7.921 0.991 3.610 41 3HG2 THR 6 1HG2 THR 6 9.433 0.945 2.703 42 H SER 7 HN SER 7 11.518 1.236 3.952 43 HA SER 7 HA SER 7 13.408 2.463 1.977 44 1HB SER 7 2HB SER 7 14.597 2.472 4.030 45 2HB SER 7 1HB SER 7 13.931 0.914 4.517 46 HG SER 7 HG SER 7 15.740 1.394 2.387 47 H TYR 8 HN TYR 8 13.339 1.256 0.129 48 HA TYR 8 HA TYR 8 11.932 -1.139 -0.270 49 1HB TYR 8 2HB TYR 8 14.425 -0.075 -1.638 50 2HB TYR 8 1HB TYR 8 13.336 -1.282 -2.323 51 HD1 TYR 8 HD1 TYR 8 10.704 -0.494 -1.991 52 HD2 TYR 8 HD2 TYR 8 14.116 2.073 -2.470 53 HE1 TYR 8 HE1 TYR 8 9.227 1.314 -2.825 54 HE2 TYR 8 HE2 TYR 8 12.637 3.882 -3.304 55 HH TYR 8 HH TYR 8 9.212 3.715 -3.056 56 H ALA 9 HN ALA 9 15.451 -0.775 0.328 57 HA ALA 9 HA ALA 9 16.259 -3.443 0.265 58 1HB ALA 9 2HB ALA 9 17.093 -0.919 1.462 59 2HB ALA 9 1HB ALA 9 17.567 -2.293 2.460 60 3HB ALA 9 3HB ALA 9 18.086 -2.205 0.778 61 H GLU 10 HN GLU 10 14.338 -1.815 2.724 62 HA GLU 10 HA GLU 10 14.478 -4.186 4.518 63 1HB GLU 10 2HB GLU 10 14.732 -1.800 5.310 64 2HB GLU 10 1HB GLU 10 13.053 -1.526 4.844 65 1HG GLU 10 2HG GLU 10 12.426 -3.470 6.344 66 2HG GLU 10 1HG GLU 10 14.090 -3.466 6.928 67 H LEU 11 HN LEU 11 12.213 -2.370 2.490 68 HA LEU 11 HA LEU 11 9.847 -3.851 3.283 69 1HB LEU 11 2HB LEU 11 10.132 -1.519 2.180 70 2HB LEU 11 1HB LEU 11 10.304 -2.410 0.669 71 HG LEU 11 HG LEU 11 8.106 -3.618 1.458 72 1HD1 LEU 11 1HD1 LEU 11 8.503 -1.735 3.544 73 2HD1 LEU 11 3HD1 LEU 11 7.111 -1.177 2.615 74 3HD1 LEU 11 2HD1 LEU 11 7.117 -2.800 3.307 75 1HD2 LEU 11 2HD2 LEU 11 8.680 -1.305 -0.127 76 2HD2 LEU 11 1HD2 LEU 11 7.356 -2.455 -0.317 77 3HD2 LEU 11 3HD2 LEU 11 7.150 -1.033 0.707 78 H CYS 12 HN CYS 12 11.620 -3.810 0.183 79 HA CYS 12 HA CYS 12 10.451 -6.207 -0.848 80 1HB CYS 12 2HB CYS 12 12.836 -4.477 -1.385 81 2HB CYS 12 1HB CYS 12 12.751 -6.044 -2.191 82 H ASN 13 HN ASN 13 12.793 -5.694 1.595 83 HA ASN 13 HA ASN 13 14.626 -7.752 1.509 84 1HB ASN 13 2HB ASN 13 14.100 -6.003 3.308 85 2HB ASN 13 1HB ASN 13 12.910 -7.143 3.927 86 1HD2 ASN 13 1HD2 ASN 13 15.430 -6.264 5.271 87 2HD2 ASN 13 2HD2 ASN 13 16.340 -7.675 5.522 88 H GLU 14 HN GLU 14 11.255 -8.062 2.661 89 HA GLU 14 HA GLU 14 11.202 -10.774 3.352 90 1HB GLU 14 2HB GLU 14 9.325 -9.268 3.670 91 2HB GLU 14 1HB GLU 14 9.166 -9.030 1.930 92 1HG GLU 14 2HG GLU 14 8.626 -11.430 1.658 93 2HG GLU 14 1HG GLU 14 8.766 -11.653 3.402 94 H TYR 15 HN TYR 15 11.515 -9.360 0.170 95 HA TYR 15 HA TYR 15 10.801 -11.850 -1.233 96 1HB TYR 15 2HB TYR 15 11.903 -9.151 -2.063 97 2HB TYR 15 1HB TYR 15 11.535 -10.440 -3.209 98 HD1 TYR 15 HD1 TYR 15 10.113 -8.036 -0.802 99 HD2 TYR 15 HD2 TYR 15 9.242 -11.105 -3.676 100 HE1 TYR 15 HE1 TYR 15 7.726 -7.367 -0.791 101 HE2 TYR 15 HE2 TYR 15 6.853 -10.438 -3.665 102 HH TYR 15 HH TYR 15 5.433 -8.732 -1.371 103 H ARG 16 HN ARG 16 13.551 -10.604 0.333 104 HA ARG 16 HA ARG 16 15.736 -11.384 -1.264 105 1HB ARG 16 2HB ARG 16 15.308 -11.627 1.736 106 2HB ARG 16 1HB ARG 16 16.879 -11.622 0.934 107 1HG ARG 16 2HG ARG 16 14.956 -9.370 0.429 108 2HG ARG 16 1HG ARG 16 15.913 -9.378 1.910 109 1HD ARG 16 2HD ARG 16 17.988 -9.552 0.578 110 2HD ARG 16 1HD ARG 16 17.028 -9.557 -0.913 111 HE ARG 16 HE ARG 16 16.089 -7.312 0.307 112 1HH1 ARG 16 1HH1 ARG 16 18.859 -8.150 -1.353 113 2HH1 ARG 16 2HH1 ARG 16 19.787 -6.766 -0.879 114 1HH2 ARG 16 1HH2 ARG 16 17.460 -5.675 1.448 115 2HH2 ARG 16 2HH2 ARG 16 18.994 -5.364 0.707 116 H LYS 17 HN LYS 17 13.393 -13.319 0.454 117 HA LYS 17 HA LYS 17 14.964 -15.808 0.247 118 1HB LYS 17 2HB LYS 17 12.034 -15.547 0.932 119 2HB LYS 17 1HB LYS 17 13.204 -16.713 1.545 120 1HG LYS 17 2HG LYS 17 14.412 -14.610 2.524 121 2HG LYS 17 1HG LYS 17 12.854 -13.814 2.291 122 1HD LYS 17 2HD LYS 17 12.906 -16.489 3.640 123 2HD LYS 17 1HD LYS 17 13.405 -15.072 4.564 124 1HE LYS 17 2HE LYS 17 11.275 -13.993 4.209 125 2HE LYS 17 1HE LYS 17 10.790 -15.220 3.022 126 1HZ LYS 17 1HZ LYS 17 11.511 -15.813 5.848 127 2HZ LYS 17 3HZ LYS 17 9.915 -15.636 5.301 128 3HZ LYS 17 2HZ LYS 17 10.880 -16.902 4.707 129 H LEU 18 HN LEU 18 13.330 -13.963 -1.939 130 HA LEU 18 HA LEU 18 12.245 -16.308 -3.455 131 1HB LEU 18 2HB LEU 18 11.633 -13.333 -3.504 132 2HB LEU 18 1HB LEU 18 10.896 -14.512 -4.588 133 HG LEU 18 HG LEU 18 10.144 -15.769 -2.495 134 1HD1 LEU 18 3HD1 LEU 18 11.615 -13.543 -1.311 135 2HD1 LEU 18 2HD1 LEU 18 9.970 -13.658 -0.687 136 3HD1 LEU 18 1HD1 LEU 18 11.060 -15.040 -0.565 137 1HD2 LEU 18 1HD2 LEU 18 9.124 -13.294 -3.667 138 2HD2 LEU 18 3HD2 LEU 18 8.253 -14.760 -3.217 139 3HD2 LEU 18 2HD2 LEU 18 8.576 -13.520 -2.006 140 H VAL 19 HN VAL 19 13.938 -13.181 -3.880 141 HA VAL 19 HA VAL 19 14.918 -14.029 -6.544 142 HB VAL 19 HB VAL 19 14.083 -11.774 -6.285 143 1HG1 VAL 19 3HG1 VAL 19 15.720 -11.900 -3.807 144 2HG1 VAL 19 2HG1 VAL 19 15.661 -10.342 -4.631 145 3HG1 VAL 19 1HG1 VAL 19 14.169 -11.111 -4.091 146 1HG2 VAL 19 3HG2 VAL 19 16.920 -12.289 -6.829 147 2HG2 VAL 19 2HG2 VAL 19 15.755 -11.338 -7.750 148 3HG2 VAL 19 1HG2 VAL 19 16.588 -10.617 -6.372 149 H ARG 20 HN ARG 20 17.051 -14.616 -6.932 150 HA ARG 20 HA ARG 20 18.941 -14.518 -4.603 151 1HB ARG 20 2HB ARG 20 18.469 -16.678 -6.682 152 2HB ARG 20 1HB ARG 20 19.747 -16.726 -5.467 153 1HG ARG 20 2HG ARG 20 17.506 -16.166 -3.955 154 2HG ARG 20 1HG ARG 20 16.871 -17.260 -5.183 155 1HD ARG 20 2HD ARG 20 18.654 -18.896 -4.649 156 2HD ARG 20 1HD ARG 20 19.279 -17.797 -3.403 157 HE ARG 20 HE ARG 20 16.459 -18.188 -3.015 158 1HH1 ARG 20 1HH1 ARG 20 19.307 -18.690 -1.491 159 2HH1 ARG 20 2HH1 ARG 20 18.900 -20.205 -0.758 160 1HH2 ARG 20 1HH2 ARG 20 15.998 -20.624 -2.611 161 2HH2 ARG 20 2HH2 ARG 20 17.026 -21.300 -1.393 162 H ASN 21 HN ASN 21 19.616 -15.773 -7.820 163 HA ASN 21 HA ASN 21 21.713 -13.685 -8.148 164 1HB ASN 21 2HB ASN 21 21.129 -16.307 -9.565 165 2HB ASN 21 1HB ASN 21 22.544 -15.295 -9.857 166 1HD2 ASN 21 1HD2 ASN 21 21.156 -17.681 -7.731 167 2HD2 ASN 21 2HD2 ASN 21 22.445 -17.748 -6.631 168 H GLY 22 HN GLY 22 18.828 -13.104 -8.625 169 1HA GLY 22 1HA GLY 22 19.048 -12.380 -11.517 170 2HA GLY 22 2HA GLY 22 18.179 -11.419 -10.321 171 H LYS 23 HN LYS 23 17.003 -13.837 -9.059 172 HA LYS 23 HA LYS 23 14.856 -14.293 -11.084 173 1HB LYS 23 2HB LYS 23 14.951 -16.739 -10.327 174 2HB LYS 23 1HB LYS 23 16.302 -16.189 -11.317 175 1HG LYS 23 2HG LYS 23 17.592 -15.740 -9.219 176 2HG LYS 23 1HG LYS 23 16.261 -16.436 -8.294 177 1HD LYS 23 2HD LYS 23 16.535 -18.514 -9.789 178 2HD LYS 23 1HD LYS 23 18.077 -17.813 -10.278 179 1HE LYS 23 2HE LYS 23 18.990 -18.001 -8.111 180 2HE LYS 23 1HE LYS 23 17.391 -18.113 -7.350 181 1HZ LYS 23 3HZ LYS 23 18.224 -20.098 -9.368 182 2HZ LYS 23 2HZ LYS 23 18.738 -20.272 -7.758 183 3HZ LYS 23 1HZ LYS 23 17.080 -20.258 -8.127 184 H LEU 24 HN LEU 24 13.609 -12.836 -9.683 185 HA LEU 24 HA LEU 24 13.161 -13.508 -6.874 186 1HB LEU 24 2HB LEU 24 13.103 -11.211 -7.775 187 2HB LEU 24 1HB LEU 24 11.760 -11.653 -8.829 188 HG LEU 24 HG LEU 24 10.383 -12.178 -6.842 189 1HD1 LEU 24 1HD1 LEU 24 12.337 -12.775 -5.379 190 2HD1 LEU 24 3HD1 LEU 24 12.703 -11.054 -5.256 191 3HD1 LEU 24 2HD1 LEU 24 11.187 -11.682 -4.612 192 1HD2 LEU 24 1HD2 LEU 24 11.675 -9.453 -7.018 193 2HD2 LEU 24 3HD2 LEU 24 10.102 -9.955 -7.639 194 3HD2 LEU 24 2HD2 LEU 24 10.349 -9.783 -5.902 195 H ALA 25 HN ALA 25 11.754 -15.076 -6.204 196 HA ALA 25 HA ALA 25 9.785 -16.177 -8.143 197 1HB ALA 25 3HB ALA 25 10.938 -17.928 -7.174 198 2HB ALA 25 1HB ALA 25 9.639 -17.779 -5.990 199 3HB ALA 25 2HB ALA 25 11.213 -17.047 -5.671 200 H CYS 26 HN CYS 26 7.852 -15.075 -8.083 201 HA CYS 26 HA CYS 26 6.519 -14.766 -5.437 202 1HB CYS 26 2HB CYS 26 6.049 -12.448 -5.867 203 2HB CYS 26 1HB CYS 26 7.771 -12.671 -6.170 204 H THR 27 HN THR 27 4.212 -13.543 -6.287 205 HA THR 27 HA THR 27 3.059 -15.623 -8.082 206 HB THR 27 HB THR 27 0.921 -14.714 -7.085 207 HG1 THR 27 1HG THR 27 1.352 -13.374 -5.191 208 1HG2 THR 27 3HG2 THR 27 3.163 -15.992 -5.638 209 2HG2 THR 27 2HG2 THR 27 1.870 -15.351 -4.621 210 3HG2 THR 27 1HG2 THR 27 1.503 -16.547 -5.865 211 H ARG 28 HN ARG 28 0.848 -14.359 -9.038 212 HA ARG 28 HA ARG 28 1.907 -12.755 -11.216 213 1HB ARG 28 2HB ARG 28 -0.813 -13.659 -10.268 214 2HB ARG 28 1HB ARG 28 -0.638 -12.614 -11.678 215 1HG ARG 28 2HG ARG 28 1.017 -14.331 -12.582 216 2HG ARG 28 1HG ARG 28 0.485 -15.398 -11.283 217 1HD ARG 28 2HD ARG 28 -1.886 -15.101 -12.119 218 2HD ARG 28 1HD ARG 28 -1.217 -14.240 -13.518 219 HE ARG 28 HE ARG 28 -0.928 -17.121 -12.960 220 1HH1 ARG 28 1HH1 ARG 28 -1.213 -15.120 -15.485 221 2HH1 ARG 28 2HH1 ARG 28 0.176 -15.655 -16.370 222 1HH2 ARG 28 1HH2 ARG 28 1.481 -17.484 -13.729 223 2HH2 ARG 28 2HH2 ARG 28 1.703 -16.994 -15.375 224 H GLU 29 HN GLU 29 -0.307 -12.022 -8.483 225 HA GLU 29 HA GLU 29 0.464 -9.143 -8.788 226 1HB GLU 29 2HB GLU 29 -2.253 -10.448 -8.611 227 2HB GLU 29 1HB GLU 29 -2.024 -8.746 -8.209 228 1HG GLU 29 2HG GLU 29 -0.942 -8.442 -10.468 229 2HG GLU 29 1HG GLU 29 -1.414 -10.096 -10.854 230 H ASN 30 HN ASN 30 0.623 -8.006 -6.831 231 HA ASN 30 HA ASN 30 -0.278 -9.226 -4.300 232 1HB ASN 30 2HB ASN 30 2.655 -8.742 -4.928 233 2HB ASN 30 1HB ASN 30 2.010 -9.355 -3.406 234 1HD2 ASN 30 1HD2 ASN 30 3.204 -10.300 -6.462 235 2HD2 ASN 30 2HD2 ASN 30 2.690 -11.917 -6.428 236 H ASP 31 HN ASP 31 -1.474 -7.156 -4.277 237 HA ASP 31 HA ASP 31 -1.727 -4.921 -3.540 238 1HB ASP 31 2HB ASP 31 0.721 -6.033 -2.348 239 2HB ASP 31 1HB ASP 31 0.734 -4.272 -2.449 240 HA PRO 32 HA PRO 32 0.245 -3.444 -7.412 241 1HB PRO 32 2HB PRO 32 -1.837 -1.460 -7.466 242 2HB PRO 32 1HB PRO 32 -1.647 -2.867 -8.514 243 1HG PRO 32 2HG PRO 32 -3.591 -2.464 -6.441 244 2HG PRO 32 1HG PRO 32 -3.391 -3.878 -7.478 245 1HD PRO 32 2HD PRO 32 -2.771 -3.634 -4.665 246 2HD PRO 32 1HD PRO 32 -2.594 -5.066 -5.704 247 H ILE 33 HN ILE 33 1.822 -1.880 -7.394 248 HA ILE 33 HA ILE 33 1.457 0.556 -5.720 249 HB ILE 33 HB ILE 33 3.396 0.164 -4.446 250 1HG1 ILE 33 2HG1 ILE 33 4.960 -0.318 -6.220 251 2HG1 ILE 33 1HG1 ILE 33 5.051 -1.637 -5.052 252 1HG2 ILE 33 2HG2 ILE 33 1.459 -1.582 -4.171 253 2HG2 ILE 33 1HG2 ILE 33 2.632 -2.712 -4.849 254 3HG2 ILE 33 3HG2 ILE 33 2.995 -1.857 -3.350 255 1HD1 ILE 33 2HD1 ILE 33 3.246 -2.767 -6.566 256 2HD1 ILE 33 1HD1 ILE 33 3.792 -1.616 -7.785 257 3HD1 ILE 33 3HD1 ILE 33 4.927 -2.777 -7.098 258 H GLN 34 HN GLN 34 3.892 1.730 -6.077 259 HA GLN 34 HA GLN 34 4.217 1.823 -9.061 260 1HB GLN 34 2HB GLN 34 4.455 4.060 -7.022 261 2HB GLN 34 1HB GLN 34 4.521 4.233 -8.776 262 1HG GLN 34 2HG GLN 34 2.186 3.171 -8.813 263 2HG GLN 34 1HG GLN 34 2.153 3.439 -7.070 264 1HE2 GLN 34 1HE2 GLN 34 0.323 4.795 -8.814 265 2HE2 GLN 34 2HE2 GLN 34 0.703 6.450 -8.805 266 H GLY 35 HN GLY 35 6.424 2.761 -9.675 267 1HA GLY 35 1HA GLY 35 8.698 1.876 -9.608 268 2HA GLY 35 2HA GLY 35 8.496 1.593 -7.881 269 HA PRO 36 HA PRO 36 10.023 5.541 -6.730 270 1HB PRO 36 2HB PRO 36 12.770 4.706 -6.899 271 2HB PRO 36 1HB PRO 36 11.764 4.846 -5.456 272 1HG PRO 36 2HG PRO 36 12.682 2.449 -6.736 273 2HG PRO 36 1HG PRO 36 11.657 2.588 -5.306 274 1HD PRO 36 2HD PRO 36 10.896 1.746 -7.968 275 2HD PRO 36 1HD PRO 36 9.871 1.852 -6.517 276 H ASP 37 HN ASP 37 11.219 3.917 -9.595 277 HA ASP 37 HA ASP 37 12.710 6.172 -10.669 278 1HB ASP 37 2HB ASP 37 13.144 3.821 -11.250 279 2HB ASP 37 1HB ASP 37 11.522 3.678 -11.927 280 H GLY 38 HN GLY 38 9.460 5.847 -10.129 281 1HA GLY 38 1HA GLY 38 8.828 7.707 -12.373 282 2HA GLY 38 2HA GLY 38 7.936 7.620 -10.854 283 H LYS 39 HN LYS 39 8.934 4.725 -12.554 284 HA LYS 39 HA LYS 39 6.217 4.358 -13.706 285 1HB LYS 39 2HB LYS 39 8.267 3.983 -15.055 286 2HB LYS 39 1HB LYS 39 8.780 2.741 -13.911 287 1HG LYS 39 2HG LYS 39 6.355 1.768 -14.428 288 2HG LYS 39 1HG LYS 39 6.571 2.669 -15.928 289 1HD LYS 39 2HD LYS 39 8.893 1.519 -16.038 290 2HD LYS 39 1HD LYS 39 8.239 0.404 -14.837 291 1HE LYS 39 2HE LYS 39 6.684 0.999 -17.357 292 2HE LYS 39 1HE LYS 39 7.969 -0.225 -17.355 293 1HZ LYS 39 3HZ LYS 39 6.889 -1.105 -15.275 294 2HZ LYS 39 2HZ LYS 39 5.564 -0.097 -15.615 295 3HZ LYS 39 1HZ LYS 39 5.995 -1.333 -16.698 296 H VAL 40 HN VAL 40 5.010 2.396 -13.230 297 HA VAL 40 HA VAL 40 5.587 1.315 -10.504 298 HB VAL 40 HB VAL 40 3.223 0.938 -10.396 299 1HG1 VAL 40 2HG1 VAL 40 4.096 3.361 -10.404 300 2HG1 VAL 40 1HG1 VAL 40 3.446 3.461 -12.041 301 3HG1 VAL 40 3HG1 VAL 40 2.370 3.135 -10.682 302 1HG2 VAL 40 1HG2 VAL 40 3.521 0.786 -13.301 303 2HG2 VAL 40 3HG2 VAL 40 2.289 0.072 -12.261 304 3HG2 VAL 40 2HG2 VAL 40 2.120 1.739 -12.811 305 H HIS 41 HN HIS 41 4.357 -1.057 -10.465 306 HA HIS 41 HA HIS 41 5.249 -2.623 -12.846 307 1HB HIS 41 2HB HIS 41 5.962 -3.342 -9.991 308 2HB HIS 41 1HB HIS 41 6.612 -4.043 -11.473 309 HD1 HIS 41 HD1 HIS 41 8.663 -2.952 -12.439 310 HD2 HIS 41 HD2 HIS 41 6.775 -0.512 -9.634 311 HE1 HIS 41 HE1 HIS 41 10.170 -0.944 -12.107 312 H GLY 42 HN GLY 42 4.489 -4.989 -12.556 313 1HA GLY 42 1HA GLY 42 2.759 -6.523 -12.143 314 2HA GLY 42 2HA GLY 42 1.699 -5.116 -12.214 315 H ASN 43 HN ASN 43 4.083 -6.537 -9.937 316 HA ASN 43 HA ASN 43 2.241 -5.756 -7.706 317 1HB ASN 43 2HB ASN 43 2.822 -8.010 -6.728 318 2HB ASN 43 1HB ASN 43 1.871 -8.085 -8.210 319 1HD2 ASN 43 1HD2 ASN 43 2.910 -10.349 -8.298 320 2HD2 ASN 43 2HD2 ASN 43 4.436 -10.478 -9.027 321 H THR 44 HN THR 44 3.774 -6.804 -5.649 322 HA THR 44 HA THR 44 5.814 -4.779 -5.333 323 HB THR 44 HB THR 44 5.073 -7.274 -3.779 324 HG1 THR 44 1HG THR 44 3.657 -6.019 -2.851 325 1HG2 THR 44 2HG2 THR 44 7.437 -6.313 -3.425 326 2HG2 THR 44 1HG2 THR 44 6.627 -4.909 -2.732 327 3HG2 THR 44 3HG2 THR 44 6.422 -6.498 -1.995 328 H CYS 45 HN CYS 45 6.015 -8.345 -5.644 329 HA CYS 45 HA CYS 45 8.821 -8.573 -5.552 330 1HB CYS 45 2HB CYS 45 8.468 -10.728 -6.436 331 2HB CYS 45 1HB CYS 45 6.936 -10.346 -5.654 332 H SER 46 HN SER 46 6.728 -7.828 -8.352 333 HA SER 46 HA SER 46 8.764 -7.797 -10.355 334 1HB SER 46 2HB SER 46 6.292 -7.695 -10.713 335 2HB SER 46 1HB SER 46 6.282 -6.064 -10.042 336 HG SER 46 HG SER 46 8.037 -5.785 -11.772 337 H MET 47 HN MET 47 7.672 -5.409 -7.996 338 HA MET 47 HA MET 47 9.397 -3.249 -8.923 339 1HB MET 47 2HB MET 47 7.194 -3.245 -7.533 340 2HB MET 47 1HB MET 47 8.226 -3.640 -6.162 341 1HG MET 47 2HG MET 47 9.565 -1.628 -6.560 342 2HG MET 47 1HG MET 47 8.581 -1.230 -7.969 343 1HE MET 47 2HE MET 47 9.073 -1.744 -4.464 344 2HE MET 47 1HE MET 47 7.958 -0.689 -3.600 345 3HE MET 47 3HE MET 47 7.469 -2.332 -4.035 346 H CYS 48 HN CYS 48 9.487 -5.778 -6.477 347 HA CYS 48 HA CYS 48 11.931 -4.988 -5.174 348 1HB CYS 48 2HB CYS 48 10.375 -7.568 -5.482 349 2HB CYS 48 1HB CYS 48 11.795 -7.453 -4.451 350 H GLU 49 HN GLU 49 11.213 -6.776 -8.106 351 HA GLU 49 HA GLU 49 13.781 -8.064 -8.420 352 1HB GLU 49 2HB GLU 49 11.458 -7.298 -10.191 353 2HB GLU 49 1HB GLU 49 12.902 -8.042 -10.876 354 1HG GLU 49 2HG GLU 49 12.408 -9.670 -8.724 355 2HG GLU 49 1HG GLU 49 10.773 -9.232 -9.224 356 H VAL 50 HN VAL 50 12.379 -5.134 -9.962 357 HA VAL 50 HA VAL 50 14.724 -4.286 -11.321 358 HB VAL 50 HB VAL 50 12.544 -3.298 -11.734 359 1HG1 VAL 50 2HG1 VAL 50 12.701 -2.453 -8.828 360 2HG1 VAL 50 1HG1 VAL 50 11.504 -1.834 -9.963 361 3HG1 VAL 50 3HG1 VAL 50 11.525 -3.548 -9.552 362 1HG2 VAL 50 1HG2 VAL 50 14.553 -1.834 -12.008 363 2HG2 VAL 50 3HG2 VAL 50 13.095 -0.923 -11.616 364 3HG2 VAL 50 2HG2 VAL 50 14.302 -1.235 -10.368 365 H PHE 51 HN PHE 51 13.661 -3.802 -7.978 366 HA PHE 51 HA PHE 51 15.823 -2.009 -7.241 367 1HB PHE 51 2HB PHE 51 13.793 -2.006 -5.965 368 2HB PHE 51 1HB PHE 51 13.833 -3.759 -5.776 369 HD1 PHE 51 HD1 PHE 51 16.334 -1.007 -5.263 370 HD2 PHE 51 HD2 PHE 51 14.277 -4.381 -3.581 371 HE1 PHE 51 HE1 PHE 51 17.629 -0.748 -3.162 372 HE2 PHE 51 HE2 PHE 51 15.571 -4.122 -1.479 373 HZ PHE 51 HZ PHE 51 17.247 -2.307 -1.270 374 H PHE 52 HN PHE 52 15.191 -5.483 -6.905 375 HA PHE 52 HA PHE 52 17.567 -6.229 -5.516 376 1HB PHE 52 2HB PHE 52 15.534 -7.499 -7.318 377 2HB PHE 52 1HB PHE 52 16.982 -8.423 -6.931 378 HD1 PHE 52 HD1 PHE 52 17.542 -7.506 -4.164 379 HD2 PHE 52 HD2 PHE 52 13.826 -8.525 -6.062 380 HE1 PHE 52 HE1 PHE 52 16.571 -8.083 -1.958 381 HE2 PHE 52 HE2 PHE 52 12.856 -9.103 -3.855 382 HZ PHE 52 HZ PHE 52 14.227 -8.882 -1.803 383 H GLN 53 HN GLN 53 16.863 -5.764 -8.958 384 HA GLN 53 HA GLN 53 19.306 -6.798 -10.034 385 1HB GLN 53 2HB GLN 53 17.055 -6.116 -11.119 386 2HB GLN 53 1HB GLN 53 17.703 -4.477 -11.121 387 1HG GLN 53 2HG GLN 53 19.787 -5.547 -12.257 388 2HG GLN 53 1HG GLN 53 18.712 -6.904 -12.595 389 1HE2 GLN 53 1HE2 GLN 53 16.394 -4.817 -12.711 390 2HE2 GLN 53 2HE2 GLN 53 16.544 -4.155 -14.267 391 H ALA 54 HN ALA 54 18.339 -3.450 -9.214 392 HA ALA 54 HA ALA 54 20.784 -2.164 -9.863 393 1HB ALA 54 3HB ALA 54 18.895 -1.489 -7.589 394 2HB ALA 54 1HB ALA 54 18.506 -1.188 -9.283 395 3HB ALA 54 2HB ALA 54 19.876 -0.367 -8.533 396 H GLU 55 HN GLU 55 19.774 -3.869 -6.909 397 HA GLU 55 HA GLU 55 21.831 -3.095 -5.142 398 1HB GLU 55 2HB GLU 55 20.318 -5.678 -5.596 399 2HB GLU 55 1HB GLU 55 21.413 -5.461 -4.230 400 1HG GLU 55 2HG GLU 55 20.102 -3.385 -3.626 401 2HG GLU 55 1HG GLU 55 18.932 -3.841 -4.865 402 H GLU 56 HN GLU 56 21.907 -5.336 -7.859 403 HA GLU 56 HA GLU 56 24.393 -6.637 -7.271 404 1HB GLU 56 2HB GLU 56 23.029 -5.968 -9.901 405 2HB GLU 56 1HB GLU 56 24.288 -7.185 -9.691 406 1HG GLU 56 2HG GLU 56 22.837 -8.398 -8.094 407 2HG GLU 56 1HG GLU 56 21.576 -7.188 -8.329 408 H GLU 57 HN GLU 57 23.621 -3.487 -8.600 409 HA GLU 57 HA GLU 57 26.161 -2.944 -9.859 410 1HB GLU 57 2HB GLU 57 24.123 -1.055 -8.635 411 2HB GLU 57 1HB GLU 57 25.295 -0.661 -9.893 412 1HG GLU 57 2HG GLU 57 24.216 -2.448 -11.325 413 2HG GLU 57 1HG GLU 57 22.950 -2.567 -10.103 414 H GLU 58 HN GLU 58 24.822 -2.039 -6.657 415 HA GLU 58 HA GLU 58 26.980 -0.575 -5.629 416 1HB GLU 58 2HB GLU 58 25.141 -2.590 -4.299 417 2HB GLU 58 1HB GLU 58 26.107 -1.398 -3.429 418 1HG GLU 58 2HG GLU 58 24.953 0.423 -4.602 419 2HG GLU 58 1HG GLU 58 24.014 -0.750 -5.527 420 H LYS 59 HN LYS 59 26.652 -4.076 -6.000 421 HA LYS 59 HA LYS 59 29.016 -4.733 -4.426 422 1HB LYS 59 2HB LYS 59 27.354 -6.234 -6.474 423 2HB LYS 59 1HB LYS 59 28.593 -6.979 -5.464 424 1HG LYS 59 2HG LYS 59 27.356 -6.184 -3.441 425 2HG LYS 59 1HG LYS 59 26.081 -5.580 -4.499 426 1HD LYS 59 2HD LYS 59 25.922 -7.944 -5.443 427 2HD LYS 59 1HD LYS 59 26.960 -8.451 -4.110 428 1HE LYS 59 2HE LYS 59 25.334 -7.792 -2.473 429 2HE LYS 59 1HE LYS 59 24.376 -6.917 -3.682 430 1HZ LYS 59 3HZ LYS 59 24.379 -9.187 -4.887 431 2HZ LYS 59 2HZ LYS 59 24.755 -9.828 -3.359 432 3HZ LYS 59 1HZ LYS 59 23.312 -8.960 -3.589 433 H LYS 60 HN LYS 60 28.642 -3.281 -7.435 434 HA LYS 60 HA LYS 60 30.489 -4.512 -9.158 435 1HB LYS 60 2HB LYS 60 30.625 -2.300 -10.175 436 2HB LYS 60 1HB LYS 60 28.979 -2.548 -9.592 437 1HG LYS 60 2HG LYS 60 29.616 -1.343 -7.479 438 2HG LYS 60 1HG LYS 60 31.176 -0.976 -8.216 439 1HD LYS 60 2HD LYS 60 29.906 0.086 -10.135 440 2HD LYS 60 1HD LYS 60 28.440 -0.098 -9.173 441 1HE LYS 60 2HE LYS 60 29.077 1.533 -7.650 442 2HE LYS 60 1HE LYS 60 30.807 1.209 -7.876 443 1HZ LYS 60 3HZ LYS 60 29.059 2.322 -10.005 444 2HZ LYS 60 2HZ LYS 60 29.971 3.300 -8.958 445 3HZ LYS 60 1HZ LYS 60 30.751 2.218 -10.010 446 H LYS 61 HN LYS 61 31.088 -2.419 -6.361 447 HA LYS 61 HA LYS 61 33.881 -1.945 -6.815 448 1HB LYS 61 2HB LYS 61 32.241 -2.133 -4.266 449 2HB LYS 61 1HB LYS 61 33.825 -1.369 -4.399 450 1HG LYS 61 2HG LYS 61 32.895 0.200 -6.093 451 2HG LYS 61 1HG LYS 61 31.307 -0.534 -5.871 452 1HD LYS 61 2HD LYS 61 31.421 0.067 -3.445 453 2HD LYS 61 1HD LYS 61 32.944 0.900 -3.757 454 1HE LYS 61 2HE LYS 61 31.672 2.265 -5.522 455 2HE LYS 61 1HE LYS 61 30.190 1.601 -4.809 456 1HZ LYS 61 1HZ LYS 61 32.219 2.598 -2.963 457 2HZ LYS 61 3HZ LYS 61 31.384 3.772 -3.857 458 3HZ LYS 61 2HZ LYS 61 30.526 2.693 -2.864 459 H LYS 62 HN LYS 62 35.707 -3.096 -6.039 460 HA LYS 62 HA LYS 62 35.557 -5.945 -5.933 461 1HB LYS 62 2HB LYS 62 37.638 -3.948 -4.986 462 2HB LYS 62 1HB LYS 62 37.934 -5.679 -5.156 463 1HG LYS 62 2HG LYS 62 37.320 -5.527 -7.558 464 2HG LYS 62 1HG LYS 62 37.091 -3.789 -7.375 465 1HD LYS 62 2HD LYS 62 39.471 -3.610 -6.611 466 2HD LYS 62 1HD LYS 62 39.673 -5.327 -6.963 467 1HE LYS 62 2HE LYS 62 38.477 -4.147 -9.267 468 2HE LYS 62 1HE LYS 62 39.841 -3.118 -8.792 469 1HZ LYS 62 3HZ LYS 62 41.163 -5.184 -8.520 470 2HZ LYS 62 2HZ LYS 62 39.868 -6.069 -9.177 471 3HZ LYS 62 1HZ LYS 62 40.679 -4.913 -10.123 472 H GLU 63 HN GLU 63 35.119 -3.515 -3.476 473 HA GLU 63 HA GLU 63 35.729 -5.142 -1.165 474 1HB GLU 63 2HB GLU 63 35.635 -2.653 -1.251 475 2HB GLU 63 1HB GLU 63 33.893 -2.747 -1.507 476 1HG GLU 63 2HG GLU 63 33.705 -4.006 0.656 477 2HG GLU 63 1HG GLU 63 35.425 -3.719 0.923 478 H GLY 64 HN GLY 64 32.971 -4.895 -3.288 479 1HA GLY 64 1HA GLY 64 30.917 -6.029 -3.293 480 2HA GLY 64 2HA GLY 64 30.919 -5.818 -1.542 481 H GLU 65 HN GLU 65 33.526 -7.501 -3.164 482 HA GLU 65 HA GLU 65 32.377 -10.150 -2.446 483 1HB GLU 65 2HB GLU 65 33.356 -9.654 -4.699 484 2HB GLU 65 1HB GLU 65 34.915 -9.375 -3.921 485 1HG GLU 65 2HG GLU 65 34.826 -11.696 -3.003 486 2HG GLU 65 1HG GLU 65 33.329 -11.961 -3.897 487 H SER 66 HN SER 66 33.216 -11.372 -0.767 488 HA SER 66 HA SER 66 34.998 -10.105 1.156 489 1HB SER 66 2HB SER 66 34.521 -12.080 2.444 490 2HB SER 66 1HB SER 66 33.042 -11.690 1.567 491 HG SER 66 HG SER 66 34.802 -13.805 1.253 492 H ARG 67 HN ARG 67 37.040 -11.164 1.892 493 HA ARG 67 HA ARG 67 38.934 -11.565 -0.173 494 1HB ARG 67 2HB ARG 67 39.376 -10.965 2.204 495 2HB ARG 67 1HB ARG 67 38.930 -12.603 2.682 496 1HG ARG 67 2HG ARG 67 40.746 -13.479 1.200 497 2HG ARG 67 1HG ARG 67 41.231 -11.816 0.868 498 1HD ARG 67 2HD ARG 67 41.127 -13.064 3.641 499 2HD ARG 67 1HD ARG 67 42.604 -12.807 2.693 500 HE ARG 67 HE ARG 67 41.320 -10.330 2.684 501 1HH1 ARG 67 1HH1 ARG 67 42.874 -12.489 4.854 502 2HH1 ARG 67 2HH1 ARG 67 43.018 -11.325 6.128 503 1HH2 ARG 67 1HH2 ARG 67 41.311 -8.841 4.414 504 2HH2 ARG 67 2HH2 ARG 67 42.134 -9.260 5.879 505 H ASN 68 HN ASN 68 36.978 -13.927 1.631 506 HA ASN 68 HA ASN 68 38.035 -16.077 -0.175 507 1HB ASN 68 2HB ASN 68 38.340 -16.026 2.431 508 2HB ASN 68 1HB ASN 68 36.650 -16.526 2.460 509 1HD2 ASN 68 1HD2 ASN 68 37.487 -18.635 3.370 510 2HD2 ASN 68 2HD2 ASN 68 38.116 -19.797 2.303 No H/Q in entry = 510 Start of MODEL 11 1 H1 GLU 1 3H GLU 1 2.641 12.059 1.013 2 H2 GLU 1 2H GLU 1 1.324 11.081 1.453 3 H3 GLU 1 1H GLU 1 1.832 12.338 2.477 4 HA GLU 1 HA GLU 1 3.533 11.147 3.352 5 1HB GLU 1 2HB GLU 1 1.608 9.148 2.131 6 2HB GLU 1 1HB GLU 1 2.818 8.709 3.337 7 1HG GLU 1 2HG GLU 1 1.846 10.347 4.909 8 2HG GLU 1 1HG GLU 1 0.638 10.788 3.701 9 H SER 2 HN SER 2 5.603 11.043 2.560 10 HA SER 2 HA SER 2 6.101 9.921 -0.141 11 1HB SER 2 2HB SER 2 8.234 11.005 0.105 12 2HB SER 2 1HB SER 2 7.037 12.109 0.784 13 HG SER 2 HG SER 2 9.011 11.625 2.063 14 H GLY 3 HN GLY 3 5.868 8.706 2.955 15 1HA GLY 3 1HA GLY 3 6.710 6.131 2.473 16 2HA GLY 3 2HA GLY 3 6.826 6.864 4.070 17 H LYS 4 HN LYS 4 8.740 8.921 3.140 18 HA LYS 4 HA LYS 4 11.076 7.783 1.964 19 1HB LYS 4 2HB LYS 4 10.599 10.195 2.262 20 2HB LYS 4 1HB LYS 4 10.751 10.005 4.009 21 1HG LYS 4 2HG LYS 4 13.097 9.199 3.666 22 2HG LYS 4 1HG LYS 4 12.926 9.548 1.945 23 1HD LYS 4 2HD LYS 4 12.346 11.926 2.575 24 2HD LYS 4 1HD LYS 4 12.779 11.525 4.237 25 1HE LYS 4 2HE LYS 4 14.706 10.998 1.966 26 2HE LYS 4 1HE LYS 4 14.635 12.580 2.767 27 1HZ LYS 4 1HZ LYS 4 14.612 11.092 4.899 28 2HZ LYS 4 3HZ LYS 4 15.352 9.952 3.883 29 3HZ LYS 4 2HZ LYS 4 16.085 11.464 4.137 30 H ALA 5 HN ALA 5 9.960 7.905 5.334 31 HA ALA 5 HA ALA 5 12.295 7.051 6.672 32 1HB ALA 5 1HB ALA 5 9.737 7.670 7.322 33 2HB ALA 5 2HB ALA 5 10.839 6.866 8.440 34 3HB ALA 5 3HB ALA 5 9.678 5.918 7.512 35 H THR 6 HN THR 6 10.116 5.256 4.604 36 HA THR 6 HA THR 6 10.893 2.606 5.522 37 HB THR 6 HB THR 6 9.811 3.262 2.792 38 HG1 THR 6 1HG THR 6 7.836 3.692 3.686 39 1HG2 THR 6 1HG2 THR 6 10.079 0.953 4.425 40 2HG2 THR 6 3HG2 THR 6 8.356 1.309 4.307 41 3HG2 THR 6 2HG2 THR 6 9.313 1.077 2.843 42 H SER 7 HN SER 7 12.164 1.081 4.197 43 HA SER 7 HA SER 7 14.103 2.399 2.329 44 1HB SER 7 2HB SER 7 15.437 2.207 4.208 45 2HB SER 7 1HB SER 7 14.509 0.851 4.850 46 HG SER 7 HG SER 7 16.749 0.804 3.411 47 H TYR 8 HN TYR 8 13.992 1.341 0.391 48 HA TYR 8 HA TYR 8 12.528 -0.912 -0.281 49 1HB TYR 8 2HB TYR 8 15.241 -0.055 -1.343 50 2HB TYR 8 1HB TYR 8 14.077 -1.059 -2.208 51 HD1 TYR 8 HD1 TYR 8 11.525 0.253 -1.457 52 HD2 TYR 8 HD2 TYR 8 15.301 1.957 -2.591 53 HE1 TYR 8 HE1 TYR 8 10.364 2.293 -2.257 54 HE2 TYR 8 HE2 TYR 8 14.139 3.998 -3.392 55 HH TYR 8 HH TYR 8 11.503 5.040 -2.592 56 H ALA 9 HN ALA 9 16.048 -0.981 0.431 57 HA ALA 9 HA ALA 9 16.535 -3.707 0.370 58 1HB ALA 9 2HB ALA 9 18.365 -2.337 0.828 59 2HB ALA 9 3HB ALA 9 18.078 -3.045 2.418 60 3HB ALA 9 1HB ALA 9 17.494 -1.420 2.057 61 H GLU 10 HN GLU 10 14.867 -1.889 2.902 62 HA GLU 10 HA GLU 10 14.581 -4.296 4.601 63 1HB GLU 10 2HB GLU 10 15.036 -1.876 5.352 64 2HB GLU 10 1HB GLU 10 13.348 -1.555 4.952 65 1HG GLU 10 2HG GLU 10 12.844 -3.634 6.437 66 2HG GLU 10 1HG GLU 10 14.470 -3.380 7.070 67 H LEU 11 HN LEU 11 12.660 -2.243 2.461 68 HA LEU 11 HA LEU 11 10.092 -3.420 3.114 69 1HB LEU 11 2HB LEU 11 10.798 -1.160 1.969 70 2HB LEU 11 1HB LEU 11 10.803 -2.125 0.493 71 HG LEU 11 HG LEU 11 8.437 -2.916 1.513 72 1HD1 LEU 11 1HD1 LEU 11 9.195 -0.777 3.194 73 2HD1 LEU 11 3HD1 LEU 11 7.944 -0.136 2.128 74 3HD1 LEU 11 2HD1 LEU 11 7.616 -1.561 3.114 75 1HD2 LEU 11 1HD2 LEU 11 9.340 -0.887 -0.401 76 2HD2 LEU 11 3HD2 LEU 11 8.077 -2.106 -0.572 77 3HD2 LEU 11 2HD2 LEU 11 7.720 -0.572 0.221 78 H CYS 12 HN CYS 12 12.103 -3.665 0.171 79 HA CYS 12 HA CYS 12 10.697 -5.925 -0.909 80 1HB CYS 12 2HB CYS 12 13.321 -4.531 -1.349 81 2HB CYS 12 1HB CYS 12 12.998 -6.048 -2.190 82 H ASN 13 HN ASN 13 12.826 -5.654 1.716 83 HA ASN 13 HA ASN 13 14.500 -7.838 1.792 84 1HB ASN 13 2HB ASN 13 13.965 -6.130 3.573 85 2HB ASN 13 1HB ASN 13 12.524 -7.059 3.958 86 1HD2 ASN 13 1HD2 ASN 13 16.089 -7.526 3.612 87 2HD2 ASN 13 2HD2 ASN 13 16.205 -8.681 4.850 88 H GLU 14 HN GLU 14 11.017 -7.920 2.566 89 HA GLU 14 HA GLU 14 10.679 -10.639 3.125 90 1HB GLU 14 2HB GLU 14 8.968 -8.842 3.259 91 2HB GLU 14 1HB GLU 14 8.883 -8.807 1.499 92 1HG GLU 14 2HG GLU 14 8.135 -11.142 1.465 93 2HG GLU 14 1HG GLU 14 8.284 -11.232 3.221 94 H TYR 15 HN TYR 15 11.423 -9.155 0.043 95 HA TYR 15 HA TYR 15 10.766 -11.661 -1.425 96 1HB TYR 15 2HB TYR 15 11.652 -8.886 -2.272 97 2HB TYR 15 1HB TYR 15 11.273 -10.194 -3.396 98 HD1 TYR 15 HD1 TYR 15 8.931 -11.257 -3.253 99 HD2 TYR 15 HD2 TYR 15 9.958 -7.537 -1.380 100 HE1 TYR 15 HE1 TYR 15 6.526 -10.686 -3.067 101 HE2 TYR 15 HE2 TYR 15 7.559 -6.956 -1.207 102 HH TYR 15 HH TYR 15 5.372 -8.188 -1.123 103 H ARG 16 HN ARG 16 13.264 -10.695 0.410 104 HA ARG 16 HA ARG 16 15.528 -11.161 -1.378 105 1HB ARG 16 2HB ARG 16 15.064 -10.813 1.582 106 2HB ARG 16 1HB ARG 16 16.656 -11.270 0.975 107 1HG ARG 16 2HG ARG 16 16.510 -9.288 -0.596 108 2HG ARG 16 1HG ARG 16 15.068 -8.786 0.283 109 1HD ARG 16 2HD ARG 16 16.553 -8.965 2.411 110 2HD ARG 16 1HD ARG 16 17.916 -8.942 1.275 111 HE ARG 16 HE ARG 16 15.824 -6.861 0.932 112 1HH1 ARG 16 1HH1 ARG 16 18.422 -6.551 -0.414 113 2HH1 ARG 16 2HH1 ARG 16 19.293 -5.495 0.648 114 1HH2 ARG 16 1HH2 ARG 16 17.184 -6.032 3.346 115 2HH2 ARG 16 2HH2 ARG 16 18.592 -5.202 2.776 116 H LYS 17 HN LYS 17 13.535 -13.069 0.804 117 HA LYS 17 HA LYS 17 15.258 -15.408 0.872 118 1HB LYS 17 2HB LYS 17 12.253 -15.345 1.219 119 2HB LYS 17 1HB LYS 17 13.425 -16.367 2.049 120 1HG LYS 17 2HG LYS 17 14.387 -14.135 2.975 121 2HG LYS 17 1HG LYS 17 12.844 -13.438 2.479 122 1HD LYS 17 2HD LYS 17 12.855 -15.970 4.091 123 2HD LYS 17 1HD LYS 17 13.115 -14.428 4.907 124 1HE LYS 17 2HE LYS 17 11.002 -13.576 3.813 125 2HE LYS 17 1HE LYS 17 10.714 -15.225 3.224 126 1HZ LYS 17 1HZ LYS 17 11.284 -15.772 5.727 127 2HZ LYS 17 3HZ LYS 17 10.707 -14.195 5.971 128 3HZ LYS 17 2HZ LYS 17 9.703 -15.364 5.255 129 H LEU 18 HN LEU 18 13.447 -13.967 -1.564 130 HA LEU 18 HA LEU 18 12.805 -16.524 -2.953 131 1HB LEU 18 2HB LEU 18 12.102 -13.614 -3.492 132 2HB LEU 18 1HB LEU 18 11.473 -14.991 -4.394 133 HG LEU 18 HG LEU 18 10.605 -15.885 -2.157 134 1HD1 LEU 18 2HD1 LEU 18 11.736 -13.256 -1.352 135 2HD1 LEU 18 1HD1 LEU 18 10.171 -13.681 -0.664 136 3HD1 LEU 18 3HD1 LEU 18 11.561 -14.738 -0.415 137 1HD2 LEU 18 2HD2 LEU 18 9.414 -14.369 -4.026 138 2HD2 LEU 18 1HD2 LEU 18 8.580 -14.851 -2.548 139 3HD2 LEU 18 3HD2 LEU 18 9.305 -13.247 -2.667 140 H VAL 19 HN VAL 19 14.650 -13.505 -3.276 141 HA VAL 19 HA VAL 19 15.617 -13.801 -5.924 142 HB VAL 19 HB VAL 19 16.957 -12.677 -3.436 143 1HG1 VAL 19 2HG1 VAL 19 17.695 -12.756 -6.282 144 2HG1 VAL 19 1HG1 VAL 19 17.701 -11.132 -5.594 145 3HG1 VAL 19 3HG1 VAL 19 18.692 -12.399 -4.871 146 1HG2 VAL 19 3HG2 VAL 19 14.575 -11.913 -4.759 147 2HG2 VAL 19 2HG2 VAL 19 15.449 -11.007 -3.525 148 3HG2 VAL 19 1HG2 VAL 19 15.799 -10.734 -5.233 149 H ARG 20 HN ARG 20 17.351 -15.003 -6.785 150 HA ARG 20 HA ARG 20 18.606 -16.992 -4.927 151 1HB ARG 20 2HB ARG 20 17.990 -16.990 -7.895 152 2HB ARG 20 1HB ARG 20 18.912 -18.266 -7.099 153 1HG ARG 20 2HG ARG 20 16.642 -17.916 -5.491 154 2HG ARG 20 1HG ARG 20 16.038 -17.835 -7.146 155 1HD ARG 20 2HD ARG 20 17.299 -19.964 -7.640 156 2HD ARG 20 1HD ARG 20 17.683 -20.072 -5.911 157 HE ARG 20 HE ARG 20 14.852 -19.894 -6.889 158 1HH1 ARG 20 1HH1 ARG 20 17.123 -22.120 -5.877 159 2HH1 ARG 20 2HH1 ARG 20 16.177 -22.774 -4.581 160 1HH2 ARG 20 1HH2 ARG 20 13.711 -20.347 -4.804 161 2HH2 ARG 20 2HH2 ARG 20 14.245 -21.770 -3.974 162 H ASN 21 HN ASN 21 19.893 -16.538 -8.117 163 HA ASN 21 HA ASN 21 22.374 -15.382 -6.914 164 1HB ASN 21 2HB ASN 21 21.857 -16.847 -9.524 165 2HB ASN 21 1HB ASN 21 23.442 -16.387 -8.902 166 1HD2 ASN 21 1HD2 ASN 21 20.772 -18.655 -8.538 167 2HD2 ASN 21 2HD2 ASN 21 21.537 -19.663 -7.410 168 H GLY 22 HN GLY 22 20.419 -13.487 -7.293 169 1HA GLY 22 1HA GLY 22 21.466 -11.985 -9.644 170 2HA GLY 22 2HA GLY 22 20.712 -11.251 -8.227 171 H LYS 23 HN LYS 23 18.775 -13.765 -8.634 172 HA LYS 23 HA LYS 23 16.998 -12.336 -10.586 173 1HB LYS 23 2HB LYS 23 16.317 -14.558 -11.365 174 2HB LYS 23 1HB LYS 23 18.074 -14.423 -11.451 175 1HG LYS 23 2HG LYS 23 18.156 -15.497 -9.149 176 2HG LYS 23 1HG LYS 23 16.434 -15.831 -9.329 177 1HD LYS 23 2HD LYS 23 17.380 -16.763 -11.711 178 2HD LYS 23 1HD LYS 23 18.753 -17.102 -10.657 179 1HE LYS 23 2HE LYS 23 17.062 -18.159 -9.036 180 2HE LYS 23 1HE LYS 23 15.903 -18.088 -10.377 181 1HZ LYS 23 3HZ LYS 23 18.550 -19.056 -11.068 182 2HZ LYS 23 2HZ LYS 23 17.674 -20.079 -10.032 183 3HZ LYS 23 1HZ LYS 23 17.029 -19.639 -11.540 184 H LEU 24 HN LEU 24 15.125 -11.696 -9.598 185 HA LEU 24 HA LEU 24 14.376 -12.842 -6.972 186 1HB LEU 24 2HB LEU 24 14.450 -10.346 -7.791 187 2HB LEU 24 1HB LEU 24 12.889 -10.724 -8.510 188 HG LEU 24 HG LEU 24 13.653 -10.542 -5.620 189 1HD1 LEU 24 1HD1 LEU 24 12.339 -8.816 -6.997 190 2HD1 LEU 24 3HD1 LEU 24 11.012 -9.978 -6.969 191 3HD1 LEU 24 2HD1 LEU 24 11.632 -9.311 -5.459 192 1HD2 LEU 24 1HD2 LEU 24 11.520 -12.381 -6.735 193 2HD2 LEU 24 3HD2 LEU 24 12.876 -12.827 -5.698 194 3HD2 LEU 24 2HD2 LEU 24 11.563 -11.839 -5.058 195 H ALA 25 HN ALA 25 12.750 -14.347 -6.765 196 HA ALA 25 HA ALA 25 11.054 -14.910 -9.171 197 1HB ALA 25 1HB ALA 25 12.697 -16.612 -8.126 198 2HB ALA 25 3HB ALA 25 11.547 -16.709 -6.793 199 3HB ALA 25 2HB ALA 25 11.050 -17.167 -8.421 200 H CYS 26 HN CYS 26 8.917 -14.369 -8.970 201 HA CYS 26 HA CYS 26 7.541 -14.631 -6.370 202 1HB CYS 26 2HB CYS 26 8.810 -12.309 -6.813 203 2HB CYS 26 1HB CYS 26 7.329 -11.965 -7.705 204 H THR 27 HN THR 27 5.149 -14.058 -6.678 205 HA THR 27 HA THR 27 4.252 -15.103 -9.301 206 HB THR 27 HB THR 27 2.020 -14.983 -7.941 207 HG1 THR 27 1HG THR 27 2.554 -13.713 -6.270 208 1HG2 THR 27 2HG2 THR 27 4.395 -16.750 -7.448 209 2HG2 THR 27 1HG2 THR 27 2.926 -16.985 -6.501 210 3HG2 THR 27 3HG2 THR 27 2.875 -17.128 -8.257 211 H ARG 28 HN ARG 28 2.300 -14.002 -10.302 212 HA ARG 28 HA ARG 28 2.815 -11.285 -10.950 213 1HB ARG 28 2HB ARG 28 0.327 -13.012 -11.091 214 2HB ARG 28 1HB ARG 28 0.469 -11.443 -11.883 215 1HG ARG 28 2HG ARG 28 2.526 -12.316 -13.056 216 2HG ARG 28 1HG ARG 28 2.162 -13.906 -12.387 217 1HD ARG 28 2HD ARG 28 -0.173 -13.634 -13.456 218 2HD ARG 28 1HD ARG 28 0.544 -12.299 -14.377 219 HE ARG 28 HE ARG 28 1.499 -15.136 -14.466 220 1HH1 ARG 28 1HH1 ARG 28 3.286 -12.600 -15.046 221 2HH1 ARG 28 2HH1 ARG 28 3.289 -12.652 -16.777 222 1HH2 ARG 28 1HH2 ARG 28 0.672 -14.918 -16.978 223 2HH2 ARG 28 2HH2 ARG 28 1.809 -13.965 -17.871 224 H GLU 29 HN GLU 29 0.604 -12.713 -8.547 225 HA GLU 29 HA GLU 29 -0.510 -11.711 -6.718 226 1HB GLU 29 2HB GLU 29 1.932 -10.988 -6.460 227 2HB GLU 29 1HB GLU 29 1.454 -9.456 -7.190 228 1HG GLU 29 2HG GLU 29 -0.326 -9.266 -5.404 229 2HG GLU 29 1HG GLU 29 0.396 -10.674 -4.624 230 H ASN 30 HN ASN 30 -2.211 -10.198 -6.366 231 HA ASN 30 HA ASN 30 -2.934 -8.565 -8.767 232 1HB ASN 30 2HB ASN 30 -5.227 -8.752 -7.760 233 2HB ASN 30 1HB ASN 30 -4.501 -10.321 -8.109 234 1HD2 ASN 30 1HD2 ASN 30 -4.652 -11.774 -6.401 235 2HD2 ASN 30 2HD2 ASN 30 -4.757 -11.350 -4.762 236 H ASP 31 HN ASP 31 -1.058 -7.254 -7.320 237 HA ASP 31 HA ASP 31 -2.628 -5.095 -5.999 238 1HB ASP 31 2HB ASP 31 -1.325 -7.095 -4.589 239 2HB ASP 31 1HB ASP 31 -0.138 -5.790 -4.604 240 HA PRO 32 HA PRO 32 0.625 -3.607 -8.974 241 1HB PRO 32 2HB PRO 32 -1.171 -1.420 -9.490 242 2HB PRO 32 1HB PRO 32 -0.721 -2.736 -10.576 243 1HG PRO 32 2HG PRO 32 -3.234 -2.324 -9.252 244 2HG PRO 32 1HG PRO 32 -2.781 -3.646 -10.331 245 1HD PRO 32 2HD PRO 32 -3.168 -3.741 -7.468 246 2HD PRO 32 1HD PRO 32 -2.729 -5.077 -8.556 247 H ILE 33 HN ILE 33 2.142 -2.067 -8.381 248 HA ILE 33 HA ILE 33 1.353 0.008 -6.377 249 HB ILE 33 HB ILE 33 3.060 -0.639 -4.902 250 1HG1 ILE 33 2HG1 ILE 33 4.888 -0.650 -6.544 251 2HG1 ILE 33 1HG1 ILE 33 4.950 -2.102 -5.546 252 1HG2 ILE 33 2HG2 ILE 33 2.122 -3.181 -6.260 253 2HG2 ILE 33 1HG2 ILE 33 2.929 -3.130 -4.694 254 3HG2 ILE 33 3HG2 ILE 33 1.352 -2.367 -4.897 255 1HD1 ILE 33 2HD1 ILE 33 3.528 -3.198 -7.414 256 2HD1 ILE 33 1HD1 ILE 33 4.026 -1.823 -8.402 257 3HD1 ILE 33 3HD1 ILE 33 5.240 -2.919 -7.741 258 H GLN 34 HN GLN 34 3.812 1.207 -6.061 259 HA GLN 34 HA GLN 34 4.560 2.011 -8.856 260 1HB GLN 34 2HB GLN 34 4.272 3.693 -6.345 261 2HB GLN 34 1HB GLN 34 4.743 4.301 -7.931 262 1HG GLN 34 2HG GLN 34 2.590 3.592 -8.869 263 2HG GLN 34 1HG GLN 34 2.119 2.908 -7.313 264 1HE2 GLN 34 1HE2 GLN 34 0.825 5.171 -8.811 265 2HE2 GLN 34 2HE2 GLN 34 0.865 6.498 -7.755 266 H GLY 35 HN GLY 35 6.782 2.876 -9.033 267 1HA GLY 35 1HA GLY 35 9.014 1.844 -8.661 268 2HA GLY 35 2HA GLY 35 8.590 1.710 -6.956 269 HA PRO 36 HA PRO 36 10.410 5.577 -6.027 270 1HB PRO 36 2HB PRO 36 13.109 4.914 -6.768 271 2HB PRO 36 1HB PRO 36 12.396 4.925 -5.155 272 1HG PRO 36 2HG PRO 36 13.154 2.649 -6.732 273 2HG PRO 36 1HG PRO 36 12.435 2.658 -5.121 274 1HD PRO 36 2HD PRO 36 11.193 1.892 -7.613 275 2HD PRO 36 1HD PRO 36 10.469 1.898 -5.988 276 H ASP 37 HN ASP 37 10.967 4.203 -9.180 277 HA ASP 37 HA ASP 37 12.179 6.578 -10.363 278 1HB ASP 37 2HB ASP 37 10.860 4.092 -11.495 279 2HB ASP 37 1HB ASP 37 11.745 5.272 -12.463 280 H GLY 38 HN GLY 38 8.914 5.270 -10.064 281 1HA GLY 38 1HA GLY 38 7.900 7.734 -11.423 282 2HA GLY 38 2HA GLY 38 7.151 7.091 -9.964 283 H LYS 39 HN LYS 39 8.367 4.846 -12.310 284 HA LYS 39 HA LYS 39 5.865 4.573 -13.804 285 1HB LYS 39 2HB LYS 39 8.084 4.163 -14.783 286 2HB LYS 39 1HB LYS 39 8.384 2.888 -13.600 287 1HG LYS 39 2HG LYS 39 6.216 1.806 -14.514 288 2HG LYS 39 1HG LYS 39 6.404 2.908 -15.879 289 1HD LYS 39 2HD LYS 39 8.800 2.021 -16.071 290 2HD LYS 39 1HD LYS 39 8.309 0.747 -14.954 291 1HE LYS 39 2HE LYS 39 8.089 0.137 -17.418 292 2HE LYS 39 1HE LYS 39 6.583 -0.016 -16.494 293 1HZ LYS 39 1HZ LYS 39 7.236 2.600 -17.637 294 2HZ LYS 39 3HZ LYS 39 6.706 1.400 -18.711 295 3HZ LYS 39 2HZ LYS 39 5.719 1.870 -17.409 296 H VAL 40 HN VAL 40 4.551 2.598 -13.759 297 HA VAL 40 HA VAL 40 4.307 1.474 -11.022 298 HB VAL 40 HB VAL 40 2.609 1.365 -13.535 299 1HG1 VAL 40 2HG1 VAL 40 2.435 -0.645 -11.964 300 2HG1 VAL 40 1HG1 VAL 40 1.819 0.478 -10.753 301 3HG1 VAL 40 3HG1 VAL 40 0.935 0.233 -12.259 302 1HG2 VAL 40 3HG2 VAL 40 2.912 3.536 -12.128 303 2HG2 VAL 40 2HG2 VAL 40 1.275 3.021 -12.529 304 3HG2 VAL 40 1HG2 VAL 40 1.930 2.704 -10.923 305 H HIS 41 HN HIS 41 4.207 -0.850 -10.702 306 HA HIS 41 HA HIS 41 5.558 -2.428 -12.870 307 1HB HIS 41 2HB HIS 41 5.749 -2.579 -9.844 308 2HB HIS 41 1HB HIS 41 6.552 -3.694 -10.950 309 HD1 HIS 41 HD1 HIS 41 8.474 -2.712 -12.451 310 HD2 HIS 41 HD2 HIS 41 6.961 -0.036 -9.635 311 HE1 HIS 41 HE1 HIS 41 10.113 -0.785 -12.342 312 H GLY 42 HN GLY 42 5.159 -4.922 -12.314 313 1HA GLY 42 1HA GLY 42 3.574 -6.653 -12.286 314 2HA GLY 42 2HA GLY 42 2.358 -5.419 -12.621 315 H ASN 43 HN ASN 43 4.490 -6.252 -9.860 316 HA ASN 43 HA ASN 43 2.257 -5.609 -8.004 317 1HB ASN 43 2HB ASN 43 2.574 -7.863 -6.940 318 2HB ASN 43 1HB ASN 43 1.946 -7.953 -8.583 319 1HD2 ASN 43 1HD2 ASN 43 3.548 -10.024 -7.145 320 2HD2 ASN 43 2HD2 ASN 43 4.944 -10.266 -8.081 321 H THR 44 HN THR 44 3.348 -6.530 -5.676 322 HA THR 44 HA THR 44 5.318 -4.607 -4.995 323 HB THR 44 HB THR 44 4.606 -7.276 -3.743 324 HG1 THR 44 1HG THR 44 3.190 -6.016 -2.538 325 1HG2 THR 44 2HG2 THR 44 6.770 -6.287 -2.949 326 2HG2 THR 44 1HG2 THR 44 5.881 -4.841 -2.471 327 3HG2 THR 44 3HG2 THR 44 5.539 -6.385 -1.690 328 H CYS 45 HN CYS 45 5.655 -7.966 -6.086 329 HA CYS 45 HA CYS 45 8.489 -8.177 -5.557 330 1HB CYS 45 2HB CYS 45 6.926 -9.605 -7.718 331 2HB CYS 45 1HB CYS 45 8.314 -10.200 -6.814 332 H SER 46 HN SER 46 6.655 -7.532 -8.578 333 HA SER 46 HA SER 46 8.737 -7.126 -10.381 334 1HB SER 46 2HB SER 46 6.202 -5.505 -9.951 335 2HB SER 46 1HB SER 46 7.156 -5.489 -11.434 336 HG SER 46 HG SER 46 5.501 -6.976 -11.648 337 H MET 47 HN MET 47 7.430 -4.776 -8.029 338 HA MET 47 HA MET 47 9.253 -2.638 -8.670 339 1HB MET 47 2HB MET 47 7.011 -3.019 -7.140 340 2HB MET 47 1HB MET 47 8.257 -2.925 -5.897 341 1HG MET 47 2HG MET 47 8.135 -0.899 -8.127 342 2HG MET 47 1HG MET 47 7.159 -0.707 -6.671 343 1HE MET 47 2HE MET 47 7.992 -1.175 -4.463 344 2HE MET 47 1HE MET 47 9.478 -2.122 -4.437 345 3HE MET 47 3HE MET 47 9.468 -0.471 -3.802 346 H CYS 48 HN CYS 48 9.476 -5.533 -6.760 347 HA CYS 48 HA CYS 48 11.912 -4.675 -5.335 348 1HB CYS 48 2HB CYS 48 10.105 -7.089 -5.411 349 2HB CYS 48 1HB CYS 48 11.650 -7.167 -4.567 350 H GLU 49 HN GLU 49 10.999 -6.766 -8.060 351 HA GLU 49 HA GLU 49 13.462 -8.155 -8.423 352 1HB GLU 49 2HB GLU 49 11.484 -7.069 -10.471 353 2HB GLU 49 1HB GLU 49 12.643 -8.366 -10.759 354 1HG GLU 49 2HG GLU 49 11.503 -9.532 -8.737 355 2HG GLU 49 1HG GLU 49 10.193 -8.386 -9.008 356 H VAL 50 HN VAL 50 12.344 -5.013 -9.706 357 HA VAL 50 HA VAL 50 14.714 -4.394 -11.197 358 HB VAL 50 HB VAL 50 13.732 -2.219 -11.345 359 1HG1 VAL 50 2HG1 VAL 50 12.234 -4.508 -11.762 360 2HG1 VAL 50 1HG1 VAL 50 11.158 -3.508 -10.787 361 3HG1 VAL 50 3HG1 VAL 50 11.797 -2.890 -12.311 362 1HG2 VAL 50 1HG2 VAL 50 12.261 -2.912 -8.786 363 2HG2 VAL 50 3HG2 VAL 50 13.588 -1.761 -8.937 364 3HG2 VAL 50 2HG2 VAL 50 12.039 -1.429 -9.713 365 H PHE 51 HN PHE 51 13.727 -3.609 -7.855 366 HA PHE 51 HA PHE 51 16.074 -2.103 -7.165 367 1HB PHE 51 2HB PHE 51 14.090 -1.967 -5.816 368 2HB PHE 51 1HB PHE 51 14.030 -3.720 -5.619 369 HD1 PHE 51 HD1 PHE 51 16.507 -0.938 -5.100 370 HD2 PHE 51 HD2 PHE 51 14.747 -4.545 -3.568 371 HE1 PHE 51 HE1 PHE 51 17.909 -0.757 -3.062 372 HE2 PHE 51 HE2 PHE 51 16.150 -4.363 -1.530 373 HZ PHE 51 HZ PHE 51 17.730 -2.469 -1.277 374 H PHE 52 HN PHE 52 15.239 -5.539 -6.978 375 HA PHE 52 HA PHE 52 17.634 -6.417 -5.641 376 1HB PHE 52 2HB PHE 52 15.338 -7.541 -7.177 377 2HB PHE 52 1HB PHE 52 16.749 -8.578 -7.015 378 HD1 PHE 52 HD1 PHE 52 17.746 -7.682 -4.323 379 HD2 PHE 52 HD2 PHE 52 13.781 -8.536 -5.722 380 HE1 PHE 52 HE1 PHE 52 17.042 -8.209 -2.007 381 HE2 PHE 52 HE2 PHE 52 13.076 -9.069 -3.413 382 HZ PHE 52 HZ PHE 52 14.703 -8.904 -1.548 383 H GLN 53 HN GLN 53 16.719 -5.942 -9.020 384 HA GLN 53 HA GLN 53 19.067 -7.156 -10.193 385 1HB GLN 53 2HB GLN 53 16.686 -6.457 -11.104 386 2HB GLN 53 1HB GLN 53 17.482 -4.919 -11.427 387 1HG GLN 53 2HG GLN 53 19.336 -6.433 -12.519 388 2HG GLN 53 1HG GLN 53 18.039 -7.627 -12.607 389 1HE2 GLN 53 1HE2 GLN 53 16.067 -5.223 -12.848 390 2HE2 GLN 53 2HE2 GLN 53 16.185 -4.783 -14.484 391 H ALA 54 HN ALA 54 18.173 -3.840 -9.268 392 HA ALA 54 HA ALA 54 20.506 -2.527 -10.302 393 1HB ALA 54 3HB ALA 54 18.776 -1.798 -7.919 394 2HB ALA 54 1HB ALA 54 18.305 -1.520 -9.596 395 3HB ALA 54 2HB ALA 54 19.709 -0.690 -8.925 396 H GLU 55 HN GLU 55 19.821 -4.128 -7.202 397 HA GLU 55 HA GLU 55 22.050 -3.205 -5.707 398 1HB GLU 55 2HB GLU 55 20.419 -5.746 -5.775 399 2HB GLU 55 1HB GLU 55 21.707 -5.521 -4.593 400 1HG GLU 55 2HG GLU 55 19.266 -3.763 -4.978 401 2HG GLU 55 1HG GLU 55 19.617 -4.794 -3.591 402 H GLU 56 HN GLU 56 21.829 -5.629 -8.248 403 HA GLU 56 HA GLU 56 24.393 -6.880 -7.777 404 1HB GLU 56 2HB GLU 56 22.722 -6.602 -10.298 405 2HB GLU 56 1HB GLU 56 23.974 -7.810 -10.017 406 1HG GLU 56 2HG GLU 56 22.698 -8.804 -8.214 407 2HG GLU 56 1HG GLU 56 21.508 -7.502 -8.281 408 H GLU 57 HN GLU 57 23.451 -3.849 -9.121 409 HA GLU 57 HA GLU 57 25.720 -3.485 -10.911 410 1HB GLU 57 2HB GLU 57 23.888 -1.462 -9.581 411 2HB GLU 57 1HB GLU 57 24.826 -1.220 -11.054 412 1HG GLU 57 2HG GLU 57 23.541 -3.127 -12.090 413 2HG GLU 57 1HG GLU 57 22.514 -3.139 -10.657 414 H GLU 58 HN GLU 58 24.978 -2.621 -7.542 415 HA GLU 58 HA GLU 58 27.290 -0.963 -7.098 416 1HB GLU 58 2HB GLU 58 25.239 -1.001 -5.713 417 2HB GLU 58 1HB GLU 58 25.611 -2.650 -5.211 418 1HG GLU 58 2HG GLU 58 27.791 -1.804 -4.286 419 2HG GLU 58 1HG GLU 58 27.254 -0.164 -4.653 420 H LYS 59 HN LYS 59 26.702 -4.450 -6.802 421 HA LYS 59 HA LYS 59 29.299 -4.995 -5.567 422 1HB LYS 59 2HB LYS 59 27.228 -6.776 -6.893 423 2HB LYS 59 1HB LYS 59 28.545 -7.332 -5.860 424 1HG LYS 59 2HG LYS 59 27.634 -6.007 -3.985 425 2HG LYS 59 1HG LYS 59 26.316 -5.453 -5.019 426 1HD LYS 59 2HD LYS 59 25.610 -7.817 -5.341 427 2HD LYS 59 1HD LYS 59 26.887 -8.328 -4.238 428 1HE LYS 59 2HE LYS 59 25.785 -7.502 -2.370 429 2HE LYS 59 1HE LYS 59 24.976 -6.219 -3.290 430 1HZ LYS 59 3HZ LYS 59 23.782 -8.063 -4.487 431 2HZ LYS 59 2HZ LYS 59 24.386 -9.132 -3.313 432 3HZ LYS 59 1HZ LYS 59 23.344 -7.869 -2.860 433 H LYS 60 HN LYS 60 28.311 -4.253 -8.715 434 HA LYS 60 HA LYS 60 29.714 -5.987 -10.416 435 1HB LYS 60 2HB LYS 60 29.594 -4.169 -11.976 436 2HB LYS 60 1HB LYS 60 28.196 -3.988 -10.916 437 1HG LYS 60 2HG LYS 60 29.506 -2.374 -9.531 438 2HG LYS 60 1HG LYS 60 30.832 -2.503 -10.687 439 1HD LYS 60 2HD LYS 60 29.239 -1.766 -12.490 440 2HD LYS 60 1HD LYS 60 28.030 -1.481 -11.238 441 1HE LYS 60 2HE LYS 60 30.562 -0.234 -10.526 442 2HE LYS 60 1HE LYS 60 29.978 0.347 -12.096 443 1HZ LYS 60 3HZ LYS 60 27.742 0.548 -11.028 444 2HZ LYS 60 2HZ LYS 60 28.482 0.246 -9.529 445 3HZ LYS 60 1HZ LYS 60 28.897 1.631 -10.422 446 H LYS 61 HN LYS 61 30.969 -3.150 -8.642 447 HA LYS 61 HA LYS 61 33.606 -3.122 -9.672 448 1HB LYS 61 2HB LYS 61 32.521 -2.500 -6.906 449 2HB LYS 61 1HB LYS 61 34.095 -1.976 -7.504 450 1HG LYS 61 2HG LYS 61 32.938 -0.803 -9.386 451 2HG LYS 61 1HG LYS 61 31.390 -1.246 -8.667 452 1HD LYS 61 2HD LYS 61 32.028 -0.041 -6.593 453 2HD LYS 61 1HD LYS 61 33.547 0.435 -7.353 454 1HE LYS 61 2HE LYS 61 31.381 1.095 -9.132 455 2HE LYS 61 1HE LYS 61 31.047 1.776 -7.528 456 1HZ LYS 61 2HZ LYS 61 33.717 1.933 -8.814 457 2HZ LYS 61 1HZ LYS 61 32.544 3.145 -9.018 458 3HZ LYS 61 3HZ LYS 61 33.152 2.807 -7.472 459 H LYS 62 HN LYS 62 32.122 -5.198 -7.230 460 HA LYS 62 HA LYS 62 34.730 -6.412 -6.516 461 1HB LYS 62 2HB LYS 62 31.856 -6.800 -5.626 462 2HB LYS 62 1HB LYS 62 33.212 -7.706 -4.954 463 1HG LYS 62 2HG LYS 62 34.294 -5.526 -4.349 464 2HG LYS 62 1HG LYS 62 32.836 -4.696 -4.894 465 1HD LYS 62 2HD LYS 62 31.511 -6.022 -3.248 466 2HD LYS 62 1HD LYS 62 33.008 -6.751 -2.667 467 1HE LYS 62 2HE LYS 62 32.452 -4.877 -1.203 468 2HE LYS 62 1HE LYS 62 33.851 -4.403 -2.184 469 1HZ LYS 62 1HZ LYS 62 31.046 -3.910 -3.023 470 2HZ LYS 62 3HZ LYS 62 31.942 -2.770 -2.143 471 3HZ LYS 62 2HZ LYS 62 32.462 -3.249 -3.689 472 H GLU 63 HN GLU 63 35.334 -8.495 -7.157 473 HA GLU 63 HA GLU 63 33.679 -9.738 -9.306 474 1HB GLU 63 2HB GLU 63 36.083 -9.104 -9.655 475 2HB GLU 63 1HB GLU 63 36.529 -10.264 -8.403 476 1HG GLU 63 2HG GLU 63 35.408 -12.059 -9.741 477 2HG GLU 63 1HG GLU 63 35.120 -10.879 -11.019 478 H GLY 64 HN GLY 64 32.901 -11.853 -9.090 479 1HA GLY 64 1HA GLY 64 32.129 -13.742 -7.928 480 2HA GLY 64 2HA GLY 64 32.556 -12.908 -6.434 481 H GLU 65 HN GLU 65 33.392 -14.984 -5.649 482 HA GLU 65 HA GLU 65 36.208 -15.269 -5.848 483 1HB GLU 65 2HB GLU 65 34.037 -17.246 -5.074 484 2HB GLU 65 1HB GLU 65 35.746 -17.426 -4.680 485 1HG GLU 65 2HG GLU 65 35.669 -15.271 -3.448 486 2HG GLU 65 1HG GLU 65 33.947 -15.143 -3.807 487 H SER 66 HN SER 66 37.516 -16.633 -7.113 488 HA SER 66 HA SER 66 36.185 -18.412 -9.104 489 1HB SER 66 2HB SER 66 37.400 -17.343 -10.914 490 2HB SER 66 1HB SER 66 36.553 -16.085 -10.014 491 HG SER 66 HG SER 66 38.732 -16.188 -8.767 492 H ARG 67 HN ARG 67 37.773 -19.926 -10.100 493 HA ARG 67 HA ARG 67 39.485 -21.207 -8.265 494 1HB ARG 67 2HB ARG 67 38.555 -22.104 -10.406 495 2HB ARG 67 1HB ARG 67 39.694 -21.089 -11.291 496 1HG ARG 67 2HG ARG 67 40.711 -23.254 -11.130 497 2HG ARG 67 1HG ARG 67 41.549 -22.228 -9.966 498 1HD ARG 67 2HD ARG 67 40.092 -23.117 -8.155 499 2HD ARG 67 1HD ARG 67 39.302 -24.180 -9.334 500 HE ARG 67 HE ARG 67 42.180 -24.445 -9.470 501 1HH1 ARG 67 1HH1 ARG 67 40.897 -24.659 -6.549 502 2HH1 ARG 67 2HH1 ARG 67 40.910 -26.382 -6.388 503 1HH2 ARG 67 1HH2 ARG 67 41.551 -26.956 -9.747 504 2HH2 ARG 67 2HH2 ARG 67 41.281 -27.684 -8.198 505 H ASN 68 HN ASN 68 40.223 -18.662 -10.641 506 HA ASN 68 HA ASN 68 43.091 -18.685 -9.970 507 1HB ASN 68 2HB ASN 68 41.333 -16.907 -11.693 508 2HB ASN 68 1HB ASN 68 43.094 -16.818 -11.638 509 1HD2 ASN 68 1HD2 ASN 68 41.492 -17.545 -14.009 510 2HD2 ASN 68 2HD2 ASN 68 41.934 -19.129 -14.426 No H/Q in entry = 510 Start of MODEL 12 1 H1 GLU 1 3H GLU 1 11.681 15.489 5.100 2 H2 GLU 1 2H GLU 1 10.684 14.120 4.965 3 H3 GLU 1 1H GLU 1 10.111 15.518 5.742 4 HA GLU 1 HA GLU 1 11.425 15.186 7.624 5 1HB GLU 1 2HB GLU 1 10.506 12.545 6.445 6 2HB GLU 1 1HB GLU 1 10.896 12.785 8.147 7 1HG GLU 1 2HG GLU 1 9.164 14.568 8.263 8 2HG GLU 1 1HG GLU 1 8.744 14.242 6.581 9 H SER 2 HN SER 2 12.931 13.145 8.537 10 HA SER 2 HA SER 2 15.516 13.562 7.359 11 1HB SER 2 2HB SER 2 14.508 11.389 9.223 12 2HB SER 2 1HB SER 2 16.191 11.882 9.023 13 HG SER 2 HG SER 2 15.163 12.870 10.831 14 H GLY 3 HN GLY 3 13.173 10.904 7.131 15 1HA GLY 3 1HA GLY 3 14.522 8.878 5.908 16 2HA GLY 3 2HA GLY 3 14.372 10.047 4.596 17 H LYS 4 HN LYS 4 13.126 7.642 4.245 18 HA LYS 4 HA LYS 4 10.277 8.439 4.206 19 1HB LYS 4 2HB LYS 4 11.629 7.494 2.258 20 2HB LYS 4 1HB LYS 4 11.617 5.951 3.112 21 1HG LYS 4 2HG LYS 4 9.089 6.132 3.191 22 2HG LYS 4 1HG LYS 4 9.226 7.512 2.102 23 1HD LYS 4 2HD LYS 4 10.495 6.037 0.506 24 2HD LYS 4 1HD LYS 4 10.140 4.672 1.564 25 1HE LYS 4 2HE LYS 4 8.163 4.443 0.474 26 2HE LYS 4 1HE LYS 4 7.671 6.009 1.145 27 1HZ LYS 4 3HZ LYS 4 9.547 5.984 -1.110 28 2HZ LYS 4 2HZ LYS 4 7.913 5.654 -1.443 29 3HZ LYS 4 1HZ LYS 4 8.356 7.125 -0.715 30 H ALA 5 HN ALA 5 8.677 7.373 5.389 31 HA ALA 5 HA ALA 5 9.268 6.065 7.818 32 1HB ALA 5 2HB ALA 5 6.876 6.061 5.962 33 2HB ALA 5 1HB ALA 5 6.832 5.296 7.551 34 3HB ALA 5 3HB ALA 5 7.115 7.032 7.416 35 H THR 6 HN THR 6 9.346 4.819 4.590 36 HA THR 6 HA THR 6 9.709 2.049 5.687 37 HB THR 6 HB THR 6 8.475 2.739 3.012 38 HG1 THR 6 1HG THR 6 6.470 2.399 4.130 39 1HG2 THR 6 2HG2 THR 6 8.802 0.307 4.720 40 2HG2 THR 6 1HG2 THR 6 7.359 0.434 3.713 41 3HG2 THR 6 3HG2 THR 6 8.957 0.478 2.971 42 H SER 7 HN SER 7 11.053 0.675 4.208 43 HA SER 7 HA SER 7 12.803 2.200 2.334 44 1HB SER 7 2HB SER 7 14.146 2.354 4.218 45 2HB SER 7 1HB SER 7 13.499 0.875 4.925 46 HG SER 7 HG SER 7 15.710 0.816 4.018 47 H TYR 8 HN TYR 8 12.819 1.020 0.465 48 HA TYR 8 HA TYR 8 11.743 -1.477 -0.037 49 1HB TYR 8 2HB TYR 8 14.282 -0.298 -1.216 50 2HB TYR 8 1HB TYR 8 13.230 -1.479 -1.999 51 HD1 TYR 8 HD1 TYR 8 10.569 -0.664 -1.670 52 HD2 TYR 8 HD2 TYR 8 14.029 1.846 -2.095 53 HE1 TYR 8 HE1 TYR 8 9.132 1.175 -2.509 54 HE2 TYR 8 HE2 TYR 8 12.592 3.684 -2.935 55 HH TYR 8 HH TYR 8 10.286 4.394 -2.858 56 H ALA 9 HN ALA 9 15.242 -0.944 0.601 57 HA ALA 9 HA ALA 9 16.187 -3.536 0.712 58 1HB ALA 9 1HB ALA 9 17.757 -1.872 1.134 59 2HB ALA 9 2HB ALA 9 17.530 -2.503 2.766 60 3HB ALA 9 3HB ALA 9 16.704 -1.027 2.268 61 H GLU 10 HN GLU 10 14.014 -1.980 2.991 62 HA GLU 10 HA GLU 10 14.153 -4.300 4.855 63 1HB GLU 10 2HB GLU 10 14.179 -1.797 5.498 64 2HB GLU 10 1HB GLU 10 12.469 -1.794 5.065 65 1HG GLU 10 2HG GLU 10 12.330 -3.880 6.638 66 2HG GLU 10 1HG GLU 10 13.853 -3.275 7.290 67 H LEU 11 HN LEU 11 11.832 -2.484 2.854 68 HA LEU 11 HA LEU 11 9.561 -4.188 3.354 69 1HB LEU 11 2HB LEU 11 9.455 -1.873 2.508 70 2HB LEU 11 1HB LEU 11 10.307 -2.361 1.046 71 HG LEU 11 HG LEU 11 8.063 -4.110 1.441 72 1HD1 LEU 11 2HD1 LEU 11 7.574 -1.522 2.455 73 2HD1 LEU 11 1HD1 LEU 11 6.817 -1.563 0.863 74 3HD1 LEU 11 3HD1 LEU 11 6.375 -2.760 2.081 75 1HD2 LEU 11 2HD2 LEU 11 9.438 -2.784 -0.614 76 2HD2 LEU 11 1HD2 LEU 11 8.073 -3.883 -0.805 77 3HD2 LEU 11 3HD2 LEU 11 7.795 -2.145 -0.686 78 H CYS 12 HN CYS 12 11.509 -3.833 0.392 79 HA CYS 12 HA CYS 12 10.624 -6.198 -0.911 80 1HB CYS 12 2HB CYS 12 13.068 -4.441 -1.001 81 2HB CYS 12 1HB CYS 12 12.988 -5.884 -2.011 82 H ASN 13 HN ASN 13 12.691 -5.778 1.809 83 HA ASN 13 HA ASN 13 14.573 -7.784 1.813 84 1HB ASN 13 2HB ASN 13 13.860 -6.188 3.651 85 2HB ASN 13 1HB ASN 13 12.563 -7.317 4.032 86 1HD2 ASN 13 1HD2 ASN 13 14.802 -6.658 5.826 87 2HD2 ASN 13 2HD2 ASN 13 15.668 -8.096 6.079 88 H GLU 14 HN GLU 14 11.148 -8.294 2.706 89 HA GLU 14 HA GLU 14 11.168 -11.057 3.131 90 1HB GLU 14 2HB GLU 14 9.298 -8.941 2.588 91 2HB GLU 14 1HB GLU 14 8.803 -10.382 1.701 92 1HG GLU 14 2HG GLU 14 8.793 -11.709 3.712 93 2HG GLU 14 1HG GLU 14 9.554 -10.415 4.635 94 H TYR 15 HN TYR 15 11.653 -9.378 0.116 95 HA TYR 15 HA TYR 15 11.070 -11.828 -1.469 96 1HB TYR 15 2HB TYR 15 11.722 -8.940 -2.107 97 2HB TYR 15 1HB TYR 15 11.546 -10.175 -3.356 98 HD1 TYR 15 HD1 TYR 15 9.360 -11.785 -2.778 99 HD2 TYR 15 HD2 TYR 15 9.829 -7.631 -1.806 100 HE1 TYR 15 HE1 TYR 15 6.900 -11.545 -2.640 101 HE2 TYR 15 HE2 TYR 15 7.369 -7.381 -1.676 102 HH TYR 15 HH TYR 15 5.399 -8.372 -2.037 103 H ARG 16 HN ARG 16 13.637 -10.633 0.259 104 HA ARG 16 HA ARG 16 15.843 -10.949 -1.569 105 1HB ARG 16 2HB ARG 16 15.516 -11.076 1.443 106 2HB ARG 16 1HB ARG 16 17.091 -11.146 0.650 107 1HG ARG 16 2HG ARG 16 16.608 -8.977 -0.454 108 2HG ARG 16 1HG ARG 16 15.064 -8.903 0.392 109 1HD ARG 16 2HD ARG 16 16.254 -8.918 2.565 110 2HD ARG 16 1HD ARG 16 17.806 -8.973 1.706 111 HE ARG 16 HE ARG 16 15.905 -6.790 1.009 112 1HH1 ARG 16 1HH1 ARG 16 17.899 -7.256 3.591 113 2HH1 ARG 16 2HH1 ARG 16 19.002 -5.969 3.236 114 1HH2 ARG 16 1HH2 ARG 16 17.723 -5.391 0.066 115 2HH2 ARG 16 2HH2 ARG 16 18.903 -4.913 1.240 116 H LYS 17 HN LYS 17 13.889 -13.173 0.290 117 HA LYS 17 HA LYS 17 15.742 -15.422 0.152 118 1HB LYS 17 2HB LYS 17 12.744 -15.534 0.521 119 2HB LYS 17 1HB LYS 17 13.970 -16.580 1.233 120 1HG LYS 17 2HG LYS 17 14.838 -14.373 2.343 121 2HG LYS 17 1HG LYS 17 13.224 -13.762 1.978 122 1HD LYS 17 2HD LYS 17 13.127 -16.433 3.143 123 2HD LYS 17 1HD LYS 17 13.946 -15.289 4.206 124 1HE LYS 17 2HE LYS 17 11.374 -14.453 2.892 125 2HE LYS 17 1HE LYS 17 11.317 -15.502 4.321 126 1HZ LYS 17 3HZ LYS 17 12.939 -13.015 4.154 127 2HZ LYS 17 2HZ LYS 17 11.384 -13.070 4.835 128 3HZ LYS 17 1HZ LYS 17 12.652 -13.960 5.533 129 H LEU 18 HN LEU 18 13.318 -14.017 -1.925 130 HA LEU 18 HA LEU 18 13.061 -16.430 -3.608 131 1HB LEU 18 2HB LEU 18 12.081 -13.685 -4.331 132 2HB LEU 18 1HB LEU 18 11.310 -15.241 -4.614 133 HG LEU 18 HG LEU 18 11.484 -13.685 -2.028 134 1HD1 LEU 18 1HD1 LEU 18 9.630 -13.344 -3.773 135 2HD1 LEU 18 3HD1 LEU 18 9.093 -14.971 -3.355 136 3HD1 LEU 18 2HD1 LEU 18 9.109 -13.704 -2.127 137 1HD2 LEU 18 1HD2 LEU 18 11.605 -16.527 -2.355 138 2HD2 LEU 18 3HD2 LEU 18 11.486 -15.602 -0.858 139 3HD2 LEU 18 2HD2 LEU 18 10.021 -16.109 -1.699 140 H VAL 19 HN VAL 19 14.265 -13.075 -3.989 141 HA VAL 19 HA VAL 19 15.467 -13.657 -6.591 142 HB VAL 19 HB VAL 19 14.515 -11.469 -5.980 143 1HG1 VAL 19 2HG1 VAL 19 15.952 -11.933 -3.570 144 2HG1 VAL 19 1HG1 VAL 19 16.616 -10.473 -4.304 145 3HG1 VAL 19 3HG1 VAL 19 14.891 -10.577 -3.953 146 1HG2 VAL 19 2HG2 VAL 19 17.306 -11.856 -6.834 147 2HG2 VAL 19 1HG2 VAL 19 16.029 -10.892 -7.574 148 3HG2 VAL 19 3HG2 VAL 19 16.961 -10.237 -6.227 149 H ARG 20 HN ARG 20 17.269 -14.944 -6.626 150 HA ARG 20 HA ARG 20 19.204 -14.874 -4.384 151 1HB ARG 20 2HB ARG 20 19.223 -16.506 -6.935 152 2HB ARG 20 1HB ARG 20 20.044 -16.880 -5.419 153 1HG ARG 20 2HG ARG 20 17.041 -16.756 -5.833 154 2HG ARG 20 1HG ARG 20 17.997 -18.224 -5.628 155 1HD ARG 20 2HD ARG 20 18.722 -17.364 -3.373 156 2HD ARG 20 1HD ARG 20 17.585 -16.018 -3.582 157 HE ARG 20 HE ARG 20 15.754 -17.649 -3.623 158 1HH1 ARG 20 1HH1 ARG 20 16.936 -18.392 -1.052 159 2HH1 ARG 20 2HH1 ARG 20 17.218 -20.094 -1.215 160 1HH2 ARG 20 1HH2 ARG 20 16.958 -20.074 -4.673 161 2HH2 ARG 20 2HH2 ARG 20 17.231 -21.046 -3.266 162 H ASN 21 HN ASN 21 19.654 -14.971 -7.922 163 HA ASN 21 HA ASN 21 21.817 -12.912 -7.602 164 1HB ASN 21 2HB ASN 21 21.561 -15.243 -9.530 165 2HB ASN 21 1HB ASN 21 22.918 -14.119 -9.465 166 1HD2 ASN 21 1HD2 ASN 21 21.520 -16.959 -8.009 167 2HD2 ASN 21 2HD2 ASN 21 22.700 -17.172 -6.809 168 H GLY 22 HN GLY 22 19.618 -11.591 -7.995 169 1HA GLY 22 1HA GLY 22 19.740 -10.685 -10.771 170 2HA GLY 22 2HA GLY 22 18.743 -9.985 -9.497 171 H LYS 23 HN LYS 23 17.672 -12.752 -8.867 172 HA LYS 23 HA LYS 23 15.704 -12.854 -11.126 173 1HB LYS 23 2HB LYS 23 15.777 -15.390 -10.662 174 2HB LYS 23 1HB LYS 23 17.178 -14.693 -11.475 175 1HG LYS 23 2HG LYS 23 18.378 -14.559 -9.339 176 2HG LYS 23 1HG LYS 23 16.967 -15.189 -8.487 177 1HD LYS 23 2HD LYS 23 17.476 -16.994 -10.604 178 2HD LYS 23 1HD LYS 23 19.044 -16.643 -9.876 179 1HE LYS 23 2HE LYS 23 17.319 -16.948 -7.685 180 2HE LYS 23 1HE LYS 23 16.854 -18.239 -8.810 181 1HZ LYS 23 2HZ LYS 23 19.706 -17.640 -8.424 182 2HZ LYS 23 1HZ LYS 23 18.905 -18.538 -7.225 183 3HZ LYS 23 3HZ LYS 23 18.961 -19.114 -8.819 184 H LEU 24 HN LEU 24 14.455 -11.504 -9.508 185 HA LEU 24 HA LEU 24 13.617 -12.754 -7.000 186 1HB LEU 24 2HB LEU 24 13.850 -10.325 -7.268 187 2HB LEU 24 1HB LEU 24 12.666 -10.338 -8.572 188 HG LEU 24 HG LEU 24 10.882 -10.868 -7.096 189 1HD1 LEU 24 1HD1 LEU 24 12.119 -12.660 -5.881 190 2HD1 LEU 24 3HD1 LEU 24 12.951 -11.413 -4.951 191 3HD1 LEU 24 2HD1 LEU 24 11.206 -11.610 -4.796 192 1HD2 LEU 24 1HD2 LEU 24 12.292 -8.576 -6.752 193 2HD2 LEU 24 3HD2 LEU 24 10.804 -8.933 -5.876 194 3HD2 LEU 24 2HD2 LEU 24 12.368 -9.229 -5.116 195 H ALA 25 HN ALA 25 12.070 -14.330 -6.927 196 HA ALA 25 HA ALA 25 10.085 -14.489 -9.164 197 1HB ALA 25 1HB ALA 25 11.613 -16.406 -8.797 198 2HB ALA 25 3HB ALA 25 11.036 -16.540 -7.135 199 3HB ALA 25 2HB ALA 25 9.939 -16.860 -8.478 200 H CYS 26 HN CYS 26 7.907 -14.303 -8.672 201 HA CYS 26 HA CYS 26 7.009 -14.532 -5.851 202 1HB CYS 26 2HB CYS 26 7.839 -12.136 -6.706 203 2HB CYS 26 1HB CYS 26 6.206 -12.084 -7.370 204 H THR 27 HN THR 27 4.452 -13.679 -6.058 205 HA THR 27 HA THR 27 3.324 -15.346 -8.280 206 HB THR 27 HB THR 27 1.355 -15.395 -6.570 207 HG1 THR 27 1HG THR 27 1.843 -14.006 -5.040 208 1HG2 THR 27 1HG2 THR 27 3.900 -16.847 -6.664 209 2HG2 THR 27 3HG2 THR 27 3.091 -16.959 -5.101 210 3HG2 THR 27 2HG2 THR 27 2.253 -17.470 -6.566 211 H ARG 28 HN ARG 28 0.745 -14.541 -8.319 212 HA ARG 28 HA ARG 28 0.937 -11.756 -9.324 213 1HB ARG 28 2HB ARG 28 -0.072 -13.782 -10.539 214 2HB ARG 28 1HB ARG 28 -1.412 -13.665 -9.399 215 1HG ARG 28 2HG ARG 28 -1.735 -11.284 -10.099 216 2HG ARG 28 1HG ARG 28 -0.479 -11.508 -11.317 217 1HD ARG 28 2HD ARG 28 -3.049 -13.128 -11.145 218 2HD ARG 28 1HD ARG 28 -2.728 -11.830 -12.311 219 HE ARG 28 HE ARG 28 -0.597 -13.338 -12.818 220 1HH1 ARG 28 1HH1 ARG 28 -3.450 -13.794 -14.066 221 2HH1 ARG 28 2HH1 ARG 28 -3.501 -15.525 -14.031 222 1HH2 ARG 28 1HH2 ARG 28 -0.795 -15.824 -11.882 223 2HH2 ARG 28 2HH2 ARG 28 -1.997 -16.674 -12.795 224 H GLU 29 HN GLU 29 1.146 -11.496 -6.664 225 HA GLU 29 HA GLU 29 -1.148 -11.559 -5.022 226 1HB GLU 29 2HB GLU 29 1.197 -11.086 -4.337 227 2HB GLU 29 1HB GLU 29 1.093 -9.512 -5.127 228 1HG GLU 29 2HG GLU 29 0.615 -9.071 -2.842 229 2HG GLU 29 1HG GLU 29 -0.962 -9.093 -3.633 230 H ASN 30 HN ASN 30 -2.706 -9.889 -4.506 231 HA ASN 30 HA ASN 30 -3.392 -8.172 -6.827 232 1HB ASN 30 2HB ASN 30 -4.784 -9.014 -4.270 233 2HB ASN 30 1HB ASN 30 -5.506 -7.905 -5.434 234 1HD2 ASN 30 1HD2 ASN 30 -5.713 -11.041 -4.586 235 2HD2 ASN 30 2HD2 ASN 30 -5.984 -11.762 -6.097 236 H ASP 31 HN ASP 31 -1.196 -7.027 -5.844 237 HA ASP 31 HA ASP 31 -2.225 -4.688 -4.289 238 1HB ASP 31 2HB ASP 31 -1.075 -6.408 -2.843 239 2HB ASP 31 1HB ASP 31 0.391 -6.139 -3.786 240 HA PRO 32 HA PRO 32 0.245 -3.610 -8.128 241 1HB PRO 32 2HB PRO 32 -1.717 -1.554 -8.571 242 2HB PRO 32 1HB PRO 32 -1.415 -2.998 -9.542 243 1HG PRO 32 2HG PRO 32 -3.662 -2.467 -7.848 244 2HG PRO 32 1HG PRO 32 -3.334 -3.931 -8.779 245 1HD PRO 32 2HD PRO 32 -3.174 -3.559 -5.907 246 2HD PRO 32 1HD PRO 32 -2.924 -5.053 -6.838 247 H ILE 33 HN ILE 33 1.736 -1.918 -8.111 248 HA ILE 33 HA ILE 33 1.236 0.459 -6.403 249 HB ILE 33 HB ILE 33 3.039 0.037 -4.943 250 1HG1 ILE 33 2HG1 ILE 33 4.787 -0.471 -6.507 251 2HG1 ILE 33 1HG1 ILE 33 4.685 -1.841 -5.402 252 1HG2 ILE 33 2HG2 ILE 33 1.105 -1.560 -4.661 253 2HG2 ILE 33 1HG2 ILE 33 2.040 -2.753 -5.562 254 3HG2 ILE 33 3HG2 ILE 33 2.635 -2.151 -4.015 255 1HD1 ILE 33 2HD1 ILE 33 3.055 -2.853 -7.152 256 2HD1 ILE 33 1HD1 ILE 33 3.724 -1.647 -8.252 257 3HD1 ILE 33 3HD1 ILE 33 4.778 -2.859 -7.525 258 H GLN 34 HN GLN 34 3.685 1.632 -6.469 259 HA GLN 34 HA GLN 34 4.356 1.775 -9.392 260 1HB GLN 34 2HB GLN 34 4.753 4.208 -8.894 261 2HB GLN 34 1HB GLN 34 3.084 3.708 -8.623 262 1HG GLN 34 2HG GLN 34 3.521 3.480 -6.219 263 2HG GLN 34 1HG GLN 34 5.213 3.908 -6.469 264 1HE2 GLN 34 1HE2 GLN 34 5.376 6.132 -7.844 265 2HE2 GLN 34 2HE2 GLN 34 4.369 7.375 -7.276 266 H GLY 35 HN GLY 35 6.626 2.721 -9.719 267 1HA GLY 35 1HA GLY 35 8.856 1.723 -9.355 268 2HA GLY 35 2HA GLY 35 8.457 1.599 -7.641 269 HA PRO 36 HA PRO 36 10.019 5.577 -6.684 270 1HB PRO 36 2HB PRO 36 12.759 4.707 -6.625 271 2HB PRO 36 1HB PRO 36 11.664 4.943 -5.260 272 1HG PRO 36 2HG PRO 36 12.632 2.464 -6.329 273 2HG PRO 36 1HG PRO 36 11.517 2.698 -4.982 274 1HD PRO 36 2HD PRO 36 10.925 1.710 -7.639 275 2HD PRO 36 1HD PRO 36 9.811 1.899 -6.265 276 H ASP 37 HN ASP 37 11.616 3.740 -9.248 277 HA ASP 37 HA ASP 37 13.168 5.845 -10.400 278 1HB ASP 37 2HB ASP 37 11.870 3.331 -11.479 279 2HB ASP 37 1HB ASP 37 12.968 4.322 -12.439 280 H GLY 38 HN GLY 38 9.784 5.467 -10.226 281 1HA GLY 38 1HA GLY 38 9.439 7.431 -12.458 282 2HA GLY 38 2HA GLY 38 8.461 7.444 -10.991 283 H LYS 39 HN LYS 39 9.409 4.534 -12.735 284 HA LYS 39 HA LYS 39 6.749 4.258 -13.992 285 1HB LYS 39 2HB LYS 39 8.861 3.662 -15.148 286 2HB LYS 39 1HB LYS 39 9.199 2.463 -13.900 287 1HG LYS 39 2HG LYS 39 6.783 1.587 -14.545 288 2HG LYS 39 1HG LYS 39 7.124 2.419 -16.062 289 1HD LYS 39 2HD LYS 39 9.325 1.162 -16.139 290 2HD LYS 39 1HD LYS 39 8.746 0.208 -14.773 291 1HE LYS 39 2HE LYS 39 6.604 0.092 -16.524 292 2HE LYS 39 1HE LYS 39 8.003 0.028 -17.612 293 1HZ LYS 39 2HZ LYS 39 7.655 -1.614 -15.152 294 2HZ LYS 39 1HZ LYS 39 7.428 -2.179 -16.738 295 3HZ LYS 39 3HZ LYS 39 8.970 -1.692 -16.226 296 H VAL 40 HN VAL 40 5.371 2.395 -13.524 297 HA VAL 40 HA VAL 40 5.636 1.473 -10.696 298 HB VAL 40 HB VAL 40 3.257 1.232 -10.780 299 1HG1 VAL 40 3HG1 VAL 40 4.522 3.644 -11.595 300 2HG1 VAL 40 2HG1 VAL 40 3.044 3.489 -12.544 301 3HG1 VAL 40 1HG1 VAL 40 2.967 3.463 -10.783 302 1HG2 VAL 40 2HG2 VAL 40 3.193 0.009 -12.934 303 2HG2 VAL 40 1HG2 VAL 40 1.988 1.296 -12.877 304 3HG2 VAL 40 3HG2 VAL 40 3.481 1.525 -13.789 305 H HIS 41 HN HIS 41 4.359 -0.828 -10.561 306 HA HIS 41 HA HIS 41 5.311 -2.613 -12.754 307 1HB HIS 41 2HB HIS 41 5.870 -3.023 -9.801 308 2HB HIS 41 1HB HIS 41 6.473 -4.006 -11.134 309 HD1 HIS 41 HD1 HIS 41 8.603 -3.246 -12.250 310 HD2 HIS 41 HD2 HIS 41 6.966 -0.285 -9.814 311 HE1 HIS 41 HE1 HIS 41 10.298 -1.366 -12.172 312 H GLY 42 HN GLY 42 4.601 -5.016 -11.899 313 1HA GLY 42 1HA GLY 42 2.684 -6.375 -11.736 314 2HA GLY 42 2HA GLY 42 1.704 -4.909 -11.761 315 H ASN 43 HN ASN 43 3.440 -7.159 -9.698 316 HA ASN 43 HA ASN 43 1.758 -6.336 -7.411 317 1HB ASN 43 2HB ASN 43 2.813 -8.391 -6.420 318 2HB ASN 43 1HB ASN 43 2.021 -8.694 -7.966 319 1HD2 ASN 43 1HD2 ASN 43 3.867 -10.572 -7.479 320 2HD2 ASN 43 2HD2 ASN 43 5.324 -10.291 -8.303 321 H THR 44 HN THR 44 3.353 -6.871 -5.268 322 HA THR 44 HA THR 44 5.042 -4.491 -5.101 323 HB THR 44 HB THR 44 4.257 -6.769 -3.270 324 HG1 THR 44 1HG THR 44 2.848 -5.361 -2.595 325 1HG2 THR 44 3HG2 THR 44 6.588 -6.057 -2.758 326 2HG2 THR 44 2HG2 THR 44 6.016 -4.399 -2.578 327 3HG2 THR 44 1HG2 THR 44 5.460 -5.650 -1.465 328 H CYS 45 HN CYS 45 5.506 -7.861 -5.814 329 HA CYS 45 HA CYS 45 8.321 -7.978 -5.057 330 1HB CYS 45 2HB CYS 45 6.986 -9.724 -7.125 331 2HB CYS 45 1HB CYS 45 8.223 -10.160 -5.955 332 H SER 46 HN SER 46 6.545 -7.607 -8.147 333 HA SER 46 HA SER 46 8.693 -7.383 -9.944 334 1HB SER 46 2HB SER 46 6.180 -7.300 -10.361 335 2HB SER 46 1HB SER 46 6.229 -5.608 -9.864 336 HG SER 46 HG SER 46 8.087 -5.638 -11.533 337 H MET 47 HN MET 47 7.357 -4.979 -7.696 338 HA MET 47 HA MET 47 9.043 -2.779 -8.523 339 1HB MET 47 2HB MET 47 6.869 -3.190 -6.894 340 2HB MET 47 1HB MET 47 8.151 -2.964 -5.705 341 1HG MET 47 2HG MET 47 8.711 -0.962 -7.493 342 2HG MET 47 1HG MET 47 6.951 -1.017 -7.573 343 1HE MET 47 1HE MET 47 9.976 -1.191 -5.440 344 2HE MET 47 3HE MET 47 9.597 -0.403 -3.902 345 3HE MET 47 2HE MET 47 9.020 -2.036 -4.225 346 H CYS 48 HN CYS 48 9.441 -5.567 -6.482 347 HA CYS 48 HA CYS 48 11.878 -4.575 -5.154 348 1HB CYS 48 2HB CYS 48 10.264 -7.136 -5.202 349 2HB CYS 48 1HB CYS 48 11.778 -7.013 -4.308 350 H GLU 49 HN GLU 49 10.972 -6.625 -7.879 351 HA GLU 49 HA GLU 49 13.455 -7.979 -8.298 352 1HB GLU 49 2HB GLU 49 11.437 -6.983 -10.347 353 2HB GLU 49 1HB GLU 49 12.525 -8.359 -10.524 354 1HG GLU 49 2HG GLU 49 11.303 -9.140 -8.291 355 2HG GLU 49 1HG GLU 49 10.023 -8.110 -8.913 356 H VAL 50 HN VAL 50 12.213 -4.889 -9.616 357 HA VAL 50 HA VAL 50 14.463 -4.232 -11.231 358 HB VAL 50 HB VAL 50 12.318 -3.055 -11.322 359 1HG1 VAL 50 3HG1 VAL 50 12.129 -3.287 -8.697 360 2HG1 VAL 50 2HG1 VAL 50 12.899 -1.701 -8.707 361 3HG1 VAL 50 1HG1 VAL 50 11.352 -1.936 -9.522 362 1HG2 VAL 50 2HG2 VAL 50 14.565 -1.270 -10.337 363 2HG2 VAL 50 1HG2 VAL 50 14.298 -1.778 -12.005 364 3HG2 VAL 50 3HG2 VAL 50 13.139 -0.710 -11.211 365 H PHE 51 HN PHE 51 13.756 -3.514 -7.818 366 HA PHE 51 HA PHE 51 16.152 -2.044 -7.249 367 1HB PHE 51 2HB PHE 51 14.254 -1.966 -5.773 368 2HB PHE 51 1HB PHE 51 14.216 -3.722 -5.632 369 HD1 PHE 51 HD1 PHE 51 17.241 -1.569 -5.555 370 HD2 PHE 51 HD2 PHE 51 14.518 -3.991 -3.285 371 HE1 PHE 51 HE1 PHE 51 18.757 -1.431 -3.595 372 HE2 PHE 51 HE2 PHE 51 16.031 -3.850 -1.320 373 HZ PHE 51 HZ PHE 51 18.151 -2.573 -1.478 374 H PHE 52 HN PHE 52 15.281 -5.445 -6.705 375 HA PHE 52 HA PHE 52 17.757 -6.406 -5.726 376 1HB PHE 52 2HB PHE 52 15.354 -7.467 -7.156 377 2HB PHE 52 1HB PHE 52 16.748 -8.533 -7.010 378 HD1 PHE 52 HD1 PHE 52 17.903 -7.921 -4.445 379 HD2 PHE 52 HD2 PHE 52 13.766 -8.060 -5.571 380 HE1 PHE 52 HE1 PHE 52 17.279 -8.383 -2.089 381 HE2 PHE 52 HE2 PHE 52 13.138 -8.524 -3.222 382 HZ PHE 52 HZ PHE 52 14.893 -8.684 -1.479 383 H GLN 53 HN GLN 53 16.568 -6.026 -9.057 384 HA GLN 53 HA GLN 53 18.740 -7.269 -10.425 385 1HB GLN 53 2HB GLN 53 16.449 -6.466 -11.250 386 2HB GLN 53 1HB GLN 53 17.155 -4.853 -11.328 387 1HG GLN 53 2HG GLN 53 18.985 -5.831 -12.782 388 2HG GLN 53 1HG GLN 53 18.047 -7.324 -12.839 389 1HE2 GLN 53 1HE2 GLN 53 15.505 -5.503 -12.720 390 2HE2 GLN 53 2HE2 GLN 53 15.326 -4.984 -14.325 391 H ALA 54 HN ALA 54 18.183 -3.799 -9.740 392 HA ALA 54 HA ALA 54 20.834 -2.999 -10.612 393 1HB ALA 54 1HB ALA 54 18.971 -1.493 -8.769 394 2HB ALA 54 3HB ALA 54 20.068 -0.837 -9.984 395 3HB ALA 54 2HB ALA 54 18.607 -1.688 -10.483 396 H GLU 55 HN GLU 55 19.544 -4.308 -7.678 397 HA GLU 55 HA GLU 55 21.053 -3.218 -5.618 398 1HB GLU 55 2HB GLU 55 19.357 -5.079 -5.545 399 2HB GLU 55 1HB GLU 55 20.607 -6.172 -6.138 400 1HG GLU 55 2HG GLU 55 22.016 -5.321 -4.139 401 2HG GLU 55 1HG GLU 55 20.490 -4.706 -3.503 402 H GLU 56 HN GLU 56 22.130 -5.628 -8.001 403 HA GLU 56 HA GLU 56 24.776 -5.968 -6.890 404 1HB GLU 56 2HB GLU 56 23.460 -6.487 -9.566 405 2HB GLU 56 1HB GLU 56 25.142 -6.915 -9.253 406 1HG GLU 56 2HG GLU 56 24.349 -8.218 -7.241 407 2HG GLU 56 1HG GLU 56 22.694 -7.921 -7.776 408 H GLU 57 HN GLU 57 23.298 -3.534 -8.865 409 HA GLU 57 HA GLU 57 25.772 -2.544 -10.074 410 1HB GLU 57 2HB GLU 57 23.521 -2.353 -11.097 411 2HB GLU 57 1HB GLU 57 23.006 -1.334 -9.754 412 1HG GLU 57 2HG GLU 57 24.981 0.191 -10.369 413 2HG GLU 57 1HG GLU 57 25.071 -0.724 -11.873 414 H GLU 58 HN GLU 58 23.708 -1.658 -7.310 415 HA GLU 58 HA GLU 58 24.989 0.799 -6.621 416 1HB GLU 58 2HB GLU 58 22.813 -0.022 -5.770 417 2HB GLU 58 1HB GLU 58 23.645 -1.304 -4.890 418 1HG GLU 58 2HG GLU 58 24.925 0.444 -3.642 419 2HG GLU 58 1HG GLU 58 23.970 1.682 -4.460 420 H LYS 59 HN LYS 59 25.967 -2.527 -6.173 421 HA LYS 59 HA LYS 59 27.901 -1.977 -4.049 422 1HB LYS 59 2HB LYS 59 27.406 -4.304 -5.932 423 2HB LYS 59 1HB LYS 59 28.548 -4.351 -4.588 424 1HG LYS 59 2HG LYS 59 26.681 -3.792 -3.031 425 2HG LYS 59 1HG LYS 59 25.560 -3.864 -4.390 426 1HD LYS 59 2HD LYS 59 26.340 -6.228 -4.803 427 2HD LYS 59 1HD LYS 59 27.255 -6.128 -3.299 428 1HE LYS 59 2HE LYS 59 24.242 -5.910 -3.631 429 2HE LYS 59 1HE LYS 59 25.144 -7.142 -2.729 430 1HZ LYS 59 1HZ LYS 59 26.102 -5.258 -1.408 431 2HZ LYS 59 3HZ LYS 59 24.969 -4.233 -2.145 432 3HZ LYS 59 2HZ LYS 59 24.440 -5.514 -1.163 433 H LYS 60 HN LYS 60 27.859 -1.174 -7.282 434 HA LYS 60 HA LYS 60 30.518 -1.884 -8.139 435 1HB LYS 60 2HB LYS 60 30.014 -0.373 -9.952 436 2HB LYS 60 1HB LYS 60 28.503 -1.172 -9.517 437 1HG LYS 60 2HG LYS 60 27.925 0.783 -8.081 438 2HG LYS 60 1HG LYS 60 29.398 1.587 -8.624 439 1HD LYS 60 2HD LYS 60 28.504 1.183 -11.017 440 2HD LYS 60 1HD LYS 60 26.955 0.855 -10.241 441 1HE LYS 60 2HE LYS 60 26.631 3.060 -9.682 442 2HE LYS 60 1HE LYS 60 28.353 3.328 -9.348 443 1HZ LYS 60 2HZ LYS 60 28.659 2.964 -11.836 444 2HZ LYS 60 1HZ LYS 60 26.982 3.198 -11.972 445 3HZ LYS 60 3HZ LYS 60 27.962 4.439 -11.362 446 H LYS 61 HN LYS 61 29.295 0.566 -6.007 447 HA LYS 61 HA LYS 61 31.249 2.608 -6.281 448 1HB LYS 61 2HB LYS 61 29.751 1.546 -3.863 449 2HB LYS 61 1HB LYS 61 30.576 3.104 -3.921 450 1HG LYS 61 2HG LYS 61 29.144 3.691 -5.918 451 2HG LYS 61 1HG LYS 61 28.229 2.212 -5.620 452 1HD LYS 61 2HD LYS 61 28.619 4.438 -3.595 453 2HD LYS 61 1HD LYS 61 27.169 4.215 -4.574 454 1HE LYS 61 2HE LYS 61 26.766 2.027 -3.556 455 2HE LYS 61 1HE LYS 61 28.286 2.140 -2.650 456 1HZ LYS 61 1HZ LYS 61 27.460 4.207 -1.652 457 2HZ LYS 61 3HZ LYS 61 25.988 4.025 -2.473 458 3HZ LYS 61 2HZ LYS 61 26.442 2.897 -1.286 459 H LYS 62 HN LYS 62 31.323 -0.444 -4.457 460 HA LYS 62 HA LYS 62 34.067 0.169 -3.478 461 1HB LYS 62 2HB LYS 62 32.054 -2.038 -2.938 462 2HB LYS 62 1HB LYS 62 33.632 -1.932 -2.157 463 1HG LYS 62 2HG LYS 62 33.008 0.352 -1.332 464 2HG LYS 62 1HG LYS 62 31.395 0.110 -2.002 465 1HD LYS 62 2HD LYS 62 31.117 -1.898 -0.579 466 2HD LYS 62 1HD LYS 62 32.718 -1.624 0.108 467 1HE LYS 62 2HE LYS 62 31.883 -0.096 1.561 468 2HE LYS 62 1HE LYS 62 31.108 0.799 0.240 469 1HZ LYS 62 1HZ LYS 62 29.495 -1.190 0.216 470 2HZ LYS 62 3HZ LYS 62 30.074 -1.504 1.778 471 3HZ LYS 62 2HZ LYS 62 29.311 -0.025 1.440 472 H GLU 63 HN GLU 63 35.859 -1.102 -4.099 473 HA GLU 63 HA GLU 63 35.756 -2.357 -6.707 474 1HB GLU 63 2HB GLU 63 37.842 -2.304 -4.501 475 2HB GLU 63 1HB GLU 63 38.147 -2.834 -6.155 476 1HG GLU 63 2HG GLU 63 37.469 -0.604 -6.987 477 2HG GLU 63 1HG GLU 63 37.189 -0.076 -5.329 478 H GLY 64 HN GLY 64 35.232 -3.496 -3.480 479 1HA GLY 64 1HA GLY 64 36.057 -6.200 -3.687 480 2HA GLY 64 2HA GLY 64 34.419 -6.098 -4.332 481 H GLU 65 HN GLU 65 34.679 -7.615 -2.112 482 HA GLU 65 HA GLU 65 32.945 -6.334 -0.198 483 1HB GLU 65 2HB GLU 65 34.629 -8.858 -0.093 484 2HB GLU 65 1HB GLU 65 33.329 -8.470 1.034 485 1HG GLU 65 2HG GLU 65 31.728 -8.391 -0.848 486 2HG GLU 65 1HG GLU 65 33.029 -8.785 -1.970 487 H SER 66 HN SER 66 36.368 -6.339 -0.600 488 HA SER 66 HA SER 66 36.671 -4.923 2.005 489 1HB SER 66 2HB SER 66 38.535 -6.370 2.612 490 2HB SER 66 1HB SER 66 37.136 -7.383 2.255 491 HG SER 66 HG SER 66 39.211 -7.980 1.253 492 H ARG 67 HN ARG 67 38.525 -3.504 2.023 493 HA ARG 67 HA ARG 67 39.178 -2.203 -0.404 494 1HB ARG 67 2HB ARG 67 40.704 -2.425 2.212 495 2HB ARG 67 1HB ARG 67 40.971 -1.180 0.992 496 1HG ARG 67 2HG ARG 67 38.598 -0.469 1.239 497 2HG ARG 67 1HG ARG 67 38.391 -1.670 2.514 498 1HD ARG 67 2HD ARG 67 40.271 -0.543 3.775 499 2HD ARG 67 1HD ARG 67 40.239 0.741 2.552 500 HE ARG 67 HE ARG 67 38.150 0.217 4.563 501 1HH1 ARG 67 1HH1 ARG 67 39.149 2.946 3.750 502 2HH1 ARG 67 2HH1 ARG 67 37.824 3.538 2.804 503 1HH2 ARG 67 1HH2 ARG 67 36.375 0.414 2.394 504 2HH2 ARG 67 2HH2 ARG 67 36.254 2.104 2.036 505 H ASN 68 HN ASN 68 40.737 -4.933 1.225 506 HA ASN 68 HA ASN 68 42.412 -6.416 0.455 507 1HB ASN 68 2HB ASN 68 40.735 -6.254 -1.494 508 2HB ASN 68 1HB ASN 68 41.886 -5.147 -2.241 509 1HD2 ASN 68 1HD2 ASN 68 41.420 -7.522 -3.597 510 2HD2 ASN 68 2HD2 ASN 68 42.748 -8.567 -3.437 No H/Q in entry = 510 Start of MODEL 13 1 H1 GLU 1 3H GLU 1 22.339 5.433 8.750 2 H2 GLU 1 2H GLU 1 23.269 4.136 8.167 3 H3 GLU 1 1H GLU 1 23.679 5.732 7.754 4 HA GLU 1 HA GLU 1 22.588 5.177 5.844 5 1HB GLU 1 2HB GLU 1 22.321 2.868 6.787 6 2HB GLU 1 1HB GLU 1 20.847 3.408 7.591 7 1HG GLU 1 2HG GLU 1 19.916 4.045 5.362 8 2HG GLU 1 1HG GLU 1 21.360 3.377 4.601 9 H SER 2 HN SER 2 22.102 7.521 7.077 10 HA SER 2 HA SER 2 19.464 8.063 8.005 11 1HB SER 2 2HB SER 2 21.379 9.815 6.428 12 2HB SER 2 1HB SER 2 20.083 10.382 7.481 13 HG SER 2 HG SER 2 21.365 10.135 9.100 14 H GLY 3 HN GLY 3 17.771 9.288 6.764 15 1HA GLY 3 1HA GLY 3 17.385 8.057 4.103 16 2HA GLY 3 2HA GLY 3 17.406 9.819 4.158 17 H LYS 4 HN LYS 4 15.218 7.659 3.713 18 HA LYS 4 HA LYS 4 13.112 9.133 5.135 19 1HB LYS 4 2HB LYS 4 13.119 6.748 3.256 20 2HB LYS 4 1HB LYS 4 11.669 7.604 3.782 21 1HG LYS 4 2HG LYS 4 12.591 9.704 2.814 22 2HG LYS 4 1HG LYS 4 13.987 8.798 2.232 23 1HD LYS 4 2HD LYS 4 12.481 7.351 0.899 24 2HD LYS 4 1HD LYS 4 11.097 8.289 1.462 25 1HE LYS 4 2HE LYS 4 12.639 10.310 0.532 26 2HE LYS 4 1HE LYS 4 13.173 9.008 -0.547 27 1HZ LYS 4 3HZ LYS 4 10.844 8.481 -0.984 28 2HZ LYS 4 2HZ LYS 4 10.347 9.751 0.029 29 3HZ LYS 4 1HZ LYS 4 11.179 10.087 -1.414 30 H ALA 5 HN ALA 5 11.434 7.903 6.391 31 HA ALA 5 HA ALA 5 12.536 6.406 8.545 32 1HB ALA 5 1HB ALA 5 9.958 7.323 7.540 33 2HB ALA 5 2HB ALA 5 10.492 7.118 9.209 34 3HB ALA 5 3HB ALA 5 9.819 5.749 8.325 35 H THR 6 HN THR 6 11.616 5.413 5.354 36 HA THR 6 HA THR 6 11.876 2.539 6.183 37 HB THR 6 HB THR 6 10.318 3.649 3.834 38 HG1 THR 6 1HG THR 6 8.770 4.108 5.159 39 1HG2 THR 6 3HG2 THR 6 10.874 1.001 4.956 40 2HG2 THR 6 2HG2 THR 6 9.151 1.307 4.733 41 3HG2 THR 6 1HG2 THR 6 10.255 1.439 3.364 42 H SER 7 HN SER 7 12.693 1.150 4.321 43 HA SER 7 HA SER 7 14.332 2.607 2.313 44 1HB SER 7 2HB SER 7 15.934 2.477 4.002 45 2HB SER 7 1HB SER 7 15.279 0.973 4.645 46 HG SER 7 HG SER 7 16.933 1.400 2.421 47 H TYR 8 HN TYR 8 14.087 1.538 0.391 48 HA TYR 8 HA TYR 8 12.565 -0.712 -0.126 49 1HB TYR 8 2HB TYR 8 15.152 0.120 -1.479 50 2HB TYR 8 1HB TYR 8 13.870 -0.843 -2.216 51 HD1 TYR 8 HD1 TYR 8 11.431 0.468 -1.283 52 HD2 TYR 8 HD2 TYR 8 15.142 2.200 -2.578 53 HE1 TYR 8 HE1 TYR 8 10.237 2.546 -1.921 54 HE2 TYR 8 HE2 TYR 8 13.948 4.279 -3.216 55 HH TYR 8 HH TYR 8 11.583 5.384 -2.328 56 H ALA 9 HN ALA 9 16.140 -0.788 0.227 57 HA ALA 9 HA ALA 9 16.675 -3.485 0.082 58 1HB ALA 9 1HB ALA 9 18.122 -1.397 0.696 59 2HB ALA 9 3HB ALA 9 17.745 -1.830 2.363 60 3HB ALA 9 2HB ALA 9 18.609 -2.969 1.331 61 H GLU 10 HN GLU 10 15.021 -1.820 2.715 62 HA GLU 10 HA GLU 10 14.900 -4.311 4.334 63 1HB GLU 10 2HB GLU 10 13.763 -1.547 4.864 64 2HB GLU 10 1HB GLU 10 14.070 -2.816 6.051 65 1HG GLU 10 2HG GLU 10 16.521 -2.690 5.369 66 2HG GLU 10 1HG GLU 10 16.108 -1.230 4.469 67 H LEU 11 HN LEU 11 12.887 -2.215 2.348 68 HA LEU 11 HA LEU 11 10.339 -3.354 3.123 69 1HB LEU 11 2HB LEU 11 10.910 -1.104 1.997 70 2HB LEU 11 1HB LEU 11 11.053 -2.027 0.501 71 HG LEU 11 HG LEU 11 8.691 -2.976 1.267 72 1HD1 LEU 11 2HD1 LEU 11 9.219 -0.916 3.177 73 2HD1 LEU 11 1HD1 LEU 11 7.891 -0.377 2.150 74 3HD1 LEU 11 3HD1 LEU 11 7.769 -1.907 3.019 75 1HD2 LEU 11 1HD2 LEU 11 9.608 -0.861 -0.449 76 2HD2 LEU 11 3HD2 LEU 11 8.206 -1.912 -0.655 77 3HD2 LEU 11 2HD2 LEU 11 8.053 -0.401 0.245 78 H CYS 12 HN CYS 12 12.245 -3.669 0.118 79 HA CYS 12 HA CYS 12 10.744 -5.901 -0.898 80 1HB CYS 12 2HB CYS 12 13.350 -4.526 -1.444 81 2HB CYS 12 1HB CYS 12 13.055 -6.086 -2.211 82 H ASN 13 HN ASN 13 12.970 -5.656 1.651 83 HA ASN 13 HA ASN 13 14.609 -7.857 1.707 84 1HB ASN 13 2HB ASN 13 14.179 -6.175 3.505 85 2HB ASN 13 1HB ASN 13 12.680 -7.006 3.890 86 1HD2 ASN 13 1HD2 ASN 13 14.188 -7.050 6.045 87 2HD2 ASN 13 2HD2 ASN 13 15.075 -8.484 6.236 88 H GLU 14 HN GLU 14 11.161 -7.938 2.636 89 HA GLU 14 HA GLU 14 10.808 -10.643 3.171 90 1HB GLU 14 2HB GLU 14 9.093 -8.862 3.316 91 2HB GLU 14 1HB GLU 14 9.012 -8.803 1.555 92 1HG GLU 14 2HG GLU 14 8.216 -11.097 1.464 93 2HG GLU 14 1HG GLU 14 8.447 -11.285 3.202 94 H TYR 15 HN TYR 15 11.246 -9.125 0.002 95 HA TYR 15 HA TYR 15 10.678 -11.649 -1.426 96 1HB TYR 15 2HB TYR 15 11.624 -8.896 -2.290 97 2HB TYR 15 1HB TYR 15 11.200 -10.198 -3.401 98 HD1 TYR 15 HD1 TYR 15 8.822 -11.280 -3.041 99 HD2 TYR 15 HD2 TYR 15 9.976 -7.411 -1.590 100 HE1 TYR 15 HE1 TYR 15 6.435 -10.635 -2.860 101 HE2 TYR 15 HE2 TYR 15 7.594 -6.759 -1.418 102 HH TYR 15 HH TYR 15 5.362 -8.025 -1.124 103 H ARG 16 HN ARG 16 13.327 -10.157 0.106 104 HA ARG 16 HA ARG 16 15.558 -10.785 -1.502 105 1HB ARG 16 2HB ARG 16 15.149 -9.675 0.894 106 2HB ARG 16 1HB ARG 16 15.603 -11.287 1.447 107 1HG ARG 16 2HG ARG 16 17.739 -11.152 0.444 108 2HG ARG 16 1HG ARG 16 17.262 -9.803 -0.588 109 1HD ARG 16 2HD ARG 16 17.286 -9.590 2.432 110 2HD ARG 16 1HD ARG 16 18.695 -9.171 1.437 111 HE ARG 16 HE ARG 16 16.115 -7.971 0.618 112 1HH1 ARG 16 1HH1 ARG 16 18.241 -7.504 3.161 113 2HH1 ARG 16 2HH1 ARG 16 18.637 -5.865 2.770 114 1HH2 ARG 16 1HH2 ARG 16 16.999 -5.921 -0.287 115 2HH2 ARG 16 2HH2 ARG 16 17.934 -4.968 0.817 116 H LYS 17 HN LYS 17 13.536 -12.847 0.511 117 HA LYS 17 HA LYS 17 15.275 -15.191 0.331 118 1HB LYS 17 2HB LYS 17 12.321 -15.147 0.973 119 2HB LYS 17 1HB LYS 17 13.568 -16.204 1.632 120 1HG LYS 17 2HG LYS 17 14.615 -14.032 2.589 121 2HG LYS 17 1HG LYS 17 13.046 -13.298 2.258 122 1HD LYS 17 2HD LYS 17 13.106 -15.912 3.714 123 2HD LYS 17 1HD LYS 17 13.544 -14.452 4.601 124 1HE LYS 17 2HE LYS 17 11.403 -13.599 4.505 125 2HE LYS 17 1HE LYS 17 11.083 -14.310 2.913 126 1HZ LYS 17 1HZ LYS 17 11.540 -16.040 5.261 127 2HZ LYS 17 3HZ LYS 17 10.003 -15.377 4.993 128 3HZ LYS 17 2HZ LYS 17 10.705 -16.391 3.824 129 H LEU 18 HN LEU 18 13.531 -13.604 -1.961 130 HA LEU 18 HA LEU 18 12.645 -16.096 -3.357 131 1HB LEU 18 2HB LEU 18 11.845 -13.177 -3.543 132 2HB LEU 18 1HB LEU 18 11.215 -14.432 -4.610 133 HG LEU 18 HG LEU 18 10.542 -15.680 -2.465 134 1HD1 LEU 18 1HD1 LEU 18 11.790 -13.319 -1.356 135 2HD1 LEU 18 3HD1 LEU 18 10.117 -13.448 -0.819 136 3HD1 LEU 18 2HD1 LEU 18 11.242 -14.776 -0.532 137 1HD2 LEU 18 1HD2 LEU 18 9.325 -13.197 -3.589 138 2HD2 LEU 18 3HD2 LEU 18 8.688 -14.841 -3.557 139 3HD2 LEU 18 2HD2 LEU 18 8.625 -13.843 -2.105 140 H VAL 19 HN VAL 19 14.782 -13.336 -3.494 141 HA VAL 19 HA VAL 19 15.553 -14.056 -6.297 142 HB VAL 19 HB VAL 19 14.969 -11.789 -6.265 143 1HG1 VAL 19 3HG1 VAL 19 16.016 -11.894 -3.469 144 2HG1 VAL 19 2HG1 VAL 19 16.059 -10.342 -4.307 145 3HG1 VAL 19 1HG1 VAL 19 14.525 -11.180 -4.084 146 1HG2 VAL 19 3HG2 VAL 19 17.285 -12.144 -7.129 147 2HG2 VAL 19 2HG2 VAL 19 17.034 -10.525 -6.477 148 3HG2 VAL 19 1HG2 VAL 19 17.907 -11.730 -5.531 149 H ARG 20 HN ARG 20 17.142 -15.625 -6.046 150 HA ARG 20 HA ARG 20 19.115 -15.505 -3.891 151 1HB ARG 20 2HB ARG 20 19.091 -17.216 -6.388 152 2HB ARG 20 1HB ARG 20 19.843 -17.592 -4.839 153 1HG ARG 20 2HG ARG 20 16.883 -17.397 -5.451 154 2HG ARG 20 1HG ARG 20 17.779 -18.826 -4.934 155 1HD ARG 20 2HD ARG 20 18.289 -17.681 -2.768 156 2HD ARG 20 1HD ARG 20 17.281 -16.317 -3.287 157 HE ARG 20 HE ARG 20 15.344 -17.803 -3.253 158 1HH1 ARG 20 1HH1 ARG 20 16.936 -20.327 -3.901 159 2HH1 ARG 20 2HH1 ARG 20 16.804 -21.195 -2.408 160 1HH2 ARG 20 1HH2 ARG 20 15.759 -18.433 -0.590 161 2HH2 ARG 20 2HH2 ARG 20 16.136 -20.123 -0.533 162 H ASN 21 HN ASN 21 19.686 -15.780 -7.400 163 HA ASN 21 HA ASN 21 21.917 -13.797 -7.087 164 1HB ASN 21 2HB ASN 21 21.677 -16.208 -8.917 165 2HB ASN 21 1HB ASN 21 23.087 -15.157 -8.774 166 1HD2 ASN 21 1HD2 ASN 21 21.463 -17.895 -7.395 167 2HD2 ASN 21 2HD2 ASN 21 22.504 -18.114 -6.073 168 H GLY 22 HN GLY 22 19.931 -12.330 -7.675 169 1HA GLY 22 1HA GLY 22 20.166 -11.664 -10.500 170 2HA GLY 22 2HA GLY 22 19.170 -10.815 -9.319 171 H LYS 23 HN LYS 23 18.012 -13.583 -8.592 172 HA LYS 23 HA LYS 23 16.055 -13.669 -10.862 173 1HB LYS 23 2HB LYS 23 16.028 -16.171 -10.394 174 2HB LYS 23 1HB LYS 23 17.535 -15.559 -11.074 175 1HG LYS 23 2HG LYS 23 18.459 -15.393 -8.758 176 2HG LYS 23 1HG LYS 23 16.978 -16.129 -8.147 177 1HD LYS 23 2HD LYS 23 17.713 -17.862 -10.166 178 2HD LYS 23 1HD LYS 23 19.272 -17.377 -9.498 179 1HE LYS 23 2HE LYS 23 18.926 -18.623 -7.631 180 2HE LYS 23 1HE LYS 23 17.321 -17.907 -7.387 181 1HZ LYS 23 1HZ LYS 23 16.624 -19.322 -9.359 182 2HZ LYS 23 3HZ LYS 23 18.075 -20.172 -9.149 183 3HZ LYS 23 2HZ LYS 23 16.916 -20.152 -7.906 184 H LEU 24 HN LEU 24 14.719 -12.281 -9.430 185 HA LEU 24 HA LEU 24 13.870 -13.275 -6.813 186 1HB LEU 24 2HB LEU 24 14.027 -10.855 -7.942 187 2HB LEU 24 1HB LEU 24 12.368 -11.228 -8.401 188 HG LEU 24 HG LEU 24 13.535 -10.868 -5.650 189 1HD1 LEU 24 2HD1 LEU 24 12.321 -9.050 -6.899 190 2HD1 LEU 24 1HD1 LEU 24 10.876 -10.061 -6.845 191 3HD1 LEU 24 3HD1 LEU 24 11.597 -9.472 -5.347 192 1HD2 LEU 24 3HD2 LEU 24 11.130 -12.543 -6.391 193 2HD2 LEU 24 2HD2 LEU 24 12.524 -13.029 -5.424 194 3HD2 LEU 24 1HD2 LEU 24 11.368 -11.860 -4.783 195 H ALA 25 HN ALA 25 12.125 -14.614 -6.433 196 HA ALA 25 HA ALA 25 10.347 -15.261 -8.764 197 1HB ALA 25 3HB ALA 25 12.040 -16.917 -7.529 198 2HB ALA 25 2HB ALA 25 10.693 -17.063 -6.400 199 3HB ALA 25 1HB ALA 25 10.469 -17.480 -8.099 200 H CYS 26 HN CYS 26 8.154 -14.993 -8.458 201 HA CYS 26 HA CYS 26 7.050 -14.804 -5.712 202 1HB CYS 26 2HB CYS 26 7.892 -12.559 -7.157 203 2HB CYS 26 1HB CYS 26 6.143 -12.592 -7.384 204 H THR 27 HN THR 27 4.518 -14.035 -6.203 205 HA THR 27 HA THR 27 3.547 -16.054 -8.186 206 HB THR 27 HB THR 27 1.415 -15.702 -6.757 207 HG1 THR 27 1HG THR 27 1.570 -14.369 -5.151 208 1HG2 THR 27 2HG2 THR 27 3.992 -16.962 -5.911 209 2HG2 THR 27 1HG2 THR 27 2.656 -16.934 -4.761 210 3HG2 THR 27 3HG2 THR 27 2.456 -17.722 -6.324 211 H ARG 28 HN ARG 28 1.187 -15.318 -8.969 212 HA ARG 28 HA ARG 28 1.579 -12.779 -10.410 213 1HB ARG 28 2HB ARG 28 -0.667 -14.823 -10.394 214 2HB ARG 28 1HB ARG 28 -0.450 -13.545 -11.590 215 1HG ARG 28 2HG ARG 28 1.712 -14.509 -12.251 216 2HG ARG 28 1HG ARG 28 1.537 -15.768 -11.028 217 1HD ARG 28 2HD ARG 28 -0.552 -16.538 -12.169 218 2HD ARG 28 1HD ARG 28 -0.265 -15.332 -13.438 219 HE ARG 28 HE ARG 28 2.148 -16.639 -13.308 220 1HH1 ARG 28 1HH1 ARG 28 0.746 -19.029 -12.212 221 2HH1 ARG 28 2HH1 ARG 28 0.298 -19.889 -13.647 222 1HH2 ARG 28 1HH2 ARG 28 0.766 -17.166 -15.744 223 2HH2 ARG 28 2HH2 ARG 28 0.308 -18.833 -15.647 224 H GLU 29 HN GLU 29 1.409 -12.016 -7.826 225 HA GLU 29 HA GLU 29 -1.158 -11.675 -6.654 226 1HB GLU 29 2HB GLU 29 1.098 -11.290 -5.624 227 2HB GLU 29 1HB GLU 29 1.240 -9.816 -6.583 228 1HG GLU 29 2HG GLU 29 0.416 -9.132 -4.441 229 2HG GLU 29 1HG GLU 29 -0.966 -9.077 -5.535 230 H ASN 30 HN ASN 30 -2.775 -10.141 -6.982 231 HA ASN 30 HA ASN 30 -2.521 -8.443 -9.416 232 1HB ASN 30 2HB ASN 30 -4.876 -9.220 -7.663 233 2HB ASN 30 1HB ASN 30 -4.988 -8.347 -9.191 234 1HD2 ASN 30 1HD2 ASN 30 -5.502 -11.351 -8.029 235 2HD2 ASN 30 2HD2 ASN 30 -5.032 -12.289 -9.363 236 H ASP 31 HN ASP 31 -0.987 -7.299 -7.512 237 HA ASP 31 HA ASP 31 -2.689 -5.072 -6.444 238 1HB ASP 31 2HB ASP 31 -0.504 -6.736 -5.205 239 2HB ASP 31 1HB ASP 31 -0.814 -5.104 -4.611 240 HA PRO 32 HA PRO 32 0.616 -3.483 -9.317 241 1HB PRO 32 2HB PRO 32 -1.276 -1.434 -10.015 242 2HB PRO 32 1HB PRO 32 -0.682 -2.756 -11.023 243 1HG PRO 32 2HG PRO 32 -3.292 -2.459 -9.882 244 2HG PRO 32 1HG PRO 32 -2.684 -3.803 -10.852 245 1HD PRO 32 2HD PRO 32 -3.237 -3.754 -8.006 246 2HD PRO 32 1HD PRO 32 -2.696 -5.128 -8.997 247 H ILE 33 HN ILE 33 1.984 -1.799 -8.744 248 HA ILE 33 HA ILE 33 0.981 0.387 -7.000 249 HB ILE 33 HB ILE 33 2.406 -0.146 -5.196 250 1HG1 ILE 33 2HG1 ILE 33 4.473 -0.471 -6.437 251 2HG1 ILE 33 1HG1 ILE 33 4.218 -1.864 -5.385 252 1HG2 ILE 33 1HG2 ILE 33 0.518 -1.805 -5.580 253 2HG2 ILE 33 3HG2 ILE 33 1.725 -2.893 -6.267 254 3HG2 ILE 33 2HG2 ILE 33 1.846 -2.392 -4.580 255 1HD1 ILE 33 3HD1 ILE 33 2.973 -2.840 -7.501 256 2HD1 ILE 33 2HD1 ILE 33 3.965 -1.665 -8.366 257 3HD1 ILE 33 1HD1 ILE 33 4.732 -2.921 -7.393 258 H GLN 34 HN GLN 34 3.385 1.547 -6.357 259 HA GLN 34 HA GLN 34 4.617 2.084 -9.041 260 1HB GLN 34 2HB GLN 34 4.189 3.918 -6.658 261 2HB GLN 34 1HB GLN 34 4.861 4.395 -8.218 262 1HG GLN 34 2HG GLN 34 2.766 3.826 -9.336 263 2HG GLN 34 1HG GLN 34 2.090 3.228 -7.821 264 1HE2 GLN 34 1HE2 GLN 34 0.844 5.375 -9.263 265 2HE2 GLN 34 2HE2 GLN 34 0.991 6.792 -8.341 266 H GLY 35 HN GLY 35 6.915 2.838 -8.899 267 1HA GLY 35 1HA GLY 35 8.962 1.568 -8.189 268 2HA GLY 35 2HA GLY 35 8.311 1.614 -6.551 269 HA PRO 36 HA PRO 36 10.524 5.289 -5.688 270 1HB PRO 36 2HB PRO 36 13.179 4.395 -6.348 271 2HB PRO 36 1HB PRO 36 12.431 4.498 -4.753 272 1HG PRO 36 2HG PRO 36 13.035 2.136 -6.273 273 2HG PRO 36 1HG PRO 36 12.294 2.238 -4.673 274 1HD PRO 36 2HD PRO 36 11.032 1.511 -7.165 275 2HD PRO 36 1HD PRO 36 10.282 1.629 -5.556 276 H ASP 37 HN ASP 37 11.031 3.807 -8.801 277 HA ASP 37 HA ASP 37 12.398 6.127 -9.973 278 1HB ASP 37 2HB ASP 37 11.140 3.641 -11.176 279 2HB ASP 37 1HB ASP 37 12.219 4.750 -12.023 280 H GLY 38 HN GLY 38 9.162 5.237 -9.319 281 1HA GLY 38 1HA GLY 38 8.235 7.531 -10.960 282 2HA GLY 38 2HA GLY 38 7.355 6.809 -9.618 283 H LYS 39 HN LYS 39 8.739 4.484 -11.681 284 HA LYS 39 HA LYS 39 6.569 4.364 -13.639 285 1HB LYS 39 2HB LYS 39 8.709 2.344 -12.902 286 2HB LYS 39 1HB LYS 39 7.815 2.420 -14.419 287 1HG LYS 39 2HG LYS 39 8.804 4.606 -14.921 288 2HG LYS 39 1HG LYS 39 9.652 4.596 -13.374 289 1HD LYS 39 2HD LYS 39 10.868 2.551 -14.064 290 2HD LYS 39 1HD LYS 39 10.036 2.591 -15.619 291 1HE LYS 39 2HE LYS 39 11.553 5.024 -14.692 292 2HE LYS 39 1HE LYS 39 12.423 3.673 -15.444 293 1HZ LYS 39 1HZ LYS 39 10.000 4.976 -16.579 294 2HZ LYS 39 3HZ LYS 39 11.584 5.305 -17.085 295 3HZ LYS 39 2HZ LYS 39 10.926 3.754 -17.312 296 H VAL 40 HN VAL 40 5.092 2.516 -13.808 297 HA VAL 40 HA VAL 40 4.261 1.495 -11.131 298 HB VAL 40 HB VAL 40 2.892 1.544 -13.843 299 1HG1 VAL 40 1HG1 VAL 40 2.097 -0.243 -12.291 300 2HG1 VAL 40 3HG1 VAL 40 1.765 0.996 -11.081 301 3HG1 VAL 40 2HG1 VAL 40 0.867 0.983 -12.598 302 1HG2 VAL 40 3HG2 VAL 40 3.446 3.758 -12.585 303 2HG2 VAL 40 2HG2 VAL 40 1.793 3.507 -13.146 304 3HG2 VAL 40 1HG2 VAL 40 2.200 3.240 -11.451 305 H HIS 41 HN HIS 41 3.819 -0.797 -10.879 306 HA HIS 41 HA HIS 41 5.031 -2.545 -12.992 307 1HB HIS 41 2HB HIS 41 5.329 -2.813 -9.986 308 2HB HIS 41 1HB HIS 41 6.164 -3.760 -11.217 309 HD1 HIS 41 HD1 HIS 41 7.883 -2.407 -12.766 310 HD2 HIS 41 HD2 HIS 41 6.533 -0.359 -9.395 311 HE1 HIS 41 HE1 HIS 41 9.449 -0.440 -12.446 312 H GLY 42 HN GLY 42 4.485 -4.987 -12.180 313 1HA GLY 42 1HA GLY 42 2.693 -6.523 -12.225 314 2HA GLY 42 2HA GLY 42 1.580 -5.158 -12.267 315 H ASN 43 HN ASN 43 3.964 -6.505 -9.944 316 HA ASN 43 HA ASN 43 1.921 -6.056 -7.792 317 1HB ASN 43 2HB ASN 43 2.758 -8.244 -6.866 318 2HB ASN 43 1HB ASN 43 1.952 -8.398 -8.426 319 1HD2 ASN 43 1HD2 ASN 43 3.795 -10.389 -7.652 320 2HD2 ASN 43 2HD2 ASN 43 5.192 -10.267 -8.608 321 H THR 44 HN THR 44 3.399 -6.832 -5.633 322 HA THR 44 HA THR 44 5.236 -4.616 -5.267 323 HB THR 44 HB THR 44 4.524 -7.067 -3.630 324 HG1 THR 44 1HG THR 44 2.817 -5.664 -3.883 325 1HG2 THR 44 2HG2 THR 44 6.787 -5.987 -3.128 326 2HG2 THR 44 1HG2 THR 44 5.879 -4.556 -2.638 327 3HG2 THR 44 3HG2 THR 44 5.654 -6.081 -1.781 328 H CYS 45 HN CYS 45 5.574 -8.048 -6.010 329 HA CYS 45 HA CYS 45 8.386 -8.278 -5.423 330 1HB CYS 45 2HB CYS 45 6.845 -9.775 -7.554 331 2HB CYS 45 1HB CYS 45 8.206 -10.352 -6.595 332 H SER 46 HN SER 46 6.627 -7.704 -8.499 333 HA SER 46 HA SER 46 8.777 -7.424 -10.265 334 1HB SER 46 2HB SER 46 6.124 -6.010 -9.944 335 2HB SER 46 1HB SER 46 7.191 -5.632 -11.296 336 HG SER 46 HG SER 46 5.695 -7.290 -11.800 337 H MET 47 HN MET 47 7.437 -4.993 -8.019 338 HA MET 47 HA MET 47 9.240 -2.859 -8.721 339 1HB MET 47 2HB MET 47 7.027 -3.243 -7.130 340 2HB MET 47 1HB MET 47 8.304 -3.075 -5.926 341 1HG MET 47 2HG MET 47 8.129 -1.136 -8.220 342 2HG MET 47 1HG MET 47 7.107 -0.919 -6.799 343 1HE MET 47 1HE MET 47 7.882 -1.162 -4.523 344 2HE MET 47 3HE MET 47 9.319 -2.192 -4.468 345 3HE MET 47 2HE MET 47 9.397 -0.534 -3.877 346 H CYS 48 HN CYS 48 9.521 -5.728 -6.797 347 HA CYS 48 HA CYS 48 11.960 -4.835 -5.397 348 1HB CYS 48 2HB CYS 48 10.178 -7.268 -5.448 349 2HB CYS 48 1HB CYS 48 11.728 -7.322 -4.614 350 H GLU 49 HN GLU 49 11.028 -6.987 -8.068 351 HA GLU 49 HA GLU 49 13.500 -8.342 -8.454 352 1HB GLU 49 2HB GLU 49 11.522 -7.319 -10.531 353 2HB GLU 49 1HB GLU 49 12.634 -8.672 -10.733 354 1HG GLU 49 2HG GLU 49 11.444 -9.643 -8.625 355 2HG GLU 49 1HG GLU 49 10.169 -8.494 -9.019 356 H VAL 50 HN VAL 50 12.330 -5.224 -9.736 357 HA VAL 50 HA VAL 50 14.672 -4.602 -11.282 358 HB VAL 50 HB VAL 50 13.651 -2.441 -11.445 359 1HG1 VAL 50 2HG1 VAL 50 12.160 -4.803 -11.723 360 2HG1 VAL 50 1HG1 VAL 50 11.082 -3.674 -10.903 361 3HG1 VAL 50 3HG1 VAL 50 11.801 -3.238 -12.453 362 1HG2 VAL 50 2HG2 VAL 50 12.214 -3.142 -8.867 363 2HG2 VAL 50 1HG2 VAL 50 13.507 -1.957 -9.043 364 3HG2 VAL 50 3HG2 VAL 50 11.944 -1.677 -9.809 365 H PHE 51 HN PHE 51 13.706 -3.786 -7.943 366 HA PHE 51 HA PHE 51 16.055 -2.243 -7.314 367 1HB PHE 51 2HB PHE 51 14.092 -2.027 -5.963 368 2HB PHE 51 1HB PHE 51 13.977 -3.772 -5.730 369 HD1 PHE 51 HD1 PHE 51 16.525 -1.048 -5.242 370 HD2 PHE 51 HD2 PHE 51 14.665 -4.584 -3.667 371 HE1 PHE 51 HE1 PHE 51 17.913 -0.867 -3.195 372 HE2 PHE 51 HE2 PHE 51 16.054 -4.404 -1.621 373 HZ PHE 51 HZ PHE 51 17.679 -2.546 -1.385 374 H PHE 52 HN PHE 52 15.209 -5.670 -7.027 375 HA PHE 52 HA PHE 52 17.577 -6.512 -5.628 376 1HB PHE 52 2HB PHE 52 15.322 -7.686 -7.185 377 2HB PHE 52 1HB PHE 52 16.743 -8.704 -6.989 378 HD1 PHE 52 HD1 PHE 52 17.668 -7.709 -4.277 379 HD2 PHE 52 HD2 PHE 52 13.770 -8.757 -5.749 380 HE1 PHE 52 HE1 PHE 52 16.934 -8.232 -1.969 381 HE2 PHE 52 HE2 PHE 52 13.041 -9.279 -3.445 382 HZ PHE 52 HZ PHE 52 14.619 -9.017 -1.551 383 H GLN 53 HN GLN 53 16.782 -5.977 -9.014 384 HA GLN 53 HA GLN 53 19.118 -7.268 -10.139 385 1HB GLN 53 2HB GLN 53 16.807 -6.506 -11.133 386 2HB GLN 53 1HB GLN 53 17.622 -4.962 -11.369 387 1HG GLN 53 2HG GLN 53 19.500 -6.366 -12.482 388 2HG GLN 53 1HG GLN 53 18.290 -7.646 -12.573 389 1HE2 GLN 53 1HE2 GLN 53 16.159 -5.384 -12.833 390 2HE2 GLN 53 2HE2 GLN 53 16.256 -4.940 -14.467 391 H ALA 54 HN ALA 54 18.301 -3.905 -9.282 392 HA ALA 54 HA ALA 54 20.789 -2.745 -10.163 393 1HB ALA 54 3HB ALA 54 18.773 -1.865 -8.068 394 2HB ALA 54 1HB ALA 54 18.658 -1.531 -9.797 395 3HB ALA 54 2HB ALA 54 19.964 -0.822 -8.847 396 H GLU 55 HN GLU 55 19.681 -4.102 -7.069 397 HA GLU 55 HA GLU 55 21.601 -3.282 -5.260 398 1HB GLU 55 2HB GLU 55 20.241 -5.906 -5.819 399 2HB GLU 55 1HB GLU 55 21.405 -5.793 -4.498 400 1HG GLU 55 2HG GLU 55 19.049 -3.915 -4.830 401 2HG GLU 55 1HG GLU 55 19.022 -5.348 -3.802 402 H GLU 56 HN GLU 56 22.011 -5.716 -7.811 403 HA GLU 56 HA GLU 56 24.672 -6.533 -7.092 404 1HB GLU 56 2HB GLU 56 23.081 -6.516 -9.673 405 2HB GLU 56 1HB GLU 56 24.643 -7.317 -9.510 406 1HG GLU 56 2HG GLU 56 23.740 -8.695 -7.667 407 2HG GLU 56 1HG GLU 56 22.177 -7.898 -7.840 408 H GLU 57 HN GLU 57 23.395 -3.834 -8.962 409 HA GLU 57 HA GLU 57 25.870 -3.064 -10.238 410 1HB GLU 57 2HB GLU 57 23.785 -2.303 -11.123 411 2HB GLU 57 1HB GLU 57 23.258 -1.697 -9.553 412 1HG GLU 57 2HG GLU 57 23.947 0.211 -10.854 413 2HG GLU 57 1HG GLU 57 25.196 -0.069 -9.641 414 H GLU 58 HN GLU 58 24.264 -2.104 -7.201 415 HA GLU 58 HA GLU 58 25.941 0.022 -6.411 416 1HB GLU 58 2HB GLU 58 24.640 -2.184 -4.778 417 2HB GLU 58 1HB GLU 58 25.202 -0.644 -4.127 418 1HG GLU 58 2HG GLU 58 23.638 0.564 -5.587 419 2HG GLU 58 1HG GLU 58 23.098 -0.961 -6.291 420 H LYS 59 HN LYS 59 26.460 -3.482 -6.182 421 HA LYS 59 HA LYS 59 28.885 -3.286 -4.586 422 1HB LYS 59 2HB LYS 59 27.732 -5.466 -6.360 423 2HB LYS 59 1HB LYS 59 29.033 -5.698 -5.192 424 1HG LYS 59 2HG LYS 59 27.557 -5.071 -3.358 425 2HG LYS 59 1HG LYS 59 26.265 -4.674 -4.490 426 1HD LYS 59 2HD LYS 59 25.793 -6.875 -3.641 427 2HD LYS 59 1HD LYS 59 26.376 -7.080 -5.293 428 1HE LYS 59 2HE LYS 59 28.613 -7.651 -4.472 429 2HE LYS 59 1HE LYS 59 28.101 -7.344 -2.802 430 1HZ LYS 59 3HZ LYS 59 26.165 -8.962 -3.581 431 2HZ LYS 59 2HZ LYS 59 27.397 -9.546 -4.593 432 3HZ LYS 59 1HZ LYS 59 27.606 -9.549 -2.907 433 H LYS 60 HN LYS 60 28.220 -2.492 -7.789 434 HA LYS 60 HA LYS 60 30.233 -3.447 -9.421 435 1HB LYS 60 2HB LYS 60 30.075 -1.255 -10.536 436 2HB LYS 60 1HB LYS 60 28.481 -1.778 -9.994 437 1HG LYS 60 2HG LYS 60 28.850 -0.420 -7.893 438 2HG LYS 60 1HG LYS 60 30.308 0.228 -8.645 439 1HD LYS 60 2HD LYS 60 28.805 0.886 -10.619 440 2HD LYS 60 1HD LYS 60 27.442 0.550 -9.551 441 1HE LYS 60 2HE LYS 60 28.800 2.117 -7.878 442 2HE LYS 60 1HE LYS 60 29.478 2.746 -9.392 443 1HZ LYS 60 2HZ LYS 60 26.570 2.297 -9.016 444 2HZ LYS 60 1HZ LYS 60 27.306 3.775 -8.619 445 3HZ LYS 60 3HZ LYS 60 27.341 3.215 -10.219 446 H LYS 61 HN LYS 61 30.576 -1.098 -6.787 447 HA LYS 61 HA LYS 61 33.231 -0.213 -7.314 448 1HB LYS 61 2HB LYS 61 31.772 -0.669 -4.689 449 2HB LYS 61 1HB LYS 61 33.171 0.381 -4.912 450 1HG LYS 61 2HG LYS 61 31.882 1.737 -6.535 451 2HG LYS 61 1HG LYS 61 30.480 0.699 -6.278 452 1HD LYS 61 2HD LYS 61 30.526 1.300 -3.856 453 2HD LYS 61 1HD LYS 61 31.855 2.412 -4.186 454 1HE LYS 61 2HE LYS 61 29.584 2.808 -6.005 455 2HE LYS 61 1HE LYS 61 29.165 3.079 -4.302 456 1HZ LYS 61 2HZ LYS 61 31.245 4.397 -4.116 457 2HZ LYS 61 1HZ LYS 61 31.451 4.260 -5.797 458 3HZ LYS 61 3HZ LYS 61 30.110 5.091 -5.174 459 H LYS 62 HN LYS 62 32.009 -3.198 -5.918 460 HA LYS 62 HA LYS 62 33.137 -5.131 -5.156 461 1HB LYS 62 2HB LYS 62 35.138 -3.911 -7.085 462 2HB LYS 62 1HB LYS 62 35.207 -5.572 -6.495 463 1HG LYS 62 2HG LYS 62 32.965 -5.997 -7.452 464 2HG LYS 62 1HG LYS 62 32.914 -4.341 -8.054 465 1HD LYS 62 2HD LYS 62 35.009 -4.819 -9.358 466 2HD LYS 62 1HD LYS 62 34.881 -6.505 -8.854 467 1HE LYS 62 2HE LYS 62 32.650 -6.654 -9.927 468 2HE LYS 62 1HE LYS 62 32.797 -4.965 -10.447 469 1HZ LYS 62 2HZ LYS 62 34.981 -5.637 -11.459 470 2HZ LYS 62 1HZ LYS 62 34.542 -7.254 -11.179 471 3HZ LYS 62 3HZ LYS 62 33.611 -6.293 -12.221 472 H GLU 63 HN GLU 63 33.396 -2.824 -3.447 473 HA GLU 63 HA GLU 63 36.127 -2.324 -2.679 474 1HB GLU 63 2HB GLU 63 33.523 -2.144 -1.127 475 2HB GLU 63 1HB GLU 63 35.030 -1.337 -0.695 476 1HG GLU 63 2HG GLU 63 34.979 -0.106 -2.841 477 2HG GLU 63 1HG GLU 63 33.460 -0.902 -3.256 478 H GLY 64 HN GLY 64 37.299 -3.229 -0.896 479 1HA GLY 64 1HA GLY 64 36.187 -5.376 0.720 480 2HA GLY 64 2HA GLY 64 37.872 -4.852 0.717 481 H GLU 65 HN GLU 65 35.989 -7.453 0.051 482 HA GLU 65 HA GLU 65 38.025 -8.559 -1.837 483 1HB GLU 65 2HB GLU 65 35.979 -9.855 -0.005 484 2HB GLU 65 1HB GLU 65 37.184 -10.723 -0.955 485 1HG GLU 65 2HG GLU 65 38.977 -9.460 0.241 486 2HG GLU 65 1HG GLU 65 37.737 -8.708 1.245 487 H SER 66 HN SER 66 37.251 -9.876 -3.639 488 HA SER 66 HA SER 66 35.034 -8.753 -5.076 489 1HB SER 66 2HB SER 66 35.583 -10.501 -6.681 490 2HB SER 66 1HB SER 66 37.086 -9.886 -5.993 491 HG SER 66 HG SER 66 37.416 -11.918 -5.576 492 H ARG 67 HN ARG 67 35.270 -11.340 -2.746 493 HA ARG 67 HA ARG 67 32.387 -12.010 -3.250 494 1HB ARG 67 2HB ARG 67 34.716 -13.761 -2.399 495 2HB ARG 67 1HB ARG 67 33.042 -14.309 -2.491 496 1HG ARG 67 2HG ARG 67 33.012 -13.666 -4.907 497 2HG ARG 67 1HG ARG 67 34.722 -13.252 -4.787 498 1HD ARG 67 2HD ARG 67 35.145 -15.627 -3.992 499 2HD ARG 67 1HD ARG 67 33.459 -15.989 -4.413 500 HE ARG 67 HE ARG 67 34.558 -14.663 -6.643 501 1HH1 ARG 67 1HH1 ARG 67 36.180 -16.999 -4.857 502 2HH1 ARG 67 2HH1 ARG 67 36.349 -18.130 -6.158 503 1HH2 ARG 67 1HH2 ARG 67 34.307 -16.348 -8.323 504 2HH2 ARG 67 2HH2 ARG 67 35.288 -17.761 -8.121 505 H ASN 68 HN ASN 68 31.085 -12.130 -1.396 506 HA ASN 68 HA ASN 68 30.464 -11.507 0.810 507 1HB ASN 68 2HB ASN 68 32.987 -13.141 1.242 508 2HB ASN 68 1HB ASN 68 31.730 -12.866 2.448 509 1HD2 ASN 68 1HD2 ASN 68 32.685 -15.392 0.869 510 2HD2 ASN 68 2HD2 ASN 68 31.234 -16.057 0.290 No H/Q in entry = 510 Start of MODEL 14 1 H1 GLU 1 3H GLU 1 19.039 9.569 0.697 2 H2 GLU 1 2H GLU 1 19.578 9.638 -0.913 3 H3 GLU 1 1H GLU 1 20.326 10.590 0.279 4 HA GLU 1 HA GLU 1 18.509 12.041 0.454 5 1HB GLU 1 2HB GLU 1 19.936 12.212 -1.574 6 2HB GLU 1 1HB GLU 1 18.829 11.138 -2.429 7 1HG GLU 1 2HG GLU 1 16.984 12.791 -1.942 8 2HG GLU 1 1HG GLU 1 18.213 13.888 -1.313 9 H SER 2 HN SER 2 17.704 8.915 -0.873 10 HA SER 2 HA SER 2 14.790 9.597 -0.619 11 1HB SER 2 2HB SER 2 15.678 9.298 -2.957 12 2HB SER 2 1HB SER 2 16.114 7.644 -2.527 13 HG SER 2 HG SER 2 14.143 7.173 -3.014 14 H GLY 3 HN GLY 3 13.552 8.098 0.535 15 1HA GLY 3 1HA GLY 3 14.666 5.451 1.185 16 2HA GLY 3 2HA GLY 3 13.059 6.034 1.621 17 H LYS 4 HN LYS 4 13.965 8.514 2.816 18 HA LYS 4 HA LYS 4 15.933 8.019 4.875 19 1HB LYS 4 2HB LYS 4 13.686 10.032 4.548 20 2HB LYS 4 1HB LYS 4 14.936 10.145 5.786 21 1HG LYS 4 2HG LYS 4 16.665 10.142 3.989 22 2HG LYS 4 1HG LYS 4 15.377 10.136 2.785 23 1HD LYS 4 2HD LYS 4 14.507 12.262 3.756 24 2HD LYS 4 1HD LYS 4 15.871 12.279 4.875 25 1HE LYS 4 2HE LYS 4 16.972 13.439 3.249 26 2HE LYS 4 1HE LYS 4 17.071 11.895 2.382 27 1HZ LYS 4 3HZ LYS 4 14.569 12.571 1.849 28 2HZ LYS 4 2HZ LYS 4 15.226 14.129 2.006 29 3HZ LYS 4 1HZ LYS 4 15.862 13.047 0.861 30 H ALA 5 HN ALA 5 12.355 8.291 5.046 31 HA ALA 5 HA ALA 5 12.265 7.270 7.775 32 1HB ALA 5 1HB ALA 5 10.170 7.741 5.629 33 2HB ALA 5 3HB ALA 5 9.804 7.377 7.315 34 3HB ALA 5 2HB ALA 5 10.640 8.873 6.897 35 H THR 6 HN THR 6 12.169 5.874 4.577 36 HA THR 6 HA THR 6 11.814 3.173 5.810 37 HB THR 6 HB THR 6 10.512 3.965 3.207 38 HG1 THR 6 1HG THR 6 9.626 4.397 5.850 39 1HG2 THR 6 1HG2 THR 6 10.507 1.677 5.054 40 2HG2 THR 6 3HG2 THR 6 8.898 2.186 4.541 41 3HG2 THR 6 2HG2 THR 6 10.107 1.739 3.338 42 H SER 7 HN SER 7 12.642 1.437 4.360 43 HA SER 7 HA SER 7 14.528 2.413 2.251 44 1HB SER 7 2HB SER 7 15.648 2.088 4.469 45 2HB SER 7 1HB SER 7 15.131 0.402 4.444 46 HG SER 7 HG SER 7 17.041 0.247 3.510 47 H TYR 8 HN TYR 8 14.288 1.217 0.402 48 HA TYR 8 HA TYR 8 12.382 -0.853 0.078 49 1HB TYR 8 2HB TYR 8 14.888 -0.094 -1.451 50 2HB TYR 8 1HB TYR 8 13.681 -1.223 -2.066 51 HD1 TYR 8 HD1 TYR 8 11.138 -0.120 -1.319 52 HD2 TYR 8 HD2 TYR 8 14.689 1.941 -2.582 53 HE1 TYR 8 HE1 TYR 8 9.755 1.785 -2.100 54 HE2 TYR 8 HE2 TYR 8 13.307 3.846 -3.362 55 HH TYR 8 HH TYR 8 10.451 4.537 -2.450 56 H ALA 9 HN ALA 9 15.917 -1.072 0.590 57 HA ALA 9 HA ALA 9 16.311 -3.827 0.325 58 1HB ALA 9 3HB ALA 9 17.531 -1.543 1.670 59 2HB ALA 9 2HB ALA 9 17.819 -3.047 2.543 60 3HB ALA 9 1HB ALA 9 18.308 -2.899 0.855 61 H GLU 10 HN GLU 10 14.955 -2.056 3.081 62 HA GLU 10 HA GLU 10 14.704 -4.454 4.750 63 1HB GLU 10 2HB GLU 10 15.055 -2.083 5.546 64 2HB GLU 10 1HB GLU 10 13.421 -1.713 4.996 65 1HG GLU 10 2HG GLU 10 12.555 -3.520 6.488 66 2HG GLU 10 1HG GLU 10 14.194 -3.762 7.094 67 H LEU 11 HN LEU 11 12.598 -2.459 2.709 68 HA LEU 11 HA LEU 11 10.139 -3.837 3.348 69 1HB LEU 11 2HB LEU 11 10.829 -1.521 2.143 70 2HB LEU 11 1HB LEU 11 10.567 -2.518 0.712 71 HG LEU 11 HG LEU 11 8.384 -3.192 2.197 72 1HD1 LEU 11 2HD1 LEU 11 9.369 -1.175 3.706 73 2HD1 LEU 11 1HD1 LEU 11 8.382 -0.243 2.579 74 3HD1 LEU 11 3HD1 LEU 11 7.642 -1.506 3.563 75 1HD2 LEU 11 1HD2 LEU 11 8.685 -2.275 -0.217 76 2HD2 LEU 11 3HD2 LEU 11 7.152 -1.972 0.601 77 3HD2 LEU 11 2HD2 LEU 11 8.367 -0.697 0.505 78 H CYS 12 HN CYS 12 12.128 -3.872 0.382 79 HA CYS 12 HA CYS 12 10.863 -6.157 -0.791 80 1HB CYS 12 2HB CYS 12 13.488 -4.705 -1.094 81 2HB CYS 12 1HB CYS 12 13.164 -6.160 -2.038 82 H ASN 13 HN ASN 13 12.992 -5.877 1.863 83 HA ASN 13 HA ASN 13 14.699 -8.040 1.877 84 1HB ASN 13 2HB ASN 13 14.213 -6.398 3.711 85 2HB ASN 13 1HB ASN 13 12.747 -7.296 4.079 86 1HD2 ASN 13 1HD2 ASN 13 14.951 -7.005 5.957 87 2HD2 ASN 13 2HD2 ASN 13 15.604 -8.550 6.222 88 H GLU 14 HN GLU 14 11.259 -8.219 2.832 89 HA GLU 14 HA GLU 14 10.993 -10.965 3.242 90 1HB GLU 14 2HB GLU 14 9.283 -9.114 3.488 91 2HB GLU 14 1HB GLU 14 9.043 -9.191 1.742 92 1HG GLU 14 2HG GLU 14 8.352 -11.525 1.899 93 2HG GLU 14 1HG GLU 14 8.703 -11.543 3.627 94 H TYR 15 HN TYR 15 11.517 -9.279 0.210 95 HA TYR 15 HA TYR 15 10.800 -11.659 -1.399 96 1HB TYR 15 2HB TYR 15 11.797 -8.862 -2.016 97 2HB TYR 15 1HB TYR 15 11.447 -10.063 -3.258 98 HD1 TYR 15 HD1 TYR 15 9.149 -10.840 -3.656 99 HD2 TYR 15 HD2 TYR 15 10.015 -7.828 -0.719 100 HE1 TYR 15 HE1 TYR 15 6.741 -10.254 -3.547 101 HE2 TYR 15 HE2 TYR 15 7.607 -7.242 -0.609 102 HH TYR 15 HH TYR 15 5.543 -7.831 -1.238 103 H ARG 16 HN ARG 16 13.537 -10.387 0.205 104 HA ARG 16 HA ARG 16 15.679 -11.062 -1.536 105 1HB ARG 16 2HB ARG 16 15.309 -10.997 1.466 106 2HB ARG 16 1HB ARG 16 16.877 -11.335 0.732 107 1HG ARG 16 2HG ARG 16 16.716 -9.200 -0.533 108 2HG ARG 16 1HG ARG 16 15.186 -8.858 0.275 109 1HD ARG 16 2HD ARG 16 16.463 -9.095 2.487 110 2HD ARG 16 1HD ARG 16 17.944 -9.025 1.511 111 HE ARG 16 HE ARG 16 15.902 -6.921 1.033 112 1HH1 ARG 16 1HH1 ARG 16 17.709 -7.114 3.673 113 2HH1 ARG 16 2HH1 ARG 16 18.851 -5.869 3.289 114 1HH2 ARG 16 1HH2 ARG 16 17.896 -5.655 -0.038 115 2HH2 ARG 16 2HH2 ARG 16 18.958 -5.043 1.187 116 H LYS 17 HN LYS 17 13.559 -13.066 0.402 117 HA LYS 17 HA LYS 17 15.246 -15.462 0.228 118 1HB LYS 17 2HB LYS 17 12.300 -15.278 0.896 119 2HB LYS 17 1HB LYS 17 13.475 -16.450 1.491 120 1HG LYS 17 2HG LYS 17 14.694 -14.470 2.560 121 2HG LYS 17 1HG LYS 17 13.254 -13.517 2.199 122 1HD LYS 17 2HD LYS 17 13.113 -16.134 3.707 123 2HD LYS 17 1HD LYS 17 13.352 -14.591 4.527 124 1HE LYS 17 2HE LYS 17 11.109 -14.264 4.453 125 2HE LYS 17 1HE LYS 17 11.204 -14.233 2.683 126 1HZ LYS 17 3HZ LYS 17 11.313 -16.791 4.157 127 2HZ LYS 17 2HZ LYS 17 9.812 -16.074 3.808 128 3HZ LYS 17 1HZ LYS 17 10.862 -16.512 2.546 129 H LEU 18 HN LEU 18 13.617 -13.793 -2.059 130 HA LEU 18 HA LEU 18 12.638 -16.235 -3.497 131 1HB LEU 18 2HB LEU 18 11.908 -13.291 -3.670 132 2HB LEU 18 1HB LEU 18 11.232 -14.541 -4.713 133 HG LEU 18 HG LEU 18 10.509 -15.738 -2.571 134 1HD1 LEU 18 3HD1 LEU 18 11.874 -13.419 -1.471 135 2HD1 LEU 18 2HD1 LEU 18 10.213 -13.520 -0.892 136 3HD1 LEU 18 1HD1 LEU 18 11.317 -14.875 -0.650 137 1HD2 LEU 18 2HD2 LEU 18 9.045 -14.312 -4.099 138 2HD2 LEU 18 1HD2 LEU 18 8.477 -14.472 -2.436 139 3HD2 LEU 18 3HD2 LEU 18 9.290 -12.994 -2.951 140 H VAL 19 HN VAL 19 14.688 -13.384 -3.629 141 HA VAL 19 HA VAL 19 15.576 -14.144 -6.389 142 HB VAL 19 HB VAL 19 14.693 -11.926 -6.306 143 1HG1 VAL 19 2HG1 VAL 19 16.281 -11.698 -3.745 144 2HG1 VAL 19 1HG1 VAL 19 15.649 -10.283 -4.586 145 3HG1 VAL 19 3HG1 VAL 19 14.543 -11.509 -3.966 146 1HG2 VAL 19 3HG2 VAL 19 17.432 -12.399 -6.812 147 2HG2 VAL 19 2HG2 VAL 19 16.441 -11.080 -7.435 148 3HG2 VAL 19 1HG2 VAL 19 17.350 -10.869 -5.938 149 H ARG 20 HN ARG 20 17.375 -15.442 -6.181 150 HA ARG 20 HA ARG 20 19.270 -15.038 -3.953 151 1HB ARG 20 2HB ARG 20 19.379 -16.982 -6.269 152 2HB ARG 20 1HB ARG 20 20.154 -17.148 -4.694 153 1HG ARG 20 2HG ARG 20 17.169 -17.142 -5.235 154 2HG ARG 20 1HG ARG 20 18.142 -18.536 -4.763 155 1HD ARG 20 2HD ARG 20 18.675 -17.466 -2.610 156 2HD ARG 20 1HD ARG 20 17.753 -16.027 -3.086 157 HE ARG 20 HE ARG 20 15.722 -17.325 -2.929 158 1HH1 ARG 20 1HH1 ARG 20 18.105 -18.509 -0.990 159 2HH1 ARG 20 2HH1 ARG 20 17.506 -20.131 -0.893 160 1HH2 ARG 20 1HH2 ARG 20 15.141 -19.690 -3.390 161 2HH2 ARG 20 2HH2 ARG 20 15.827 -20.799 -2.251 162 H ASN 21 HN ASN 21 19.856 -15.605 -7.426 163 HA ASN 21 HA ASN 21 21.943 -13.450 -7.319 164 1HB ASN 21 2HB ASN 21 21.874 -16.095 -8.806 165 2HB ASN 21 1HB ASN 21 23.171 -14.906 -8.930 166 1HD2 ASN 21 1HD2 ASN 21 21.851 -17.471 -6.968 167 2HD2 ASN 21 2HD2 ASN 21 23.009 -17.393 -5.730 168 H GLY 22 HN GLY 22 19.270 -12.848 -8.087 169 1HA GLY 22 1HA GLY 22 19.685 -12.307 -10.995 170 2HA GLY 22 2HA GLY 22 18.725 -11.295 -9.916 171 H LYS 23 HN LYS 23 17.742 -14.054 -8.780 172 HA LYS 23 HA LYS 23 15.676 -14.485 -10.916 173 1HB LYS 23 2HB LYS 23 15.717 -16.846 -10.249 174 2HB LYS 23 1HB LYS 23 17.350 -16.319 -10.655 175 1HG LYS 23 2HG LYS 23 17.346 -15.719 -8.027 176 2HG LYS 23 1HG LYS 23 16.195 -17.055 -8.012 177 1HD LYS 23 2HD LYS 23 18.082 -18.137 -9.600 178 2HD LYS 23 1HD LYS 23 19.105 -17.063 -8.646 179 1HE LYS 23 2HE LYS 23 19.080 -18.667 -7.034 180 2HE LYS 23 1HE LYS 23 17.372 -18.263 -6.776 181 1HZ LYS 23 3HZ LYS 23 18.281 -20.051 -8.962 182 2HZ LYS 23 2HZ LYS 23 17.863 -20.646 -7.426 183 3HZ LYS 23 1HZ LYS 23 16.704 -19.843 -8.374 184 H LEU 24 HN LEU 24 14.466 -12.788 -9.649 185 HA LEU 24 HA LEU 24 13.614 -13.411 -6.920 186 1HB LEU 24 2HB LEU 24 13.915 -11.115 -7.781 187 2HB LEU 24 1HB LEU 24 12.666 -11.402 -8.990 188 HG LEU 24 HG LEU 24 10.966 -11.609 -7.316 189 1HD1 LEU 24 2HD1 LEU 24 12.283 -12.938 -5.703 190 2HD1 LEU 24 1HD1 LEU 24 13.205 -11.496 -5.276 191 3HD1 LEU 24 3HD1 LEU 24 11.484 -11.581 -4.908 192 1HD2 LEU 24 2HD2 LEU 24 12.892 -9.339 -6.871 193 2HD2 LEU 24 1HD2 LEU 24 11.322 -9.313 -7.672 194 3HD2 LEU 24 3HD2 LEU 24 11.414 -9.458 -5.917 195 H ALA 25 HN ALA 25 11.957 -14.802 -6.445 196 HA ALA 25 HA ALA 25 10.279 -15.921 -8.567 197 1HB ALA 25 3HB ALA 25 11.226 -17.147 -6.576 198 2HB ALA 25 2HB ALA 25 10.131 -16.220 -5.551 199 3HB ALA 25 1HB ALA 25 9.481 -17.333 -6.754 200 H CYS 26 HN CYS 26 8.664 -14.581 -9.334 201 HA CYS 26 HA CYS 26 7.224 -12.786 -7.456 202 1HB CYS 26 2HB CYS 26 8.136 -12.613 -10.071 203 2HB CYS 26 1HB CYS 26 6.405 -12.880 -10.273 204 H THR 27 HN THR 27 4.936 -12.933 -7.171 205 HA THR 27 HA THR 27 3.761 -15.588 -7.917 206 HB THR 27 HB THR 27 2.236 -14.918 -5.918 207 HG1 THR 27 1HG THR 27 2.705 -12.854 -5.551 208 1HG2 THR 27 3HG2 THR 27 5.164 -15.615 -5.733 209 2HG2 THR 27 2HG2 THR 27 4.150 -15.526 -4.293 210 3HG2 THR 27 1HG2 THR 27 3.769 -16.682 -5.570 211 H ARG 28 HN ARG 28 1.113 -15.125 -7.601 212 HA ARG 28 HA ARG 28 0.517 -13.165 -9.767 213 1HB ARG 28 2HB ARG 28 -0.143 -15.599 -9.878 214 2HB ARG 28 1HB ARG 28 -1.207 -15.317 -8.500 215 1HG ARG 28 2HG ARG 28 -2.356 -13.525 -9.823 216 2HG ARG 28 1HG ARG 28 -1.361 -13.964 -11.211 217 1HD ARG 28 2HD ARG 28 -3.076 -15.999 -9.757 218 2HD ARG 28 1HD ARG 28 -3.677 -15.057 -11.135 219 HE ARG 28 HE ARG 28 -1.177 -16.705 -11.318 220 1HH1 ARG 28 1HH1 ARG 28 -2.857 -14.724 -13.267 221 2HH1 ARG 28 2HH1 ARG 28 -3.327 -15.905 -14.445 222 1HH2 ARG 28 1HH2 ARG 28 -2.359 -18.613 -12.508 223 2HH2 ARG 28 2HH2 ARG 28 -3.045 -18.106 -14.015 224 H GLU 29 HN GLU 29 1.009 -11.699 -7.586 225 HA GLU 29 HA GLU 29 -1.400 -11.374 -5.915 226 1HB GLU 29 2HB GLU 29 0.915 -11.184 -5.038 227 2HB GLU 29 1HB GLU 29 1.202 -9.819 -6.118 228 1HG GLU 29 2HG GLU 29 -0.722 -8.632 -5.018 229 2HG GLU 29 1HG GLU 29 -0.814 -9.957 -3.858 230 H ASN 30 HN ASN 30 -2.954 -9.806 -6.252 231 HA ASN 30 HA ASN 30 -2.711 -8.128 -8.693 232 1HB ASN 30 2HB ASN 30 -4.965 -8.840 -6.792 233 2HB ASN 30 1HB ASN 30 -5.166 -7.781 -8.188 234 1HD2 ASN 30 1HD2 ASN 30 -5.594 -10.941 -7.269 235 2HD2 ASN 30 2HD2 ASN 30 -5.403 -11.704 -8.772 236 H ASP 31 HN ASP 31 -0.971 -7.035 -7.004 237 HA ASP 31 HA ASP 31 -2.431 -4.717 -5.779 238 1HB ASP 31 2HB ASP 31 -0.222 -6.495 -4.768 239 2HB ASP 31 1HB ASP 31 -0.351 -4.839 -4.176 240 HA PRO 32 HA PRO 32 0.733 -3.450 -9.015 241 1HB PRO 32 2HB PRO 32 -1.206 -1.504 -9.865 242 2HB PRO 32 1HB PRO 32 -0.621 -2.916 -10.750 243 1HG PRO 32 2HG PRO 32 -3.203 -2.532 -9.568 244 2HG PRO 32 1HG PRO 32 -2.605 -3.958 -10.419 245 1HD PRO 32 2HD PRO 32 -3.082 -3.640 -7.579 246 2HD PRO 32 1HD PRO 32 -2.539 -5.095 -8.445 247 H ILE 33 HN ILE 33 2.098 -1.711 -8.634 248 HA ILE 33 HA ILE 33 1.110 0.638 -7.104 249 HB ILE 33 HB ILE 33 2.587 0.305 -5.292 250 1HG1 ILE 33 2HG1 ILE 33 4.610 -0.154 -6.578 251 2HG1 ILE 33 1HG1 ILE 33 4.409 -1.393 -5.339 252 1HG2 ILE 33 1HG2 ILE 33 0.691 -1.394 -5.468 253 2HG2 ILE 33 3HG2 ILE 33 1.902 -2.544 -6.035 254 3HG2 ILE 33 2HG2 ILE 33 2.035 -1.849 -4.420 255 1HD1 ILE 33 1HD1 ILE 33 3.137 -2.701 -7.208 256 2HD1 ILE 33 3HD1 ILE 33 3.963 -1.598 -8.309 257 3HD1 ILE 33 2HD1 ILE 33 4.899 -2.658 -7.256 258 H GLN 34 HN GLN 34 3.559 1.821 -6.612 259 HA GLN 34 HA GLN 34 4.707 2.138 -9.368 260 1HB GLN 34 2HB GLN 34 4.303 4.148 -7.127 261 2HB GLN 34 1HB GLN 34 5.014 4.511 -8.699 262 1HG GLN 34 2HG GLN 34 2.929 3.856 -9.817 263 2HG GLN 34 1HG GLN 34 2.215 3.426 -8.263 264 1HE2 GLN 34 1HE2 GLN 34 1.022 5.437 -9.906 265 2HE2 GLN 34 2HE2 GLN 34 1.198 6.940 -9.136 266 H GLY 35 HN GLY 35 6.991 2.402 -9.495 267 1HA GLY 35 1HA GLY 35 9.093 1.474 -8.755 268 2HA GLY 35 2HA GLY 35 8.462 1.430 -7.108 269 HA PRO 36 HA PRO 36 10.499 5.169 -6.104 270 1HB PRO 36 2HB PRO 36 13.200 4.330 -6.635 271 2HB PRO 36 1HB PRO 36 12.370 4.402 -5.079 272 1HG PRO 36 2HG PRO 36 13.101 2.067 -6.583 273 2HG PRO 36 1HG PRO 36 12.265 2.139 -5.028 274 1HD PRO 36 2HD PRO 36 11.166 1.426 -7.604 275 2HD PRO 36 1HD PRO 36 10.327 1.488 -6.036 276 H ASP 37 HN ASP 37 11.186 3.720 -9.195 277 HA ASP 37 HA ASP 37 12.501 6.137 -10.272 278 1HB ASP 37 2HB ASP 37 11.658 3.464 -11.434 279 2HB ASP 37 1HB ASP 37 12.537 4.695 -12.339 280 H GLY 38 HN GLY 38 9.501 5.831 -9.386 281 1HA GLY 38 1HA GLY 38 8.443 7.623 -11.385 282 2HA GLY 38 2HA GLY 38 7.522 6.890 -10.074 283 H LYS 39 HN LYS 39 8.857 4.276 -11.379 284 HA LYS 39 HA LYS 39 7.071 4.019 -13.737 285 1HB LYS 39 2HB LYS 39 9.234 2.290 -12.497 286 2HB LYS 39 1HB LYS 39 8.365 1.869 -13.973 287 1HG LYS 39 2HG LYS 39 9.118 4.068 -14.949 288 2HG LYS 39 1HG LYS 39 10.125 4.296 -13.520 289 1HD LYS 39 2HD LYS 39 11.205 2.070 -14.034 290 2HD LYS 39 1HD LYS 39 10.321 2.064 -15.560 291 1HE LYS 39 2HE LYS 39 11.894 4.523 -14.893 292 2HE LYS 39 1HE LYS 39 12.787 3.083 -15.416 293 1HZ LYS 39 3HZ LYS 39 10.366 4.071 -16.820 294 2HZ LYS 39 2HZ LYS 39 11.931 4.575 -17.251 295 3HZ LYS 39 1HZ LYS 39 11.500 2.936 -17.373 296 H VAL 40 HN VAL 40 5.743 1.987 -13.895 297 HA VAL 40 HA VAL 40 4.599 1.262 -11.220 298 HB VAL 40 HB VAL 40 3.379 1.155 -13.999 299 1HG1 VAL 40 3HG1 VAL 40 2.536 -0.276 -11.930 300 2HG1 VAL 40 2HG1 VAL 40 1.834 1.264 -11.433 301 3HG1 VAL 40 1HG1 VAL 40 1.381 0.548 -12.980 302 1HG2 VAL 40 1HG2 VAL 40 3.961 3.466 -13.246 303 2HG2 VAL 40 3HG2 VAL 40 2.221 3.214 -13.386 304 3HG2 VAL 40 2HG2 VAL 40 2.987 3.206 -11.798 305 H HIS 41 HN HIS 41 4.150 -0.972 -10.819 306 HA HIS 41 HA HIS 41 5.271 -2.913 -12.809 307 1HB HIS 41 2HB HIS 41 5.634 -3.023 -9.803 308 2HB HIS 41 1HB HIS 41 6.460 -4.000 -11.017 309 HD1 HIS 41 HD1 HIS 41 8.300 -2.816 -12.458 310 HD2 HIS 41 HD2 HIS 41 6.683 -0.415 -9.458 311 HE1 HIS 41 HE1 HIS 41 9.827 -0.807 -12.247 312 H GLY 42 HN GLY 42 4.502 -5.196 -12.285 313 1HA GLY 42 1HA GLY 42 2.748 -6.706 -11.890 314 2HA GLY 42 2HA GLY 42 1.675 -5.325 -12.123 315 H ASN 43 HN ASN 43 4.083 -6.181 -9.610 316 HA ASN 43 HA ASN 43 2.149 -5.300 -7.534 317 1HB ASN 43 2HB ASN 43 2.500 -7.527 -6.378 318 2HB ASN 43 1HB ASN 43 1.589 -7.627 -7.884 319 1HD2 ASN 43 1HD2 ASN 43 2.849 -9.956 -7.074 320 2HD2 ASN 43 2HD2 ASN 43 4.210 -10.264 -8.038 321 H THR 44 HN THR 44 3.455 -6.143 -5.299 322 HA THR 44 HA THR 44 5.606 -4.347 -4.961 323 HB THR 44 HB THR 44 4.852 -6.924 -3.557 324 HG1 THR 44 1HG THR 44 3.333 -5.662 -2.886 325 1HG2 THR 44 3HG2 THR 44 6.813 -4.754 -2.782 326 2HG2 THR 44 2HG2 THR 44 6.154 -5.921 -1.635 327 3HG2 THR 44 1HG2 THR 44 7.144 -6.475 -2.986 328 H CYS 45 HN CYS 45 5.819 -7.901 -5.339 329 HA CYS 45 HA CYS 45 8.588 -8.201 -5.428 330 1HB CYS 45 2HB CYS 45 7.379 -10.162 -5.489 331 2HB CYS 45 1HB CYS 45 6.234 -9.555 -6.686 332 H SER 46 HN SER 46 6.538 -7.773 -8.366 333 HA SER 46 HA SER 46 8.541 -7.407 -10.271 334 1HB SER 46 2HB SER 46 5.992 -5.779 -9.943 335 2HB SER 46 1HB SER 46 6.854 -6.062 -11.456 336 HG SER 46 HG SER 46 5.254 -7.561 -11.380 337 H MET 47 HN MET 47 7.402 -5.152 -7.806 338 HA MET 47 HA MET 47 9.041 -2.906 -8.734 339 1HB MET 47 2HB MET 47 6.812 -3.073 -7.308 340 2HB MET 47 1HB MET 47 7.932 -3.244 -5.960 341 1HG MET 47 2HG MET 47 9.071 -1.149 -6.693 342 2HG MET 47 1HG MET 47 7.847 -0.956 -7.946 343 1HE MET 47 3HE MET 47 7.711 -2.297 -4.288 344 2HE MET 47 2HE MET 47 8.758 -0.882 -4.227 345 3HE MET 47 1HE MET 47 7.205 -0.857 -3.395 346 H CYS 48 HN CYS 48 9.234 -5.533 -6.426 347 HA CYS 48 HA CYS 48 11.675 -4.598 -5.125 348 1HB CYS 48 2HB CYS 48 9.805 -6.920 -5.062 349 2HB CYS 48 1HB CYS 48 11.406 -7.183 -4.387 350 H GLU 49 HN GLU 49 10.862 -6.663 -7.852 351 HA GLU 49 HA GLU 49 13.403 -8.016 -8.066 352 1HB GLU 49 2HB GLU 49 12.368 -8.994 -9.881 353 2HB GLU 49 1HB GLU 49 10.931 -8.277 -9.157 354 1HG GLU 49 2HG GLU 49 11.029 -6.387 -10.643 355 2HG GLU 49 1HG GLU 49 12.611 -6.871 -11.250 356 H VAL 50 HN VAL 50 12.061 -5.134 -9.735 357 HA VAL 50 HA VAL 50 14.324 -4.504 -11.320 358 HB VAL 50 HB VAL 50 12.161 -3.397 -11.554 359 1HG1 VAL 50 2HG1 VAL 50 12.724 -2.279 -8.789 360 2HG1 VAL 50 1HG1 VAL 50 11.359 -1.828 -9.812 361 3HG1 VAL 50 3HG1 VAL 50 11.487 -3.471 -9.186 362 1HG2 VAL 50 3HG2 VAL 50 14.193 -2.112 -12.184 363 2HG2 VAL 50 2HG2 VAL 50 12.894 -1.055 -11.630 364 3HG2 VAL 50 1HG2 VAL 50 14.244 -1.429 -10.558 365 H PHE 51 HN PHE 51 13.558 -3.715 -7.945 366 HA PHE 51 HA PHE 51 15.872 -2.062 -7.455 367 1HB PHE 51 2HB PHE 51 13.966 -1.950 -5.999 368 2HB PHE 51 1HB PHE 51 13.975 -3.696 -5.750 369 HD1 PHE 51 HD1 PHE 51 16.628 -1.046 -5.609 370 HD2 PHE 51 HD2 PHE 51 14.580 -4.217 -3.561 371 HE1 PHE 51 HE1 PHE 51 18.128 -0.752 -3.654 372 HE2 PHE 51 HE2 PHE 51 16.078 -3.925 -1.605 373 HZ PHE 51 HZ PHE 51 17.853 -2.192 -1.652 374 H PHE 52 HN PHE 52 15.143 -5.493 -6.898 375 HA PHE 52 HA PHE 52 17.612 -6.288 -5.731 376 1HB PHE 52 2HB PHE 52 15.327 -7.503 -7.215 377 2HB PHE 52 1HB PHE 52 16.781 -8.485 -7.067 378 HD1 PHE 52 HD1 PHE 52 17.876 -7.817 -4.487 379 HD2 PHE 52 HD2 PHE 52 13.761 -8.228 -5.644 380 HE1 PHE 52 HE1 PHE 52 17.268 -8.348 -2.141 381 HE2 PHE 52 HE2 PHE 52 13.153 -8.760 -3.300 382 HZ PHE 52 HZ PHE 52 14.907 -8.819 -1.550 383 H GLN 53 HN GLN 53 16.591 -5.962 -9.111 384 HA GLN 53 HA GLN 53 18.926 -7.089 -10.343 385 1HB GLN 53 2HB GLN 53 16.575 -6.481 -11.251 386 2HB GLN 53 1HB GLN 53 17.212 -4.848 -11.427 387 1HG GLN 53 2HG GLN 53 19.183 -6.002 -12.680 388 2HG GLN 53 1HG GLN 53 18.083 -7.372 -12.823 389 1HE2 GLN 53 1HE2 GLN 53 15.770 -5.260 -12.854 390 2HE2 GLN 53 2HE2 GLN 53 15.768 -4.717 -14.462 391 H ALA 54 HN ALA 54 18.011 -3.711 -9.612 392 HA ALA 54 HA ALA 54 20.594 -2.642 -10.456 393 1HB ALA 54 2HB ALA 54 18.344 -1.432 -8.816 394 2HB ALA 54 3HB ALA 54 18.394 -1.458 -10.578 395 3HB ALA 54 1HB ALA 54 19.601 -0.541 -9.676 396 H GLU 55 HN GLU 55 19.245 -3.914 -7.501 397 HA GLU 55 HA GLU 55 20.650 -2.651 -5.460 398 1HB GLU 55 2HB GLU 55 19.002 -4.587 -5.381 399 2HB GLU 55 1HB GLU 55 20.351 -5.651 -5.778 400 1HG GLU 55 2HG GLU 55 21.561 -4.632 -3.766 401 2HG GLU 55 1HG GLU 55 20.009 -3.923 -3.317 402 H GLU 56 HN GLU 56 21.901 -4.869 -7.896 403 HA GLU 56 HA GLU 56 24.449 -5.405 -6.668 404 1HB GLU 56 2HB GLU 56 23.518 -5.349 -9.559 405 2HB GLU 56 1HB GLU 56 25.020 -6.088 -9.006 406 1HG GLU 56 2HG GLU 56 23.718 -7.592 -7.524 407 2HG GLU 56 1HG GLU 56 22.225 -6.871 -8.124 408 H GLU 57 HN GLU 57 23.233 -2.776 -8.692 409 HA GLU 57 HA GLU 57 25.762 -1.605 -9.390 410 1HB GLU 57 2HB GLU 57 22.968 -0.473 -9.032 411 2HB GLU 57 1HB GLU 57 24.294 0.393 -9.810 412 1HG GLU 57 2HG GLU 57 24.499 -1.471 -11.454 413 2HG GLU 57 1HG GLU 57 23.104 -2.250 -10.708 414 H GLU 58 HN GLU 58 23.562 -1.123 -6.628 415 HA GLU 58 HA GLU 58 24.907 1.098 -5.438 416 1HB GLU 58 2HB GLU 58 22.627 0.192 -4.911 417 2HB GLU 58 1HB GLU 58 23.398 -1.184 -4.123 418 1HG GLU 58 2HG GLU 58 24.569 0.386 -2.586 419 2HG GLU 58 1HG GLU 58 23.714 1.731 -3.343 420 H LYS 59 HN LYS 59 25.421 -2.410 -5.150 421 HA LYS 59 HA LYS 59 27.477 -2.136 -3.085 422 1HB LYS 59 2HB LYS 59 26.560 -4.400 -4.888 423 2HB LYS 59 1HB LYS 59 27.704 -4.596 -3.560 424 1HG LYS 59 2HG LYS 59 25.991 -3.716 -1.987 425 2HG LYS 59 1HG LYS 59 24.847 -3.601 -3.325 426 1HD LYS 59 2HD LYS 59 25.100 -6.047 -3.713 427 2HD LYS 59 1HD LYS 59 26.171 -6.137 -2.315 428 1HE LYS 59 2HE LYS 59 23.947 -4.787 -1.322 429 2HE LYS 59 1HE LYS 59 23.247 -6.015 -2.393 430 1HZ LYS 59 2HZ LYS 59 24.859 -7.613 -1.359 431 2HZ LYS 59 1HZ LYS 59 25.207 -6.423 -0.196 432 3HZ LYS 59 3HZ LYS 59 23.641 -7.063 -0.310 433 H LYS 60 HN LYS 60 27.514 -1.273 -6.255 434 HA LYS 60 HA LYS 60 29.822 -2.484 -7.388 435 1HB LYS 60 2HB LYS 60 29.721 -0.618 -8.904 436 2HB LYS 60 1HB LYS 60 28.058 -0.961 -8.427 437 1HG LYS 60 2HG LYS 60 28.211 0.811 -6.693 438 2HG LYS 60 1HG LYS 60 29.851 1.176 -7.231 439 1HD LYS 60 2HD LYS 60 28.848 1.542 -9.559 440 2HD LYS 60 1HD LYS 60 27.270 1.512 -8.773 441 1HE LYS 60 2HE LYS 60 27.544 3.619 -7.957 442 2HE LYS 60 1HE LYS 60 29.188 3.261 -7.395 443 1HZ LYS 60 3HZ LYS 60 29.885 3.328 -9.768 444 2HZ LYS 60 2HZ LYS 60 28.333 3.885 -10.176 445 3HZ LYS 60 1HZ LYS 60 29.343 4.826 -9.186 446 H LYS 61 HN LYS 61 29.498 0.302 -5.197 447 HA LYS 61 HA LYS 61 32.191 1.227 -5.287 448 1HB LYS 61 2HB LYS 61 30.088 1.204 -3.098 449 2HB LYS 61 1HB LYS 61 31.562 2.172 -3.039 450 1HG LYS 61 2HG LYS 61 30.891 3.257 -5.183 451 2HG LYS 61 1HG LYS 61 29.382 2.346 -5.141 452 1HD LYS 61 2HD LYS 61 28.865 3.380 -2.928 453 2HD LYS 61 1HD LYS 61 30.330 4.352 -3.072 454 1HE LYS 61 2HE LYS 61 28.970 4.717 -5.513 455 2HE LYS 61 1HE LYS 61 27.723 4.820 -4.257 456 1HZ LYS 61 1HZ LYS 61 29.284 6.273 -2.999 457 2HZ LYS 61 3HZ LYS 61 30.307 6.291 -4.351 458 3HZ LYS 61 2HZ LYS 61 28.749 6.960 -4.458 459 H LYS 62 HN LYS 62 30.642 -1.242 -3.224 460 HA LYS 62 HA LYS 62 33.364 -2.312 -2.605 461 1HB LYS 62 2HB LYS 62 32.542 -0.785 -0.802 462 2HB LYS 62 1HB LYS 62 31.125 -1.818 -0.614 463 1HG LYS 62 2HG LYS 62 32.602 -3.732 -0.076 464 2HG LYS 62 1HG LYS 62 34.009 -2.680 -0.235 465 1HD LYS 62 2HD LYS 62 33.043 -1.218 1.563 466 2HD LYS 62 1HD LYS 62 31.763 -2.411 1.784 467 1HE LYS 62 2HE LYS 62 33.417 -2.974 3.420 468 2HE LYS 62 1HE LYS 62 33.691 -4.125 2.098 469 1HZ LYS 62 1HZ LYS 62 35.117 -2.082 1.224 470 2HZ LYS 62 3HZ LYS 62 35.257 -1.783 2.887 471 3HZ LYS 62 2HZ LYS 62 35.780 -3.266 2.245 472 H GLU 63 HN GLU 63 33.406 -4.525 -2.824 473 HA GLU 63 HA GLU 63 30.920 -5.942 -3.514 474 1HB GLU 63 2HB GLU 63 33.117 -6.209 -4.691 475 2HB GLU 63 1HB GLU 63 33.782 -6.908 -3.214 476 1HG GLU 63 2HG GLU 63 32.027 -8.674 -3.300 477 2HG GLU 63 1HG GLU 63 31.457 -8.001 -4.827 478 H GLY 64 HN GLY 64 29.813 -7.301 -2.132 479 1HA GLY 64 1HA GLY 64 29.156 -8.059 0.021 480 2HA GLY 64 2HA GLY 64 30.660 -7.412 0.676 481 H GLU 65 HN GLU 65 30.280 -9.746 1.714 482 HA GLU 65 HA GLU 65 31.870 -11.679 0.056 483 1HB GLU 65 2HB GLU 65 31.703 -11.244 3.057 484 2HB GLU 65 1HB GLU 65 32.709 -12.458 2.266 485 1HG GLU 65 2HG GLU 65 33.885 -10.647 1.035 486 2HG GLU 65 1HG GLU 65 32.910 -9.453 1.890 487 H SER 66 HN SER 66 31.268 -13.930 0.244 488 HA SER 66 HA SER 66 28.460 -14.345 1.214 489 1HB SER 66 2HB SER 66 28.908 -14.517 -1.235 490 2HB SER 66 1HB SER 66 30.068 -15.804 -0.909 491 HG SER 66 HG SER 66 28.486 -17.146 -0.672 492 H ARG 67 HN ARG 67 28.144 -15.926 2.759 493 HA ARG 67 HA ARG 67 30.302 -17.048 4.238 494 1HB ARG 67 2HB ARG 67 27.405 -17.896 3.915 495 2HB ARG 67 1HB ARG 67 28.466 -18.432 5.217 496 1HG ARG 67 2HG ARG 67 28.795 -16.055 5.886 497 2HG ARG 67 1HG ARG 67 27.657 -15.567 4.629 498 1HD ARG 67 2HD ARG 67 25.921 -17.037 5.724 499 2HD ARG 67 1HD ARG 67 27.066 -17.301 7.053 500 HE ARG 67 HE ARG 67 27.087 -14.583 6.865 501 1HH1 ARG 67 1HH1 ARG 67 25.326 -16.454 8.725 502 2HH1 ARG 67 2HH1 ARG 67 23.829 -15.587 8.640 503 1HH2 ARG 67 1HH2 ARG 67 24.807 -13.635 5.946 504 2HH2 ARG 67 2HH2 ARG 67 23.535 -13.991 7.068 505 H ASN 68 HN ASN 68 28.464 -18.296 1.477 506 HA ASN 68 HA ASN 68 29.789 -20.933 1.629 507 1HB ASN 68 2HB ASN 68 27.866 -19.673 -0.356 508 2HB ASN 68 1HB ASN 68 28.319 -21.377 -0.322 509 1HD2 ASN 68 1HD2 ASN 68 25.647 -19.915 0.258 510 2HD2 ASN 68 2HD2 ASN 68 25.167 -20.541 1.761 No H/Q in entry = 510 Start of MODEL 15 1 H1 GLU 1 1H GLU 1 11.210 11.969 -2.921 2 H2 GLU 1 3H GLU 1 12.702 12.776 -2.920 3 H3 GLU 1 2H GLU 1 12.271 11.792 -4.236 4 HA GLU 1 HA GLU 1 13.793 10.507 -2.994 5 1HB GLU 1 2HB GLU 1 12.187 11.716 -0.743 6 2HB GLU 1 1HB GLU 1 13.202 10.300 -0.464 7 1HG GLU 1 2HG GLU 1 15.133 11.571 -1.449 8 2HG GLU 1 1HG GLU 1 14.097 12.997 -1.526 9 H SER 2 HN SER 2 13.444 8.256 -2.663 10 HA SER 2 HA SER 2 10.990 7.141 -3.607 11 1HB SER 2 2HB SER 2 13.159 5.884 -1.895 12 2HB SER 2 1HB SER 2 12.055 5.032 -2.974 13 HG SER 2 HG SER 2 14.382 6.219 -3.542 14 H GLY 3 HN GLY 3 11.961 8.205 -0.442 15 1HA GLY 3 1HA GLY 3 9.611 6.807 0.765 16 2HA GLY 3 2HA GLY 3 9.861 8.534 1.023 17 H LYS 4 HN LYS 4 11.620 9.205 2.366 18 HA LYS 4 HA LYS 4 13.618 7.519 3.482 19 1HB LYS 4 2HB LYS 4 13.489 10.033 3.466 20 2HB LYS 4 1HB LYS 4 12.256 9.929 4.722 21 1HG LYS 4 2HG LYS 4 13.938 8.571 6.079 22 2HG LYS 4 1HG LYS 4 15.148 9.052 4.889 23 1HD LYS 4 2HD LYS 4 14.508 11.454 5.337 24 2HD LYS 4 1HD LYS 4 13.506 10.875 6.667 25 1HE LYS 4 2HE LYS 4 15.390 11.048 7.941 26 2HE LYS 4 1HE LYS 4 15.959 9.603 7.085 27 1HZ LYS 4 3HZ LYS 4 16.780 11.072 5.309 28 2HZ LYS 4 2HZ LYS 4 16.318 12.429 6.220 29 3HZ LYS 4 1HZ LYS 4 17.540 11.396 6.791 30 H ALA 5 HN ALA 5 10.265 8.086 4.433 31 HA ALA 5 HA ALA 5 10.318 7.016 7.067 32 1HB ALA 5 3HB ALA 5 7.899 6.321 5.691 33 2HB ALA 5 1HB ALA 5 8.454 7.881 5.085 34 3HB ALA 5 2HB ALA 5 8.169 7.656 6.811 35 H THR 6 HN THR 6 10.832 5.448 4.054 36 HA THR 6 HA THR 6 10.866 2.810 5.416 37 HB THR 6 HB THR 6 9.387 3.206 2.810 38 HG1 THR 6 1HG THR 6 8.079 3.012 5.279 39 1HG2 THR 6 3HG2 THR 6 10.100 0.984 4.455 40 2HG2 THR 6 2HG2 THR 6 8.347 1.168 4.517 41 3HG2 THR 6 1HG2 THR 6 9.158 0.978 2.964 42 H SER 7 HN SER 7 11.963 1.164 4.027 43 HA SER 7 HA SER 7 13.621 2.339 1.830 44 1HB SER 7 2HB SER 7 14.486 1.874 4.424 45 2HB SER 7 1HB SER 7 14.999 0.419 3.571 46 HG SER 7 HG SER 7 16.260 1.582 2.280 47 H TYR 8 HN TYR 8 13.533 1.016 0.059 48 HA TYR 8 HA TYR 8 12.036 -1.341 -0.163 49 1HB TYR 8 2HB TYR 8 14.531 -0.451 -1.646 50 2HB TYR 8 1HB TYR 8 13.399 -1.671 -2.230 51 HD1 TYR 8 HD1 TYR 8 10.791 -0.593 -1.506 52 HD2 TYR 8 HD2 TYR 8 14.263 1.444 -3.006 53 HE1 TYR 8 HE1 TYR 8 9.342 1.195 -2.432 54 HE2 TYR 8 HE2 TYR 8 12.814 3.232 -3.932 55 HH TYR 8 HH TYR 8 10.614 3.687 -4.531 56 H ALA 9 HN ALA 9 15.547 -1.040 0.481 57 HA ALA 9 HA ALA 9 16.292 -3.740 0.499 58 1HB ALA 9 1HB ALA 9 17.201 -1.195 1.547 59 2HB ALA 9 3HB ALA 9 17.581 -2.495 2.677 60 3HB ALA 9 2HB ALA 9 18.160 -2.575 1.012 61 H GLU 10 HN GLU 10 14.411 -1.953 2.876 62 HA GLU 10 HA GLU 10 14.469 -4.224 4.792 63 1HB GLU 10 2HB GLU 10 13.203 -1.462 4.820 64 2HB GLU 10 1HB GLU 10 13.184 -2.584 6.181 65 1HG GLU 10 2HG GLU 10 15.663 -1.436 4.859 66 2HG GLU 10 1HG GLU 10 15.020 -0.966 6.432 67 H LEU 11 HN LEU 11 12.319 -2.612 2.509 68 HA LEU 11 HA LEU 11 9.945 -4.121 3.336 69 1HB LEU 11 2HB LEU 11 10.224 -1.743 2.253 70 2HB LEU 11 1HB LEU 11 10.302 -2.645 0.739 71 HG LEU 11 HG LEU 11 8.148 -3.840 1.753 72 1HD1 LEU 11 3HD1 LEU 11 8.661 -1.794 3.643 73 2HD1 LEU 11 2HD1 LEU 11 7.244 -1.281 2.728 74 3HD1 LEU 11 1HD1 LEU 11 7.242 -2.838 3.555 75 1HD2 LEU 11 2HD2 LEU 11 8.644 -1.640 -0.038 76 2HD2 LEU 11 1HD2 LEU 11 7.364 -2.851 -0.111 77 3HD2 LEU 11 3HD2 LEU 11 7.122 -1.367 0.812 78 H CYS 12 HN CYS 12 11.733 -3.932 0.251 79 HA CYS 12 HA CYS 12 10.670 -6.314 -0.893 80 1HB CYS 12 2HB CYS 12 13.223 -4.726 -1.234 81 2HB CYS 12 1HB CYS 12 12.858 -6.122 -2.249 82 H ASN 13 HN ASN 13 12.926 -5.840 1.651 83 HA ASN 13 HA ASN 13 14.733 -7.934 1.579 84 1HB ASN 13 2HB ASN 13 14.126 -6.130 3.359 85 2HB ASN 13 1HB ASN 13 13.051 -7.357 4.017 86 1HD2 ASN 13 1HD2 ASN 13 14.043 -8.588 5.618 87 2HD2 ASN 13 2HD2 ASN 13 15.700 -8.954 5.687 88 H GLU 14 HN GLU 14 11.309 -8.140 2.572 89 HA GLU 14 HA GLU 14 11.222 -10.872 3.302 90 1HB GLU 14 2HB GLU 14 9.404 -8.711 2.517 91 2HB GLU 14 1HB GLU 14 8.783 -10.307 2.095 92 1HG GLU 14 2HG GLU 14 9.320 -11.034 4.459 93 2HG GLU 14 1HG GLU 14 9.669 -9.345 4.828 94 H TYR 15 HN TYR 15 11.708 -9.469 0.188 95 HA TYR 15 HA TYR 15 10.943 -12.013 -1.184 96 1HB TYR 15 2HB TYR 15 11.565 -9.210 -2.174 97 2HB TYR 15 1HB TYR 15 11.126 -10.563 -3.218 98 HD1 TYR 15 HD1 TYR 15 9.017 -11.947 -1.864 99 HD2 TYR 15 HD2 TYR 15 9.773 -7.723 -2.029 100 HE1 TYR 15 HE1 TYR 15 6.613 -11.501 -1.442 101 HE2 TYR 15 HE2 TYR 15 7.371 -7.276 -1.606 102 HH TYR 15 HH TYR 15 5.430 -8.609 -0.446 103 H ARG 16 HN ARG 16 13.609 -10.419 0.119 104 HA ARG 16 HA ARG 16 15.663 -10.937 -1.813 105 1HB ARG 16 2HB ARG 16 16.131 -9.412 -0.086 106 2HB ARG 16 1HB ARG 16 15.455 -10.470 1.150 107 1HG ARG 16 2HG ARG 16 17.341 -11.999 0.934 108 2HG ARG 16 1HG ARG 16 17.996 -11.046 -0.398 109 1HD ARG 16 2HD ARG 16 18.987 -10.628 1.970 110 2HD ARG 16 1HD ARG 16 18.500 -9.203 1.035 111 HE ARG 16 HE ARG 16 16.308 -9.307 2.304 112 1HH1 ARG 16 1HH1 ARG 16 18.826 -8.800 4.076 113 2HH1 ARG 16 2HH1 ARG 16 18.421 -9.769 5.452 114 1HH2 ARG 16 1HH2 ARG 16 15.892 -11.495 3.825 115 2HH2 ARG 16 2HH2 ARG 16 16.760 -11.296 5.310 116 H LYS 17 HN LYS 17 14.116 -12.920 0.654 117 HA LYS 17 HA LYS 17 16.059 -15.092 0.533 118 1HB LYS 17 2HB LYS 17 13.176 -15.283 1.421 119 2HB LYS 17 1HB LYS 17 14.578 -16.130 2.069 120 1HG LYS 17 2HG LYS 17 15.445 -13.775 2.719 121 2HG LYS 17 1HG LYS 17 13.783 -13.244 2.455 122 1HD LYS 17 2HD LYS 17 14.173 -15.686 4.118 123 2HD LYS 17 1HD LYS 17 14.629 -14.142 4.841 124 1HE LYS 17 2HE LYS 17 12.436 -13.308 4.748 125 2HE LYS 17 1HE LYS 17 11.969 -14.415 3.442 126 1HZ LYS 17 2HZ LYS 17 12.284 -16.273 4.985 127 2HZ LYS 17 1HZ LYS 17 12.662 -15.185 6.234 128 3HZ LYS 17 3HZ LYS 17 11.104 -15.196 5.563 129 H LEU 18 HN LEU 18 13.767 -13.930 -1.609 130 HA LEU 18 HA LEU 18 13.141 -16.608 -2.774 131 1HB LEU 18 2HB LEU 18 12.022 -13.811 -3.200 132 2HB LEU 18 1HB LEU 18 11.417 -15.264 -3.994 133 HG LEU 18 HG LEU 18 11.048 -16.222 -1.651 134 1HD1 LEU 18 2HD1 LEU 18 12.049 -13.513 -1.025 135 2HD1 LEU 18 1HD1 LEU 18 10.617 -14.009 -0.126 136 3HD1 LEU 18 3HD1 LEU 18 12.086 -14.979 -0.050 137 1HD2 LEU 18 1HD2 LEU 18 9.257 -15.256 -3.139 138 2HD2 LEU 18 3HD2 LEU 18 8.907 -15.106 -1.417 139 3HD2 LEU 18 2HD2 LEU 18 9.491 -13.708 -2.323 140 H VAL 19 HN VAL 19 14.862 -13.614 -3.289 141 HA VAL 19 HA VAL 19 15.221 -13.690 -6.119 142 HB VAL 19 HB VAL 19 17.047 -12.680 -3.914 143 1HG1 VAL 19 1HG1 VAL 19 16.892 -12.252 -6.879 144 2HG1 VAL 19 3HG1 VAL 19 17.431 -10.927 -5.848 145 3HG1 VAL 19 2HG1 VAL 19 18.313 -12.455 -5.854 146 1HG2 VAL 19 3HG2 VAL 19 14.460 -11.987 -4.180 147 2HG2 VAL 19 2HG2 VAL 19 15.701 -10.830 -3.696 148 3HG2 VAL 19 1HG2 VAL 19 15.163 -10.896 -5.376 149 H ARG 20 HN ARG 20 16.376 -15.136 -7.333 150 HA ARG 20 HA ARG 20 18.010 -17.208 -6.062 151 1HB ARG 20 2HB ARG 20 17.218 -16.435 -8.875 152 2HB ARG 20 1HB ARG 20 18.330 -17.767 -8.565 153 1HG ARG 20 2HG ARG 20 16.267 -18.255 -6.782 154 2HG ARG 20 1HG ARG 20 15.423 -17.645 -8.205 155 1HD ARG 20 2HD ARG 20 16.821 -19.293 -9.579 156 2HD ARG 20 1HD ARG 20 17.293 -20.024 -8.032 157 HE ARG 20 HE ARG 20 14.398 -19.633 -8.683 158 1HH1 ARG 20 1HH1 ARG 20 15.469 -22.092 -9.940 159 2HH1 ARG 20 2HH1 ARG 20 15.247 -23.282 -8.701 160 1HH2 ARG 20 1HH2 ARG 20 14.809 -20.953 -6.171 161 2HH2 ARG 20 2HH2 ARG 20 14.873 -22.638 -6.568 162 H ASN 21 HN ASN 21 18.964 -15.473 -8.977 163 HA ASN 21 HA ASN 21 21.477 -14.572 -7.613 164 1HB ASN 21 2HB ASN 21 21.062 -16.103 -10.193 165 2HB ASN 21 1HB ASN 21 22.570 -15.261 -9.835 166 1HD2 ASN 21 1HD2 ASN 21 20.667 -18.099 -9.128 167 2HD2 ASN 21 2HD2 ASN 21 21.748 -18.795 -8.022 168 H GLY 22 HN GLY 22 19.011 -13.105 -8.336 169 1HA GLY 22 1HA GLY 22 20.001 -11.378 -10.558 170 2HA GLY 22 2HA GLY 22 19.518 -10.653 -9.024 171 H LYS 23 HN LYS 23 17.605 -13.339 -9.552 172 HA LYS 23 HA LYS 23 15.522 -11.765 -11.024 173 1HB LYS 23 2HB LYS 23 15.530 -14.746 -10.551 174 2HB LYS 23 1HB LYS 23 14.766 -13.845 -11.859 175 1HG LYS 23 2HG LYS 23 17.355 -13.147 -12.263 176 2HG LYS 23 1HG LYS 23 17.577 -14.756 -11.575 177 1HD LYS 23 2HD LYS 23 15.908 -15.622 -13.249 178 2HD LYS 23 1HD LYS 23 15.902 -14.024 -13.994 179 1HE LYS 23 2HE LYS 23 17.512 -15.782 -15.010 180 2HE LYS 23 1HE LYS 23 18.213 -14.202 -14.614 181 1HZ LYS 23 1HZ LYS 23 18.086 -16.295 -12.548 182 2HZ LYS 23 3HZ LYS 23 19.316 -16.372 -13.714 183 3HZ LYS 23 2HZ LYS 23 19.186 -15.010 -12.708 184 H LEU 24 HN LEU 24 13.237 -12.269 -10.269 185 HA LEU 24 HA LEU 24 13.101 -12.966 -7.361 186 1HB LEU 24 2HB LEU 24 13.074 -10.400 -8.372 187 2HB LEU 24 1HB LEU 24 11.354 -10.772 -8.271 188 HG LEU 24 HG LEU 24 13.400 -10.676 -6.060 189 1HD1 LEU 24 1HD1 LEU 24 11.517 -8.901 -6.933 190 2HD1 LEU 24 3HD1 LEU 24 10.606 -9.776 -5.704 191 3HD1 LEU 24 2HD1 LEU 24 12.112 -8.965 -5.274 192 1HD2 LEU 24 2HD2 LEU 24 11.030 -12.461 -6.292 193 2HD2 LEU 24 1HD2 LEU 24 12.508 -12.669 -5.352 194 3HD2 LEU 24 3HD2 LEU 24 11.228 -11.611 -4.760 195 H ALA 25 HN ALA 25 11.331 -14.256 -6.898 196 HA ALA 25 HA ALA 25 9.223 -14.525 -9.019 197 1HB ALA 25 2HB ALA 25 10.901 -16.406 -8.795 198 2HB ALA 25 1HB ALA 25 10.299 -16.666 -7.158 199 3HB ALA 25 3HB ALA 25 9.228 -16.902 -8.540 200 H CYS 26 HN CYS 26 7.165 -14.161 -8.262 201 HA CYS 26 HA CYS 26 6.600 -14.556 -5.359 202 1HB CYS 26 2HB CYS 26 5.657 -12.324 -5.235 203 2HB CYS 26 1HB CYS 26 7.275 -12.179 -5.922 204 H THR 27 HN THR 27 4.076 -14.108 -5.098 205 HA THR 27 HA THR 27 2.611 -16.048 -6.541 206 HB THR 27 HB THR 27 1.833 -15.188 -4.444 207 HG1 THR 27 1HG THR 27 -0.097 -15.354 -5.213 208 1HG2 THR 27 2HG2 THR 27 2.553 -12.644 -5.707 209 2HG2 THR 27 1HG2 THR 27 1.031 -12.571 -4.818 210 3HG2 THR 27 3HG2 THR 27 2.507 -13.076 -3.997 211 H ARG 28 HN ARG 28 0.336 -14.848 -7.535 212 HA ARG 28 HA ARG 28 1.203 -13.961 -10.169 213 1HB ARG 28 2HB ARG 28 -0.759 -15.391 -9.774 214 2HB ARG 28 1HB ARG 28 -1.512 -14.115 -8.818 215 1HG ARG 28 2HG ARG 28 -1.407 -12.628 -10.841 216 2HG ARG 28 1HG ARG 28 -0.827 -14.010 -11.770 217 1HD ARG 28 2HD ARG 28 -2.907 -15.257 -11.143 218 2HD ARG 28 1HD ARG 28 -3.496 -13.795 -10.331 219 HE ARG 28 HE ARG 28 -2.688 -12.988 -12.905 220 1HH1 ARG 28 1HH1 ARG 28 -3.692 -15.569 -13.888 221 2HH1 ARG 28 2HH1 ARG 28 -5.383 -15.275 -14.116 222 1HH2 ARG 28 1HH2 ARG 28 -5.421 -12.416 -12.154 223 2HH2 ARG 28 2HH2 ARG 28 -6.362 -13.489 -13.134 224 H GLU 29 HN GLU 29 0.147 -12.366 -7.223 225 HA GLU 29 HA GLU 29 0.843 -9.748 -8.350 226 1HB GLU 29 2HB GLU 29 -1.452 -10.263 -9.215 227 2HB GLU 29 1HB GLU 29 -2.017 -10.370 -7.548 228 1HG GLU 29 2HG GLU 29 -1.225 -8.024 -7.182 229 2HG GLU 29 1HG GLU 29 -0.809 -7.934 -8.893 230 H ASN 30 HN ASN 30 0.826 -8.072 -6.681 231 HA ASN 30 HA ASN 30 0.244 -8.916 -3.897 232 1HB ASN 30 2HB ASN 30 2.969 -8.212 -5.022 233 2HB ASN 30 1HB ASN 30 2.621 -8.214 -3.294 234 1HD2 ASN 30 1HD2 ASN 30 4.278 -10.073 -5.202 235 2HD2 ASN 30 2HD2 ASN 30 3.774 -11.628 -4.745 236 H ASP 31 HN ASP 31 -1.256 -7.013 -5.034 237 HA ASP 31 HA ASP 31 -1.939 -4.765 -4.718 238 1HB ASP 31 2HB ASP 31 -0.571 -5.525 -2.494 239 2HB ASP 31 1HB ASP 31 0.438 -4.183 -3.035 240 HA PRO 32 HA PRO 32 1.062 -3.538 -7.969 241 1HB PRO 32 2HB PRO 32 -1.069 -1.919 -9.024 242 2HB PRO 32 1HB PRO 32 -0.395 -3.405 -9.698 243 1HG PRO 32 2HG PRO 32 -2.954 -3.039 -8.453 244 2HG PRO 32 1HG PRO 32 -2.273 -4.529 -9.110 245 1HD PRO 32 2HD PRO 32 -2.665 -3.824 -6.333 246 2HD PRO 32 1HD PRO 32 -2.007 -5.338 -6.996 247 H ILE 33 HN ILE 33 2.272 -1.647 -7.975 248 HA ILE 33 HA ILE 33 1.151 0.833 -6.788 249 HB ILE 33 HB ILE 33 2.717 0.930 -5.025 250 1HG1 ILE 33 2HG1 ILE 33 4.749 0.473 -6.247 251 2HG1 ILE 33 1HG1 ILE 33 4.669 -0.663 -4.899 252 1HG2 ILE 33 2HG2 ILE 33 0.993 -0.920 -4.797 253 2HG2 ILE 33 1HG2 ILE 33 2.259 -2.049 -5.280 254 3HG2 ILE 33 3HG2 ILE 33 2.432 -1.110 -3.798 255 1HD1 ILE 33 1HD1 ILE 33 3.554 -2.287 -6.544 256 2HD1 ILE 33 3HD1 ILE 33 4.080 -1.186 -7.817 257 3HD1 ILE 33 2HD1 ILE 33 5.274 -1.979 -6.789 258 H GLN 34 HN GLN 34 3.407 2.359 -6.681 259 HA GLN 34 HA GLN 34 4.365 2.321 -9.520 260 1HB GLN 34 2HB GLN 34 4.221 4.565 -7.479 261 2HB GLN 34 1HB GLN 34 4.624 4.740 -9.187 262 1HG GLN 34 2HG GLN 34 2.401 3.963 -9.830 263 2HG GLN 34 1HG GLN 34 1.994 3.643 -8.145 264 1HE2 GLN 34 1HE2 GLN 34 0.381 5.440 -9.592 265 2HE2 GLN 34 2HE2 GLN 34 0.644 7.020 -9.030 266 H GLY 35 HN GLY 35 6.636 2.903 -9.870 267 1HA GLY 35 1HA GLY 35 8.863 2.151 -9.366 268 2HA GLY 35 2HA GLY 35 8.376 1.914 -7.687 269 HA PRO 36 HA PRO 36 10.132 5.733 -6.486 270 1HB PRO 36 2HB PRO 36 12.854 5.175 -7.229 271 2HB PRO 36 1HB PRO 36 12.117 5.057 -5.629 272 1HG PRO 36 2HG PRO 36 12.941 2.914 -7.356 273 2HG PRO 36 1HG PRO 36 12.210 2.796 -5.754 274 1HD PRO 36 2HD PRO 36 11.002 2.177 -8.303 275 2HD PRO 36 1HD PRO 36 10.263 2.064 -6.690 276 H ASP 37 HN ASP 37 10.735 4.584 -9.715 277 HA ASP 37 HA ASP 37 11.786 7.173 -10.671 278 1HB ASP 37 2HB ASP 37 11.068 4.533 -11.980 279 2HB ASP 37 1HB ASP 37 11.767 5.898 -12.852 280 H GLY 38 HN GLY 38 8.748 5.909 -9.997 281 1HA GLY 38 1HA GLY 38 7.487 7.965 -11.734 282 2HA GLY 38 2HA GLY 38 6.743 7.226 -10.317 283 H LYS 39 HN LYS 39 8.351 4.958 -12.273 284 HA LYS 39 HA LYS 39 6.160 4.437 -14.142 285 1HB LYS 39 2HB LYS 39 8.623 4.053 -14.533 286 2HB LYS 39 1HB LYS 39 8.547 2.735 -13.363 287 1HG LYS 39 2HG LYS 39 6.774 1.658 -14.755 288 2HG LYS 39 1HG LYS 39 6.977 2.937 -15.951 289 1HD LYS 39 2HD LYS 39 9.407 2.304 -16.111 290 2HD LYS 39 1HD LYS 39 9.066 0.928 -15.061 291 1HE LYS 39 2HE LYS 39 7.148 1.067 -17.250 292 2HE LYS 39 1HE LYS 39 8.813 0.966 -17.853 293 1HZ LYS 39 3HZ LYS 39 7.663 -0.756 -15.715 294 2HZ LYS 39 2HZ LYS 39 7.871 -1.237 -17.331 295 3HZ LYS 39 1HZ LYS 39 9.224 -0.877 -16.368 296 H VAL 40 HN VAL 40 4.934 2.395 -14.134 297 HA VAL 40 HA VAL 40 4.303 1.498 -11.362 298 HB VAL 40 HB VAL 40 2.871 1.120 -14.014 299 1HG1 VAL 40 3HG1 VAL 40 2.244 0.418 -11.160 300 2HG1 VAL 40 2HG1 VAL 40 0.929 0.814 -12.267 301 3HG1 VAL 40 1HG1 VAL 40 2.001 -0.541 -12.620 302 1HG2 VAL 40 1HG2 VAL 40 2.861 3.276 -11.944 303 2HG2 VAL 40 3HG2 VAL 40 2.652 3.397 -13.691 304 3HG2 VAL 40 2HG2 VAL 40 1.320 2.840 -12.680 305 H HIS 41 HN HIS 41 3.994 -0.837 -10.996 306 HA HIS 41 HA HIS 41 5.520 -2.568 -12.914 307 1HB HIS 41 2HB HIS 41 5.580 -2.641 -9.881 308 2HB HIS 41 1HB HIS 41 6.581 -3.597 -10.973 309 HD1 HIS 41 HD1 HIS 41 8.604 -2.451 -12.051 310 HD2 HIS 41 HD2 HIS 41 6.284 0.154 -9.769 311 HE1 HIS 41 HE1 HIS 41 9.934 -0.307 -11.839 312 H GLY 42 HN GLY 42 5.048 -4.979 -12.347 313 1HA GLY 42 1HA GLY 42 3.454 -6.696 -12.226 314 2HA GLY 42 2HA GLY 42 2.244 -5.462 -12.575 315 H ASN 43 HN ASN 43 4.455 -5.780 -9.790 316 HA ASN 43 HA ASN 43 2.266 -5.208 -7.930 317 1HB ASN 43 2HB ASN 43 2.609 -7.492 -6.812 318 2HB ASN 43 1HB ASN 43 1.731 -7.492 -8.340 319 1HD2 ASN 43 1HD2 ASN 43 2.690 -9.888 -8.063 320 2HD2 ASN 43 2HD2 ASN 43 4.174 -10.145 -8.838 321 H THR 44 HN THR 44 3.408 -6.303 -5.643 322 HA THR 44 HA THR 44 5.484 -4.407 -5.042 323 HB THR 44 HB THR 44 4.587 -6.917 -3.595 324 HG1 THR 44 1HG THR 44 2.886 -5.815 -3.098 325 1HG2 THR 44 1HG2 THR 44 6.777 -5.641 -2.936 326 2HG2 THR 44 3HG2 THR 44 5.665 -4.424 -2.311 327 3HG2 THR 44 2HG2 THR 44 5.618 -6.069 -1.676 328 H CYS 45 HN CYS 45 5.592 -7.971 -5.367 329 HA CYS 45 HA CYS 45 8.369 -8.304 -4.949 330 1HB CYS 45 2HB CYS 45 8.034 -10.443 -5.976 331 2HB CYS 45 1HB CYS 45 6.511 -10.037 -5.185 332 H SER 46 HN SER 46 6.602 -7.436 -7.920 333 HA SER 46 HA SER 46 8.796 -7.575 -9.747 334 1HB SER 46 2HB SER 46 6.300 -5.860 -9.566 335 2HB SER 46 1HB SER 46 7.363 -5.848 -10.972 336 HG SER 46 HG SER 46 5.427 -7.526 -10.469 337 H MET 47 HN MET 47 7.435 -4.656 -8.156 338 HA MET 47 HA MET 47 9.492 -2.841 -8.782 339 1HB MET 47 2HB MET 47 7.190 -2.889 -7.290 340 2HB MET 47 1HB MET 47 8.411 -2.738 -6.029 341 1HG MET 47 2HG MET 47 8.460 -0.981 -8.480 342 2HG MET 47 1HG MET 47 7.503 -0.550 -7.064 343 1HE MET 47 1HE MET 47 8.369 -0.821 -4.759 344 2HE MET 47 3HE MET 47 9.694 -1.992 -4.771 345 3HE MET 47 2HE MET 47 9.974 -0.345 -4.213 346 H CYS 48 HN CYS 48 9.446 -5.527 -6.585 347 HA CYS 48 HA CYS 48 11.839 -4.710 -5.090 348 1HB CYS 48 2HB CYS 48 9.968 -7.071 -5.195 349 2HB CYS 48 1HB CYS 48 11.459 -7.164 -4.261 350 H GLU 49 HN GLU 49 11.049 -6.870 -7.799 351 HA GLU 49 HA GLU 49 13.570 -8.260 -7.861 352 1HB GLU 49 2HB GLU 49 12.663 -9.231 -9.764 353 2HB GLU 49 1HB GLU 49 11.193 -8.583 -9.046 354 1HG GLU 49 2HG GLU 49 11.247 -6.656 -10.499 355 2HG GLU 49 1HG GLU 49 12.851 -7.083 -11.093 356 H VAL 50 HN VAL 50 12.376 -5.394 -9.645 357 HA VAL 50 HA VAL 50 14.764 -4.855 -11.108 358 HB VAL 50 HB VAL 50 13.746 -2.699 -11.445 359 1HG1 VAL 50 2HG1 VAL 50 12.439 -4.964 -11.991 360 2HG1 VAL 50 1HG1 VAL 50 11.287 -4.284 -10.841 361 3HG1 VAL 50 3HG1 VAL 50 11.712 -3.386 -12.299 362 1HG2 VAL 50 1HG2 VAL 50 12.193 -3.284 -8.904 363 2HG2 VAL 50 3HG2 VAL 50 13.472 -2.084 -9.086 364 3HG2 VAL 50 2HG2 VAL 50 11.942 -1.879 -9.940 365 H PHE 51 HN PHE 51 13.680 -3.833 -7.875 366 HA PHE 51 HA PHE 51 15.945 -2.180 -7.241 367 1HB PHE 51 2HB PHE 51 13.963 -2.003 -5.926 368 2HB PHE 51 1HB PHE 51 13.880 -3.747 -5.680 369 HD1 PHE 51 HD1 PHE 51 16.321 -0.942 -5.121 370 HD2 PHE 51 HD2 PHE 51 14.544 -4.546 -3.600 371 HE1 PHE 51 HE1 PHE 51 17.637 -0.710 -3.031 372 HE2 PHE 51 HE2 PHE 51 15.860 -4.311 -1.510 373 HZ PHE 51 HZ PHE 51 17.406 -2.394 -1.227 374 H PHE 52 HN PHE 52 15.269 -5.630 -6.953 375 HA PHE 52 HA PHE 52 17.593 -6.372 -5.430 376 1HB PHE 52 2HB PHE 52 15.495 -7.636 -7.130 377 2HB PHE 52 1HB PHE 52 16.957 -8.582 -6.867 378 HD1 PHE 52 HD1 PHE 52 17.712 -7.668 -4.123 379 HD2 PHE 52 HD2 PHE 52 13.889 -8.725 -5.779 380 HE1 PHE 52 HE1 PHE 52 16.897 -8.272 -1.862 381 HE2 PHE 52 HE2 PHE 52 13.078 -9.327 -3.515 382 HZ PHE 52 HZ PHE 52 14.582 -9.101 -1.560 383 H GLN 53 HN GLN 53 16.919 -6.077 -8.901 384 HA GLN 53 HA GLN 53 19.368 -7.163 -9.901 385 1HB GLN 53 2HB GLN 53 17.086 -6.419 -10.988 386 2HB GLN 53 1HB GLN 53 17.893 -4.863 -11.163 387 1HG GLN 53 2HG GLN 53 19.814 -6.122 -12.265 388 2HG GLN 53 1HG GLN 53 18.754 -7.532 -12.304 389 1HE2 GLN 53 1HE2 GLN 53 16.395 -5.508 -12.662 390 2HE2 GLN 53 2HE2 GLN 53 16.451 -5.139 -14.318 391 H ALA 54 HN ALA 54 18.434 -3.850 -8.983 392 HA ALA 54 HA ALA 54 20.822 -2.513 -9.772 393 1HB ALA 54 2HB ALA 54 19.601 -1.491 -7.332 394 2HB ALA 54 1HB ALA 54 19.616 -0.784 -8.948 395 3HB ALA 54 3HB ALA 54 18.377 -1.961 -8.511 396 H GLU 55 HN GLU 55 19.938 -4.049 -6.660 397 HA GLU 55 HA GLU 55 22.188 -3.348 -5.126 398 1HB GLU 55 2HB GLU 55 20.431 -5.802 -5.292 399 2HB GLU 55 1HB GLU 55 21.684 -5.651 -4.059 400 1HG GLU 55 2HG GLU 55 20.659 -3.452 -3.390 401 2HG GLU 55 1HG GLU 55 19.337 -3.784 -4.510 402 H GLU 56 HN GLU 56 21.935 -5.607 -7.793 403 HA GLU 56 HA GLU 56 24.421 -7.021 -7.250 404 1HB GLU 56 2HB GLU 56 22.614 -8.013 -8.547 405 2HB GLU 56 1HB GLU 56 22.663 -6.680 -9.701 406 1HG GLU 56 2HG GLU 56 25.081 -7.329 -10.164 407 2HG GLU 56 1HG GLU 56 24.781 -8.791 -9.223 408 H GLU 57 HN GLU 57 23.521 -4.065 -8.907 409 HA GLU 57 HA GLU 57 25.963 -3.791 -10.460 410 1HB GLU 57 2HB GLU 57 23.839 -1.827 -9.536 411 2HB GLU 57 1HB GLU 57 25.060 -1.480 -10.760 412 1HG GLU 57 2HG GLU 57 23.117 -3.795 -10.963 413 2HG GLU 57 1HG GLU 57 22.816 -2.213 -11.682 414 H GLU 58 HN GLU 58 24.840 -2.587 -7.298 415 HA GLU 58 HA GLU 58 26.886 -0.760 -6.685 416 1HB GLU 58 2HB GLU 58 24.865 -1.216 -5.338 417 2HB GLU 58 1HB GLU 58 25.508 -2.801 -4.907 418 1HG GLU 58 2HG GLU 58 27.501 -1.643 -3.902 419 2HG GLU 58 1HG GLU 58 26.698 -0.101 -4.203 420 H LYS 59 HN LYS 59 26.913 -4.310 -6.472 421 HA LYS 59 HA LYS 59 29.529 -4.467 -5.208 422 1HB LYS 59 2HB LYS 59 27.838 -6.453 -6.764 423 2HB LYS 59 1HB LYS 59 29.246 -6.878 -5.791 424 1HG LYS 59 2HG LYS 59 28.133 -5.921 -3.791 425 2HG LYS 59 1HG LYS 59 26.715 -5.549 -4.772 426 1HD LYS 59 2HD LYS 59 26.479 -7.962 -5.311 427 2HD LYS 59 1HD LYS 59 27.864 -8.314 -4.279 428 1HE LYS 59 2HE LYS 59 26.003 -6.685 -2.802 429 2HE LYS 59 1HE LYS 59 25.145 -8.082 -3.482 430 1HZ LYS 59 3HZ LYS 59 27.759 -8.219 -2.065 431 2HZ LYS 59 2HZ LYS 59 26.264 -8.590 -1.350 432 3HZ LYS 59 1HZ LYS 59 26.853 -9.534 -2.635 433 H LYS 60 HN LYS 60 28.530 -3.678 -8.351 434 HA LYS 60 HA LYS 60 30.287 -4.939 -10.115 435 1HB LYS 60 2HB LYS 60 29.979 -2.957 -11.473 436 2HB LYS 60 1HB LYS 60 28.491 -3.211 -10.560 437 1HG LYS 60 2HG LYS 60 29.426 -1.615 -8.815 438 2HG LYS 60 1HG LYS 60 30.704 -1.231 -9.968 439 1HD LYS 60 2HD LYS 60 28.844 -0.711 -11.644 440 2HD LYS 60 1HD LYS 60 27.728 -0.786 -10.281 441 1HE LYS 60 2HE LYS 60 29.924 0.844 -9.469 442 2HE LYS 60 1HE LYS 60 29.405 1.407 -11.069 443 1HZ LYS 60 3HZ LYS 60 27.050 1.031 -10.081 444 2HZ LYS 60 2HZ LYS 60 27.839 1.157 -8.581 445 3HZ LYS 60 1HZ LYS 60 27.894 2.448 -9.684 446 H LYS 61 HN LYS 61 30.983 -2.222 -7.916 447 HA LYS 61 HA LYS 61 33.599 -1.585 -8.806 448 1HB LYS 61 2HB LYS 61 32.338 -1.572 -6.044 449 2HB LYS 61 1HB LYS 61 33.823 -0.719 -6.464 450 1HG LYS 61 2HG LYS 61 32.509 0.466 -8.279 451 2HG LYS 61 1HG LYS 61 31.051 -0.243 -7.586 452 1HD LYS 61 2HD LYS 61 31.658 0.800 -5.388 453 2HD LYS 61 1HD LYS 61 33.007 1.606 -6.188 454 1HE LYS 61 2HE LYS 61 30.169 1.888 -7.209 455 2HE LYS 61 1HE LYS 61 30.836 2.976 -5.975 456 1HZ LYS 61 1HZ LYS 61 32.179 2.363 -8.557 457 2HZ LYS 61 3HZ LYS 61 31.215 3.736 -8.307 458 3HZ LYS 61 2HZ LYS 61 32.644 3.529 -7.412 459 H LYS 62 HN LYS 62 35.674 -2.326 -8.058 460 HA LYS 62 HA LYS 62 37.230 -3.980 -7.400 461 1HB LYS 62 2HB LYS 62 34.985 -4.612 -5.456 462 2HB LYS 62 1HB LYS 62 36.691 -5.007 -5.243 463 1HG LYS 62 2HG LYS 62 35.559 -2.202 -5.488 464 2HG LYS 62 1HG LYS 62 36.073 -2.965 -3.984 465 1HD LYS 62 2HD LYS 62 38.360 -3.241 -4.958 466 2HD LYS 62 1HD LYS 62 37.823 -2.355 -6.386 467 1HE LYS 62 2HE LYS 62 38.685 -0.581 -5.158 468 2HE LYS 62 1HE LYS 62 37.046 -0.601 -4.480 469 1HZ LYS 62 3HZ LYS 62 37.899 -2.274 -2.846 470 2HZ LYS 62 2HZ LYS 62 39.470 -1.946 -3.405 471 3HZ LYS 62 1HZ LYS 62 38.558 -0.721 -2.660 472 H GLU 63 HN GLU 63 36.072 -4.799 -9.663 473 HA GLU 63 HA GLU 63 35.465 -7.687 -9.164 474 1HB GLU 63 2HB GLU 63 33.988 -5.725 -10.947 475 2HB GLU 63 1HB GLU 63 33.702 -7.465 -10.940 476 1HG GLU 63 2HG GLU 63 33.370 -5.591 -8.577 477 2HG GLU 63 1HG GLU 63 32.065 -6.341 -9.498 478 H GLY 64 HN GLY 64 36.225 -9.073 -10.841 479 1HA GLY 64 1HA GLY 64 38.107 -7.762 -12.750 480 2HA GLY 64 2HA GLY 64 36.970 -8.977 -13.335 481 H GLU 65 HN GLU 65 38.828 -10.294 -13.962 482 HA GLU 65 HA GLU 65 39.572 -12.248 -11.976 483 1HB GLU 65 2HB GLU 65 40.654 -11.593 -14.737 484 2HB GLU 65 1HB GLU 65 40.983 -13.085 -13.856 485 1HG GLU 65 2HG GLU 65 38.561 -13.581 -13.800 486 2HG GLU 65 1HG GLU 65 38.240 -12.094 -14.692 487 H SER 66 HN SER 66 40.923 -9.194 -12.907 488 HA SER 66 HA SER 66 43.212 -9.664 -11.051 489 1HB SER 66 2HB SER 66 43.863 -10.151 -13.424 490 2HB SER 66 1HB SER 66 43.422 -8.497 -13.846 491 HG SER 66 HG SER 66 45.117 -7.745 -12.798 492 H ARG 67 HN ARG 67 43.597 -7.864 -9.783 493 HA ARG 67 HA ARG 67 41.789 -5.684 -9.654 494 1HB ARG 67 2HB ARG 67 44.683 -5.942 -8.771 495 2HB ARG 67 1HB ARG 67 43.555 -4.722 -8.180 496 1HG ARG 67 2HG ARG 67 42.049 -6.568 -7.403 497 2HG ARG 67 1HG ARG 67 43.290 -7.729 -7.877 498 1HD ARG 67 2HD ARG 67 43.654 -5.496 -5.841 499 2HD ARG 67 1HD ARG 67 43.486 -7.223 -5.469 500 HE ARG 67 HE ARG 67 45.539 -7.114 -7.350 501 1HH1 ARG 67 1HH1 ARG 67 45.802 -4.387 -5.832 502 2HH1 ARG 67 2HH1 ARG 67 47.050 -4.802 -4.705 503 1HH2 ARG 67 1HH2 ARG 67 46.759 -8.217 -5.232 504 2HH2 ARG 67 2HH2 ARG 67 47.592 -6.970 -4.366 505 H ASN 68 HN ASN 68 44.799 -6.076 -11.473 506 HA ASN 68 HA ASN 68 44.705 -3.253 -12.391 507 1HB ASN 68 2HB ASN 68 46.780 -4.576 -11.635 508 2HB ASN 68 1HB ASN 68 46.642 -5.444 -13.165 509 1HD2 ASN 68 1HD2 ASN 68 48.947 -3.953 -12.846 510 2HD2 ASN 68 2HD2 ASN 68 48.886 -2.544 -13.790 No H/Q in entry = 510 Start of MODEL 16 1 H1 GLU 1 1H GLU 1 9.268 16.324 10.276 2 H2 GLU 1 3H GLU 1 8.118 17.051 9.262 3 H3 GLU 1 2H GLU 1 7.611 16.154 10.612 4 HA GLU 1 HA GLU 1 7.955 14.145 9.608 5 1HB GLU 1 2HB GLU 1 6.322 15.599 8.381 6 2HB GLU 1 1HB GLU 1 7.622 16.075 7.289 7 1HG GLU 1 2HG GLU 1 7.950 13.683 6.682 8 2HG GLU 1 1HG GLU 1 6.591 13.254 7.720 9 H SER 2 HN SER 2 9.360 12.753 8.422 10 HA SER 2 HA SER 2 11.882 14.045 7.428 11 1HB SER 2 2HB SER 2 12.029 12.780 9.581 12 2HB SER 2 1HB SER 2 11.465 11.337 8.737 13 HG SER 2 HG SER 2 13.934 12.330 8.879 14 H GLY 3 HN GLY 3 12.670 13.296 5.437 15 1HA GLY 3 1HA GLY 3 12.376 12.460 3.246 16 2HA GLY 3 2HA GLY 3 10.785 11.872 3.728 17 H LYS 4 HN LYS 4 11.805 10.021 2.305 18 HA LYS 4 HA LYS 4 12.556 7.780 2.277 19 1HB LYS 4 2HB LYS 4 14.515 8.955 4.277 20 2HB LYS 4 1HB LYS 4 14.762 7.497 3.317 21 1HG LYS 4 2HG LYS 4 14.295 10.254 2.142 22 2HG LYS 4 1HG LYS 4 15.886 9.522 2.350 23 1HD LYS 4 2HD LYS 4 15.028 7.555 0.981 24 2HD LYS 4 1HD LYS 4 13.615 8.540 0.603 25 1HE LYS 4 2HE LYS 4 16.229 9.887 0.195 26 2HE LYS 4 1HE LYS 4 15.874 8.552 -0.917 27 1HZ LYS 4 1HZ LYS 4 13.602 9.559 -1.149 28 2HZ LYS 4 3HZ LYS 4 14.183 10.922 -0.325 29 3HZ LYS 4 2HZ LYS 4 14.858 10.484 -1.821 30 H ALA 5 HN ALA 5 10.355 8.202 3.972 31 HA ALA 5 HA ALA 5 10.732 7.310 6.675 32 1HB ALA 5 3HB ALA 5 8.386 7.182 4.753 33 2HB ALA 5 2HB ALA 5 8.262 6.897 6.489 34 3HB ALA 5 1HB ALA 5 8.741 8.484 5.889 35 H THR 6 HN THR 6 10.707 5.623 3.640 36 HA THR 6 HA THR 6 10.760 3.015 5.121 37 HB THR 6 HB THR 6 9.636 3.414 2.346 38 HG1 THR 6 1HG THR 6 7.774 4.018 3.178 39 1HG2 THR 6 2HG2 THR 6 9.889 1.237 4.282 40 2HG2 THR 6 1HG2 THR 6 8.238 1.439 3.698 41 3HG2 THR 6 3HG2 THR 6 9.552 1.167 2.552 42 H SER 7 HN SER 7 11.970 1.314 3.892 43 HA SER 7 HA SER 7 14.001 2.469 2.011 44 1HB SER 7 2HB SER 7 15.057 2.267 4.145 45 2HB SER 7 1HB SER 7 14.309 0.700 4.447 46 HG SER 7 HG SER 7 16.580 0.731 3.710 47 H TYR 8 HN TYR 8 14.196 1.273 0.150 48 HA TYR 8 HA TYR 8 12.504 -0.918 -0.485 49 1HB TYR 8 2HB TYR 8 15.170 0.000 -1.609 50 2HB TYR 8 1HB TYR 8 14.095 -1.139 -2.420 51 HD1 TYR 8 HD1 TYR 8 11.435 -0.063 -1.883 52 HD2 TYR 8 HD2 TYR 8 15.079 2.005 -2.833 53 HE1 TYR 8 HE1 TYR 8 10.122 1.830 -2.801 54 HE2 TYR 8 HE2 TYR 8 13.765 3.897 -3.751 55 HH TYR 8 HH TYR 8 10.238 3.984 -3.488 56 H ALA 9 HN ALA 9 15.970 -0.920 0.434 57 HA ALA 9 HA ALA 9 16.447 -3.700 0.301 58 1HB ALA 9 1HB ALA 9 17.971 -1.643 0.783 59 2HB ALA 9 3HB ALA 9 17.536 -1.907 2.472 60 3HB ALA 9 2HB ALA 9 18.372 -3.171 1.568 61 H GLU 10 HN GLU 10 14.669 -1.833 2.681 62 HA GLU 10 HA GLU 10 14.529 -4.144 4.547 63 1HB GLU 10 2HB GLU 10 14.950 -1.714 5.212 64 2HB GLU 10 1HB GLU 10 13.276 -1.392 4.758 65 1HG GLU 10 2HG GLU 10 12.566 -3.202 6.351 66 2HG GLU 10 1HG GLU 10 14.243 -3.325 6.885 67 H LEU 11 HN LEU 11 12.504 -2.197 2.393 68 HA LEU 11 HA LEU 11 9.991 -3.446 3.125 69 1HB LEU 11 2HB LEU 11 10.511 -1.176 1.996 70 2HB LEU 11 1HB LEU 11 10.682 -2.106 0.508 71 HG LEU 11 HG LEU 11 8.362 -3.108 1.142 72 1HD1 LEU 11 1HD1 LEU 11 8.805 -1.312 3.313 73 2HD1 LEU 11 3HD1 LEU 11 7.466 -0.674 2.358 74 3HD1 LEU 11 2HD1 LEU 11 7.385 -2.312 3.005 75 1HD2 LEU 11 2HD2 LEU 11 9.182 -0.743 -0.276 76 2HD2 LEU 11 1HD2 LEU 11 7.834 -1.823 -0.630 77 3HD2 LEU 11 3HD2 LEU 11 7.606 -0.456 0.461 78 H CYS 12 HN CYS 12 11.781 -3.605 0.041 79 HA CYS 12 HA CYS 12 10.466 -5.967 -0.907 80 1HB CYS 12 2HB CYS 12 12.888 -4.343 -1.548 81 2HB CYS 12 1HB CYS 12 12.775 -5.947 -2.273 82 H ASN 13 HN ASN 13 12.816 -5.526 1.524 83 HA ASN 13 HA ASN 13 14.571 -7.654 1.466 84 1HB ASN 13 2HB ASN 13 14.061 -5.862 3.251 85 2HB ASN 13 1HB ASN 13 12.870 -6.995 3.878 86 1HD2 ASN 13 1HD2 ASN 13 15.275 -6.186 5.328 87 2HD2 ASN 13 2HD2 ASN 13 16.233 -7.573 5.529 88 H GLU 14 HN GLU 14 11.178 -7.819 2.585 89 HA GLU 14 HA GLU 14 10.984 -10.511 3.293 90 1HB GLU 14 2HB GLU 14 9.234 -8.692 3.376 91 2HB GLU 14 1HB GLU 14 8.980 -8.936 1.648 92 1HG GLU 14 2HG GLU 14 7.328 -10.232 2.894 93 2HG GLU 14 1HG GLU 14 8.457 -11.334 2.105 94 H TYR 15 HN TYR 15 11.484 -9.167 0.109 95 HA TYR 15 HA TYR 15 10.737 -11.681 -1.258 96 1HB TYR 15 2HB TYR 15 11.814 -8.995 -2.164 97 2HB TYR 15 1HB TYR 15 11.361 -10.298 -3.264 98 HD1 TYR 15 HD1 TYR 15 9.022 -10.963 -3.544 99 HD2 TYR 15 HD2 TYR 15 10.136 -7.787 -0.880 100 HE1 TYR 15 HE1 TYR 15 6.654 -10.258 -3.391 101 HE2 TYR 15 HE2 TYR 15 7.768 -7.072 -0.739 102 HH TYR 15 HH TYR 15 5.196 -9.013 -1.876 103 H ARG 16 HN ARG 16 13.518 -10.338 0.221 104 HA ARG 16 HA ARG 16 15.608 -11.239 -1.492 105 1HB ARG 16 2HB ARG 16 15.230 -10.587 1.394 106 2HB ARG 16 1HB ARG 16 16.694 -11.467 0.957 107 1HG ARG 16 2HG ARG 16 17.308 -9.757 -0.652 108 2HG ARG 16 1HG ARG 16 15.777 -8.918 -0.403 109 1HD ARG 16 2HD ARG 16 16.679 -9.023 2.160 110 2HD ARG 16 1HD ARG 16 18.216 -8.924 1.281 111 HE ARG 16 HE ARG 16 16.036 -7.056 0.495 112 1HH1 ARG 16 1HH1 ARG 16 17.372 -6.408 3.165 113 2HH1 ARG 16 2HH1 ARG 16 18.615 -5.314 2.657 114 1HH2 ARG 16 1HH2 ARG 16 18.384 -6.187 -0.691 115 2HH2 ARG 16 2HH2 ARG 16 19.188 -5.189 0.475 116 H LYS 17 HN LYS 17 13.486 -12.964 0.701 117 HA LYS 17 HA LYS 17 15.088 -15.411 0.765 118 1HB LYS 17 2HB LYS 17 12.131 -15.068 1.329 119 2HB LYS 17 1HB LYS 17 13.238 -16.240 2.042 120 1HG LYS 17 2HG LYS 17 14.519 -14.243 2.993 121 2HG LYS 17 1HG LYS 17 13.142 -13.252 2.514 122 1HD LYS 17 2HD LYS 17 12.752 -15.739 4.172 123 2HD LYS 17 1HD LYS 17 13.174 -14.204 4.930 124 1HE LYS 17 2HE LYS 17 11.183 -13.259 3.483 125 2HE LYS 17 1HE LYS 17 10.666 -14.955 3.445 126 1HZ LYS 17 1HZ LYS 17 11.471 -13.539 5.932 127 2HZ LYS 17 3HZ LYS 17 9.858 -13.652 5.416 128 3HZ LYS 17 2HZ LYS 17 10.725 -15.061 5.805 129 H LEU 18 HN LEU 18 13.326 -13.864 -1.601 130 HA LEU 18 HA LEU 18 12.448 -16.390 -2.934 131 1HB LEU 18 2HB LEU 18 11.753 -13.455 -3.320 132 2HB LEU 18 1HB LEU 18 11.079 -14.771 -4.281 133 HG LEU 18 HG LEU 18 10.319 -15.801 -2.058 134 1HD1 LEU 18 1HD1 LEU 18 11.606 -13.338 -1.141 135 2HD1 LEU 18 3HD1 LEU 18 9.969 -13.529 -0.524 136 3HD1 LEU 18 2HD1 LEU 18 11.172 -14.782 -0.232 137 1HD2 LEU 18 1HD2 LEU 18 8.880 -14.502 -3.721 138 2HD2 LEU 18 3HD2 LEU 18 8.285 -14.531 -2.061 139 3HD2 LEU 18 2HD2 LEU 18 9.105 -13.097 -2.678 140 H VAL 19 HN VAL 19 14.703 -13.759 -3.031 141 HA VAL 19 HA VAL 19 15.365 -13.950 -5.870 142 HB VAL 19 HB VAL 19 16.831 -12.745 -3.497 143 1HG1 VAL 19 2HG1 VAL 19 17.071 -12.319 -6.488 144 2HG1 VAL 19 1HG1 VAL 19 17.820 -11.274 -5.282 145 3HG1 VAL 19 3HG1 VAL 19 18.306 -12.964 -5.407 146 1HG2 VAL 19 3HG2 VAL 19 14.340 -12.044 -4.612 147 2HG2 VAL 19 2HG2 VAL 19 15.321 -11.072 -3.514 148 3HG2 VAL 19 1HG2 VAL 19 15.492 -10.874 -5.259 149 H ARG 20 HN ARG 20 16.952 -15.250 -6.783 150 HA ARG 20 HA ARG 20 18.269 -17.247 -5.013 151 1HB ARG 20 2HB ARG 20 17.750 -16.938 -7.974 152 2HB ARG 20 1HB ARG 20 18.820 -18.195 -7.354 153 1HG ARG 20 2HG ARG 20 16.614 -18.430 -5.712 154 2HG ARG 20 1HG ARG 20 15.889 -18.024 -7.269 155 1HD ARG 20 2HD ARG 20 17.275 -19.851 -8.318 156 2HD ARG 20 1HD ARG 20 17.794 -20.316 -6.685 157 HE ARG 20 HE ARG 20 15.390 -20.720 -6.149 158 1HH1 ARG 20 1HH1 ARG 20 16.612 -21.633 -9.097 159 2HH1 ARG 20 2HH1 ARG 20 15.084 -21.827 -9.889 160 1HH2 ARG 20 1HH2 ARG 20 13.265 -20.387 -7.313 161 2HH2 ARG 20 2HH2 ARG 20 13.189 -21.121 -8.880 162 H ASN 21 HN ASN 21 19.729 -16.387 -8.048 163 HA ASN 21 HA ASN 21 21.946 -14.964 -6.615 164 1HB ASN 21 2HB ASN 21 21.995 -17.196 -8.668 165 2HB ASN 21 1HB ASN 21 23.422 -16.237 -8.274 166 1HD2 ASN 21 1HD2 ASN 21 21.372 -18.839 -7.196 167 2HD2 ASN 21 2HD2 ASN 21 22.188 -19.152 -5.742 168 H GLY 22 HN GLY 22 19.935 -13.529 -7.824 169 1HA GLY 22 1HA GLY 22 21.107 -12.700 -10.448 170 2HA GLY 22 2HA GLY 22 20.554 -11.523 -9.256 171 H LYS 23 HN LYS 23 18.421 -13.912 -8.837 172 HA LYS 23 HA LYS 23 16.520 -12.796 -10.867 173 1HB LYS 23 2HB LYS 23 16.571 -15.675 -9.943 174 2HB LYS 23 1HB LYS 23 15.791 -15.007 -11.374 175 1HG LYS 23 2HG LYS 23 18.793 -14.951 -10.986 176 2HG LYS 23 1HG LYS 23 17.962 -16.283 -11.786 177 1HD LYS 23 2HD LYS 23 16.913 -14.550 -13.325 178 2HD LYS 23 1HD LYS 23 18.033 -13.377 -12.633 179 1HE LYS 23 2HE LYS 23 19.346 -14.102 -14.399 180 2HE LYS 23 1HE LYS 23 19.780 -15.364 -13.232 181 1HZ LYS 23 1HZ LYS 23 17.634 -16.482 -14.083 182 2HZ LYS 23 3HZ LYS 23 17.807 -15.464 -15.429 183 3HZ LYS 23 2HZ LYS 23 19.031 -16.580 -15.046 184 H LEU 24 HN LEU 24 14.251 -12.927 -10.146 185 HA LEU 24 HA LEU 24 13.995 -13.137 -7.161 186 1HB LEU 24 2HB LEU 24 13.744 -10.915 -8.669 187 2HB LEU 24 1HB LEU 24 12.095 -11.531 -8.803 188 HG LEU 24 HG LEU 24 13.612 -10.837 -6.275 189 1HD1 LEU 24 1HD1 LEU 24 11.023 -9.875 -7.530 190 2HD1 LEU 24 3HD1 LEU 24 11.568 -9.417 -5.915 191 3HD1 LEU 24 2HD1 LEU 24 12.509 -8.947 -7.331 192 1HD2 LEU 24 3HD2 LEU 24 11.171 -12.532 -6.723 193 2HD2 LEU 24 2HD2 LEU 24 12.522 -12.800 -5.622 194 3HD2 LEU 24 1HD2 LEU 24 11.314 -11.568 -5.253 195 H ALA 25 HN ALA 25 12.376 -14.494 -6.412 196 HA ALA 25 HA ALA 25 10.764 -15.944 -8.466 197 1HB ALA 25 3HB ALA 25 12.323 -17.090 -6.812 198 2HB ALA 25 2HB ALA 25 11.214 -16.582 -5.538 199 3HB ALA 25 1HB ALA 25 10.662 -17.683 -6.801 200 H CYS 26 HN CYS 26 8.772 -14.981 -8.739 201 HA CYS 26 HA CYS 26 7.009 -14.685 -6.405 202 1HB CYS 26 2HB CYS 26 8.624 -12.553 -7.192 203 2HB CYS 26 1HB CYS 26 7.067 -12.195 -7.938 204 H THR 27 HN THR 27 4.943 -13.297 -7.477 205 HA THR 27 HA THR 27 4.418 -14.411 -10.197 206 HB THR 27 HB THR 27 3.542 -16.104 -8.786 207 HG1 THR 27 1HG THR 27 1.168 -15.433 -8.732 208 1HG2 THR 27 2HG2 THR 27 3.832 -14.813 -6.677 209 2HG2 THR 27 1HG2 THR 27 2.361 -13.916 -7.054 210 3HG2 THR 27 3HG2 THR 27 2.282 -15.651 -6.745 211 H ARG 28 HN ARG 28 1.902 -13.632 -10.642 212 HA ARG 28 HA ARG 28 1.969 -10.845 -11.058 213 1HB ARG 28 2HB ARG 28 -0.368 -12.748 -10.687 214 2HB ARG 28 1HB ARG 28 -0.484 -11.152 -11.429 215 1HG ARG 28 2HG ARG 28 1.243 -11.887 -13.107 216 2HG ARG 28 1HG ARG 28 1.141 -13.510 -12.425 217 1HD ARG 28 2HD ARG 28 -1.348 -13.462 -12.903 218 2HD ARG 28 1HD ARG 28 -1.080 -11.948 -13.788 219 HE ARG 28 HE ARG 28 0.201 -14.566 -14.497 220 1HH1 ARG 28 1HH1 ARG 28 -1.961 -13.616 -16.263 221 2HH1 ARG 28 2HH1 ARG 28 -1.107 -12.735 -17.486 222 1HH2 ARG 28 1HH2 ARG 28 1.805 -12.454 -15.624 223 2HH2 ARG 28 2HH2 ARG 28 1.024 -12.077 -17.124 224 H GLU 29 HN GLU 29 0.667 -12.687 -8.306 225 HA GLU 29 HA GLU 29 -0.035 -11.956 -6.171 226 1HB GLU 29 2HB GLU 29 2.282 -11.143 -6.190 227 2HB GLU 29 1HB GLU 29 1.778 -9.677 -7.031 228 1HG GLU 29 2HG GLU 29 0.335 -9.084 -5.105 229 2HG GLU 29 1HG GLU 29 0.878 -10.535 -4.263 230 H ASN 30 HN ASN 30 -1.380 -10.254 -5.091 231 HA ASN 30 HA ASN 30 -2.961 -8.685 -7.103 232 1HB ASN 30 2HB ASN 30 -3.692 -9.998 -4.466 233 2HB ASN 30 1HB ASN 30 -4.798 -8.991 -5.401 234 1HD2 ASN 30 1HD2 ASN 30 -4.350 -12.131 -4.806 235 2HD2 ASN 30 2HD2 ASN 30 -4.688 -12.809 -6.324 236 H ASP 31 HN ASP 31 -0.826 -7.273 -6.342 237 HA ASP 31 HA ASP 31 -1.953 -5.194 -4.567 238 1HB ASP 31 2HB ASP 31 -0.814 -6.921 -3.132 239 2HB ASP 31 1HB ASP 31 0.691 -6.568 -3.983 240 HA PRO 32 HA PRO 32 0.566 -3.728 -8.208 241 1HB PRO 32 2HB PRO 32 -1.334 -1.575 -8.376 242 2HB PRO 32 1HB PRO 32 -1.093 -2.905 -9.512 243 1HG PRO 32 2HG PRO 32 -3.292 -2.505 -7.716 244 2HG PRO 32 1HG PRO 32 -3.038 -3.849 -8.833 245 1HD PRO 32 2HD PRO 32 -2.827 -3.866 -5.947 246 2HD PRO 32 1HD PRO 32 -2.611 -5.228 -7.070 247 H ILE 33 HN ILE 33 1.951 -1.890 -8.193 248 HA ILE 33 HA ILE 33 1.635 0.141 -6.057 249 HB ILE 33 HB ILE 33 3.623 -0.444 -4.918 250 1HG1 ILE 33 2HG1 ILE 33 5.105 -0.691 -6.821 251 2HG1 ILE 33 1HG1 ILE 33 5.222 -2.148 -5.836 252 1HG2 ILE 33 1HG2 ILE 33 1.768 -2.073 -4.558 253 2HG2 ILE 33 3HG2 ILE 33 2.462 -3.096 -5.818 254 3HG2 ILE 33 2HG2 ILE 33 3.361 -2.795 -4.331 255 1HD1 ILE 33 2HD1 ILE 33 3.363 -3.083 -7.391 256 2HD1 ILE 33 1HD1 ILE 33 3.816 -1.765 -8.473 257 3HD1 ILE 33 3HD1 ILE 33 5.006 -2.988 -8.027 258 H GLN 34 HN GLN 34 4.126 1.296 -6.218 259 HA GLN 34 HA GLN 34 4.578 1.837 -9.127 260 1HB GLN 34 2HB GLN 34 4.192 3.859 -6.894 261 2HB GLN 34 1HB GLN 34 4.561 4.252 -8.573 262 1HG GLN 34 2HG GLN 34 2.464 3.208 -9.302 263 2HG GLN 34 1HG GLN 34 2.101 2.740 -7.641 264 1HE2 GLN 34 1HE2 GLN 34 0.532 4.594 -9.391 265 2HE2 GLN 34 2HE2 GLN 34 0.484 6.076 -8.565 266 H GLY 35 HN GLY 35 6.741 2.458 -9.613 267 1HA GLY 35 1HA GLY 35 9.067 2.103 -9.254 268 2HA GLY 35 2HA GLY 35 8.719 1.710 -7.570 269 HA PRO 36 HA PRO 36 9.970 5.669 -6.199 270 1HB PRO 36 2HB PRO 36 12.729 5.481 -6.993 271 2HB PRO 36 1HB PRO 36 12.038 5.209 -5.392 272 1HG PRO 36 2HG PRO 36 13.088 3.255 -7.219 273 2HG PRO 36 1HG PRO 36 12.404 2.984 -5.616 274 1HD PRO 36 2HD PRO 36 11.239 2.321 -8.171 275 2HD PRO 36 1HD PRO 36 10.543 2.059 -6.553 276 H ASP 37 HN ASP 37 10.670 4.740 -9.480 277 HA ASP 37 HA ASP 37 11.384 7.470 -10.340 278 1HB ASP 37 2HB ASP 37 10.890 4.861 -11.810 279 2HB ASP 37 1HB ASP 37 11.532 6.327 -12.553 280 H GLY 38 HN GLY 38 8.594 6.464 -9.272 281 1HA GLY 38 1HA GLY 38 7.027 8.225 -10.953 282 2HA GLY 38 2HA GLY 38 6.401 7.221 -9.648 283 H LYS 39 HN LYS 39 7.993 4.991 -11.275 284 HA LYS 39 HA LYS 39 6.102 4.625 -13.532 285 1HB LYS 39 2HB LYS 39 8.622 3.263 -12.551 286 2HB LYS 39 1HB LYS 39 7.686 2.646 -13.914 287 1HG LYS 39 2HG LYS 39 7.894 4.931 -14.976 288 2HG LYS 39 1HG LYS 39 9.016 5.360 -13.684 289 1HD LYS 39 2HD LYS 39 10.339 3.264 -14.353 290 2HD LYS 39 1HD LYS 39 9.345 3.235 -15.811 291 1HE LYS 39 2HE LYS 39 10.093 5.834 -15.854 292 2HE LYS 39 1HE LYS 39 11.501 5.136 -15.031 293 1HZ LYS 39 3HZ LYS 39 10.386 3.671 -17.306 294 2HZ LYS 39 2HZ LYS 39 11.257 5.086 -17.657 295 3HZ LYS 39 1HZ LYS 39 11.999 3.818 -16.805 296 H VAL 40 HN VAL 40 5.057 2.453 -13.773 297 HA VAL 40 HA VAL 40 4.248 1.348 -11.104 298 HB VAL 40 HB VAL 40 2.815 1.394 -13.782 299 1HG1 VAL 40 2HG1 VAL 40 2.183 -0.501 -12.309 300 2HG1 VAL 40 1HG1 VAL 40 1.839 0.640 -11.010 301 3HG1 VAL 40 3HG1 VAL 40 0.865 0.658 -12.479 302 1HG2 VAL 40 2HG2 VAL 40 3.207 3.448 -11.869 303 2HG2 VAL 40 1HG2 VAL 40 2.098 3.458 -13.241 304 3HG2 VAL 40 3HG2 VAL 40 1.548 2.886 -11.666 305 H HIS 41 HN HIS 41 4.063 -0.966 -10.935 306 HA HIS 41 HA HIS 41 5.309 -2.524 -13.174 307 1HB HIS 41 2HB HIS 41 5.798 -2.931 -10.211 308 2HB HIS 41 1HB HIS 41 6.687 -3.653 -11.552 309 HD1 HIS 41 HD1 HIS 41 8.112 -1.933 -13.055 310 HD2 HIS 41 HD2 HIS 41 6.745 -0.432 -9.414 311 HE1 HIS 41 HE1 HIS 41 9.449 0.169 -12.601 312 H GLY 42 HN GLY 42 4.976 -5.010 -12.576 313 1HA GLY 42 1HA GLY 42 3.431 -6.754 -12.304 314 2HA GLY 42 2HA GLY 42 2.184 -5.544 -12.603 315 H ASN 43 HN ASN 43 4.481 -6.387 -9.979 316 HA ASN 43 HA ASN 43 2.403 -5.602 -7.991 317 1HB ASN 43 2HB ASN 43 2.748 -7.826 -6.878 318 2HB ASN 43 1HB ASN 43 2.020 -7.959 -8.478 319 1HD2 ASN 43 1HD2 ASN 43 3.724 -9.972 -7.018 320 2HD2 ASN 43 2HD2 ASN 43 5.037 -10.282 -8.048 321 H THR 44 HN THR 44 3.633 -6.478 -5.718 322 HA THR 44 HA THR 44 5.703 -4.576 -5.251 323 HB THR 44 HB THR 44 4.868 -7.122 -3.829 324 HG1 THR 44 1HG THR 44 3.260 -5.866 -3.379 325 1HG2 THR 44 2HG2 THR 44 6.638 -4.849 -2.891 326 2HG2 THR 44 1HG2 THR 44 6.001 -6.122 -1.850 327 3HG2 THR 44 3HG2 THR 44 7.131 -6.523 -3.142 328 H CYS 45 HN CYS 45 5.822 -7.929 -6.344 329 HA CYS 45 HA CYS 45 8.644 -8.333 -5.849 330 1HB CYS 45 2HB CYS 45 7.005 -9.628 -8.033 331 2HB CYS 45 1HB CYS 45 8.339 -10.321 -7.112 332 H SER 46 HN SER 46 6.863 -7.670 -8.905 333 HA SER 46 HA SER 46 8.969 -7.276 -10.669 334 1HB SER 46 2HB SER 46 6.367 -5.788 -10.230 335 2HB SER 46 1HB SER 46 7.404 -5.446 -11.614 336 HG SER 46 HG SER 46 5.792 -7.036 -12.048 337 H MET 47 HN MET 47 7.743 -5.024 -8.212 338 HA MET 47 HA MET 47 9.577 -2.861 -8.810 339 1HB MET 47 2HB MET 47 7.344 -2.930 -7.489 340 2HB MET 47 1HB MET 47 8.312 -3.527 -6.144 341 1HG MET 47 2HG MET 47 9.635 -1.543 -6.085 342 2HG MET 47 1HG MET 47 9.003 -0.989 -7.636 343 1HE MET 47 1HE MET 47 8.682 -1.723 -4.130 344 2HE MET 47 3HE MET 47 7.366 -0.741 -3.471 345 3HE MET 47 2HE MET 47 7.023 -2.316 -4.186 346 H CYS 48 HN CYS 48 9.534 -5.602 -6.592 347 HA CYS 48 HA CYS 48 12.017 -5.003 -5.242 348 1HB CYS 48 2HB CYS 48 10.274 -7.449 -5.621 349 2HB CYS 48 1HB CYS 48 11.707 -7.482 -4.602 350 H GLU 49 HN GLU 49 11.181 -6.759 -8.192 351 HA GLU 49 HA GLU 49 13.665 -8.156 -8.561 352 1HB GLU 49 2HB GLU 49 11.635 -7.012 -10.516 353 2HB GLU 49 1HB GLU 49 12.887 -8.174 -10.948 354 1HG GLU 49 2HG GLU 49 11.946 -9.735 -9.233 355 2HG GLU 49 1HG GLU 49 10.626 -8.598 -8.978 356 H VAL 50 HN VAL 50 12.552 -4.927 -9.618 357 HA VAL 50 HA VAL 50 14.902 -4.165 -11.060 358 HB VAL 50 HB VAL 50 12.947 -2.518 -9.417 359 1HG1 VAL 50 1HG1 VAL 50 14.820 -1.813 -11.692 360 2HG1 VAL 50 3HG1 VAL 50 13.539 -0.749 -11.108 361 3HG1 VAL 50 2HG1 VAL 50 14.872 -1.192 -10.041 362 1HG2 VAL 50 2HG2 VAL 50 12.827 -3.769 -12.138 363 2HG2 VAL 50 1HG2 VAL 50 11.574 -3.663 -10.901 364 3HG2 VAL 50 3HG2 VAL 50 11.995 -2.240 -11.855 365 H PHE 51 HN PHE 51 13.884 -3.472 -7.721 366 HA PHE 51 HA PHE 51 16.254 -2.179 -6.835 367 1HB PHE 51 2HB PHE 51 14.199 -2.149 -5.563 368 2HB PHE 51 1HB PHE 51 14.172 -3.910 -5.467 369 HD1 PHE 51 HD1 PHE 51 16.722 -1.228 -4.829 370 HD2 PHE 51 HD2 PHE 51 14.702 -4.721 -3.360 371 HE1 PHE 51 HE1 PHE 51 18.070 -1.130 -2.746 372 HE2 PHE 51 HE2 PHE 51 16.049 -4.626 -1.277 373 HZ PHE 51 HZ PHE 51 17.733 -2.830 -0.971 374 H PHE 52 HN PHE 52 15.321 -5.607 -6.815 375 HA PHE 52 HA PHE 52 17.687 -6.627 -5.559 376 1HB PHE 52 2HB PHE 52 15.451 -7.634 -7.285 377 2HB PHE 52 1HB PHE 52 16.826 -8.698 -7.008 378 HD1 PHE 52 HD1 PHE 52 17.607 -7.906 -4.242 379 HD2 PHE 52 HD2 PHE 52 13.731 -8.570 -5.972 380 HE1 PHE 52 HE1 PHE 52 16.700 -8.451 -2.002 381 HE2 PHE 52 HE2 PHE 52 12.828 -9.115 -3.734 382 HZ PHE 52 HZ PHE 52 14.309 -9.056 -1.745 383 H GLN 53 HN GLN 53 16.826 -6.047 -8.964 384 HA GLN 53 HA GLN 53 19.168 -7.194 -10.149 385 1HB GLN 53 2HB GLN 53 16.907 -6.380 -11.135 386 2HB GLN 53 1HB GLN 53 17.657 -4.786 -11.172 387 1HG GLN 53 2HG GLN 53 19.589 -5.862 -12.441 388 2HG GLN 53 1HG GLN 53 18.572 -7.296 -12.598 389 1HE2 GLN 53 1HE2 GLN 53 16.079 -5.578 -12.779 390 2HE2 GLN 53 2HE2 GLN 53 16.101 -4.935 -14.349 391 H ALA 54 HN ALA 54 18.403 -3.824 -9.226 392 HA ALA 54 HA ALA 54 20.854 -2.618 -9.984 393 1HB ALA 54 2HB ALA 54 18.981 -2.029 -7.666 394 2HB ALA 54 3HB ALA 54 18.794 -1.437 -9.317 395 3HB ALA 54 1HB ALA 54 20.155 -0.895 -8.335 396 H GLU 55 HN GLU 55 19.968 -4.396 -7.040 397 HA GLU 55 HA GLU 55 22.328 -3.763 -5.519 398 1HB GLU 55 2HB GLU 55 20.286 -5.998 -5.518 399 2HB GLU 55 1HB GLU 55 21.578 -5.913 -4.321 400 1HG GLU 55 2HG GLU 55 19.485 -3.780 -4.850 401 2HG GLU 55 1HG GLU 55 19.561 -4.837 -3.440 402 H GLU 56 HN GLU 56 21.701 -5.983 -8.136 403 HA GLU 56 HA GLU 56 23.883 -7.818 -7.640 404 1HB GLU 56 2HB GLU 56 21.856 -8.217 -9.056 405 2HB GLU 56 1HB GLU 56 22.475 -7.043 -10.217 406 1HG GLU 56 2HG GLU 56 24.534 -8.427 -10.467 407 2HG GLU 56 1HG GLU 56 23.833 -9.623 -9.377 408 H GLU 57 HN GLU 57 23.580 -4.735 -9.346 409 HA GLU 57 HA GLU 57 26.090 -4.838 -10.754 410 1HB GLU 57 2HB GLU 57 24.365 -2.551 -9.749 411 2HB GLU 57 1HB GLU 57 25.676 -2.372 -10.913 412 1HG GLU 57 2HG GLU 57 23.247 -4.152 -11.287 413 2HG GLU 57 1HG GLU 57 23.464 -2.568 -12.031 414 H GLU 58 HN GLU 58 25.148 -3.578 -7.554 415 HA GLU 58 HA GLU 58 27.529 -2.267 -6.815 416 1HB GLU 58 2HB GLU 58 25.380 -2.320 -5.566 417 2HB GLU 58 1HB GLU 58 25.688 -4.002 -5.135 418 1HG GLU 58 2HG GLU 58 27.827 -3.264 -4.045 419 2HG GLU 58 1HG GLU 58 27.358 -1.592 -4.358 420 H LYS 59 HN LYS 59 26.749 -5.735 -6.747 421 HA LYS 59 HA LYS 59 29.255 -6.483 -5.439 422 1HB LYS 59 2HB LYS 59 27.097 -8.018 -6.924 423 2HB LYS 59 1HB LYS 59 28.401 -8.774 -6.009 424 1HG LYS 59 2HG LYS 59 27.635 -7.526 -3.980 425 2HG LYS 59 1HG LYS 59 26.272 -6.912 -4.914 426 1HD LYS 59 2HD LYS 59 25.588 -9.277 -5.373 427 2HD LYS 59 1HD LYS 59 26.883 -9.820 -4.307 428 1HE LYS 59 2HE LYS 59 24.624 -9.656 -3.170 429 2HE LYS 59 1HE LYS 59 25.870 -8.646 -2.412 430 1HZ LYS 59 3HZ LYS 59 24.341 -7.532 -4.655 431 2HZ LYS 59 2HZ LYS 59 23.565 -7.634 -3.147 432 3HZ LYS 59 1HZ LYS 59 25.002 -6.743 -3.307 433 H LYS 60 HN LYS 60 28.533 -5.422 -8.537 434 HA LYS 60 HA LYS 60 29.874 -7.130 -10.320 435 1HB LYS 60 2HB LYS 60 30.025 -5.164 -11.702 436 2HB LYS 60 1HB LYS 60 28.562 -4.986 -10.734 437 1HG LYS 60 2HG LYS 60 29.883 -3.632 -9.088 438 2HG LYS 60 1HG LYS 60 31.261 -3.717 -10.184 439 1HD LYS 60 2HD LYS 60 29.625 -2.778 -11.969 440 2HD LYS 60 1HD LYS 60 28.615 -2.332 -10.594 441 1HE LYS 60 2HE LYS 60 31.361 -1.563 -10.081 442 2HE LYS 60 1HE LYS 60 30.803 -0.869 -11.616 443 1HZ LYS 60 1HZ LYS 60 28.885 -0.889 -9.423 444 2HZ LYS 60 3HZ LYS 60 30.191 0.179 -9.246 445 3HZ LYS 60 2HZ LYS 60 29.172 0.302 -10.600 446 H LYS 61 HN LYS 61 31.230 -4.716 -8.088 447 HA LYS 61 HA LYS 61 33.901 -4.625 -8.976 448 1HB LYS 61 2HB LYS 61 32.762 -4.646 -6.161 449 2HB LYS 61 1HB LYS 61 34.360 -4.041 -6.601 450 1HG LYS 61 2HG LYS 61 33.274 -2.405 -8.141 451 2HG LYS 61 1HG LYS 61 31.698 -2.969 -7.587 452 1HD LYS 61 2HD LYS 61 32.388 -2.374 -5.241 453 2HD LYS 61 1HD LYS 61 33.853 -1.654 -5.909 454 1HE LYS 61 2HE LYS 61 31.394 -0.749 -7.257 455 2HE LYS 61 1HE LYS 61 31.480 -0.295 -5.545 456 1HZ LYS 61 2HZ LYS 61 33.895 -0.068 -7.204 457 2HZ LYS 61 1HZ LYS 61 32.701 1.131 -7.355 458 3HZ LYS 61 3HZ LYS 61 33.430 0.848 -5.850 459 H LYS 62 HN LYS 62 32.225 -7.135 -7.137 460 HA LYS 62 HA LYS 62 34.572 -8.608 -6.327 461 1HB LYS 62 2HB LYS 62 32.340 -8.790 -5.289 462 2HB LYS 62 1HB LYS 62 31.690 -9.443 -6.793 463 1HG LYS 62 2HG LYS 62 33.384 -11.310 -6.609 464 2HG LYS 62 1HG LYS 62 33.787 -10.703 -5.003 465 1HD LYS 62 2HD LYS 62 31.350 -10.932 -4.393 466 2HD LYS 62 1HD LYS 62 31.095 -11.730 -5.944 467 1HE LYS 62 2HE LYS 62 33.356 -12.963 -4.689 468 2HE LYS 62 1HE LYS 62 32.029 -12.907 -3.514 469 1HZ LYS 62 1HZ LYS 62 31.423 -13.586 -6.307 470 2HZ LYS 62 3HZ LYS 62 32.126 -14.782 -5.332 471 3HZ LYS 62 2HZ LYS 62 30.642 -14.086 -4.884 472 H GLU 63 HN GLU 63 32.830 -8.347 -9.325 473 HA GLU 63 HA GLU 63 33.730 -10.908 -10.425 474 1HB GLU 63 2HB GLU 63 31.625 -9.770 -11.064 475 2HB GLU 63 1HB GLU 63 32.557 -8.412 -11.696 476 1HG GLU 63 2HG GLU 63 33.720 -10.054 -13.234 477 2HG GLU 63 1HG GLU 63 32.550 -11.266 -12.711 478 H GLY 64 HN GLY 64 35.061 -7.732 -10.093 479 1HA GLY 64 1HA GLY 64 37.582 -8.525 -11.242 480 2HA GLY 64 2HA GLY 64 37.153 -6.886 -10.751 481 H GLU 65 HN GLU 65 38.611 -7.312 -13.097 482 HA GLU 65 HA GLU 65 36.919 -5.989 -15.059 483 1HB GLU 65 2HB GLU 65 39.710 -7.179 -15.199 484 2HB GLU 65 1HB GLU 65 39.019 -6.071 -16.384 485 1HG GLU 65 2HG GLU 65 38.756 -4.355 -14.628 486 2HG GLU 65 1HG GLU 65 39.444 -5.463 -13.441 487 H SER 66 HN SER 66 35.628 -7.015 -16.532 488 HA SER 66 HA SER 66 35.969 -9.946 -16.948 489 1HB SER 66 2HB SER 66 33.794 -8.803 -16.258 490 2HB SER 66 1HB SER 66 33.756 -8.094 -17.873 491 HG SER 66 HG SER 66 33.572 -10.086 -18.758 492 H ARG 67 HN ARG 67 36.377 -6.890 -18.569 493 HA ARG 67 HA ARG 67 37.351 -8.322 -20.986 494 1HB ARG 67 2HB ARG 67 34.908 -7.811 -21.234 495 2HB ARG 67 1HB ARG 67 35.284 -6.099 -21.032 496 1HG ARG 67 2HG ARG 67 36.799 -6.229 -23.002 497 2HG ARG 67 1HG ARG 67 36.333 -7.915 -23.225 498 1HD ARG 67 2HD ARG 67 33.959 -7.202 -23.496 499 2HD ARG 67 1HD ARG 67 34.474 -5.510 -23.349 500 HE ARG 67 HE ARG 67 36.110 -6.243 -25.314 501 1HH1 ARG 67 1HH1 ARG 67 33.297 -5.182 -25.924 502 2HH1 ARG 67 2HH1 ARG 67 32.752 -6.353 -27.077 503 1HH2 ARG 67 1HH2 ARG 67 35.228 -8.655 -26.306 504 2HH2 ARG 67 2HH2 ARG 67 33.845 -8.319 -27.294 505 H ASN 68 HN ASN 68 39.065 -7.217 -21.951 506 HA ASN 68 HA ASN 68 39.609 -4.417 -21.039 507 1HB ASN 68 2HB ASN 68 41.885 -5.047 -20.529 508 2HB ASN 68 1HB ASN 68 40.835 -6.219 -19.732 509 1HD2 ASN 68 1HD2 ASN 68 43.436 -7.046 -20.263 510 2HD2 ASN 68 2HD2 ASN 68 43.452 -8.156 -21.547 No H/Q in entry = 510 Start of MODEL 17 1 H1 GLU 1 3H GLU 1 20.509 15.419 5.794 2 H2 GLU 1 2H GLU 1 20.456 14.979 7.435 3 H3 GLU 1 1H GLU 1 21.894 14.795 6.548 4 HA GLU 1 HA GLU 1 21.119 12.956 5.385 5 1HB GLU 1 2HB GLU 1 19.866 12.982 8.151 6 2HB GLU 1 1HB GLU 1 20.230 11.531 7.217 7 1HG GLU 1 2HG GLU 1 22.631 12.203 7.175 8 2HG GLU 1 1HG GLU 1 22.236 13.588 8.193 9 H SER 2 HN SER 2 19.604 12.812 3.772 10 HA SER 2 HA SER 2 16.742 13.394 4.469 11 1HB SER 2 2HB SER 2 18.244 13.628 1.839 12 2HB SER 2 1HB SER 2 16.554 14.062 2.095 13 HG SER 2 HG SER 2 17.682 15.921 2.336 14 H GLY 3 HN GLY 3 15.246 12.177 2.811 15 1HA GLY 3 1HA GLY 3 16.134 9.337 2.778 16 2HA GLY 3 2HA GLY 3 15.509 10.045 1.289 17 H LYS 4 HN LYS 4 14.062 7.973 2.047 18 HA LYS 4 HA LYS 4 11.550 9.190 3.064 19 1HB LYS 4 2HB LYS 4 12.175 6.511 1.777 20 2HB LYS 4 1HB LYS 4 10.561 7.156 2.072 21 1HG LYS 4 2HG LYS 4 12.656 8.521 0.356 22 2HG LYS 4 1HG LYS 4 11.348 7.522 -0.279 23 1HD LYS 4 2HD LYS 4 9.714 9.043 0.871 24 2HD LYS 4 1HD LYS 4 11.066 10.087 1.312 25 1HE LYS 4 2HE LYS 4 11.332 9.571 -1.469 26 2HE LYS 4 1HE LYS 4 9.632 9.989 -1.186 27 1HZ LYS 4 2HZ LYS 4 10.414 11.865 0.190 28 2HZ LYS 4 1HZ LYS 4 12.016 11.499 -0.240 29 3HZ LYS 4 3HZ LYS 4 10.916 12.003 -1.428 30 H ALA 5 HN ALA 5 10.259 7.942 4.658 31 HA ALA 5 HA ALA 5 11.786 7.132 6.956 32 1HB ALA 5 1HB ALA 5 9.494 8.125 6.927 33 2HB ALA 5 3HB ALA 5 8.882 6.624 6.232 34 3HB ALA 5 2HB ALA 5 9.563 6.630 7.859 35 H THR 6 HN THR 6 10.552 5.387 4.190 36 HA THR 6 HA THR 6 11.084 2.769 5.528 37 HB THR 6 HB THR 6 9.927 3.104 2.780 38 HG1 THR 6 1HG THR 6 7.966 3.646 3.645 39 1HG2 THR 6 3HG2 THR 6 10.238 1.022 4.674 40 2HG2 THR 6 2HG2 THR 6 8.512 1.375 4.593 41 3HG2 THR 6 1HG2 THR 6 9.395 0.950 3.127 42 H SER 7 HN SER 7 12.236 1.126 4.136 43 HA SER 7 HA SER 7 14.144 2.356 2.189 44 1HB SER 7 2HB SER 7 15.226 2.298 4.373 45 2HB SER 7 1HB SER 7 14.763 0.611 4.593 46 HG SER 7 HG SER 7 16.700 0.343 3.773 47 H TYR 8 HN TYR 8 14.175 1.135 0.346 48 HA TYR 8 HA TYR 8 12.663 -1.204 -0.089 49 1HB TYR 8 2HB TYR 8 15.248 -0.386 -1.450 50 2HB TYR 8 1HB TYR 8 13.929 -1.318 -2.160 51 HD1 TYR 8 HD1 TYR 8 11.522 0.039 -1.384 52 HD2 TYR 8 HD2 TYR 8 15.325 1.726 -2.451 53 HE1 TYR 8 HE1 TYR 8 10.398 2.144 -2.058 54 HE2 TYR 8 HE2 TYR 8 14.202 3.832 -3.125 55 HH TYR 8 HH TYR 8 12.282 4.933 -3.242 56 H ALA 9 HN ALA 9 16.150 -0.921 0.683 57 HA ALA 9 HA ALA 9 16.905 -3.616 0.573 58 1HB ALA 9 2HB ALA 9 18.108 -1.334 1.211 59 2HB ALA 9 1HB ALA 9 17.786 -1.882 2.857 60 3HB ALA 9 3HB ALA 9 18.759 -2.874 1.771 61 H GLU 10 HN GLU 10 14.934 -1.968 2.971 62 HA GLU 10 HA GLU 10 14.884 -4.403 4.697 63 1HB GLU 10 2HB GLU 10 15.188 -1.823 5.342 64 2HB GLU 10 1HB GLU 10 13.426 -1.861 5.311 65 1HG GLU 10 2HG GLU 10 14.343 -2.370 7.572 66 2HG GLU 10 1HG GLU 10 13.407 -3.712 6.911 67 H LEU 11 HN LEU 11 12.786 -2.237 2.822 68 HA LEU 11 HA LEU 11 10.295 -3.548 3.428 69 1HB LEU 11 2HB LEU 11 10.622 -1.248 2.499 70 2HB LEU 11 1HB LEU 11 11.173 -1.968 0.989 71 HG LEU 11 HG LEU 11 8.524 -2.801 2.132 72 1HD1 LEU 11 1HD1 LEU 11 9.158 -0.232 0.669 73 2HD1 LEU 11 3HD1 LEU 11 7.548 -0.952 0.643 74 3HD1 LEU 11 2HD1 LEU 11 8.257 -0.433 2.172 75 1HD2 LEU 11 3HD2 LEU 11 10.054 -3.284 -0.224 76 2HD2 LEU 11 2HD2 LEU 11 8.448 -3.901 0.170 77 3HD2 LEU 11 1HD2 LEU 11 8.620 -2.378 -0.702 78 H CYS 12 HN CYS 12 12.250 -3.612 0.446 79 HA CYS 12 HA CYS 12 10.908 -5.824 -0.767 80 1HB CYS 12 2HB CYS 12 13.575 -4.453 -1.025 81 2HB CYS 12 1HB CYS 12 13.257 -5.913 -1.962 82 H ASN 13 HN ASN 13 13.066 -5.662 1.885 83 HA ASN 13 HA ASN 13 14.672 -7.882 1.925 84 1HB ASN 13 2HB ASN 13 14.200 -6.243 3.759 85 2HB ASN 13 1HB ASN 13 12.699 -7.096 4.090 86 1HD2 ASN 13 1HD2 ASN 13 14.712 -6.941 6.094 87 2HD2 ASN 13 2HD2 ASN 13 15.377 -8.485 6.326 88 H GLU 14 HN GLU 14 11.204 -7.962 2.778 89 HA GLU 14 HA GLU 14 10.854 -10.696 3.209 90 1HB GLU 14 2HB GLU 14 9.194 -8.807 3.413 91 2HB GLU 14 1HB GLU 14 8.989 -8.872 1.663 92 1HG GLU 14 2HG GLU 14 8.283 -11.233 1.834 93 2HG GLU 14 1HG GLU 14 8.491 -11.167 3.585 94 H TYR 15 HN TYR 15 11.354 -9.043 0.126 95 HA TYR 15 HA TYR 15 10.663 -11.470 -1.419 96 1HB TYR 15 2HB TYR 15 11.647 -8.691 -2.136 97 2HB TYR 15 1HB TYR 15 11.256 -9.931 -3.327 98 HD1 TYR 15 HD1 TYR 15 8.902 -10.933 -3.314 99 HD2 TYR 15 HD2 TYR 15 9.946 -7.363 -1.167 100 HE1 TYR 15 HE1 TYR 15 6.504 -10.318 -3.166 101 HE2 TYR 15 HE2 TYR 15 7.551 -6.746 -1.025 102 HH TYR 15 HH TYR 15 5.213 -8.419 -1.145 103 H ARG 16 HN ARG 16 13.250 -10.699 0.403 104 HA ARG 16 HA ARG 16 15.436 -11.199 -1.473 105 1HB ARG 16 2HB ARG 16 15.122 -10.989 1.526 106 2HB ARG 16 1HB ARG 16 16.677 -11.359 0.778 107 1HG ARG 16 2HG ARG 16 16.329 -9.288 -0.666 108 2HG ARG 16 1HG ARG 16 14.981 -8.883 0.394 109 1HD ARG 16 2HD ARG 16 16.661 -9.127 2.340 110 2HD ARG 16 1HD ARG 16 17.919 -9.071 1.089 111 HE ARG 16 HE ARG 16 15.880 -6.966 0.852 112 1HH1 ARG 16 1HH1 ARG 16 18.021 -7.478 3.310 113 2HH1 ARG 16 2HH1 ARG 16 19.008 -6.085 3.016 114 1HH2 ARG 16 1HH2 ARG 16 17.535 -5.360 -0.039 115 2HH2 ARG 16 2HH2 ARG 16 18.733 -4.886 1.120 116 H LYS 17 HN LYS 17 13.477 -13.103 0.759 117 HA LYS 17 HA LYS 17 15.109 -15.496 0.675 118 1HB LYS 17 2HB LYS 17 12.119 -15.299 1.124 119 2HB LYS 17 1HB LYS 17 13.246 -16.454 1.836 120 1HG LYS 17 2HG LYS 17 14.399 -14.372 2.869 121 2HG LYS 17 1HG LYS 17 12.905 -13.523 2.470 122 1HD LYS 17 2HD LYS 17 12.792 -16.141 3.943 123 2HD LYS 17 1HD LYS 17 13.136 -14.650 4.822 124 1HE LYS 17 2HE LYS 17 11.048 -13.648 3.988 125 2HE LYS 17 1HE LYS 17 10.711 -15.110 3.040 126 1HZ LYS 17 2HZ LYS 17 11.369 -15.444 5.872 127 2HZ LYS 17 1HZ LYS 17 9.831 -14.820 5.509 128 3HZ LYS 17 3HZ LYS 17 10.296 -16.333 4.900 129 H LEU 18 HN LEU 18 13.222 -13.912 -1.627 130 HA LEU 18 HA LEU 18 12.501 -16.385 -3.121 131 1HB LEU 18 2HB LEU 18 11.857 -13.440 -3.526 132 2HB LEU 18 1HB LEU 18 11.154 -14.772 -4.440 133 HG LEU 18 HG LEU 18 10.338 -15.697 -2.196 134 1HD1 LEU 18 1HD1 LEU 18 11.560 -13.110 -1.370 135 2HD1 LEU 18 3HD1 LEU 18 10.022 -13.540 -0.622 136 3HD1 LEU 18 2HD1 LEU 18 11.411 -14.617 -0.470 137 1HD2 LEU 18 1HD2 LEU 18 8.974 -14.384 -3.913 138 2HD2 LEU 18 3HD2 LEU 18 8.358 -14.346 -2.261 139 3HD2 LEU 18 2HD2 LEU 18 9.245 -12.963 -2.903 140 H VAL 19 HN VAL 19 14.366 -13.372 -3.364 141 HA VAL 19 HA VAL 19 15.250 -13.578 -6.052 142 HB VAL 19 HB VAL 19 16.594 -12.471 -3.566 143 1HG1 VAL 19 2HG1 VAL 19 17.118 -12.064 -6.519 144 2HG1 VAL 19 1HG1 VAL 19 17.695 -10.946 -5.284 145 3HG1 VAL 19 3HG1 VAL 19 18.254 -12.619 -5.289 146 1HG2 VAL 19 2HG2 VAL 19 14.194 -11.726 -4.528 147 2HG2 VAL 19 1HG2 VAL 19 15.331 -10.569 -3.835 148 3HG2 VAL 19 3HG2 VAL 19 15.227 -10.762 -5.586 149 H ARG 20 HN ARG 20 16.880 -14.768 -7.013 150 HA ARG 20 HA ARG 20 18.326 -16.744 -5.291 151 1HB ARG 20 2HB ARG 20 17.504 -16.623 -8.205 152 2HB ARG 20 1HB ARG 20 18.608 -17.854 -7.589 153 1HG ARG 20 2HG ARG 20 16.543 -17.916 -5.752 154 2HG ARG 20 1HG ARG 20 15.699 -17.625 -7.272 155 1HD ARG 20 2HD ARG 20 16.803 -19.580 -8.284 156 2HD ARG 20 1HD ARG 20 17.711 -19.855 -6.786 157 HE ARG 20 HE ARG 20 15.193 -19.823 -5.813 158 1HH1 ARG 20 1HH1 ARG 20 16.868 -21.675 -8.135 159 2HH1 ARG 20 2HH1 ARG 20 15.565 -22.784 -8.411 160 1HH2 ARG 20 1HH2 ARG 20 13.330 -21.073 -6.386 161 2HH2 ARG 20 2HH2 ARG 20 13.563 -22.444 -7.420 162 H ASN 21 HN ASN 21 19.265 -15.826 -8.539 163 HA ASN 21 HA ASN 21 21.773 -14.597 -7.437 164 1HB ASN 21 2HB ASN 21 22.931 -15.689 -9.233 165 2HB ASN 21 1HB ASN 21 21.827 -16.896 -8.576 166 1HD2 ASN 21 1HD2 ASN 21 19.925 -17.464 -9.842 167 2HD2 ASN 21 2HD2 ASN 21 19.803 -17.046 -11.480 168 H GLY 22 HN GLY 22 19.518 -13.006 -7.876 169 1HA GLY 22 1HA GLY 22 20.328 -11.474 -10.307 170 2HA GLY 22 2HA GLY 22 19.577 -10.759 -8.878 171 H LYS 23 HN LYS 23 18.044 -13.633 -9.268 172 HA LYS 23 HA LYS 23 15.990 -12.520 -11.147 173 1HB LYS 23 2HB LYS 23 16.895 -14.514 -12.043 174 2HB LYS 23 1HB LYS 23 16.998 -15.280 -10.459 175 1HG LYS 23 2HG LYS 23 14.626 -15.579 -10.347 176 2HG LYS 23 1HG LYS 23 14.361 -14.521 -11.731 177 1HD LYS 23 2HD LYS 23 15.637 -16.153 -13.149 178 2HD LYS 23 1HD LYS 23 15.713 -17.234 -11.758 179 1HE LYS 23 2HE LYS 23 13.202 -16.261 -13.167 180 2HE LYS 23 1HE LYS 23 13.810 -17.925 -13.091 181 1HZ LYS 23 1HZ LYS 23 13.786 -17.438 -10.541 182 2HZ LYS 23 3HZ LYS 23 12.630 -16.270 -10.961 183 3HZ LYS 23 2HZ LYS 23 12.354 -17.907 -11.326 184 H LEU 24 HN LEU 24 14.195 -11.803 -10.057 185 HA LEU 24 HA LEU 24 13.642 -12.720 -7.308 186 1HB LEU 24 2HB LEU 24 13.336 -10.381 -8.766 187 2HB LEU 24 1HB LEU 24 11.688 -10.999 -8.667 188 HG LEU 24 HG LEU 24 13.573 -10.365 -6.387 189 1HD1 LEU 24 3HD1 LEU 24 11.020 -9.273 -7.492 190 2HD1 LEU 24 2HD1 LEU 24 11.245 -9.222 -5.743 191 3HD1 LEU 24 1HD1 LEU 24 12.401 -8.418 -6.805 192 1HD2 LEU 24 2HD2 LEU 24 11.122 -12.107 -6.483 193 2HD2 LEU 24 1HD2 LEU 24 12.643 -12.378 -5.631 194 3HD2 LEU 24 3HD2 LEU 24 11.493 -11.186 -5.024 195 H ALA 25 HN ALA 25 12.176 -14.319 -6.839 196 HA ALA 25 HA ALA 25 10.484 -15.369 -9.069 197 1HB ALA 25 3HB ALA 25 11.765 -17.115 -8.219 198 2HB ALA 25 1HB ALA 25 10.330 -17.260 -7.205 199 3HB ALA 25 2HB ALA 25 11.769 -16.449 -6.586 200 H CYS 26 HN CYS 26 8.366 -14.738 -9.005 201 HA CYS 26 HA CYS 26 6.959 -14.650 -6.388 202 1HB CYS 26 2HB CYS 26 7.816 -12.369 -8.023 203 2HB CYS 26 1HB CYS 26 6.086 -12.348 -7.678 204 H THR 27 HN THR 27 4.516 -13.887 -7.036 205 HA THR 27 HA THR 27 3.743 -15.628 -9.352 206 HB THR 27 HB THR 27 1.529 -15.612 -7.993 207 HG1 THR 27 1HG THR 27 1.576 -14.465 -6.258 208 1HG2 THR 27 3HG2 THR 27 4.112 -16.896 -7.125 209 2HG2 THR 27 2HG2 THR 27 2.600 -17.235 -6.283 210 3HG2 THR 27 1HG2 THR 27 2.761 -17.621 -7.997 211 H ARG 28 HN ARG 28 1.369 -14.867 -10.092 212 HA ARG 28 HA ARG 28 1.693 -12.136 -11.114 213 1HB ARG 28 2HB ARG 28 -0.468 -14.252 -11.384 214 2HB ARG 28 1HB ARG 28 -0.407 -12.761 -12.323 215 1HG ARG 28 2HG ARG 28 1.849 -13.435 -13.163 216 2HG ARG 28 1HG ARG 28 1.675 -14.967 -12.306 217 1HD ARG 28 2HD ARG 28 -0.369 -15.466 -13.628 218 2HD ARG 28 1HD ARG 28 -0.156 -13.940 -14.508 219 HE ARG 28 HE ARG 28 2.317 -15.299 -14.639 220 1HH1 ARG 28 1HH1 ARG 28 0.176 -14.477 -16.821 221 2HH1 ARG 28 2HH1 ARG 28 0.073 -15.976 -17.681 222 1HH2 ARG 28 1HH2 ARG 28 1.707 -17.801 -15.227 223 2HH2 ARG 28 2HH2 ARG 28 0.940 -17.858 -16.778 224 H GLU 29 HN GLU 29 1.510 -11.859 -8.391 225 HA GLU 29 HA GLU 29 -0.949 -11.720 -7.088 226 1HB GLU 29 2HB GLU 29 1.374 -9.765 -7.097 227 2HB GLU 29 1HB GLU 29 0.125 -9.820 -5.852 228 1HG GLU 29 2HG GLU 29 1.990 -12.099 -6.585 229 2HG GLU 29 1HG GLU 29 2.117 -11.089 -5.144 230 H ASN 30 HN ASN 30 -2.714 -10.308 -7.143 231 HA ASN 30 HA ASN 30 -2.884 -8.500 -9.495 232 1HB ASN 30 2HB ASN 30 -5.317 -8.519 -8.817 233 2HB ASN 30 1HB ASN 30 -4.660 -10.123 -9.143 234 1HD2 ASN 30 1HD2 ASN 30 -5.277 -11.608 -7.576 235 2HD2 ASN 30 2HD2 ASN 30 -5.527 -11.254 -5.936 236 H ASP 31 HN ASP 31 -1.163 -7.364 -7.729 237 HA ASP 31 HA ASP 31 -2.787 -5.157 -6.527 238 1HB ASP 31 2HB ASP 31 -0.665 -6.910 -5.288 239 2HB ASP 31 1HB ASP 31 -1.000 -5.304 -4.643 240 HA PRO 32 HA PRO 32 0.588 -3.608 -9.314 241 1HB PRO 32 2HB PRO 32 -1.152 -1.370 -9.806 242 2HB PRO 32 1HB PRO 32 -0.686 -2.653 -10.925 243 1HG PRO 32 2HG PRO 32 -3.237 -2.246 -9.681 244 2HG PRO 32 1HG PRO 32 -2.764 -3.544 -10.780 245 1HD PRO 32 2HD PRO 32 -3.249 -3.706 -7.931 246 2HD PRO 32 1HD PRO 32 -2.814 -5.021 -9.045 247 H ILE 33 HN ILE 33 1.978 -1.826 -8.876 248 HA ILE 33 HA ILE 33 1.221 0.107 -6.762 249 HB ILE 33 HB ILE 33 2.872 -0.605 -5.228 250 1HG1 ILE 33 2HG1 ILE 33 4.762 -0.798 -6.728 251 2HG1 ILE 33 1HG1 ILE 33 4.605 -2.318 -5.847 252 1HG2 ILE 33 1HG2 ILE 33 0.979 -2.187 -5.345 253 2HG2 ILE 33 3HG2 ILE 33 1.849 -3.135 -6.552 254 3HG2 ILE 33 2HG2 ILE 33 2.474 -3.014 -4.906 255 1HD1 ILE 33 1HD1 ILE 33 3.171 -3.101 -7.851 256 2HD1 ILE 33 3HD1 ILE 33 3.855 -1.718 -8.706 257 3HD1 ILE 33 2HD1 ILE 33 4.914 -2.988 -8.093 258 H GLN 34 HN GLN 34 3.674 1.229 -6.292 259 HA GLN 34 HA GLN 34 4.661 1.988 -9.023 260 1HB GLN 34 2HB GLN 34 4.323 3.742 -6.570 261 2HB GLN 34 1HB GLN 34 4.769 4.278 -8.189 262 1HG GLN 34 2HG GLN 34 2.606 3.622 -9.066 263 2HG GLN 34 1HG GLN 34 2.163 2.877 -7.529 264 1HE2 GLN 34 1HE2 GLN 34 0.710 5.091 -8.830 265 2HE2 GLN 34 2HE2 GLN 34 0.789 6.415 -7.770 266 H GLY 35 HN GLY 35 6.926 2.669 -9.071 267 1HA GLY 35 1HA GLY 35 9.049 1.515 -8.444 268 2HA GLY 35 2HA GLY 35 8.499 1.584 -6.770 269 HA PRO 36 HA PRO 36 10.569 5.375 -6.097 270 1HB PRO 36 2HB PRO 36 13.241 4.512 -6.720 271 2HB PRO 36 1HB PRO 36 12.495 4.678 -5.130 272 1HG PRO 36 2HG PRO 36 13.151 2.256 -6.532 273 2HG PRO 36 1HG PRO 36 12.418 2.422 -4.935 274 1HD PRO 36 2HD PRO 36 11.158 1.536 -7.373 275 2HD PRO 36 1HD PRO 36 10.413 1.725 -5.768 276 H ASP 37 HN ASP 37 11.104 3.742 -9.128 277 HA ASP 37 HA ASP 37 12.505 5.901 -10.470 278 1HB ASP 37 2HB ASP 37 10.887 3.536 -11.466 279 2HB ASP 37 1HB ASP 37 11.941 4.527 -12.474 280 H GLY 38 HN GLY 38 9.115 4.821 -10.383 281 1HA GLY 38 1HA GLY 38 8.368 7.385 -11.719 282 2HA GLY 38 2HA GLY 38 7.537 6.854 -10.260 283 H LYS 39 HN LYS 39 8.342 4.133 -12.010 284 HA LYS 39 HA LYS 39 5.919 4.208 -13.741 285 1HB LYS 39 2HB LYS 39 8.095 2.113 -13.473 286 2HB LYS 39 1HB LYS 39 6.959 2.298 -14.809 287 1HG LYS 39 2HG LYS 39 7.963 4.378 -15.477 288 2HG LYS 39 1HG LYS 39 8.941 4.445 -14.010 289 1HD LYS 39 2HD LYS 39 10.109 2.368 -14.724 290 2HD LYS 39 1HD LYS 39 9.166 2.371 -16.214 291 1HE LYS 39 2HE LYS 39 10.833 3.652 -17.092 292 2HE LYS 39 1HE LYS 39 10.222 4.965 -16.067 293 1HZ LYS 39 3HZ LYS 39 11.571 4.053 -14.238 294 2HZ LYS 39 2HZ LYS 39 12.218 2.895 -15.297 295 3HZ LYS 39 1HZ LYS 39 12.531 4.546 -15.546 296 H VAL 40 HN VAL 40 4.417 2.371 -13.662 297 HA VAL 40 HA VAL 40 4.092 1.308 -10.894 298 HB VAL 40 HB VAL 40 2.239 1.408 -13.298 299 1HG1 VAL 40 2HG1 VAL 40 1.993 -0.301 -11.242 300 2HG1 VAL 40 1HG1 VAL 40 1.266 1.121 -10.495 301 3HG1 VAL 40 3HG1 VAL 40 0.594 0.469 -11.990 302 1HG2 VAL 40 3HG2 VAL 40 3.091 3.575 -12.008 303 2HG2 VAL 40 2HG2 VAL 40 1.404 3.412 -12.495 304 3HG2 VAL 40 1HG2 VAL 40 1.880 3.063 -10.833 305 H HIS 41 HN HIS 41 3.732 -0.980 -10.588 306 HA HIS 41 HA HIS 41 4.565 -2.688 -12.911 307 1HB HIS 41 2HB HIS 41 5.201 -3.120 -9.980 308 2HB HIS 41 1HB HIS 41 5.912 -3.954 -11.362 309 HD1 HIS 41 HD1 HIS 41 7.407 -2.426 -12.996 310 HD2 HIS 41 HD2 HIS 41 6.474 -0.722 -9.307 311 HE1 HIS 41 HE1 HIS 41 8.986 -0.468 -12.690 312 H GLY 42 HN GLY 42 3.836 -5.008 -12.608 313 1HA GLY 42 1HA GLY 42 2.082 -6.540 -12.327 314 2HA GLY 42 2HA GLY 42 1.024 -5.144 -12.134 315 H ASN 43 HN ASN 43 3.690 -6.590 -10.215 316 HA ASN 43 HA ASN 43 1.865 -6.447 -7.833 317 1HB ASN 43 2HB ASN 43 3.147 -8.492 -7.100 318 2HB ASN 43 1HB ASN 43 2.206 -8.732 -8.572 319 1HD2 ASN 43 1HD2 ASN 43 4.396 -10.426 -8.121 320 2HD2 ASN 43 2HD2 ASN 43 5.649 -10.043 -9.201 321 H THR 44 HN THR 44 3.665 -7.030 -5.867 322 HA THR 44 HA THR 44 5.209 -4.555 -5.664 323 HB THR 44 HB THR 44 4.717 -6.981 -3.930 324 HG1 THR 44 1HG THR 44 4.085 -4.244 -3.573 325 1HG2 THR 44 1HG2 THR 44 6.541 -4.622 -3.466 326 2HG2 THR 44 3HG2 THR 44 5.846 -5.539 -2.130 327 3HG2 THR 44 2HG2 THR 44 6.909 -6.338 -3.289 328 H CYS 45 HN CYS 45 5.897 -7.979 -6.222 329 HA CYS 45 HA CYS 45 8.710 -7.952 -5.780 330 1HB CYS 45 2HB CYS 45 7.189 -9.507 -7.894 331 2HB CYS 45 1HB CYS 45 8.681 -9.985 -7.083 332 H SER 46 HN SER 46 6.937 -7.590 -8.890 333 HA SER 46 HA SER 46 9.052 -7.022 -10.606 334 1HB SER 46 2HB SER 46 6.293 -5.785 -10.345 335 2HB SER 46 1HB SER 46 7.330 -5.526 -11.748 336 HG SER 46 HG SER 46 6.040 -7.259 -12.205 337 H MET 47 HN MET 47 7.762 -5.068 -8.008 338 HA MET 47 HA MET 47 9.256 -2.646 -8.794 339 1HB MET 47 2HB MET 47 6.947 -3.053 -7.490 340 2HB MET 47 1HB MET 47 8.028 -3.078 -6.097 341 1HG MET 47 2HG MET 47 8.019 -0.867 -8.169 342 2HG MET 47 1HG MET 47 7.118 -0.789 -6.656 343 1HE MET 47 2HE MET 47 8.012 -1.537 -4.598 344 2HE MET 47 1HE MET 47 9.632 -1.262 -3.963 345 3HE MET 47 3HE MET 47 8.534 0.102 -4.216 346 H CYS 48 HN CYS 48 9.473 -5.348 -6.559 347 HA CYS 48 HA CYS 48 11.810 -4.287 -5.131 348 1HB CYS 48 2HB CYS 48 10.011 -6.670 -5.099 349 2HB CYS 48 1HB CYS 48 11.614 -6.878 -4.396 350 H GLU 49 HN GLU 49 11.173 -6.291 -7.922 351 HA GLU 49 HA GLU 49 13.682 -7.697 -8.029 352 1HB GLU 49 2HB GLU 49 12.821 -8.472 -10.047 353 2HB GLU 49 1HB GLU 49 11.339 -7.903 -9.285 354 1HG GLU 49 2HG GLU 49 11.444 -5.812 -10.510 355 2HG GLU 49 1HG GLU 49 13.023 -6.234 -11.173 356 H VAL 50 HN VAL 50 12.563 -4.667 -9.578 357 HA VAL 50 HA VAL 50 14.901 -3.999 -11.022 358 HB VAL 50 HB VAL 50 13.000 -2.228 -9.448 359 1HG1 VAL 50 2HG1 VAL 50 14.884 -1.691 -11.755 360 2HG1 VAL 50 1HG1 VAL 50 13.583 -0.591 -11.300 361 3HG1 VAL 50 3HG1 VAL 50 14.889 -0.930 -10.163 362 1HG2 VAL 50 3HG2 VAL 50 12.283 -4.029 -11.325 363 2HG2 VAL 50 2HG2 VAL 50 11.458 -2.486 -11.109 364 3HG2 VAL 50 1HG2 VAL 50 12.685 -2.662 -12.364 365 H PHE 51 HN PHE 51 13.969 -3.275 -7.690 366 HA PHE 51 HA PHE 51 16.343 -1.874 -6.918 367 1HB PHE 51 2HB PHE 51 14.324 -1.787 -5.601 368 2HB PHE 51 1HB PHE 51 14.291 -3.543 -5.438 369 HD1 PHE 51 HD1 PHE 51 16.882 -0.869 -4.976 370 HD2 PHE 51 HD2 PHE 51 14.853 -4.265 -3.308 371 HE1 PHE 51 HE1 PHE 51 18.287 -0.705 -2.935 372 HE2 PHE 51 HE2 PHE 51 16.256 -4.103 -1.266 373 HZ PHE 51 HZ PHE 51 17.974 -2.323 -1.080 374 H PHE 52 HN PHE 52 15.426 -5.298 -6.731 375 HA PHE 52 HA PHE 52 17.820 -6.253 -5.476 376 1HB PHE 52 2HB PHE 52 15.540 -7.340 -7.087 377 2HB PHE 52 1HB PHE 52 16.934 -8.386 -6.831 378 HD1 PHE 52 HD1 PHE 52 17.831 -7.535 -4.140 379 HD2 PHE 52 HD2 PHE 52 13.870 -8.208 -5.663 380 HE1 PHE 52 HE1 PHE 52 17.032 -8.025 -1.847 381 HE2 PHE 52 HE2 PHE 52 13.072 -8.701 -3.368 382 HZ PHE 52 HZ PHE 52 14.653 -8.609 -1.461 383 H GLN 53 HN GLN 53 16.866 -5.917 -8.900 384 HA GLN 53 HA GLN 53 19.233 -7.056 -10.047 385 1HB GLN 53 2HB GLN 53 16.923 -6.390 -11.045 386 2HB GLN 53 1HB GLN 53 17.623 -4.781 -11.212 387 1HG GLN 53 2HG GLN 53 19.474 -5.716 -12.545 388 2HG GLN 53 1HG GLN 53 18.797 -7.334 -12.362 389 1HE2 GLN 53 1HE2 GLN 53 17.865 -4.064 -13.575 390 2HE2 GLN 53 2HE2 GLN 53 16.864 -4.648 -14.816 391 H ALA 54 HN ALA 54 18.348 -3.688 -9.270 392 HA ALA 54 HA ALA 54 20.720 -2.410 -10.171 393 1HB ALA 54 1HB ALA 54 19.593 -1.281 -7.731 394 2HB ALA 54 3HB ALA 54 19.554 -0.638 -9.373 395 3HB ALA 54 2HB ALA 54 18.326 -1.788 -8.847 396 H GLU 55 HN GLU 55 19.953 -3.943 -7.041 397 HA GLU 55 HA GLU 55 22.190 -3.175 -5.524 398 1HB GLU 55 2HB GLU 55 20.508 -5.672 -5.728 399 2HB GLU 55 1HB GLU 55 21.818 -5.568 -4.550 400 1HG GLU 55 2HG GLU 55 20.809 -3.475 -3.656 401 2HG GLU 55 1HG GLU 55 19.472 -3.657 -4.792 402 H GLU 56 HN GLU 56 21.972 -5.471 -8.176 403 HA GLU 56 HA GLU 56 24.459 -6.843 -7.769 404 1HB GLU 56 2HB GLU 56 22.826 -6.196 -10.245 405 2HB GLU 56 1HB GLU 56 24.137 -7.375 -10.202 406 1HG GLU 56 2HG GLU 56 22.858 -8.471 -8.258 407 2HG GLU 56 1HG GLU 56 21.491 -7.469 -8.748 408 H GLU 57 HN GLU 57 23.625 -3.854 -9.516 409 HA GLU 57 HA GLU 57 26.326 -3.468 -10.562 410 1HB GLU 57 2HB GLU 57 23.964 -1.580 -10.278 411 2HB GLU 57 1HB GLU 57 25.352 -1.348 -11.341 412 1HG GLU 57 2HG GLU 57 23.599 -3.805 -11.515 413 2HG GLU 57 1HG GLU 57 23.234 -2.333 -12.414 414 H GLU 58 HN GLU 58 24.529 -2.451 -7.703 415 HA GLU 58 HA GLU 58 26.131 -0.265 -6.851 416 1HB GLU 58 2HB GLU 58 24.063 -0.720 -5.768 417 2HB GLU 58 1HB GLU 58 24.505 -2.399 -5.457 418 1HG GLU 58 2HG GLU 58 26.271 -1.644 -3.901 419 2HG GLU 58 1HG GLU 58 25.822 0.033 -4.207 420 H LYS 59 HN LYS 59 26.924 -3.603 -7.107 421 HA LYS 59 HA LYS 59 28.944 -3.657 -4.992 422 1HB LYS 59 2HB LYS 59 28.361 -5.446 -7.376 423 2HB LYS 59 1HB LYS 59 29.439 -5.861 -6.043 424 1HG LYS 59 2HG LYS 59 27.572 -5.685 -4.456 425 2HG LYS 59 1HG LYS 59 26.488 -5.213 -5.765 426 1HD LYS 59 2HD LYS 59 27.212 -7.434 -6.888 427 2HD LYS 59 1HD LYS 59 27.809 -7.883 -5.290 428 1HE LYS 59 2HE LYS 59 25.676 -8.010 -4.385 429 2HE LYS 59 1HE LYS 59 25.024 -6.788 -5.492 430 1HZ LYS 59 3HZ LYS 59 25.428 -8.400 -7.321 431 2HZ LYS 59 2HZ LYS 59 25.828 -9.573 -6.159 432 3HZ LYS 59 1HZ LYS 59 24.258 -8.926 -6.212 433 H LYS 60 HN LYS 60 28.807 -2.272 -8.077 434 HA LYS 60 HA LYS 60 31.496 -2.780 -9.010 435 1HB LYS 60 2HB LYS 60 30.936 -1.031 -10.606 436 2HB LYS 60 1HB LYS 60 29.501 -2.024 -10.348 437 1HG LYS 60 2HG LYS 60 28.823 -0.330 -8.558 438 2HG LYS 60 1HG LYS 60 30.105 0.705 -9.187 439 1HD LYS 60 2HD LYS 60 29.019 0.373 -11.491 440 2HD LYS 60 1HD LYS 60 27.633 -0.281 -10.619 441 1HE LYS 60 2HE LYS 60 26.941 1.801 -10.035 442 2HE LYS 60 1HE LYS 60 28.555 2.226 -9.436 443 1HZ LYS 60 2HZ LYS 60 27.767 2.109 -12.305 444 2HZ LYS 60 1HZ LYS 60 27.918 3.541 -11.403 445 3HZ LYS 60 3HZ LYS 60 29.284 2.580 -11.700 446 H LYS 61 HN LYS 61 30.161 -0.678 -6.598 447 HA LYS 61 HA LYS 61 32.108 1.432 -6.637 448 1HB LYS 61 2HB LYS 61 30.479 0.235 -4.371 449 2HB LYS 61 1HB LYS 61 31.228 1.831 -4.358 450 1HG LYS 61 2HG LYS 61 29.843 2.538 -6.240 451 2HG LYS 61 1HG LYS 61 29.159 0.919 -6.380 452 1HD LYS 61 2HD LYS 61 28.311 1.166 -4.014 453 2HD LYS 61 1HD LYS 61 28.830 2.851 -4.067 454 1HE LYS 61 2HE LYS 61 27.170 1.961 -6.365 455 2HE LYS 61 1HE LYS 61 26.335 2.060 -4.803 456 1HZ LYS 61 1HZ LYS 61 27.579 4.267 -4.561 457 2HZ LYS 61 3HZ LYS 61 27.836 4.173 -6.235 458 3HZ LYS 61 2HZ LYS 61 26.252 4.233 -5.622 459 H LYS 62 HN LYS 62 33.779 1.727 -4.869 460 HA LYS 62 HA LYS 62 35.620 -0.488 -4.791 461 1HB LYS 62 2HB LYS 62 35.448 2.078 -3.174 462 2HB LYS 62 1HB LYS 62 36.884 1.065 -3.327 463 1HG LYS 62 2HG LYS 62 36.875 1.430 -5.773 464 2HG LYS 62 1HG LYS 62 35.449 2.456 -5.611 465 1HD LYS 62 2HD LYS 62 36.760 3.946 -4.082 466 2HD LYS 62 1HD LYS 62 38.188 2.964 -4.411 467 1HE LYS 62 2HE LYS 62 37.547 3.446 -6.943 468 2HE LYS 62 1HE LYS 62 36.725 4.849 -6.233 469 1HZ LYS 62 3HZ LYS 62 38.944 4.966 -4.861 470 2HZ LYS 62 2HZ LYS 62 39.577 4.147 -6.208 471 3HZ LYS 62 1HZ LYS 62 38.845 5.667 -6.403 472 H GLU 63 HN GLU 63 32.879 0.297 -2.875 473 HA GLU 63 HA GLU 63 33.785 -0.905 -0.375 474 1HB GLU 63 2HB GLU 63 31.081 -0.150 -1.526 475 2HB GLU 63 1HB GLU 63 31.322 -0.686 0.137 476 1HG GLU 63 2HG GLU 63 32.961 1.187 0.443 477 2HG GLU 63 1HG GLU 63 32.552 1.757 -1.176 478 H GLY 64 HN GLY 64 32.430 -2.087 -3.357 479 1HA GLY 64 1HA GLY 64 31.599 -4.211 -3.964 480 2HA GLY 64 2HA GLY 64 31.349 -4.552 -2.251 481 H GLU 65 HN GLU 65 34.466 -3.480 -3.418 482 HA GLU 65 HA GLU 65 35.505 -6.282 -3.271 483 1HB GLU 65 2HB GLU 65 36.680 -3.737 -4.439 484 2HB GLU 65 1HB GLU 65 37.363 -5.354 -4.599 485 1HG GLU 65 2HG GLU 65 35.321 -6.098 -5.775 486 2HG GLU 65 1HG GLU 65 34.642 -4.478 -5.618 487 H SER 66 HN SER 66 37.488 -6.639 -2.056 488 HA SER 66 HA SER 66 37.623 -5.460 0.510 489 1HB SER 66 2HB SER 66 39.813 -6.761 -1.143 490 2HB SER 66 1HB SER 66 39.787 -6.633 0.616 491 HG SER 66 HG SER 66 38.612 -8.450 -0.968 492 H ARG 67 HN ARG 67 39.006 -3.836 1.384 493 HA ARG 67 HA ARG 67 39.518 -1.520 -0.150 494 1HB ARG 67 2HB ARG 67 40.845 -2.577 2.368 495 2HB ARG 67 1HB ARG 67 40.915 -0.901 1.823 496 1HG ARG 67 2HG ARG 67 38.419 -0.815 1.908 497 2HG ARG 67 1HG ARG 67 38.416 -2.449 2.571 498 1HD ARG 67 2HD ARG 67 39.931 -1.565 4.432 499 2HD ARG 67 1HD ARG 67 39.549 0.062 3.836 500 HE ARG 67 HE ARG 67 37.671 -1.774 5.167 501 1HH1 ARG 67 1HH1 ARG 67 38.220 1.399 4.883 502 2HH1 ARG 67 2HH1 ARG 67 36.626 1.873 4.397 503 1HH2 ARG 67 1HH2 ARG 67 35.565 -1.368 3.772 504 2HH2 ARG 67 2HH2 ARG 67 35.124 0.307 3.768 505 H ASN 68 HN ASN 68 41.583 -4.330 0.492 506 HA ASN 68 HA ASN 68 43.475 -3.324 -1.593 507 1HB ASN 68 2HB ASN 68 44.120 -2.850 0.868 508 2HB ASN 68 1HB ASN 68 44.376 -4.590 0.999 509 1HD2 ASN 68 1HD2 ASN 68 46.731 -4.039 1.325 510 2HD2 ASN 68 2HD2 ASN 68 47.694 -3.701 -0.031 No H/Q in entry = 510 Start of MODEL 18 1 H1 GLU 1 3H GLU 1 13.268 18.586 7.105 2 H2 GLU 1 2H GLU 1 13.409 19.666 5.801 3 H3 GLU 1 1H GLU 1 11.902 18.980 6.181 4 HA GLU 1 HA GLU 1 12.664 17.776 4.314 5 1HB GLU 1 2HB GLU 1 14.982 18.780 4.722 6 2HB GLU 1 1HB GLU 1 15.265 17.435 5.828 7 1HG GLU 1 2HG GLU 1 16.143 16.789 3.676 8 2HG GLU 1 1HG GLU 1 14.658 15.873 3.930 9 H SER 2 HN SER 2 11.793 15.737 4.367 10 HA SER 2 HA SER 2 12.186 14.104 6.857 11 1HB SER 2 2HB SER 2 9.920 15.089 6.553 12 2HB SER 2 1HB SER 2 9.797 14.281 4.990 13 HG SER 2 HG SER 2 10.200 12.294 6.206 14 H GLY 3 HN GLY 3 12.680 11.914 6.535 15 1HA GLY 3 1HA GLY 3 13.876 10.272 5.268 16 2HA GLY 3 2HA GLY 3 13.501 11.169 3.797 17 H LYS 4 HN LYS 4 13.106 8.475 3.704 18 HA LYS 4 HA LYS 4 10.206 8.291 3.270 19 1HB LYS 4 2HB LYS 4 12.502 6.336 2.916 20 2HB LYS 4 1HB LYS 4 10.868 6.100 2.298 21 1HG LYS 4 2HG LYS 4 11.140 8.300 1.056 22 2HG LYS 4 1HG LYS 4 12.845 8.255 1.509 23 1HD LYS 4 2HD LYS 4 11.447 6.000 0.045 24 2HD LYS 4 1HD LYS 4 12.342 7.282 -0.772 25 1HE LYS 4 2HE LYS 4 14.282 6.611 0.875 26 2HE LYS 4 1HE LYS 4 13.383 5.087 1.010 27 1HZ LYS 4 1HZ LYS 4 13.984 6.367 -1.599 28 2HZ LYS 4 3HZ LYS 4 15.033 5.240 -0.889 29 3HZ LYS 4 2HZ LYS 4 13.454 4.778 -1.312 30 H ALA 5 HN ALA 5 8.959 6.427 4.158 31 HA ALA 5 HA ALA 5 9.160 6.194 7.003 32 1HB ALA 5 3HB ALA 5 7.412 5.508 4.896 33 2HB ALA 5 2HB ALA 5 7.764 3.996 5.733 34 3HB ALA 5 1HB ALA 5 7.092 5.362 6.624 35 H THR 6 HN THR 6 10.644 4.403 4.398 36 HA THR 6 HA THR 6 12.242 2.854 6.329 37 HB THR 6 HB THR 6 10.112 1.603 6.116 38 HG1 THR 6 1HG THR 6 11.204 -0.189 6.069 39 1HG2 THR 6 3HG2 THR 6 10.142 2.501 3.520 40 2HG2 THR 6 2HG2 THR 6 10.618 0.814 3.328 41 3HG2 THR 6 1HG2 THR 6 9.096 1.216 4.124 42 H SER 7 HN SER 7 13.262 0.961 4.631 43 HA SER 7 HA SER 7 14.364 2.549 2.332 44 1HB SER 7 2HB SER 7 15.879 2.303 4.319 45 2HB SER 7 1HB SER 7 15.791 0.554 4.121 46 HG SER 7 HG SER 7 16.442 2.058 1.879 47 H TYR 8 HN TYR 8 14.284 1.475 0.377 48 HA TYR 8 HA TYR 8 12.744 -0.728 -0.218 49 1HB TYR 8 2HB TYR 8 15.381 0.194 -1.395 50 2HB TYR 8 1HB TYR 8 14.336 -0.989 -2.182 51 HD1 TYR 8 HD1 TYR 8 11.647 0.049 -1.545 52 HD2 TYR 8 HD2 TYR 8 15.211 2.137 -2.723 53 HE1 TYR 8 HE1 TYR 8 10.264 1.887 -2.471 54 HE2 TYR 8 HE2 TYR 8 13.828 3.976 -3.650 55 HH TYR 8 HH TYR 8 11.448 4.888 -3.200 56 H ALA 9 HN ALA 9 16.250 -0.874 0.536 57 HA ALA 9 HA ALA 9 16.670 -3.633 0.355 58 1HB ALA 9 3HB ALA 9 18.604 -2.506 0.844 59 2HB ALA 9 1HB ALA 9 18.185 -2.930 2.504 60 3HB ALA 9 2HB ALA 9 17.774 -1.337 1.871 61 H GLU 10 HN GLU 10 15.146 -1.804 2.978 62 HA GLU 10 HA GLU 10 14.854 -4.198 4.677 63 1HB GLU 10 2HB GLU 10 13.722 -1.387 4.906 64 2HB GLU 10 1HB GLU 10 13.820 -2.579 6.203 65 1HG GLU 10 2HG GLU 10 16.246 -1.550 4.709 66 2HG GLU 10 1HG GLU 10 15.669 -0.845 6.219 67 H LEU 11 HN LEU 11 12.913 -2.238 2.480 68 HA LEU 11 HA LEU 11 10.361 -3.444 3.167 69 1HB LEU 11 2HB LEU 11 11.075 -1.185 1.974 70 2HB LEU 11 1HB LEU 11 10.986 -2.179 0.520 71 HG LEU 11 HG LEU 11 8.669 -2.888 1.796 72 1HD1 LEU 11 2HD1 LEU 11 9.515 -0.695 3.242 73 2HD1 LEU 11 1HD1 LEU 11 8.428 0.030 2.057 74 3HD1 LEU 11 3HD1 LEU 11 7.844 -1.245 3.127 75 1HD2 LEU 11 3HD2 LEU 11 9.431 -1.665 -0.566 76 2HD2 LEU 11 2HD2 LEU 11 7.777 -2.102 -0.134 77 3HD2 LEU 11 1HD2 LEU 11 8.364 -0.466 0.166 78 H CYS 12 HN CYS 12 12.455 -3.710 0.285 79 HA CYS 12 HA CYS 12 11.057 -5.953 -0.847 80 1HB CYS 12 2HB CYS 12 13.784 -4.692 -1.172 81 2HB CYS 12 1HB CYS 12 13.315 -6.108 -2.115 82 H ASN 13 HN ASN 13 13.202 -5.675 1.797 83 HA ASN 13 HA ASN 13 14.792 -7.918 1.921 84 1HB ASN 13 2HB ASN 13 14.343 -6.160 3.670 85 2HB ASN 13 1HB ASN 13 12.861 -7.015 4.080 86 1HD2 ASN 13 1HD2 ASN 13 13.456 -7.841 6.148 87 2HD2 ASN 13 2HD2 ASN 13 14.764 -8.895 6.391 88 H GLU 14 HN GLU 14 11.332 -7.875 2.805 89 HA GLU 14 HA GLU 14 10.931 -10.588 3.359 90 1HB GLU 14 2HB GLU 14 9.307 -8.696 3.574 91 2HB GLU 14 1HB GLU 14 9.103 -8.713 1.822 92 1HG GLU 14 2HG GLU 14 8.323 -11.055 1.939 93 2HG GLU 14 1HG GLU 14 8.522 -11.032 3.691 94 H TYR 15 HN TYR 15 11.420 -9.054 0.219 95 HA TYR 15 HA TYR 15 10.622 -11.511 -1.228 96 1HB TYR 15 2HB TYR 15 11.649 -8.781 -2.063 97 2HB TYR 15 1HB TYR 15 11.175 -10.045 -3.199 98 HD1 TYR 15 HD1 TYR 15 8.810 -10.876 -3.227 99 HD2 TYR 15 HD2 TYR 15 10.015 -7.485 -0.887 100 HE1 TYR 15 HE1 TYR 15 6.436 -10.192 -2.995 101 HE2 TYR 15 HE2 TYR 15 7.646 -6.798 -0.656 102 HH TYR 15 HH TYR 15 5.094 -8.781 -1.247 103 H ARG 16 HN ARG 16 13.320 -10.583 0.440 104 HA ARG 16 HA ARG 16 15.431 -11.245 -1.436 105 1HB ARG 16 2HB ARG 16 15.177 -11.000 1.569 106 2HB ARG 16 1HB ARG 16 16.708 -11.412 0.793 107 1HG ARG 16 2HG ARG 16 16.435 -9.348 -0.636 108 2HG ARG 16 1HG ARG 16 15.053 -8.910 0.366 109 1HD ARG 16 2HD ARG 16 16.642 -9.123 2.377 110 2HD ARG 16 1HD ARG 16 17.957 -9.141 1.186 111 HE ARG 16 HE ARG 16 15.972 -6.987 0.834 112 1HH1 ARG 16 1HH1 ARG 16 18.326 -7.653 3.127 113 2HH1 ARG 16 2HH1 ARG 16 19.269 -6.230 2.835 114 1HH2 ARG 16 1HH2 ARG 16 17.471 -5.294 0.022 115 2HH2 ARG 16 2HH2 ARG 16 18.784 -4.894 1.078 116 H LYS 17 HN LYS 17 13.396 -13.064 0.778 117 HA LYS 17 HA LYS 17 14.973 -15.513 0.696 118 1HB LYS 17 2HB LYS 17 12.017 -15.211 1.279 119 2HB LYS 17 1HB LYS 17 13.140 -16.388 1.957 120 1HG LYS 17 2HG LYS 17 14.402 -14.348 2.918 121 2HG LYS 17 1HG LYS 17 12.940 -13.432 2.547 122 1HD LYS 17 2HD LYS 17 12.782 -16.010 4.100 123 2HD LYS 17 1HD LYS 17 13.158 -14.492 4.914 124 1HE LYS 17 2HE LYS 17 11.059 -13.548 3.724 125 2HE LYS 17 1HE LYS 17 10.638 -15.244 3.420 126 1HZ LYS 17 2HZ LYS 17 11.345 -15.440 5.938 127 2HZ LYS 17 1HZ LYS 17 10.874 -13.808 5.966 128 3HZ LYS 17 3HZ LYS 17 9.763 -15.002 5.503 129 H LEU 18 HN LEU 18 13.178 -13.886 -1.604 130 HA LEU 18 HA LEU 18 12.265 -16.364 -3.000 131 1HB LEU 18 2HB LEU 18 11.659 -13.408 -3.375 132 2HB LEU 18 1HB LEU 18 10.921 -14.712 -4.303 133 HG LEU 18 HG LEU 18 10.162 -15.682 -2.054 134 1HD1 LEU 18 2HD1 LEU 18 11.489 -13.178 -1.211 135 2HD1 LEU 18 1HD1 LEU 18 9.906 -13.463 -0.489 136 3HD1 LEU 18 3HD1 LEU 18 11.190 -14.655 -0.298 137 1HD2 LEU 18 2HD2 LEU 18 8.798 -14.268 -3.742 138 2HD2 LEU 18 1HD2 LEU 18 8.168 -14.404 -2.100 139 3HD2 LEU 18 3HD2 LEU 18 9.019 -12.941 -2.599 140 H VAL 19 HN VAL 19 14.154 -13.374 -3.419 141 HA VAL 19 HA VAL 19 14.934 -13.607 -6.111 142 HB VAL 19 HB VAL 19 16.534 -12.704 -3.691 143 1HG1 VAL 19 2HG1 VAL 19 16.809 -12.177 -6.658 144 2HG1 VAL 19 1HG1 VAL 19 17.569 -11.160 -5.433 145 3HG1 VAL 19 3HG1 VAL 19 18.015 -12.861 -5.567 146 1HG2 VAL 19 1HG2 VAL 19 14.098 -11.738 -4.715 147 2HG2 VAL 19 3HG2 VAL 19 15.170 -10.912 -3.582 148 3HG2 VAL 19 2HG2 VAL 19 15.327 -10.624 -5.316 149 H ARG 20 HN ARG 20 16.414 -14.917 -7.186 150 HA ARG 20 HA ARG 20 17.632 -17.141 -5.620 151 1HB ARG 20 2HB ARG 20 17.141 -16.637 -8.572 152 2HB ARG 20 1HB ARG 20 17.895 -18.100 -7.934 153 1HG ARG 20 2HG ARG 20 15.628 -17.862 -6.373 154 2HG ARG 20 1HG ARG 20 15.066 -17.309 -7.951 155 1HD ARG 20 2HD ARG 20 15.740 -19.368 -9.004 156 2HD ARG 20 1HD ARG 20 16.625 -19.886 -7.556 157 HE ARG 20 HE ARG 20 13.790 -19.289 -7.079 158 1HH1 ARG 20 1HH1 ARG 20 15.468 -21.285 -5.550 159 2HH1 ARG 20 2HH1 ARG 20 14.820 -22.789 -6.114 160 1HH2 ARG 20 1HH2 ARG 20 13.237 -21.381 -8.860 161 2HH2 ARG 20 2HH2 ARG 20 13.557 -22.843 -7.989 162 H ASN 21 HN ASN 21 18.920 -16.060 -8.689 163 HA ASN 21 HA ASN 21 21.412 -15.140 -7.291 164 1HB ASN 21 2HB ASN 21 21.016 -16.808 -9.797 165 2HB ASN 21 1HB ASN 21 22.582 -16.203 -9.253 166 1HD2 ASN 21 1HD2 ASN 21 20.046 -18.561 -8.613 167 2HD2 ASN 21 2HD2 ASN 21 20.876 -19.402 -7.397 168 H GLY 22 HN GLY 22 19.424 -13.298 -8.000 169 1HA GLY 22 1HA GLY 22 20.628 -11.985 -10.404 170 2HA GLY 22 2HA GLY 22 20.044 -11.088 -9.002 171 H LYS 23 HN LYS 23 17.801 -13.293 -9.009 172 HA LYS 23 HA LYS 23 16.018 -11.776 -10.864 173 1HB LYS 23 2HB LYS 23 16.735 -13.689 -12.124 174 2HB LYS 23 1HB LYS 23 16.540 -14.757 -10.734 175 1HG LYS 23 2HG LYS 23 14.437 -15.182 -11.416 176 2HG LYS 23 1HG LYS 23 14.037 -13.491 -11.117 177 1HD LYS 23 2HD LYS 23 14.646 -12.879 -13.375 178 2HD LYS 23 1HD LYS 23 15.300 -14.487 -13.686 179 1HE LYS 23 2HE LYS 23 12.896 -15.329 -13.109 180 2HE LYS 23 1HE LYS 23 12.415 -13.648 -13.405 181 1HZ LYS 23 2HZ LYS 23 13.974 -13.951 -15.466 182 2HZ LYS 23 1HZ LYS 23 13.616 -15.599 -15.251 183 3HZ LYS 23 3HZ LYS 23 12.364 -14.489 -15.530 184 H LEU 24 HN LEU 24 13.970 -11.470 -9.994 185 HA LEU 24 HA LEU 24 13.499 -12.530 -7.253 186 1HB LEU 24 2HB LEU 24 13.218 -10.068 -8.473 187 2HB LEU 24 1HB LEU 24 11.563 -10.677 -8.472 188 HG LEU 24 HG LEU 24 13.400 -10.279 -6.100 189 1HD1 LEU 24 2HD1 LEU 24 11.591 -8.595 -7.268 190 2HD1 LEU 24 1HD1 LEU 24 10.573 -9.416 -6.084 191 3HD1 LEU 24 3HD1 LEU 24 12.017 -8.551 -5.557 192 1HD2 LEU 24 1HD2 LEU 24 10.877 -11.920 -6.366 193 2HD2 LEU 24 3HD2 LEU 24 12.422 -12.399 -5.663 194 3HD2 LEU 24 2HD2 LEU 24 11.388 -11.248 -4.818 195 H ALA 25 HN ALA 25 11.830 -13.965 -6.818 196 HA ALA 25 HA ALA 25 10.161 -14.850 -9.150 197 1HB ALA 25 1HB ALA 25 11.895 -16.397 -8.077 198 2HB ALA 25 3HB ALA 25 10.867 -16.397 -6.644 199 3HB ALA 25 2HB ALA 25 10.253 -17.038 -8.168 200 H CYS 26 HN CYS 26 7.941 -14.736 -8.897 201 HA CYS 26 HA CYS 26 6.727 -14.625 -6.211 202 1HB CYS 26 2HB CYS 26 7.403 -12.288 -7.819 203 2HB CYS 26 1HB CYS 26 5.677 -12.354 -7.468 204 H THR 27 HN THR 27 4.214 -13.838 -6.779 205 HA THR 27 HA THR 27 3.346 -15.740 -8.923 206 HB THR 27 HB THR 27 1.162 -15.521 -7.530 207 HG1 THR 27 1HG THR 27 2.102 -14.998 -5.254 208 1HG2 THR 27 3HG2 THR 27 3.429 -17.157 -7.312 209 2HG2 THR 27 2HG2 THR 27 3.036 -16.699 -5.654 210 3HG2 THR 27 1HG2 THR 27 1.824 -17.490 -6.663 211 H ARG 28 HN ARG 28 0.940 -14.967 -9.637 212 HA ARG 28 HA ARG 28 1.322 -12.243 -10.768 213 1HB ARG 28 2HB ARG 28 -0.628 -14.500 -11.337 214 2HB ARG 28 1HB ARG 28 -0.521 -13.006 -12.266 215 1HG ARG 28 2HG ARG 28 1.870 -13.537 -12.763 216 2HG ARG 28 1HG ARG 28 1.670 -15.078 -11.928 217 1HD ARG 28 2HD ARG 28 -0.234 -15.587 -13.537 218 2HD ARG 28 1HD ARG 28 0.264 -14.154 -14.455 219 HE ARG 28 HE ARG 28 1.992 -16.551 -13.968 220 1HH1 ARG 28 1HH1 ARG 28 0.672 -14.490 -16.257 221 2HH1 ARG 28 2HH1 ARG 28 2.130 -14.277 -17.167 222 1HH2 ARG 28 1HH2 ARG 28 4.131 -15.906 -14.850 223 2HH2 ARG 28 2HH2 ARG 28 4.087 -15.078 -16.372 224 H GLU 29 HN GLU 29 0.689 -12.208 -8.020 225 HA GLU 29 HA GLU 29 -2.058 -12.132 -7.329 226 1HB GLU 29 2HB GLU 29 -1.271 -10.851 -5.439 227 2HB GLU 29 1HB GLU 29 0.013 -11.982 -5.864 228 1HG GLU 29 2HG GLU 29 1.134 -10.199 -7.170 229 2HG GLU 29 1HG GLU 29 -0.139 -9.070 -6.703 230 H ASN 30 HN ASN 30 -3.397 -10.145 -6.977 231 HA ASN 30 HA ASN 30 -3.080 -8.258 -9.268 232 1HB ASN 30 2HB ASN 30 -5.465 -8.600 -7.438 233 2HB ASN 30 1HB ASN 30 -5.439 -8.001 -9.097 234 1HD2 ASN 30 1HD2 ASN 30 -4.714 -9.661 -10.789 235 2HD2 ASN 30 2HD2 ASN 30 -5.170 -11.273 -10.541 236 H ASP 31 HN ASP 31 -1.281 -7.580 -7.368 237 HA ASP 31 HA ASP 31 -2.569 -5.283 -5.925 238 1HB ASP 31 2HB ASP 31 -1.781 -7.311 -4.566 239 2HB ASP 31 1HB ASP 31 -0.141 -6.853 -5.023 240 HA PRO 32 HA PRO 32 0.746 -3.919 -8.959 241 1HB PRO 32 2HB PRO 32 -0.985 -1.694 -9.534 242 2HB PRO 32 1HB PRO 32 -0.530 -3.023 -10.603 243 1HG PRO 32 2HG PRO 32 -3.074 -2.554 -9.364 244 2HG PRO 32 1HG PRO 32 -2.614 -3.894 -10.416 245 1HD PRO 32 2HD PRO 32 -3.088 -3.950 -7.563 246 2HD PRO 32 1HD PRO 32 -2.657 -5.308 -8.628 247 H ILE 33 HN ILE 33 2.027 -1.948 -8.739 248 HA ILE 33 HA ILE 33 1.334 -0.074 -6.549 249 HB ILE 33 HB ILE 33 3.180 -0.661 -5.187 250 1HG1 ILE 33 2HG1 ILE 33 4.889 -0.750 -6.922 251 2HG1 ILE 33 1HG1 ILE 33 4.961 -2.228 -5.962 252 1HG2 ILE 33 3HG2 ILE 33 1.353 -2.365 -5.177 253 2HG2 ILE 33 2HG2 ILE 33 2.251 -3.289 -6.380 254 3HG2 ILE 33 1HG2 ILE 33 2.927 -3.048 -4.769 255 1HD1 ILE 33 2HD1 ILE 33 3.336 -3.187 -7.763 256 2HD1 ILE 33 1HD1 ILE 33 3.894 -1.834 -8.748 257 3HD1 ILE 33 3HD1 ILE 33 5.047 -3.035 -8.166 258 H GLN 34 HN GLN 34 3.821 1.122 -6.297 259 HA GLN 34 HA GLN 34 4.493 1.984 -9.092 260 1HB GLN 34 2HB GLN 34 4.174 3.698 -6.606 261 2HB GLN 34 1HB GLN 34 4.535 4.284 -8.229 262 1HG GLN 34 2HG GLN 34 2.389 3.537 -9.049 263 2HG GLN 34 1HG GLN 34 2.046 2.701 -7.535 264 1HE2 GLN 34 1HE2 GLN 34 0.467 4.915 -8.760 265 2HE2 GLN 34 2HE2 GLN 34 0.463 6.173 -7.620 266 H GLY 35 HN GLY 35 6.703 2.505 -9.419 267 1HA GLY 35 1HA GLY 35 8.968 1.794 -8.992 268 2HA GLY 35 2HA GLY 35 8.532 1.511 -7.305 269 HA PRO 36 HA PRO 36 10.249 5.355 -6.120 270 1HB PRO 36 2HB PRO 36 12.937 4.946 -7.064 271 2HB PRO 36 1HB PRO 36 12.316 4.743 -5.424 272 1HG PRO 36 2HG PRO 36 13.122 2.696 -7.266 273 2HG PRO 36 1HG PRO 36 12.482 2.492 -5.634 274 1HD PRO 36 2HD PRO 36 11.164 1.927 -8.146 275 2HD PRO 36 1HD PRO 36 10.533 1.690 -6.500 276 H ASP 37 HN ASP 37 10.747 4.344 -9.427 277 HA ASP 37 HA ASP 37 11.555 7.041 -10.329 278 1HB ASP 37 2HB ASP 37 11.002 4.402 -11.720 279 2HB ASP 37 1HB ASP 37 11.585 5.847 -12.546 280 H GLY 38 HN GLY 38 8.712 5.958 -9.296 281 1HA GLY 38 1HA GLY 38 7.202 7.798 -10.992 282 2HA GLY 38 2HA GLY 38 6.564 6.885 -9.626 283 H LYS 39 HN LYS 39 8.255 4.786 -11.605 284 HA LYS 39 HA LYS 39 6.173 4.294 -13.605 285 1HB LYS 39 2HB LYS 39 8.708 3.970 -13.794 286 2HB LYS 39 1HB LYS 39 8.499 2.531 -12.796 287 1HG LYS 39 2HG LYS 39 6.884 1.634 -14.449 288 2HG LYS 39 1HG LYS 39 7.133 3.063 -15.454 289 1HD LYS 39 2HD LYS 39 9.579 2.489 -15.546 290 2HD LYS 39 1HD LYS 39 9.210 0.986 -14.700 291 1HE LYS 39 2HE LYS 39 7.925 1.806 -17.331 292 2HE LYS 39 1HE LYS 39 9.299 0.693 -17.194 293 1HZ LYS 39 1HZ LYS 39 7.938 -0.601 -15.586 294 2HZ LYS 39 3HZ LYS 39 6.612 0.391 -15.954 295 3HZ LYS 39 2HZ LYS 39 7.294 -0.595 -17.158 296 H VAL 40 HN VAL 40 4.860 2.365 -13.680 297 HA VAL 40 HA VAL 40 4.317 1.192 -10.984 298 HB VAL 40 HB VAL 40 2.700 1.427 -13.541 299 1HG1 VAL 40 3HG1 VAL 40 2.328 -0.643 -12.003 300 2HG1 VAL 40 2HG1 VAL 40 1.637 0.520 -10.872 301 3HG1 VAL 40 1HG1 VAL 40 0.923 0.315 -12.472 302 1HG2 VAL 40 3HG2 VAL 40 3.088 3.103 -11.185 303 2HG2 VAL 40 2HG2 VAL 40 2.280 3.483 -12.706 304 3HG2 VAL 40 1HG2 VAL 40 1.393 2.674 -11.414 305 H HIS 41 HN HIS 41 4.307 -1.071 -10.728 306 HA HIS 41 HA HIS 41 5.307 -2.659 -13.072 307 1HB HIS 41 2HB HIS 41 5.776 -3.179 -10.125 308 2HB HIS 41 1HB HIS 41 6.638 -3.888 -11.490 309 HD1 HIS 41 HD1 HIS 41 8.464 -2.468 -12.621 310 HD2 HIS 41 HD2 HIS 41 6.495 -0.459 -9.544 311 HE1 HIS 41 HE1 HIS 41 9.801 -0.364 -12.168 312 H GLY 42 HN GLY 42 4.833 -5.129 -12.586 313 1HA GLY 42 1HA GLY 42 3.202 -6.801 -12.359 314 2HA GLY 42 2HA GLY 42 2.016 -5.514 -12.580 315 H ASN 43 HN ASN 43 4.381 -6.320 -10.009 316 HA ASN 43 HA ASN 43 2.269 -5.739 -7.988 317 1HB ASN 43 2HB ASN 43 2.884 -7.939 -6.897 318 2HB ASN 43 1HB ASN 43 2.067 -8.106 -8.450 319 1HD2 ASN 43 1HD2 ASN 43 3.601 -10.270 -7.682 320 2HD2 ASN 43 2HD2 ASN 43 5.042 -10.334 -8.576 321 H THR 44 HN THR 44 3.599 -6.483 -5.729 322 HA THR 44 HA THR 44 5.543 -4.418 -5.345 323 HB THR 44 HB THR 44 4.815 -6.940 -3.829 324 HG1 THR 44 1HG THR 44 3.277 -5.722 -3.128 325 1HG2 THR 44 3HG2 THR 44 6.693 -4.685 -3.122 326 2HG2 THR 44 2HG2 THR 44 5.921 -5.679 -1.888 327 3HG2 THR 44 1HG2 THR 44 7.004 -6.419 -3.067 328 H CYS 45 HN CYS 45 5.859 -7.852 -6.155 329 HA CYS 45 HA CYS 45 8.695 -8.060 -5.732 330 1HB CYS 45 2HB CYS 45 7.011 -9.542 -7.768 331 2HB CYS 45 1HB CYS 45 8.460 -10.118 -6.943 332 H SER 46 HN SER 46 6.890 -7.748 -8.835 333 HA SER 46 HA SER 46 9.026 -7.283 -10.569 334 1HB SER 46 2HB SER 46 6.362 -5.816 -10.464 335 2HB SER 46 1HB SER 46 7.367 -6.029 -11.897 336 HG SER 46 HG SER 46 7.101 -8.303 -11.607 337 H MET 47 HN MET 47 7.712 -5.235 -8.075 338 HA MET 47 HA MET 47 9.186 -2.821 -8.898 339 1HB MET 47 2HB MET 47 6.893 -3.128 -7.659 340 2HB MET 47 1HB MET 47 7.892 -3.367 -6.229 341 1HG MET 47 2HG MET 47 9.072 -1.180 -6.915 342 2HG MET 47 1HG MET 47 7.692 -0.920 -7.982 343 1HE MET 47 3HE MET 47 9.048 0.536 -5.782 344 2HE MET 47 2HE MET 47 7.809 1.299 -4.788 345 3HE MET 47 1HE MET 47 8.743 -0.048 -4.140 346 H CYS 48 HN CYS 48 9.383 -5.440 -6.569 347 HA CYS 48 HA CYS 48 11.751 -4.364 -5.203 348 1HB CYS 48 2HB CYS 48 9.831 -6.615 -4.995 349 2HB CYS 48 1HB CYS 48 11.445 -6.941 -4.365 350 H GLU 49 HN GLU 49 11.107 -6.355 -7.964 351 HA GLU 49 HA GLU 49 13.573 -7.895 -7.909 352 1HB GLU 49 2HB GLU 49 12.722 -8.790 -9.887 353 2HB GLU 49 1HB GLU 49 11.241 -8.176 -9.157 354 1HG GLU 49 2HG GLU 49 11.355 -6.155 -10.503 355 2HG GLU 49 1HG GLU 49 12.925 -6.628 -11.148 356 H VAL 50 HN VAL 50 12.515 -4.959 -9.671 357 HA VAL 50 HA VAL 50 14.917 -4.487 -11.118 358 HB VAL 50 HB VAL 50 14.010 -2.272 -11.383 359 1HG1 VAL 50 3HG1 VAL 50 12.535 -4.511 -11.863 360 2HG1 VAL 50 2HG1 VAL 50 11.428 -3.607 -10.829 361 3HG1 VAL 50 1HG1 VAL 50 12.023 -2.886 -12.324 362 1HG2 VAL 50 3HG2 VAL 50 12.472 -2.853 -8.836 363 2HG2 VAL 50 2HG2 VAL 50 13.787 -1.693 -9.020 364 3HG2 VAL 50 1HG2 VAL 50 12.248 -1.418 -9.836 365 H PHE 51 HN PHE 51 13.920 -3.530 -7.840 366 HA PHE 51 HA PHE 51 16.275 -2.001 -7.201 367 1HB PHE 51 2HB PHE 51 14.301 -1.760 -5.870 368 2HB PHE 51 1HB PHE 51 14.171 -3.502 -5.623 369 HD1 PHE 51 HD1 PHE 51 16.682 -0.753 -5.103 370 HD2 PHE 51 HD2 PHE 51 14.883 -4.341 -3.576 371 HE1 PHE 51 HE1 PHE 51 18.054 -0.565 -3.046 372 HE2 PHE 51 HE2 PHE 51 16.255 -4.152 -1.518 373 HZ PHE 51 HZ PHE 51 17.841 -2.265 -1.254 374 H PHE 52 HN PHE 52 15.415 -5.416 -6.947 375 HA PHE 52 HA PHE 52 17.742 -6.288 -5.488 376 1HB PHE 52 2HB PHE 52 15.510 -7.426 -7.105 377 2HB PHE 52 1HB PHE 52 16.918 -8.461 -6.879 378 HD1 PHE 52 HD1 PHE 52 17.838 -7.612 -4.187 379 HD2 PHE 52 HD2 PHE 52 13.875 -8.344 -5.674 380 HE1 PHE 52 HE1 PHE 52 17.072 -8.134 -1.890 381 HE2 PHE 52 HE2 PHE 52 13.110 -8.869 -3.375 382 HZ PHE 52 HZ PHE 52 14.708 -8.764 -1.483 383 H GLN 53 HN GLN 53 16.987 -5.846 -8.914 384 HA GLN 53 HA GLN 53 19.354 -7.105 -9.980 385 1HB GLN 53 2HB GLN 53 17.047 -6.330 -11.003 386 2HB GLN 53 1HB GLN 53 17.897 -4.811 -11.268 387 1HG GLN 53 2HG GLN 53 19.753 -6.267 -12.335 388 2HG GLN 53 1HG GLN 53 18.533 -7.539 -12.390 389 1HE2 GLN 53 1HE2 GLN 53 16.437 -5.233 -12.725 390 2HE2 GLN 53 2HE2 GLN 53 16.538 -4.862 -14.378 391 H ALA 54 HN ALA 54 18.523 -3.744 -9.132 392 HA ALA 54 HA ALA 54 20.962 -2.528 -10.021 393 1HB ALA 54 2HB ALA 54 18.943 -1.820 -7.867 394 2HB ALA 54 3HB ALA 54 18.922 -1.284 -9.547 395 3HB ALA 54 1HB ALA 54 20.184 -0.714 -8.455 396 H GLU 55 HN GLU 55 20.019 -4.050 -6.950 397 HA GLU 55 HA GLU 55 22.148 -3.251 -5.290 398 1HB GLU 55 2HB GLU 55 20.506 -5.767 -5.582 399 2HB GLU 55 1HB GLU 55 21.720 -5.622 -4.311 400 1HG GLU 55 2HG GLU 55 20.614 -3.513 -3.555 401 2HG GLU 55 1HG GLU 55 19.356 -3.775 -4.763 402 H GLU 56 HN GLU 56 22.088 -5.633 -7.889 403 HA GLU 56 HA GLU 56 24.615 -6.893 -7.297 404 1HB GLU 56 2HB GLU 56 22.925 -6.557 -9.792 405 2HB GLU 56 1HB GLU 56 24.363 -7.577 -9.736 406 1HG GLU 56 2HG GLU 56 23.326 -8.797 -7.789 407 2HG GLU 56 1HG GLU 56 21.850 -7.870 -8.064 408 H GLU 57 HN GLU 57 23.689 -3.981 -9.065 409 HA GLU 57 HA GLU 57 26.180 -3.561 -10.447 410 1HB GLU 57 2HB GLU 57 24.046 -1.635 -9.467 411 2HB GLU 57 1HB GLU 57 25.258 -1.272 -10.697 412 1HG GLU 57 2HG GLU 57 23.211 -3.502 -10.896 413 2HG GLU 57 1HG GLU 57 23.066 -1.933 -11.688 414 H GLU 58 HN GLU 58 24.972 -2.568 -7.249 415 HA GLU 58 HA GLU 58 27.098 -0.794 -6.550 416 1HB GLU 58 2HB GLU 58 25.357 -2.638 -4.877 417 2HB GLU 58 1HB GLU 58 26.290 -1.283 -4.241 418 1HG GLU 58 2HG GLU 58 25.032 0.236 -5.791 419 2HG GLU 58 1HG GLU 58 24.028 -1.138 -6.255 420 H LYS 59 HN LYS 59 26.851 -4.307 -6.521 421 HA LYS 59 HA LYS 59 29.272 -4.710 -4.924 422 1HB LYS 59 2HB LYS 59 27.495 -6.485 -6.626 423 2HB LYS 59 1HB LYS 59 28.838 -7.094 -5.659 424 1HG LYS 59 2HG LYS 59 27.779 -6.043 -3.639 425 2HG LYS 59 1HG LYS 59 26.390 -5.623 -4.640 426 1HD LYS 59 2HD LYS 59 26.163 -8.066 -5.216 427 2HD LYS 59 1HD LYS 59 27.425 -8.407 -4.031 428 1HE LYS 59 2HE LYS 59 26.010 -8.072 -2.261 429 2HE LYS 59 1HE LYS 59 25.215 -6.693 -3.042 430 1HZ LYS 59 2HZ LYS 59 24.196 -8.306 -4.607 431 2HZ LYS 59 1HZ LYS 59 24.835 -9.576 -3.675 432 3HZ LYS 59 3HZ LYS 59 23.685 -8.528 -3.001 433 H LYS 60 HN LYS 60 28.668 -3.807 -8.131 434 HA LYS 60 HA LYS 60 30.875 -5.250 -9.387 435 1HB LYS 60 2HB LYS 60 29.515 -4.686 -11.108 436 2HB LYS 60 1HB LYS 60 28.615 -3.577 -10.080 437 1HG LYS 60 2HG LYS 60 29.501 -2.270 -11.884 438 2HG LYS 60 1HG LYS 60 30.475 -1.887 -10.465 439 1HD LYS 60 2HD LYS 60 32.209 -3.456 -11.202 440 2HD LYS 60 1HD LYS 60 31.224 -3.922 -12.589 441 1HE LYS 60 2HE LYS 60 31.249 -1.308 -13.074 442 2HE LYS 60 1HE LYS 60 32.737 -1.375 -12.110 443 1HZ LYS 60 2HZ LYS 60 32.123 -3.242 -14.340 444 2HZ LYS 60 1HZ LYS 60 33.058 -1.837 -14.533 445 3HZ LYS 60 3HZ LYS 60 33.598 -3.080 -13.512 446 H LYS 61 HN LYS 61 30.317 -1.914 -8.233 447 HA LYS 61 HA LYS 61 32.993 -1.005 -8.943 448 1HB LYS 61 2HB LYS 61 30.861 0.106 -7.087 449 2HB LYS 61 1HB LYS 61 32.248 1.005 -7.699 450 1HG LYS 61 2HG LYS 61 31.454 0.654 -10.012 451 2HG LYS 61 1HG LYS 61 30.065 -0.242 -9.398 452 1HD LYS 61 2HD LYS 61 29.337 1.767 -8.144 453 2HD LYS 61 1HD LYS 61 30.713 2.660 -8.794 454 1HE LYS 61 2HE LYS 61 29.860 2.245 -11.104 455 2HE LYS 61 1HE LYS 61 28.440 1.442 -10.405 456 1HZ LYS 61 3HZ LYS 61 28.278 3.559 -8.984 457 2HZ LYS 61 2HZ LYS 61 29.289 4.265 -10.152 458 3HZ LYS 61 1HZ LYS 61 27.768 3.651 -10.599 459 H LYS 62 HN LYS 62 34.769 -0.751 -7.525 460 HA LYS 62 HA LYS 62 36.122 -1.194 -5.635 461 1HB LYS 62 2HB LYS 62 33.471 -1.378 -4.182 462 2HB LYS 62 1HB LYS 62 35.025 -0.862 -3.527 463 1HG LYS 62 2HG LYS 62 33.565 0.597 -5.747 464 2HG LYS 62 1HG LYS 62 33.454 1.040 -4.044 465 1HD LYS 62 2HD LYS 62 35.994 1.201 -4.043 466 2HD LYS 62 1HD LYS 62 35.922 1.054 -5.799 467 1HE LYS 62 2HE LYS 62 35.659 3.319 -5.816 468 2HE LYS 62 1HE LYS 62 34.018 3.017 -5.216 469 1HZ LYS 62 2HZ LYS 62 36.278 2.931 -3.335 470 2HZ LYS 62 1HZ LYS 62 35.681 4.446 -3.817 471 3HZ LYS 62 3HZ LYS 62 34.653 3.339 -3.046 472 H GLU 63 HN GLU 63 35.554 -3.412 -7.254 473 HA GLU 63 HA GLU 63 34.401 -5.661 -5.925 474 1HB GLU 63 2HB GLU 63 36.631 -5.467 -7.977 475 2HB GLU 63 1HB GLU 63 35.683 -6.914 -7.639 476 1HG GLU 63 2HG GLU 63 33.612 -5.574 -8.212 477 2HG GLU 63 1HG GLU 63 34.682 -4.287 -8.767 478 H GLY 64 HN GLY 64 37.483 -4.071 -5.533 479 1HA GLY 64 1HA GLY 64 38.113 -5.740 -3.229 480 2HA GLY 64 2HA GLY 64 39.104 -4.420 -3.852 481 H GLU 65 HN GLU 65 40.241 -6.876 -3.045 482 HA GLU 65 HA GLU 65 41.201 -7.931 -5.684 483 1HB GLU 65 2HB GLU 65 42.804 -6.644 -4.282 484 2HB GLU 65 1HB GLU 65 42.553 -7.793 -2.969 485 1HG GLU 65 2HG GLU 65 43.327 -9.623 -4.494 486 2HG GLU 65 1HG GLU 65 43.697 -8.402 -5.712 487 H SER 66 HN SER 66 41.492 -10.218 -5.869 488 HA SER 66 HA SER 66 40.017 -11.817 -3.807 489 1HB SER 66 2HB SER 66 40.600 -12.350 -6.740 490 2HB SER 66 1HB SER 66 39.582 -13.342 -5.696 491 HG SER 66 HG SER 66 38.526 -11.108 -5.351 492 H ARG 67 HN ARG 67 40.992 -13.757 -3.049 493 HA ARG 67 HA ARG 67 43.872 -14.134 -3.808 494 1HB ARG 67 2HB ARG 67 42.455 -14.411 -1.137 495 2HB ARG 67 1HB ARG 67 44.153 -14.800 -1.412 496 1HG ARG 67 2HG ARG 67 44.540 -12.459 -2.161 497 2HG ARG 67 1HG ARG 67 42.856 -12.085 -1.798 498 1HD ARG 67 2HD ARG 67 43.268 -12.791 0.582 499 2HD ARG 67 1HD ARG 67 44.986 -12.975 0.180 500 HE ARG 67 HE ARG 67 44.624 -10.485 -0.712 501 1HH1 ARG 67 1HH1 ARG 67 44.863 -11.657 2.340 502 2HH1 ARG 67 2HH1 ARG 67 44.050 -10.352 3.137 503 1HH2 ARG 67 1HH2 ARG 67 42.888 -8.931 0.194 504 2HH2 ARG 67 2HH2 ARG 67 42.931 -8.809 1.921 505 H ASN 68 HN ASN 68 44.592 -16.331 -3.904 506 HA ASN 68 HA ASN 68 42.501 -18.286 -4.553 507 1HB ASN 68 2HB ASN 68 45.519 -18.552 -4.362 508 2HB ASN 68 1HB ASN 68 44.425 -19.627 -5.234 509 1HD2 ASN 68 1HD2 ASN 68 42.760 -17.866 -6.592 510 2HD2 ASN 68 2HD2 ASN 68 43.666 -16.889 -7.645 No H/Q in entry = 510 Start of MODEL 19 1 H1 GLU 1 1H GLU 1 22.012 13.910 7.613 2 H2 GLU 1 3H GLU 1 23.230 12.788 7.245 3 H3 GLU 1 2H GLU 1 23.327 14.375 6.644 4 HA GLU 1 HA GLU 1 21.894 13.986 4.950 5 1HB GLU 1 2HB GLU 1 22.916 11.283 5.867 6 2HB GLU 1 1HB GLU 1 22.164 11.544 4.293 7 1HG GLU 1 2HG GLU 1 24.657 12.915 5.347 8 2HG GLU 1 1HG GLU 1 24.590 11.708 4.062 9 H SER 2 HN SER 2 19.749 13.492 4.375 10 HA SER 2 HA SER 2 18.098 12.166 6.504 11 1HB SER 2 2HB SER 2 17.380 14.316 4.482 12 2HB SER 2 1HB SER 2 16.316 13.691 5.743 13 HG SER 2 HG SER 2 17.168 15.349 6.763 14 H GLY 3 HN GLY 3 16.409 10.754 5.761 15 1HA GLY 3 1HA GLY 3 16.789 8.865 3.895 16 2HA GLY 3 2HA GLY 3 16.245 10.188 2.863 17 H LYS 4 HN LYS 4 14.560 8.234 2.643 18 HA LYS 4 HA LYS 4 12.101 9.152 3.870 19 1HB LYS 4 2HB LYS 4 12.506 8.074 1.583 20 2HB LYS 4 1HB LYS 4 12.626 6.537 2.439 21 1HG LYS 4 2HG LYS 4 10.373 6.779 3.305 22 2HG LYS 4 1HG LYS 4 10.252 8.411 2.647 23 1HD LYS 4 2HD LYS 4 9.099 6.732 1.214 24 2HD LYS 4 1HD LYS 4 10.421 7.535 0.368 25 1HE LYS 4 2HE LYS 4 11.354 5.166 1.799 26 2HE LYS 4 1HE LYS 4 10.093 4.773 0.615 27 1HZ LYS 4 2HZ LYS 4 12.425 6.538 0.066 28 2HZ LYS 4 1HZ LYS 4 12.363 4.894 -0.359 29 3HZ LYS 4 3HZ LYS 4 11.275 5.990 -1.059 30 H ALA 5 HN ALA 5 10.971 8.239 5.602 31 HA ALA 5 HA ALA 5 12.299 6.877 7.676 32 1HB ALA 5 1HB ALA 5 9.442 7.243 6.812 33 2HB ALA 5 2HB ALA 5 10.274 7.930 8.207 34 3HB ALA 5 3HB ALA 5 9.801 6.230 8.209 35 H THR 6 HN THR 6 10.928 5.615 4.727 36 HA THR 6 HA THR 6 11.189 2.814 5.743 37 HB THR 6 HB THR 6 9.997 3.597 3.102 38 HG1 THR 6 1HG THR 6 8.461 3.669 5.446 39 1HG2 THR 6 3HG2 THR 6 10.010 1.323 4.913 40 2HG2 THR 6 2HG2 THR 6 8.365 1.817 4.511 41 3HG2 THR 6 1HG2 THR 6 9.501 1.404 3.226 42 H SER 7 HN SER 7 12.244 1.252 4.270 43 HA SER 7 HA SER 7 14.099 2.469 2.266 44 1HB SER 7 2HB SER 7 15.468 2.354 4.181 45 2HB SER 7 1HB SER 7 14.713 0.862 4.741 46 HG SER 7 HG SER 7 16.628 0.260 3.875 47 H TYR 8 HN TYR 8 13.827 1.329 0.386 48 HA TYR 8 HA TYR 8 12.272 -0.944 -0.030 49 1HB TYR 8 2HB TYR 8 14.831 -0.087 -1.423 50 2HB TYR 8 1HB TYR 8 13.621 -1.172 -2.109 51 HD1 TYR 8 HD1 TYR 8 11.083 0.000 -1.358 52 HD2 TYR 8 HD2 TYR 8 14.713 1.952 -2.569 53 HE1 TYR 8 HE1 TYR 8 9.771 1.956 -2.137 54 HE2 TYR 8 HE2 TYR 8 13.401 3.908 -3.347 55 HH TYR 8 HH TYR 8 9.844 3.968 -3.055 56 H ALA 9 HN ALA 9 15.836 -0.928 0.426 57 HA ALA 9 HA ALA 9 16.406 -3.638 0.335 58 1HB ALA 9 2HB ALA 9 18.287 -2.410 0.773 59 2HB ALA 9 3HB ALA 9 17.915 -2.797 2.454 60 3HB ALA 9 1HB ALA 9 17.408 -1.251 1.772 61 H GLU 10 HN GLU 10 14.646 -1.912 2.841 62 HA GLU 10 HA GLU 10 14.608 -4.294 4.615 63 1HB GLU 10 2HB GLU 10 14.952 -1.882 5.363 64 2HB GLU 10 1HB GLU 10 13.267 -1.593 4.932 65 1HG GLU 10 2HG GLU 10 12.633 -3.491 6.466 66 2HG GLU 10 1HG GLU 10 14.315 -3.554 6.993 67 H LEU 11 HN LEU 11 12.471 -2.369 2.547 68 HA LEU 11 HA LEU 11 10.021 -3.729 3.284 69 1HB LEU 11 2HB LEU 11 10.485 -1.422 2.154 70 2HB LEU 11 1HB LEU 11 10.584 -2.356 0.661 71 HG LEU 11 HG LEU 11 8.311 -3.390 1.514 72 1HD1 LEU 11 1HD1 LEU 11 8.854 -1.477 3.523 73 2HD1 LEU 11 3HD1 LEU 11 7.533 -0.812 2.562 74 3HD1 LEU 11 2HD1 LEU 11 7.368 -2.402 3.306 75 1HD2 LEU 11 2HD2 LEU 11 9.040 -1.297 -0.239 76 2HD2 LEU 11 1HD2 LEU 11 7.543 -2.231 -0.257 77 3HD2 LEU 11 3HD2 LEU 11 7.629 -0.719 0.648 78 H CYS 12 HN CYS 12 11.957 -3.831 0.287 79 HA CYS 12 HA CYS 12 10.674 -6.169 -0.783 80 1HB CYS 12 2HB CYS 12 13.263 -4.688 -1.242 81 2HB CYS 12 1HB CYS 12 12.883 -6.148 -2.157 82 H ASN 13 HN ASN 13 12.846 -5.775 1.800 83 HA ASN 13 HA ASN 13 14.653 -7.849 1.832 84 1HB ASN 13 2HB ASN 13 14.096 -6.204 3.642 85 2HB ASN 13 1HB ASN 13 12.677 -7.167 4.033 86 1HD2 ASN 13 1HD2 ASN 13 13.384 -7.926 6.107 87 2HD2 ASN 13 2HD2 ASN 13 14.738 -8.929 6.308 88 H GLU 14 HN GLU 14 11.232 -8.187 2.810 89 HA GLU 14 HA GLU 14 11.130 -10.943 3.275 90 1HB GLU 14 2HB GLU 14 9.332 -9.222 3.593 91 2HB GLU 14 1HB GLU 14 9.058 -9.243 1.851 92 1HG GLU 14 2HG GLU 14 8.525 -11.648 1.958 93 2HG GLU 14 1HG GLU 14 8.819 -11.640 3.697 94 H TYR 15 HN TYR 15 11.564 -9.309 0.214 95 HA TYR 15 HA TYR 15 10.822 -11.716 -1.346 96 1HB TYR 15 2HB TYR 15 11.783 -8.921 -2.015 97 2HB TYR 15 1HB TYR 15 11.462 -10.147 -3.241 98 HD1 TYR 15 HD1 TYR 15 9.184 -10.980 -3.636 99 HD2 TYR 15 HD2 TYR 15 9.973 -7.900 -0.749 100 HE1 TYR 15 HE1 TYR 15 6.766 -10.438 -3.554 101 HE2 TYR 15 HE2 TYR 15 7.555 -7.357 -0.668 102 HH TYR 15 HH TYR 15 5.498 -8.037 -1.271 103 H ARG 16 HN ARG 16 13.472 -10.818 0.407 104 HA ARG 16 HA ARG 16 15.623 -11.383 -1.460 105 1HB ARG 16 2HB ARG 16 15.330 -11.216 1.545 106 2HB ARG 16 1HB ARG 16 16.879 -11.555 0.772 107 1HG ARG 16 2HG ARG 16 16.458 -9.458 -0.640 108 2HG ARG 16 1HG ARG 16 15.162 -9.082 0.496 109 1HD ARG 16 2HD ARG 16 16.952 -9.408 2.343 110 2HD ARG 16 1HD ARG 16 18.130 -9.263 1.024 111 HE ARG 16 HE ARG 16 16.099 -7.190 0.885 112 1HH1 ARG 16 1HH1 ARG 16 18.007 -7.839 3.503 113 2HH1 ARG 16 2HH1 ARG 16 18.966 -6.400 3.418 114 1HH2 ARG 16 1HH2 ARG 16 17.771 -5.470 0.298 115 2HH2 ARG 16 2HH2 ARG 16 18.833 -5.059 1.603 116 H LYS 17 HN LYS 17 13.622 -13.293 0.717 117 HA LYS 17 HA LYS 17 15.257 -15.697 0.609 118 1HB LYS 17 2HB LYS 17 12.280 -15.454 1.134 119 2HB LYS 17 1HB LYS 17 13.390 -16.662 1.777 120 1HG LYS 17 2HG LYS 17 14.627 -14.718 2.894 121 2HG LYS 17 1HG LYS 17 13.230 -13.723 2.479 122 1HD LYS 17 2HD LYS 17 12.960 -16.333 3.981 123 2HD LYS 17 1HD LYS 17 13.200 -14.793 4.805 124 1HE LYS 17 2HE LYS 17 11.181 -14.029 3.241 125 2HE LYS 17 1HE LYS 17 10.820 -15.766 3.264 126 1HZ LYS 17 1HZ LYS 17 11.590 -14.473 5.780 127 2HZ LYS 17 3HZ LYS 17 10.023 -14.180 5.200 128 3HZ LYS 17 2HZ LYS 17 10.527 -15.772 5.515 129 H LEU 18 HN LEU 18 13.414 -14.071 -1.671 130 HA LEU 18 HA LEU 18 12.620 -16.531 -3.159 131 1HB LEU 18 2HB LEU 18 11.967 -13.579 -3.486 132 2HB LEU 18 1HB LEU 18 11.270 -14.880 -4.448 133 HG LEU 18 HG LEU 18 10.467 -15.895 -2.244 134 1HD1 LEU 18 2HD1 LEU 18 11.717 -13.370 -1.309 135 2HD1 LEU 18 1HD1 LEU 18 10.157 -13.775 -0.596 136 3HD1 LEU 18 3HD1 LEU 18 11.506 -14.901 -0.464 137 1HD2 LEU 18 3HD2 LEU 18 9.033 -14.603 -3.854 138 2HD2 LEU 18 2HD2 LEU 18 8.501 -14.463 -2.179 139 3HD2 LEU 18 1HD2 LEU 18 9.396 -13.142 -2.933 140 H VAL 19 HN VAL 19 14.554 -13.571 -3.355 141 HA VAL 19 HA VAL 19 15.368 -13.705 -6.075 142 HB VAL 19 HB VAL 19 16.704 -12.690 -3.548 143 1HG1 VAL 19 3HG1 VAL 19 17.432 -12.317 -6.463 144 2HG1 VAL 19 2HG1 VAL 19 18.010 -11.252 -5.181 145 3HG1 VAL 19 1HG1 VAL 19 18.451 -12.960 -5.174 146 1HG2 VAL 19 1HG2 VAL 19 14.420 -11.807 -4.653 147 2HG2 VAL 19 3HG2 VAL 19 15.585 -10.713 -3.907 148 3HG2 VAL 19 2HG2 VAL 19 15.566 -10.922 -5.660 149 H ARG 20 HN ARG 20 17.312 -14.580 -7.008 150 HA ARG 20 HA ARG 20 18.668 -16.705 -5.378 151 1HB ARG 20 2HB ARG 20 17.648 -16.724 -8.236 152 2HB ARG 20 1HB ARG 20 18.697 -17.979 -7.574 153 1HG ARG 20 2HG ARG 20 16.720 -17.756 -5.650 154 2HG ARG 20 1HG ARG 20 15.827 -17.529 -7.153 155 1HD ARG 20 2HD ARG 20 16.837 -19.624 -8.050 156 2HD ARG 20 1HD ARG 20 17.665 -19.864 -6.500 157 HE ARG 20 HE ARG 20 15.558 -20.384 -5.506 158 1HH1 ARG 20 1HH1 ARG 20 15.314 -20.418 -8.826 159 2HH1 ARG 20 2HH1 ARG 20 13.602 -20.169 -8.893 160 1HH2 ARG 20 1HH2 ARG 20 13.303 -19.475 -5.509 161 2HH2 ARG 20 2HH2 ARG 20 12.463 -19.635 -7.015 162 H ASN 21 HN ASN 21 19.342 -16.009 -8.742 163 HA ASN 21 HA ASN 21 21.951 -14.768 -7.926 164 1HB ASN 21 2HB ASN 21 22.923 -15.953 -9.775 165 2HB ASN 21 1HB ASN 21 21.871 -17.113 -8.964 166 1HD2 ASN 21 1HD2 ASN 21 19.815 -17.657 -10.007 167 2HD2 ASN 21 2HD2 ASN 21 19.563 -17.329 -11.651 168 H GLY 22 HN GLY 22 19.805 -13.067 -8.181 169 1HA GLY 22 1HA GLY 22 20.384 -11.700 -10.770 170 2HA GLY 22 2HA GLY 22 19.814 -10.890 -9.309 171 H LYS 23 HN LYS 23 18.171 -13.757 -9.495 172 HA LYS 23 HA LYS 23 15.960 -12.608 -11.160 173 1HB LYS 23 2HB LYS 23 16.667 -14.650 -12.093 174 2HB LYS 23 1HB LYS 23 16.986 -15.368 -10.515 175 1HG LYS 23 2HG LYS 23 14.638 -15.608 -10.061 176 2HG LYS 23 1HG LYS 23 14.206 -14.631 -11.465 177 1HD LYS 23 2HD LYS 23 15.531 -16.440 -12.813 178 2HD LYS 23 1HD LYS 23 15.298 -17.436 -11.376 179 1HE LYS 23 2HE LYS 23 12.782 -16.686 -11.599 180 2HE LYS 23 1HE LYS 23 13.236 -16.353 -13.282 181 1HZ LYS 23 3HZ LYS 23 14.392 -18.644 -13.102 182 2HZ LYS 23 2HZ LYS 23 13.338 -18.903 -11.794 183 3HZ LYS 23 1HZ LYS 23 12.713 -18.597 -13.344 184 H LEU 24 HN LEU 24 13.953 -12.318 -10.171 185 HA LEU 24 HA LEU 24 13.794 -12.986 -7.253 186 1HB LEU 24 2HB LEU 24 13.616 -10.588 -8.502 187 2HB LEU 24 1HB LEU 24 11.922 -11.069 -8.547 188 HG LEU 24 HG LEU 24 13.690 -10.621 -6.144 189 1HD1 LEU 24 1HD1 LEU 24 11.001 -9.650 -7.119 190 2HD1 LEU 24 3HD1 LEU 24 11.511 -9.439 -5.444 191 3HD1 LEU 24 2HD1 LEU 24 12.438 -8.697 -6.748 192 1HD2 LEU 24 3HD2 LEU 24 11.210 -12.337 -6.351 193 2HD2 LEU 24 2HD2 LEU 24 12.758 -12.744 -5.614 194 3HD2 LEU 24 1HD2 LEU 24 11.692 -11.576 -4.834 195 H ALA 25 HN ALA 25 12.070 -14.237 -6.533 196 HA ALA 25 HA ALA 25 10.382 -15.532 -8.589 197 1HB ALA 25 2HB ALA 25 11.570 -16.208 -6.109 198 2HB ALA 25 3HB ALA 25 10.561 -17.240 -7.123 199 3HB ALA 25 1HB ALA 25 9.826 -16.265 -5.851 200 H CYS 26 HN CYS 26 8.723 -14.131 -9.174 201 HA CYS 26 HA CYS 26 7.346 -12.457 -7.201 202 1HB CYS 26 2HB CYS 26 7.415 -12.915 -10.131 203 2HB CYS 26 1HB CYS 26 5.884 -12.321 -9.489 204 H THR 27 HN THR 27 4.868 -12.565 -7.165 205 HA THR 27 HA THR 27 3.955 -15.425 -7.141 206 HB THR 27 HB THR 27 2.511 -14.559 -5.202 207 HG1 THR 27 1HG THR 27 4.433 -12.520 -5.046 208 1HG2 THR 27 3HG2 THR 27 4.713 -15.870 -5.052 209 2HG2 THR 27 2HG2 THR 27 5.479 -14.320 -4.700 210 3HG2 THR 27 1HG2 THR 27 4.238 -14.955 -3.620 211 H ARG 28 HN ARG 28 1.295 -15.096 -6.748 212 HA ARG 28 HA ARG 28 0.430 -13.736 -9.247 213 1HB ARG 28 2HB ARG 28 -1.003 -15.602 -7.326 214 2HB ARG 28 1HB ARG 28 -1.576 -15.125 -8.924 215 1HG ARG 28 2HG ARG 28 0.490 -16.132 -9.913 216 2HG ARG 28 1HG ARG 28 0.942 -16.700 -8.307 217 1HD ARG 28 2HD ARG 28 -1.326 -17.886 -8.228 218 2HD ARG 28 1HD ARG 28 -1.462 -17.528 -9.961 219 HE ARG 28 HE ARG 28 0.834 -18.688 -10.145 220 1HH1 ARG 28 1HH1 ARG 28 0.923 -19.140 -7.113 221 2HH1 ARG 28 2HH1 ARG 28 0.481 -20.812 -7.022 222 1HH2 ARG 28 1HH2 ARG 28 -0.749 -20.938 -10.261 223 2HH2 ARG 28 2HH2 ARG 28 -0.465 -21.830 -8.804 224 H GLU 29 HN GLU 29 1.019 -12.420 -6.485 225 HA GLU 29 HA GLU 29 -1.422 -11.510 -5.324 226 1HB GLU 29 2HB GLU 29 0.791 -11.296 -4.292 227 2HB GLU 29 1HB GLU 29 1.313 -10.218 -5.587 228 1HG GLU 29 2HG GLU 29 -0.428 -8.592 -4.932 229 2HG GLU 29 1HG GLU 29 -0.946 -9.669 -3.636 230 H ASN 30 HN ASN 30 -2.728 -9.708 -5.803 231 HA ASN 30 HA ASN 30 -2.210 -8.401 -8.451 232 1HB ASN 30 2HB ASN 30 -4.677 -8.126 -8.476 233 2HB ASN 30 1HB ASN 30 -4.226 -9.818 -8.267 234 1HD2 ASN 30 1HD2 ASN 30 -5.064 -10.870 -6.444 235 2HD2 ASN 30 2HD2 ASN 30 -5.820 -10.084 -5.145 236 H ASP 31 HN ASP 31 -0.796 -7.223 -6.458 237 HA ASP 31 HA ASP 31 -2.451 -4.866 -5.614 238 1HB ASP 31 2HB ASP 31 -0.358 -6.553 -4.341 239 2HB ASP 31 1HB ASP 31 -0.283 -4.825 -3.988 240 HA PRO 32 HA PRO 32 0.672 -3.479 -8.786 241 1HB PRO 32 2HB PRO 32 -1.272 -1.490 -9.514 242 2HB PRO 32 1HB PRO 32 -0.728 -2.876 -10.461 243 1HG PRO 32 2HG PRO 32 -3.267 -2.510 -9.179 244 2HG PRO 32 1HG PRO 32 -2.715 -3.906 -10.108 245 1HD PRO 32 2HD PRO 32 -3.100 -3.709 -7.247 246 2HD PRO 32 1HD PRO 32 -2.576 -5.126 -8.187 247 H ILE 33 HN ILE 33 2.063 -1.768 -8.405 248 HA ILE 33 HA ILE 33 1.155 0.516 -6.728 249 HB ILE 33 HB ILE 33 2.741 0.114 -5.030 250 1HG1 ILE 33 2HG1 ILE 33 4.708 -0.213 -6.412 251 2HG1 ILE 33 1HG1 ILE 33 4.582 -1.568 -5.289 252 1HG2 ILE 33 1HG2 ILE 33 0.875 -1.656 -5.255 253 2HG2 ILE 33 3HG2 ILE 33 2.145 -2.731 -5.839 254 3HG2 ILE 33 2HG2 ILE 33 2.244 -2.050 -4.215 255 1HD1 ILE 33 2HD1 ILE 33 3.246 -2.717 -7.217 256 2HD1 ILE 33 1HD1 ILE 33 4.010 -1.502 -8.242 257 3HD1 ILE 33 3HD1 ILE 33 5.004 -2.640 -7.332 258 H GLN 34 HN GLN 34 3.548 1.799 -6.391 259 HA GLN 34 HA GLN 34 4.545 2.155 -9.201 260 1HB GLN 34 2HB GLN 34 4.142 4.159 -6.957 261 2HB GLN 34 1HB GLN 34 4.758 4.546 -8.563 262 1HG GLN 34 2HG GLN 34 2.656 3.752 -9.570 263 2HG GLN 34 1HG GLN 34 2.041 3.331 -7.972 264 1HE2 GLN 34 1HE2 GLN 34 0.564 5.178 -9.445 265 2HE2 GLN 34 2HE2 GLN 34 0.749 6.733 -8.788 266 H GLY 35 HN GLY 35 6.799 3.036 -9.299 267 1HA GLY 35 1HA GLY 35 8.984 2.021 -8.702 268 2HA GLY 35 2HA GLY 35 8.440 1.998 -7.025 269 HA PRO 36 HA PRO 36 10.307 5.877 -6.248 270 1HB PRO 36 2HB PRO 36 13.018 5.182 -6.910 271 2HB PRO 36 1HB PRO 36 12.273 5.257 -5.311 272 1HG PRO 36 2HG PRO 36 13.058 2.920 -6.785 273 2HG PRO 36 1HG PRO 36 12.309 2.995 -5.188 274 1HD PRO 36 2HD PRO 36 11.112 2.132 -7.671 275 2HD PRO 36 1HD PRO 36 10.359 2.201 -6.061 276 H ASP 37 HN ASP 37 10.921 4.373 -9.333 277 HA ASP 37 HA ASP 37 12.053 6.802 -10.554 278 1HB ASP 37 2HB ASP 37 11.145 4.123 -11.653 279 2HB ASP 37 1HB ASP 37 12.019 5.343 -12.579 280 H GLY 38 HN GLY 38 8.933 5.502 -9.957 281 1HA GLY 38 1HA GLY 38 7.769 7.625 -11.686 282 2HA GLY 38 2HA GLY 38 6.964 6.879 -10.310 283 H LYS 39 HN LYS 39 8.515 4.468 -12.009 284 HA LYS 39 HA LYS 39 6.456 4.060 -14.076 285 1HB LYS 39 2HB LYS 39 8.929 2.596 -13.128 286 2HB LYS 39 1HB LYS 39 7.898 1.967 -14.413 287 1HG LYS 39 2HG LYS 39 8.197 4.157 -15.621 288 2HG LYS 39 1HG LYS 39 9.376 4.614 -14.392 289 1HD LYS 39 2HD LYS 39 10.513 2.341 -14.977 290 2HD LYS 39 1HD LYS 39 9.552 2.424 -16.454 291 1HE LYS 39 2HE LYS 39 10.518 4.684 -16.919 292 2HE LYS 39 1HE LYS 39 11.545 4.507 -15.483 293 1HZ LYS 39 2HZ LYS 39 11.483 2.246 -17.317 294 2HZ LYS 39 1HZ LYS 39 12.262 3.639 -17.900 295 3HZ LYS 39 3HZ LYS 39 12.792 2.911 -16.462 296 H VAL 40 HN VAL 40 4.879 2.422 -14.015 297 HA VAL 40 HA VAL 40 4.246 1.342 -11.324 298 HB VAL 40 HB VAL 40 2.770 1.333 -13.978 299 1HG1 VAL 40 2HG1 VAL 40 2.046 0.437 -11.193 300 2HG1 VAL 40 1HG1 VAL 40 0.799 0.973 -12.317 301 3HG1 VAL 40 3HG1 VAL 40 1.812 -0.413 -12.721 302 1HG2 VAL 40 2HG2 VAL 40 3.305 3.566 -12.760 303 2HG2 VAL 40 1HG2 VAL 40 1.634 3.259 -13.231 304 3HG2 VAL 40 3HG2 VAL 40 2.136 3.015 -11.559 305 H HIS 41 HN HIS 41 4.189 -0.890 -10.893 306 HA HIS 41 HA HIS 41 5.149 -2.696 -13.092 307 1HB HIS 41 2HB HIS 41 5.800 -2.839 -10.133 308 2HB HIS 41 1HB HIS 41 6.539 -3.781 -11.427 309 HD1 HIS 41 HD1 HIS 41 8.262 -2.586 -12.951 310 HD2 HIS 41 HD2 HIS 41 6.691 -0.131 -9.971 311 HE1 HIS 41 HE1 HIS 41 9.699 -0.500 -12.910 312 H GLY 42 HN GLY 42 4.623 -5.059 -12.542 313 1HA GLY 42 1HA GLY 42 3.077 -6.725 -11.942 314 2HA GLY 42 2HA GLY 42 1.867 -5.487 -12.281 315 H ASN 43 HN ASN 43 4.166 -6.446 -9.708 316 HA ASN 43 HA ASN 43 2.284 -5.300 -7.692 317 1HB ASN 43 2HB ASN 43 2.602 -7.500 -6.435 318 2HB ASN 43 1HB ASN 43 1.615 -7.589 -7.893 319 1HD2 ASN 43 1HD2 ASN 43 2.662 -9.983 -7.210 320 2HD2 ASN 43 2HD2 ASN 43 4.003 -10.389 -8.167 321 H THR 44 HN THR 44 3.564 -6.203 -5.428 322 HA THR 44 HA THR 44 5.734 -4.402 -5.112 323 HB THR 44 HB THR 44 4.967 -6.910 -3.591 324 HG1 THR 44 1HG THR 44 3.727 -5.532 -2.405 325 1HG2 THR 44 2HG2 THR 44 6.897 -4.678 -3.032 326 2HG2 THR 44 1HG2 THR 44 6.062 -5.471 -1.697 327 3HG2 THR 44 3HG2 THR 44 7.096 -6.411 -2.773 328 H CYS 45 HN CYS 45 5.864 -7.974 -5.390 329 HA CYS 45 HA CYS 45 8.631 -8.326 -5.304 330 1HB CYS 45 2HB CYS 45 8.213 -10.400 -6.405 331 2HB CYS 45 1HB CYS 45 6.736 -10.032 -5.515 332 H SER 46 HN SER 46 6.665 -7.302 -8.105 333 HA SER 46 HA SER 46 8.787 -7.300 -10.038 334 1HB SER 46 2HB SER 46 6.313 -7.114 -10.460 335 2HB SER 46 1HB SER 46 6.362 -5.479 -9.799 336 HG SER 46 HG SER 46 8.174 -6.157 -11.810 337 H MET 47 HN MET 47 7.502 -4.748 -7.895 338 HA MET 47 HA MET 47 9.429 -2.738 -8.652 339 1HB MET 47 2HB MET 47 7.196 -3.130 -6.880 340 2HB MET 47 1HB MET 47 8.516 -2.403 -5.968 341 1HG MET 47 2HG MET 47 7.384 -1.387 -8.588 342 2HG MET 47 1HG MET 47 7.134 -0.653 -7.003 343 1HE MET 47 3HE MET 47 9.839 -1.133 -5.610 344 2HE MET 47 2HE MET 47 10.696 0.373 -5.924 345 3HE MET 47 1HE MET 47 8.975 0.410 -5.546 346 H CYS 48 HN CYS 48 9.540 -5.563 -6.703 347 HA CYS 48 HA CYS 48 11.883 -4.700 -5.120 348 1HB CYS 48 2HB CYS 48 10.054 -7.091 -5.283 349 2HB CYS 48 1HB CYS 48 11.557 -7.199 -4.369 350 H GLU 49 HN GLU 49 11.095 -6.743 -7.899 351 HA GLU 49 HA GLU 49 13.625 -8.113 -8.062 352 1HB GLU 49 2HB GLU 49 12.662 -9.029 -9.956 353 2HB GLU 49 1HB GLU 49 11.206 -8.362 -9.223 354 1HG GLU 49 2HG GLU 49 11.292 -6.414 -10.637 355 2HG GLU 49 1HG GLU 49 12.893 -6.848 -11.236 356 H VAL 50 HN VAL 50 12.374 -5.189 -9.711 357 HA VAL 50 HA VAL 50 14.733 -4.573 -11.190 358 HB VAL 50 HB VAL 50 13.690 -2.426 -11.454 359 1HG1 VAL 50 1HG1 VAL 50 12.332 -4.723 -11.921 360 2HG1 VAL 50 3HG1 VAL 50 11.204 -3.922 -10.827 361 3HG1 VAL 50 2HG1 VAL 50 11.693 -3.129 -12.324 362 1HG2 VAL 50 1HG2 VAL 50 12.217 -3.056 -8.877 363 2HG2 VAL 50 3HG2 VAL 50 13.490 -1.853 -9.080 364 3HG2 VAL 50 2HG2 VAL 50 11.933 -1.634 -9.880 365 H PHE 51 HN PHE 51 13.694 -3.665 -7.909 366 HA PHE 51 HA PHE 51 15.961 -2.023 -7.259 367 1HB PHE 51 2HB PHE 51 14.002 -1.877 -5.916 368 2HB PHE 51 1HB PHE 51 13.907 -3.627 -5.728 369 HD1 PHE 51 HD1 PHE 51 16.500 -0.961 -5.167 370 HD2 PHE 51 HD2 PHE 51 14.451 -4.400 -3.609 371 HE1 PHE 51 HE1 PHE 51 17.830 -0.808 -3.080 372 HE2 PHE 51 HE2 PHE 51 15.781 -4.246 -1.521 373 HZ PHE 51 HZ PHE 51 17.471 -2.451 -1.257 374 H PHE 52 HN PHE 52 15.276 -5.481 -6.948 375 HA PHE 52 HA PHE 52 17.671 -6.212 -5.528 376 1HB PHE 52 2HB PHE 52 15.481 -7.490 -7.095 377 2HB PHE 52 1HB PHE 52 16.948 -8.442 -6.885 378 HD1 PHE 52 HD1 PHE 52 17.852 -7.504 -4.205 379 HD2 PHE 52 HD2 PHE 52 13.932 -8.513 -5.641 380 HE1 PHE 52 HE1 PHE 52 17.151 -8.067 -1.895 381 HE2 PHE 52 HE2 PHE 52 13.230 -9.076 -3.331 382 HZ PHE 52 HZ PHE 52 14.840 -8.854 -1.459 383 H GLN 53 HN GLN 53 16.828 -5.968 -8.969 384 HA GLN 53 HA GLN 53 19.226 -7.097 -10.051 385 1HB GLN 53 2HB GLN 53 16.903 -6.413 -11.065 386 2HB GLN 53 1HB GLN 53 17.669 -4.843 -11.305 387 1HG GLN 53 2HG GLN 53 19.598 -6.191 -12.401 388 2HG GLN 53 1HG GLN 53 18.429 -7.509 -12.494 389 1HE2 GLN 53 1HE2 GLN 53 16.218 -5.343 -12.774 390 2HE2 GLN 53 2HE2 GLN 53 16.310 -4.890 -14.408 391 H ALA 54 HN ALA 54 18.314 -3.730 -9.292 392 HA ALA 54 HA ALA 54 20.715 -2.473 -10.183 393 1HB ALA 54 2HB ALA 54 19.062 -1.599 -7.811 394 2HB ALA 54 1HB ALA 54 19.823 -0.596 -9.046 395 3HB ALA 54 3HB ALA 54 18.397 -1.554 -9.444 396 H GLU 55 HN GLU 55 19.817 -3.846 -7.008 397 HA GLU 55 HA GLU 55 21.952 -3.048 -5.411 398 1HB GLU 55 2HB GLU 55 20.427 -5.639 -5.697 399 2HB GLU 55 1HB GLU 55 21.629 -5.424 -4.424 400 1HG GLU 55 2HG GLU 55 20.411 -3.354 -3.703 401 2HG GLU 55 1HG GLU 55 19.161 -3.724 -4.891 402 H GLU 56 HN GLU 56 21.962 -5.439 -8.007 403 HA GLU 56 HA GLU 56 24.509 -6.636 -7.473 404 1HB GLU 56 2HB GLU 56 22.731 -7.467 -9.018 405 2HB GLU 56 1HB GLU 56 23.085 -6.125 -10.107 406 1HG GLU 56 2HG GLU 56 25.436 -6.934 -10.286 407 2HG GLU 56 1HG GLU 56 25.011 -8.317 -9.277 408 H GLU 57 HN GLU 57 23.601 -3.556 -8.844 409 HA GLU 57 HA GLU 57 26.113 -3.029 -10.215 410 1HB GLU 57 2HB GLU 57 23.980 -1.137 -9.173 411 2HB GLU 57 1HB GLU 57 25.137 -0.806 -10.461 412 1HG GLU 57 2HG GLU 57 24.150 -2.584 -11.835 413 2HG GLU 57 1HG GLU 57 23.027 -2.985 -10.536 414 H GLU 58 HN GLU 58 24.698 -1.931 -7.111 415 HA GLU 58 HA GLU 58 26.774 -0.278 -6.195 416 1HB GLU 58 2HB GLU 58 25.035 -2.257 -4.685 417 2HB GLU 58 1HB GLU 58 25.894 -0.904 -3.950 418 1HG GLU 58 2HG GLU 58 24.166 -0.255 -6.281 419 2HG GLU 58 1HG GLU 58 23.334 -0.722 -4.798 420 H LYS 59 HN LYS 59 26.764 -3.734 -6.608 421 HA LYS 59 HA LYS 59 28.936 -4.316 -4.755 422 1HB LYS 59 2HB LYS 59 27.689 -5.777 -7.106 423 2HB LYS 59 1HB LYS 59 28.878 -6.500 -6.022 424 1HG LYS 59 2HG LYS 59 27.373 -6.059 -4.101 425 2HG LYS 59 1HG LYS 59 26.178 -5.380 -5.207 426 1HD LYS 59 2HD LYS 59 26.272 -7.615 -6.451 427 2HD LYS 59 1HD LYS 59 27.164 -8.237 -5.062 428 1HE LYS 59 2HE LYS 59 25.298 -7.701 -3.571 429 2HE LYS 59 1HE LYS 59 24.414 -6.945 -4.910 430 1HZ LYS 59 3HZ LYS 59 25.458 -9.666 -5.270 431 2HZ LYS 59 2HZ LYS 59 24.062 -9.470 -4.321 432 3HZ LYS 59 1HZ LYS 59 24.073 -8.950 -5.938 433 H LYS 60 HN LYS 60 28.816 -2.764 -7.765 434 HA LYS 60 HA LYS 60 31.069 -3.706 -9.176 435 1HB LYS 60 2HB LYS 60 31.067 -1.417 -10.126 436 2HB LYS 60 1HB LYS 60 29.423 -2.039 -9.965 437 1HG LYS 60 2HG LYS 60 29.321 -0.862 -7.714 438 2HG LYS 60 1HG LYS 60 30.838 -0.073 -8.148 439 1HD LYS 60 2HD LYS 60 29.641 0.635 -10.318 440 2HD LYS 60 1HD LYS 60 28.148 0.169 -9.503 441 1HE LYS 60 2HE LYS 60 28.205 2.349 -8.759 442 2HE LYS 60 1HE LYS 60 29.340 1.696 -7.563 443 1HZ LYS 60 1HZ LYS 60 31.127 2.073 -9.232 444 2HZ LYS 60 3HZ LYS 60 30.001 2.878 -10.212 445 3HZ LYS 60 2HZ LYS 60 30.403 3.510 -8.687 446 H LYS 61 HN LYS 61 30.892 -1.630 -6.320 447 HA LYS 61 HA LYS 61 33.578 -0.648 -6.333 448 1HB LYS 61 2HB LYS 61 31.696 -1.306 -4.043 449 2HB LYS 61 1HB LYS 61 33.090 -0.231 -3.942 450 1HG LYS 61 2HG LYS 61 32.065 1.204 -5.707 451 2HG LYS 61 1HG LYS 61 30.645 0.158 -5.696 452 1HD LYS 61 2HD LYS 61 30.272 0.672 -3.316 453 2HD LYS 61 1HD LYS 61 31.708 1.697 -3.306 454 1HE LYS 61 2HE LYS 61 30.412 2.819 -5.392 455 2HE LYS 61 1HE LYS 61 29.015 2.228 -4.471 456 1HZ LYS 61 3HZ LYS 61 30.421 3.157 -2.480 457 2HZ LYS 61 2HZ LYS 61 31.094 4.149 -3.684 458 3HZ LYS 61 1HZ LYS 61 29.422 4.189 -3.382 459 H LYS 62 HN LYS 62 35.378 -1.405 -4.970 460 HA LYS 62 HA LYS 62 35.913 -4.216 -5.208 461 1HB LYS 62 2HB LYS 62 37.176 -2.040 -3.507 462 2HB LYS 62 1HB LYS 62 37.920 -3.595 -3.878 463 1HG LYS 62 2HG LYS 62 37.836 -3.060 -6.288 464 2HG LYS 62 1HG LYS 62 37.093 -1.504 -5.916 465 1HD LYS 62 2HD LYS 62 39.097 -0.901 -4.569 466 2HD LYS 62 1HD LYS 62 39.843 -2.430 -5.030 467 1HE LYS 62 2HE LYS 62 40.666 -0.684 -6.531 468 2HE LYS 62 1HE LYS 62 39.570 -1.731 -7.454 469 1HZ LYS 62 2HZ LYS 62 38.582 0.636 -5.973 470 2HZ LYS 62 1HZ LYS 62 39.165 0.779 -7.564 471 3HZ LYS 62 3HZ LYS 62 37.826 -0.209 -7.237 472 H GLU 63 HN GLU 63 34.120 -2.434 -2.885 473 HA GLU 63 HA GLU 63 34.571 -4.344 -0.676 474 1HB GLU 63 2HB GLU 63 32.816 -1.904 -1.087 475 2HB GLU 63 1HB GLU 63 32.895 -2.803 0.428 476 1HG GLU 63 2HG GLU 63 35.220 -1.437 -0.964 477 2HG GLU 63 1HG GLU 63 34.426 -0.889 0.513 478 H GLY 64 HN GLY 64 33.246 -6.090 -0.294 479 1HA GLY 64 1HA GLY 64 31.620 -7.715 -0.881 480 2HA GLY 64 2HA GLY 64 31.057 -6.643 -2.165 481 H GLU 65 HN GLU 65 28.957 -7.574 -1.045 482 HA GLU 65 HA GLU 65 27.718 -5.393 0.391 483 1HB GLU 65 2HB GLU 65 26.598 -6.947 -1.197 484 2HB GLU 65 1HB GLU 65 26.844 -8.267 -0.053 485 1HG GLU 65 2HG GLU 65 25.561 -6.905 1.650 486 2HG GLU 65 1HG GLU 65 25.169 -5.775 0.354 487 H SER 66 HN SER 66 29.521 -8.174 1.390 488 HA SER 66 HA SER 66 29.031 -7.470 4.234 489 1HB SER 66 2HB SER 66 27.323 -9.149 3.521 490 2HB SER 66 1HB SER 66 28.628 -10.245 3.071 491 HG SER 66 HG SER 66 28.342 -9.124 5.653 492 H ARG 67 HN ARG 67 30.817 -8.002 5.546 493 HA ARG 67 HA ARG 67 33.145 -9.266 4.135 494 1HB ARG 67 2HB ARG 67 33.002 -7.063 6.217 495 2HB ARG 67 1HB ARG 67 34.502 -7.739 5.582 496 1HG ARG 67 2HG ARG 67 33.794 -7.071 3.288 497 2HG ARG 67 1HG ARG 67 32.349 -6.327 3.974 498 1HD ARG 67 2HD ARG 67 35.212 -5.551 4.655 499 2HD ARG 67 1HD ARG 67 34.105 -4.620 3.628 500 HE ARG 67 HE ARG 67 34.075 -4.547 6.468 501 1HH1 ARG 67 1HH1 ARG 67 32.389 -3.055 4.263 502 2HH1 ARG 67 2HH1 ARG 67 30.797 -3.357 4.876 503 1HH2 ARG 67 1HH2 ARG 67 31.829 -5.826 7.082 504 2HH2 ARG 67 2HH2 ARG 67 30.480 -4.926 6.472 505 H ASN 68 HN ASN 68 34.437 -10.702 5.405 506 HA ASN 68 HA ASN 68 33.334 -11.419 8.099 507 1HB ASN 68 2HB ASN 68 32.610 -12.889 6.142 508 2HB ASN 68 1HB ASN 68 34.301 -13.367 5.990 509 1HD2 ASN 68 1HD2 ASN 68 34.693 -15.306 7.060 510 2HD2 ASN 68 2HD2 ASN 68 33.940 -15.801 8.498 No H/Q in entry = 510 Start of MODEL 20 1 H1 GLU 1 1H GLU 1 4.492 12.051 6.822 2 H2 GLU 1 3H GLU 1 5.392 10.731 7.392 3 H3 GLU 1 2H GLU 1 5.464 12.221 8.206 4 HA GLU 1 HA GLU 1 6.634 13.251 6.415 5 1HB GLU 1 2HB GLU 1 7.643 10.464 7.076 6 2HB GLU 1 1HB GLU 1 8.642 11.796 6.498 7 1HG GLU 1 2HG GLU 1 7.967 13.127 8.492 8 2HG GLU 1 1HG GLU 1 7.051 11.739 9.082 9 H SER 2 HN SER 2 6.828 13.411 4.202 10 HA SER 2 HA SER 2 5.355 11.836 2.389 11 1HB SER 2 2HB SER 2 7.949 13.299 1.832 12 2HB SER 2 1HB SER 2 6.608 13.045 0.716 13 HG SER 2 HG SER 2 5.423 14.505 1.760 14 H GLY 3 HN GLY 3 8.794 11.582 3.278 15 1HA GLY 3 1HA GLY 3 10.187 9.679 3.253 16 2HA GLY 3 2HA GLY 3 9.712 9.642 1.555 17 H LYS 4 HN LYS 4 9.936 7.237 1.899 18 HA LYS 4 HA LYS 4 7.346 6.007 2.230 19 1HB LYS 4 2HB LYS 4 10.178 4.938 2.037 20 2HB LYS 4 1HB LYS 4 8.740 3.923 1.951 21 1HG LYS 4 2HG LYS 4 9.427 6.207 0.077 22 2HG LYS 4 1HG LYS 4 9.501 4.488 -0.312 23 1HD LYS 4 2HD LYS 4 7.045 4.334 0.208 24 2HD LYS 4 1HD LYS 4 7.023 6.089 0.388 25 1HE LYS 4 2HE LYS 4 7.942 4.652 -2.128 26 2HE LYS 4 1HE LYS 4 6.332 5.363 -1.908 27 1HZ LYS 4 2HZ LYS 4 7.810 7.378 -1.083 28 2HZ LYS 4 1HZ LYS 4 8.936 6.681 -2.148 29 3HZ LYS 4 3HZ LYS 4 7.420 7.177 -2.725 30 H ALA 5 HN ALA 5 7.124 4.051 3.782 31 HA ALA 5 HA ALA 5 7.474 4.980 6.512 32 1HB ALA 5 2HB ALA 5 6.778 2.166 5.710 33 2HB ALA 5 3HB ALA 5 5.663 3.480 5.330 34 3HB ALA 5 1HB ALA 5 6.097 3.148 7.007 35 H THR 6 HN THR 6 9.496 3.284 4.337 36 HA THR 6 HA THR 6 11.534 2.874 6.389 37 HB THR 6 HB THR 6 10.042 0.988 6.840 38 HG1 THR 6 1HG THR 6 11.575 -0.723 6.149 39 1HG2 THR 6 2HG2 THR 6 9.831 1.006 3.957 40 2HG2 THR 6 1HG2 THR 6 10.283 -0.601 4.527 41 3HG2 THR 6 3HG2 THR 6 8.819 0.172 5.137 42 H SER 7 HN SER 7 13.167 1.085 5.171 43 HA SER 7 HA SER 7 13.896 2.468 2.653 44 1HB SER 7 2HB SER 7 16.006 1.180 3.029 45 2HB SER 7 1HB SER 7 15.554 2.151 4.427 46 HG SER 7 HG SER 7 15.863 0.255 5.346 47 H TYR 8 HN TYR 8 14.262 1.257 0.690 48 HA TYR 8 HA TYR 8 12.381 -0.833 0.136 49 1HB TYR 8 2HB TYR 8 14.892 0.119 -1.276 50 2HB TYR 8 1HB TYR 8 13.684 -0.937 -2.006 51 HD1 TYR 8 HD1 TYR 8 11.189 0.212 -0.854 52 HD2 TYR 8 HD2 TYR 8 14.656 2.143 -2.499 53 HE1 TYR 8 HE1 TYR 8 9.811 2.189 -1.433 54 HE2 TYR 8 HE2 TYR 8 13.277 4.122 -3.078 55 HH TYR 8 HH TYR 8 10.474 4.332 -3.552 56 H ALA 9 HN ALA 9 15.950 -0.954 0.516 57 HA ALA 9 HA ALA 9 16.441 -3.661 0.154 58 1HB ALA 9 3HB ALA 9 17.766 -1.463 1.152 59 2HB ALA 9 2HB ALA 9 17.676 -2.504 2.572 60 3HB ALA 9 1HB ALA 9 18.442 -3.090 1.096 61 H GLU 10 HN GLU 10 14.757 -2.120 2.827 62 HA GLU 10 HA GLU 10 14.672 -4.627 4.407 63 1HB GLU 10 2HB GLU 10 13.584 -1.818 4.782 64 2HB GLU 10 1HB GLU 10 13.415 -3.104 5.978 65 1HG GLU 10 2HG GLU 10 15.954 -3.337 5.892 66 2HG GLU 10 1HG GLU 10 15.969 -1.832 4.973 67 H LEU 11 HN LEU 11 12.432 -2.418 2.719 68 HA LEU 11 HA LEU 11 10.012 -3.826 3.240 69 1HB LEU 11 2HB LEU 11 10.633 -1.498 2.138 70 2HB LEU 11 1HB LEU 11 10.555 -2.428 0.641 71 HG LEU 11 HG LEU 11 8.274 -3.289 1.716 72 1HD1 LEU 11 3HD1 LEU 11 8.970 -1.666 3.727 73 2HD1 LEU 11 2HD1 LEU 11 8.165 -0.473 2.707 74 3HD1 LEU 11 1HD1 LEU 11 7.282 -1.895 3.267 75 1HD2 LEU 11 2HD2 LEU 11 8.998 -1.508 -0.281 76 2HD2 LEU 11 1HD2 LEU 11 7.362 -2.099 0.017 77 3HD2 LEU 11 3HD2 LEU 11 7.885 -0.563 0.709 78 H CYS 12 HN CYS 12 11.742 -3.783 0.122 79 HA CYS 12 HA CYS 12 10.493 -6.112 -0.945 80 1HB CYS 12 2HB CYS 12 12.966 -4.494 -1.454 81 2HB CYS 12 1HB CYS 12 12.771 -6.023 -2.312 82 H ASN 13 HN ASN 13 12.882 -5.760 1.489 83 HA ASN 13 HA ASN 13 14.614 -7.893 1.346 84 1HB ASN 13 2HB ASN 13 14.140 -6.167 3.194 85 2HB ASN 13 1HB ASN 13 12.939 -7.305 3.793 86 1HD2 ASN 13 1HD2 ASN 13 14.489 -7.352 5.748 87 2HD2 ASN 13 2HD2 ASN 13 15.799 -8.429 5.684 88 H GLU 14 HN GLU 14 11.233 -8.099 2.501 89 HA GLU 14 HA GLU 14 11.053 -10.812 3.123 90 1HB GLU 14 2HB GLU 14 9.259 -8.691 2.064 91 2HB GLU 14 1HB GLU 14 8.665 -10.345 1.914 92 1HG GLU 14 2HG GLU 14 9.052 -10.705 4.325 93 2HG GLU 14 1HG GLU 14 9.646 -9.051 4.477 94 H TYR 15 HN TYR 15 11.472 -9.354 -0.025 95 HA TYR 15 HA TYR 15 10.771 -11.846 -1.460 96 1HB TYR 15 2HB TYR 15 11.721 -9.080 -2.258 97 2HB TYR 15 1HB TYR 15 11.415 -10.365 -3.427 98 HD1 TYR 15 HD1 TYR 15 9.109 -11.388 -3.568 99 HD2 TYR 15 HD2 TYR 15 9.935 -7.849 -1.281 100 HE1 TYR 15 HE1 TYR 15 6.689 -10.853 -3.524 101 HE2 TYR 15 HE2 TYR 15 7.517 -7.311 -1.238 102 HH TYR 15 HH TYR 15 5.458 -8.063 -1.695 103 H ARG 16 HN ARG 16 13.504 -10.417 0.011 104 HA ARG 16 HA ARG 16 15.670 -11.154 -1.642 105 1HB ARG 16 2HB ARG 16 15.316 -10.019 0.787 106 2HB ARG 16 1HB ARG 16 15.861 -11.620 1.290 107 1HG ARG 16 2HG ARG 16 17.910 -11.406 0.093 108 2HG ARG 16 1HG ARG 16 17.324 -10.002 -0.802 109 1HD ARG 16 2HD ARG 16 17.491 -9.933 2.209 110 2HD ARG 16 1HD ARG 16 18.912 -9.561 1.211 111 HE ARG 16 HE ARG 16 16.317 -8.181 0.659 112 1HH1 ARG 16 1HH1 ARG 16 19.224 -7.764 -0.490 113 2HH1 ARG 16 2HH1 ARG 16 19.597 -6.238 0.239 114 1HH2 ARG 16 1HH2 ARG 16 16.967 -6.375 2.495 115 2HH2 ARG 16 2HH2 ARG 16 18.319 -5.451 1.929 116 H LYS 17 HN LYS 17 13.616 -13.105 0.441 117 HA LYS 17 HA LYS 17 15.283 -15.501 0.308 118 1HB LYS 17 2HB LYS 17 12.333 -15.320 0.957 119 2HB LYS 17 1HB LYS 17 13.519 -16.453 1.602 120 1HG LYS 17 2HG LYS 17 14.703 -14.404 2.597 121 2HG LYS 17 1HG LYS 17 13.236 -13.502 2.210 122 1HD LYS 17 2HD LYS 17 12.996 -16.093 3.703 123 2HD LYS 17 1HD LYS 17 13.498 -14.646 4.577 124 1HE LYS 17 2HE LYS 17 11.393 -13.779 4.518 125 2HE LYS 17 1HE LYS 17 11.212 -14.159 2.793 126 1HZ LYS 17 2HZ LYS 17 10.994 -16.533 3.473 127 2HZ LYS 17 1HZ LYS 17 10.929 -16.026 5.093 128 3HZ LYS 17 3HZ LYS 17 9.714 -15.552 4.008 129 H LEU 18 HN LEU 18 13.549 -13.902 -1.997 130 HA LEU 18 HA LEU 18 12.651 -16.398 -3.383 131 1HB LEU 18 2HB LEU 18 11.853 -13.476 -3.606 132 2HB LEU 18 1HB LEU 18 11.202 -14.759 -4.626 133 HG LEU 18 HG LEU 18 10.540 -15.940 -2.445 134 1HD1 LEU 18 2HD1 LEU 18 11.823 -13.560 -1.408 135 2HD1 LEU 18 1HD1 LEU 18 10.159 -13.673 -0.843 136 3HD1 LEU 18 3HD1 LEU 18 11.283 -14.997 -0.546 137 1HD2 LEU 18 3HD2 LEU 18 8.979 -14.691 -3.981 138 2HD2 LEU 18 2HD2 LEU 18 8.467 -14.688 -2.293 139 3HD2 LEU 18 1HD2 LEU 18 9.235 -13.257 -2.985 140 H VAL 19 HN VAL 19 14.578 -13.447 -3.640 141 HA VAL 19 HA VAL 19 15.508 -14.307 -6.356 142 HB VAL 19 HB VAL 19 14.538 -12.117 -6.355 143 1HG1 VAL 19 1HG1 VAL 19 16.199 -11.684 -3.867 144 2HG1 VAL 19 3HG1 VAL 19 15.436 -10.361 -4.750 145 3HG1 VAL 19 2HG1 VAL 19 14.443 -11.622 -4.017 146 1HG2 VAL 19 1HG2 VAL 19 17.262 -12.549 -6.928 147 2HG2 VAL 19 3HG2 VAL 19 16.239 -11.255 -7.555 148 3HG2 VAL 19 2HG2 VAL 19 17.193 -10.996 -6.094 149 H ARG 20 HN ARG 20 17.494 -15.270 -6.344 150 HA ARG 20 HA ARG 20 19.252 -15.085 -4.003 151 1HB ARG 20 2HB ARG 20 19.594 -16.422 -6.705 152 2HB ARG 20 1HB ARG 20 20.535 -16.761 -5.253 153 1HG ARG 20 2HG ARG 20 17.545 -17.164 -5.563 154 2HG ARG 20 1HG ARG 20 18.760 -18.441 -5.540 155 1HD ARG 20 2HD ARG 20 19.445 -17.585 -3.234 156 2HD ARG 20 1HD ARG 20 17.980 -16.585 -3.272 157 HE ARG 20 HE ARG 20 16.980 -19.023 -3.962 158 1HH1 ARG 20 1HH1 ARG 20 17.755 -17.552 -1.115 159 2HH1 ARG 20 2HH1 ARG 20 17.926 -18.998 -0.175 160 1HH2 ARG 20 1HH2 ARG 20 17.810 -21.111 -2.921 161 2HH2 ARG 20 2HH2 ARG 20 17.957 -21.011 -1.199 162 H ASN 21 HN ASN 21 20.188 -14.825 -7.427 163 HA ASN 21 HA ASN 21 21.750 -12.362 -6.720 164 1HB ASN 21 2HB ASN 21 22.507 -14.611 -8.611 165 2HB ASN 21 1HB ASN 21 23.530 -13.257 -8.130 166 1HD2 ASN 21 1HD2 ASN 21 22.231 -16.363 -7.112 167 2HD2 ASN 21 2HD2 ASN 21 23.109 -16.469 -5.665 168 H GLY 22 HN GLY 22 19.396 -11.679 -7.669 169 1HA GLY 22 1HA GLY 22 19.941 -10.879 -10.464 170 2HA GLY 22 2HA GLY 22 18.691 -10.200 -9.423 171 H LYS 23 HN LYS 23 18.003 -13.133 -8.706 172 HA LYS 23 HA LYS 23 16.414 -13.682 -11.193 173 1HB LYS 23 2HB LYS 23 16.669 -16.087 -10.521 174 2HB LYS 23 1HB LYS 23 18.210 -15.305 -10.870 175 1HG LYS 23 2HG LYS 23 18.591 -14.938 -8.474 176 2HG LYS 23 1HG LYS 23 17.023 -15.652 -8.100 177 1HD LYS 23 2HD LYS 23 18.404 -17.494 -7.797 178 2HD LYS 23 1HD LYS 23 17.980 -17.688 -9.497 179 1HE LYS 23 2HE LYS 23 20.100 -16.231 -9.957 180 2HE LYS 23 1HE LYS 23 20.558 -16.673 -8.301 181 1HZ LYS 23 1HZ LYS 23 19.849 -19.027 -9.059 182 2HZ LYS 23 3HZ LYS 23 20.075 -18.425 -10.628 183 3HZ LYS 23 2HZ LYS 23 21.373 -18.443 -9.531 184 H LEU 24 HN LEU 24 14.982 -12.111 -9.730 185 HA LEU 24 HA LEU 24 13.675 -13.362 -7.429 186 1HB LEU 24 2HB LEU 24 14.035 -10.925 -7.657 187 2HB LEU 24 1HB LEU 24 13.035 -10.914 -9.106 188 HG LEU 24 HG LEU 24 11.066 -11.465 -7.875 189 1HD1 LEU 24 3HD1 LEU 24 12.090 -13.215 -6.460 190 2HD1 LEU 24 2HD1 LEU 24 12.884 -11.967 -5.501 191 3HD1 LEU 24 1HD1 LEU 24 11.127 -12.098 -5.496 192 1HD2 LEU 24 3HD2 LEU 24 12.269 -9.130 -7.482 193 2HD2 LEU 24 2HD2 LEU 24 10.811 -9.554 -6.588 194 3HD2 LEU 24 1HD2 LEU 24 12.393 -9.730 -5.829 195 H ALA 25 HN ALA 25 11.929 -14.723 -7.554 196 HA ALA 25 HA ALA 25 10.366 -14.777 -10.118 197 1HB ALA 25 1HB ALA 25 11.212 -16.880 -10.224 198 2HB ALA 25 2HB ALA 25 10.122 -17.265 -8.891 199 3HB ALA 25 3HB ALA 25 11.792 -16.805 -8.560 200 H CYS 26 HN CYS 26 8.255 -14.212 -9.794 201 HA CYS 26 HA CYS 26 6.810 -15.138 -7.396 202 1HB CYS 26 2HB CYS 26 6.209 -12.809 -6.757 203 2HB CYS 26 1HB CYS 26 7.948 -13.079 -6.663 204 H THR 27 HN THR 27 4.444 -14.196 -7.564 205 HA THR 27 HA THR 27 3.574 -14.591 -10.376 206 HB THR 27 HB THR 27 1.307 -14.629 -9.078 207 HG1 THR 27 1HG THR 27 1.844 -15.280 -6.831 208 1HG2 THR 27 3HG2 THR 27 3.554 -16.601 -8.989 209 2HG2 THR 27 2HG2 THR 27 2.096 -16.947 -8.057 210 3HG2 THR 27 1HG2 THR 27 1.994 -16.717 -9.803 211 H ARG 28 HN ARG 28 1.711 -13.162 -11.116 212 HA ARG 28 HA ARG 28 2.444 -10.393 -11.063 213 1HB ARG 28 2HB ARG 28 -0.137 -11.811 -11.806 214 2HB ARG 28 1HB ARG 28 0.269 -10.156 -12.260 215 1HG ARG 28 2HG ARG 28 2.291 -11.002 -13.435 216 2HG ARG 28 1HG ARG 28 1.814 -12.651 -13.030 217 1HD ARG 28 2HD ARG 28 -0.399 -12.168 -14.220 218 2HD ARG 28 1HD ARG 28 0.367 -10.692 -14.836 219 HE ARG 28 HE ARG 28 0.876 -13.306 -15.850 220 1HH1 ARG 28 1HH1 ARG 28 2.229 -10.222 -15.297 221 2HH1 ARG 28 2HH1 ARG 28 3.767 -10.607 -15.993 222 1HH2 ARG 28 1HH2 ARG 28 3.001 -13.951 -16.497 223 2HH2 ARG 28 2HH2 ARG 28 4.204 -12.717 -16.673 224 H GLU 29 HN GLU 29 0.188 -12.299 -9.126 225 HA GLU 29 HA GLU 29 -1.106 -11.710 -7.237 226 1HB GLU 29 2HB GLU 29 1.218 -11.177 -6.520 227 2HB GLU 29 1HB GLU 29 1.015 -9.539 -7.143 228 1HG GLU 29 2HG GLU 29 -0.881 -9.193 -5.587 229 2HG GLU 29 1HG GLU 29 -0.647 -10.821 -4.951 230 H ASN 30 HN ASN 30 -2.471 -9.878 -6.315 231 HA ASN 30 HA ASN 30 -3.329 -8.045 -8.528 232 1HB ASN 30 2HB ASN 30 -5.522 -8.145 -7.328 233 2HB ASN 30 1HB ASN 30 -4.959 -9.738 -7.837 234 1HD2 ASN 30 1HD2 ASN 30 -4.916 -11.302 -6.216 235 2HD2 ASN 30 2HD2 ASN 30 -4.909 -10.977 -4.550 236 H ASP 31 HN ASP 31 -1.237 -6.963 -7.242 237 HA ASP 31 HA ASP 31 -2.482 -4.867 -5.526 238 1HB ASP 31 2HB ASP 31 -0.666 -5.169 -3.880 239 2HB ASP 31 1HB ASP 31 -1.580 -6.664 -4.076 240 HA PRO 32 HA PRO 32 0.424 -3.313 -8.845 241 1HB PRO 32 2HB PRO 32 -1.407 -1.111 -9.109 242 2HB PRO 32 1HB PRO 32 -1.071 -2.391 -10.277 243 1HG PRO 32 2HG PRO 32 -3.439 -2.024 -8.696 244 2HG PRO 32 1HG PRO 32 -3.100 -3.309 -9.858 245 1HD PRO 32 2HD PRO 32 -3.201 -3.502 -6.977 246 2HD PRO 32 1HD PRO 32 -2.872 -4.800 -8.149 247 H ILE 33 HN ILE 33 1.998 -1.794 -8.353 248 HA ILE 33 HA ILE 33 1.414 0.277 -6.290 249 HB ILE 33 HB ILE 33 3.139 -0.454 -4.868 250 1HG1 ILE 33 2HG1 ILE 33 4.917 -0.626 -6.524 251 2HG1 ILE 33 1HG1 ILE 33 4.864 -2.113 -5.577 252 1HG2 ILE 33 1HG2 ILE 33 1.162 -2.111 -5.193 253 2HG2 ILE 33 3HG2 ILE 33 2.350 -3.129 -6.005 254 3HG2 ILE 33 2HG2 ILE 33 2.587 -2.672 -4.319 255 1HD1 ILE 33 2HD1 ILE 33 3.325 -3.025 -7.432 256 2HD1 ILE 33 1HD1 ILE 33 3.869 -1.646 -8.389 257 3HD1 ILE 33 3HD1 ILE 33 5.034 -2.845 -7.828 258 H GLN 34 HN GLN 34 3.915 1.363 -6.048 259 HA GLN 34 HA GLN 34 4.781 1.967 -8.854 260 1HB GLN 34 2HB GLN 34 4.428 3.983 -6.619 261 2HB GLN 34 1HB GLN 34 4.697 4.316 -8.330 262 1HG GLN 34 2HG GLN 34 2.508 3.059 -8.766 263 2HG GLN 34 1HG GLN 34 2.227 3.154 -7.027 264 1HE2 GLN 34 1HE2 GLN 34 3.077 5.703 -6.367 265 2HE2 GLN 34 2HE2 GLN 34 2.194 6.870 -7.228 266 H GLY 35 HN GLY 35 7.007 2.716 -8.997 267 1HA GLY 35 1HA GLY 35 9.188 1.761 -8.254 268 2HA GLY 35 2HA GLY 35 8.636 1.990 -6.594 269 HA PRO 36 HA PRO 36 10.519 5.933 -6.393 270 1HB PRO 36 2HB PRO 36 13.231 5.136 -6.926 271 2HB PRO 36 1HB PRO 36 12.476 5.448 -5.360 272 1HG PRO 36 2HG PRO 36 13.262 2.918 -6.464 273 2HG PRO 36 1HG PRO 36 12.494 3.227 -4.905 274 1HD PRO 36 2HD PRO 36 11.322 2.019 -7.255 275 2HD PRO 36 1HD PRO 36 10.555 2.312 -5.676 276 H ASP 37 HN ASP 37 11.196 3.978 -9.210 277 HA ASP 37 HA ASP 37 12.491 6.009 -10.806 278 1HB ASP 37 2HB ASP 37 10.943 3.488 -11.463 279 2HB ASP 37 1HB ASP 37 11.879 4.401 -12.645 280 H GLY 38 HN GLY 38 9.124 4.931 -10.485 281 1HA GLY 38 1HA GLY 38 8.321 7.310 -12.108 282 2HA GLY 38 2HA GLY 38 7.488 6.882 -10.615 283 H LYS 39 HN LYS 39 8.614 4.313 -12.649 284 HA LYS 39 HA LYS 39 6.147 4.042 -14.200 285 1HB LYS 39 2HB LYS 39 8.364 3.372 -15.035 286 2HB LYS 39 1HB LYS 39 8.522 2.214 -13.715 287 1HG LYS 39 2HG LYS 39 6.404 1.110 -14.563 288 2HG LYS 39 1HG LYS 39 6.513 2.153 -15.981 289 1HD LYS 39 2HD LYS 39 8.878 1.262 -16.304 290 2HD LYS 39 1HD LYS 39 8.502 0.060 -15.069 291 1HE LYS 39 2HE LYS 39 7.694 -1.192 -16.802 292 2HE LYS 39 1HE LYS 39 6.308 -0.084 -16.776 293 1HZ LYS 39 3HZ LYS 39 7.671 1.436 -18.188 294 2HZ LYS 39 2HZ LYS 39 8.817 0.193 -18.350 295 3HZ LYS 39 1HZ LYS 39 7.244 -0.014 -18.958 296 H VAL 40 HN VAL 40 4.675 2.208 -13.977 297 HA VAL 40 HA VAL 40 4.373 1.331 -11.142 298 HB VAL 40 HB VAL 40 2.541 1.374 -13.561 299 1HG1 VAL 40 1HG1 VAL 40 1.986 0.542 -10.696 300 2HG1 VAL 40 3HG1 VAL 40 0.760 0.742 -11.948 301 3HG1 VAL 40 2HG1 VAL 40 1.982 -0.521 -12.103 302 1HG2 VAL 40 3HG2 VAL 40 3.170 3.555 -12.408 303 2HG2 VAL 40 2HG2 VAL 40 1.444 3.195 -12.445 304 3HG2 VAL 40 1HG2 VAL 40 2.369 2.928 -10.968 305 H HIS 41 HN HIS 41 4.206 -0.900 -10.634 306 HA HIS 41 HA HIS 41 5.051 -2.771 -12.823 307 1HB HIS 41 2HB HIS 41 5.492 -2.900 -9.821 308 2HB HIS 41 1HB HIS 41 6.161 -4.012 -11.015 309 HD1 HIS 41 HD1 HIS 41 8.016 -3.077 -12.618 310 HD2 HIS 41 HD2 HIS 41 6.823 -0.411 -9.644 311 HE1 HIS 41 HE1 HIS 41 9.747 -1.227 -12.577 312 H GLY 42 HN GLY 42 4.335 -5.114 -12.276 313 1HA GLY 42 1HA GLY 42 2.556 -6.619 -11.998 314 2HA GLY 42 2HA GLY 42 1.485 -5.223 -12.122 315 H ASN 43 HN ASN 43 3.961 -6.176 -9.713 316 HA ASN 43 HA ASN 43 1.990 -5.541 -7.567 317 1HB ASN 43 2HB ASN 43 2.615 -7.750 -6.510 318 2HB ASN 43 1HB ASN 43 1.710 -7.903 -8.015 319 1HD2 ASN 43 1HD2 ASN 43 3.280 -10.077 -7.256 320 2HD2 ASN 43 2HD2 ASN 43 4.646 -10.189 -8.258 321 H THR 44 HN THR 44 3.452 -6.353 -5.402 322 HA THR 44 HA THR 44 5.434 -4.310 -5.116 323 HB THR 44 HB THR 44 4.831 -6.835 -3.548 324 HG1 THR 44 1HG THR 44 3.095 -5.505 -3.522 325 1HG2 THR 44 3HG2 THR 44 6.720 -4.565 -3.094 326 2HG2 THR 44 2HG2 THR 44 5.852 -5.211 -1.702 327 3HG2 THR 44 1HG2 THR 44 6.887 -6.267 -2.664 328 H CYS 45 HN CYS 45 5.771 -7.852 -5.491 329 HA CYS 45 HA CYS 45 8.574 -8.024 -5.360 330 1HB CYS 45 2HB CYS 45 7.405 -10.033 -5.403 331 2HB CYS 45 1HB CYS 45 6.393 -9.544 -6.763 332 H SER 46 HN SER 46 6.567 -7.516 -8.308 333 HA SER 46 HA SER 46 8.562 -7.312 -10.244 334 1HB SER 46 2HB SER 46 6.111 -5.571 -9.788 335 2HB SER 46 1HB SER 46 6.992 -5.666 -11.313 336 HG SER 46 HG SER 46 6.034 -7.984 -10.038 337 H MET 47 HN MET 47 7.512 -4.791 -7.938 338 HA MET 47 HA MET 47 9.424 -2.802 -8.824 339 1HB MET 47 2HB MET 47 7.223 -2.876 -7.215 340 2HB MET 47 1HB MET 47 8.499 -2.870 -5.998 341 1HG MET 47 2HG MET 47 8.366 -0.899 -8.295 342 2HG MET 47 1HG MET 47 7.713 -0.570 -6.690 343 1HE MET 47 1HE MET 47 8.972 -1.228 -4.640 344 2HE MET 47 3HE MET 47 10.233 -2.401 -5.042 345 3HE MET 47 2HE MET 47 10.665 -0.843 -4.346 346 H CYS 48 HN CYS 48 9.448 -5.492 -6.583 347 HA CYS 48 HA CYS 48 11.952 -4.841 -5.255 348 1HB CYS 48 2HB CYS 48 10.217 -7.302 -5.573 349 2HB CYS 48 1HB CYS 48 11.659 -7.305 -4.573 350 H GLU 49 HN GLU 49 10.989 -6.897 -8.003 351 HA GLU 49 HA GLU 49 13.458 -8.191 -8.521 352 1HB GLU 49 2HB GLU 49 11.354 -7.092 -10.432 353 2HB GLU 49 1HB GLU 49 12.537 -8.337 -10.830 354 1HG GLU 49 2HG GLU 49 11.585 -9.794 -9.082 355 2HG GLU 49 1HG GLU 49 10.406 -8.548 -8.684 356 H VAL 50 HN VAL 50 12.266 -4.990 -9.511 357 HA VAL 50 HA VAL 50 14.542 -4.235 -11.106 358 HB VAL 50 HB VAL 50 12.581 -2.606 -9.454 359 1HG1 VAL 50 3HG1 VAL 50 14.430 -1.878 -11.739 360 2HG1 VAL 50 2HG1 VAL 50 13.104 -0.849 -11.196 361 3HG1 VAL 50 1HG1 VAL 50 14.441 -1.216 -10.103 362 1HG2 VAL 50 2HG2 VAL 50 12.454 -3.952 -12.114 363 2HG2 VAL 50 1HG2 VAL 50 11.193 -3.741 -10.899 364 3HG2 VAL 50 3HG2 VAL 50 11.652 -2.390 -11.938 365 H PHE 51 HN PHE 51 13.610 -3.394 -7.776 366 HA PHE 51 HA PHE 51 15.982 -2.054 -7.001 367 1HB PHE 51 2HB PHE 51 13.988 -1.982 -5.663 368 2HB PHE 51 1HB PHE 51 13.933 -3.740 -5.541 369 HD1 PHE 51 HD1 PHE 51 16.436 -1.009 -4.922 370 HD2 PHE 51 HD2 PHE 51 14.591 -4.618 -3.501 371 HE1 PHE 51 HE1 PHE 51 17.818 -0.905 -2.862 372 HE2 PHE 51 HE2 PHE 51 15.973 -4.515 -1.443 373 HZ PHE 51 HZ PHE 51 17.587 -2.659 -1.124 374 H PHE 52 HN PHE 52 15.138 -5.497 -6.963 375 HA PHE 52 HA PHE 52 17.489 -6.467 -5.638 376 1HB PHE 52 2HB PHE 52 15.313 -7.499 -7.412 377 2HB PHE 52 1HB PHE 52 16.719 -8.531 -7.168 378 HD1 PHE 52 HD1 PHE 52 17.535 -8.016 -4.437 379 HD2 PHE 52 HD2 PHE 52 13.576 -8.303 -6.076 380 HE1 PHE 52 HE1 PHE 52 16.660 -8.666 -2.208 381 HE2 PHE 52 HE2 PHE 52 12.702 -8.951 -3.851 382 HZ PHE 52 HZ PHE 52 14.241 -9.133 -1.915 383 H GLN 53 HN GLN 53 16.757 -5.718 -9.024 384 HA GLN 53 HA GLN 53 19.090 -6.880 -10.214 385 1HB GLN 53 2HB GLN 53 16.886 -5.925 -11.202 386 2HB GLN 53 1HB GLN 53 17.699 -4.363 -11.130 387 1HG GLN 53 2HG GLN 53 19.636 -5.523 -12.381 388 2HG GLN 53 1HG GLN 53 18.478 -6.809 -12.721 389 1HE2 GLN 53 1HE2 GLN 53 16.242 -4.698 -12.763 390 2HE2 GLN 53 2HE2 GLN 53 16.393 -3.963 -14.285 391 H ALA 54 HN ALA 54 18.424 -3.553 -9.089 392 HA ALA 54 HA ALA 54 20.963 -2.424 -9.721 393 1HB ALA 54 2HB ALA 54 18.806 -1.854 -7.679 394 2HB ALA 54 3HB ALA 54 19.120 -1.011 -9.196 395 3HB ALA 54 1HB ALA 54 20.227 -0.821 -7.837 396 H GLU 55 HN GLU 55 19.822 -4.143 -6.814 397 HA GLU 55 HA GLU 55 21.993 -3.661 -5.076 398 1HB GLU 55 2HB GLU 55 20.177 -6.038 -5.548 399 2HB GLU 55 1HB GLU 55 21.305 -5.969 -4.194 400 1HG GLU 55 2HG GLU 55 19.263 -3.804 -4.756 401 2HG GLU 55 1HG GLU 55 18.954 -5.160 -3.671 402 H GLU 56 HN GLU 56 21.848 -5.615 -7.966 403 HA GLU 56 HA GLU 56 24.008 -7.415 -7.482 404 1HB GLU 56 2HB GLU 56 22.350 -7.505 -9.339 405 2HB GLU 56 1HB GLU 56 23.105 -6.083 -10.056 406 1HG GLU 56 2HG GLU 56 25.250 -7.324 -10.215 407 2HG GLU 56 1HG GLU 56 24.457 -8.752 -9.547 408 H GLU 57 HN GLU 57 23.960 -4.035 -8.549 409 HA GLU 57 HA GLU 57 26.736 -3.895 -9.339 410 1HB GLU 57 2HB GLU 57 24.801 -1.768 -8.359 411 2HB GLU 57 1HB GLU 57 26.281 -1.470 -9.271 412 1HG GLU 57 2HG GLU 57 23.980 -3.172 -10.272 413 2HG GLU 57 1HG GLU 57 24.219 -1.478 -10.702 414 H GLU 58 HN GLU 58 25.024 -3.380 -6.274 415 HA GLU 58 HA GLU 58 27.078 -2.135 -4.773 416 1HB GLU 58 2HB GLU 58 24.679 -2.513 -4.140 417 2HB GLU 58 1HB GLU 58 25.059 -4.215 -3.873 418 1HG GLU 58 2HG GLU 58 26.775 -3.529 -2.198 419 2HG GLU 58 1HG GLU 58 26.283 -1.851 -2.419 420 H LYS 59 HN LYS 59 26.604 -5.532 -5.644 421 HA LYS 59 HA LYS 59 28.645 -6.569 -3.849 422 1HB LYS 59 2HB LYS 59 27.392 -7.697 -6.375 423 2HB LYS 59 1HB LYS 59 28.252 -8.627 -5.148 424 1HG LYS 59 2HG LYS 59 26.573 -7.944 -3.464 425 2HG LYS 59 1HG LYS 59 25.709 -7.032 -4.701 426 1HD LYS 59 2HD LYS 59 25.395 -9.126 -5.999 427 2HD LYS 59 1HD LYS 59 26.212 -10.025 -4.720 428 1HE LYS 59 2HE LYS 59 24.467 -9.318 -3.108 429 2HE LYS 59 1HE LYS 59 23.643 -8.426 -4.401 430 1HZ LYS 59 3HZ LYS 59 24.369 -11.293 -4.643 431 2HZ LYS 59 2HZ LYS 59 22.870 -10.793 -4.021 432 3HZ LYS 59 1HZ LYS 59 23.303 -10.404 -5.617 433 H LYS 60 HN LYS 60 28.815 -4.740 -6.687 434 HA LYS 60 HA LYS 60 30.885 -5.839 -8.225 435 1HB LYS 60 2HB LYS 60 31.256 -3.535 -8.918 436 2HB LYS 60 1HB LYS 60 29.531 -3.753 -8.623 437 1HG LYS 60 2HG LYS 60 29.879 -2.848 -6.305 438 2HG LYS 60 1HG LYS 60 31.552 -2.497 -6.743 439 1HD LYS 60 2HD LYS 60 30.562 -1.190 -8.735 440 2HD LYS 60 1HD LYS 60 29.025 -1.288 -7.875 441 1HE LYS 60 2HE LYS 60 31.414 -0.369 -6.321 442 2HE LYS 60 1HE LYS 60 30.687 0.767 -7.475 443 1HZ LYS 60 3HZ LYS 60 29.007 -0.831 -5.639 444 2HZ LYS 60 2HZ LYS 60 29.694 0.633 -5.119 445 3HZ LYS 60 1HZ LYS 60 28.623 0.615 -6.438 446 H LYS 61 HN LYS 61 31.084 -4.173 -5.106 447 HA LYS 61 HA LYS 61 33.974 -3.902 -5.100 448 1HB LYS 61 2HB LYS 61 31.818 -3.859 -2.968 449 2HB LYS 61 1HB LYS 61 33.504 -3.455 -2.650 450 1HG LYS 61 2HG LYS 61 33.345 -1.714 -4.469 451 2HG LYS 61 1HG LYS 61 31.614 -2.043 -4.555 452 1HD LYS 61 2HD LYS 61 31.425 -1.489 -2.131 453 2HD LYS 61 1HD LYS 61 33.137 -1.070 -2.118 454 1HE LYS 61 2HE LYS 61 32.509 0.525 -4.103 455 2HE LYS 61 1HE LYS 61 30.856 0.354 -3.481 456 1HZ LYS 61 1HZ LYS 61 33.010 0.786 -1.545 457 2HZ LYS 61 3HZ LYS 61 32.539 2.120 -2.481 458 3HZ LYS 61 2HZ LYS 61 31.398 1.323 -1.507 459 H LYS 62 HN LYS 62 35.488 -5.223 -3.957 460 HA LYS 62 HA LYS 62 34.954 -8.061 -3.950 461 1HB LYS 62 2HB LYS 62 37.150 -6.927 -4.352 462 2HB LYS 62 1HB LYS 62 37.182 -6.458 -2.653 463 1HG LYS 62 2HG LYS 62 37.053 -8.866 -2.022 464 2HG LYS 62 1HG LYS 62 37.124 -9.293 -3.732 465 1HD LYS 62 2HD LYS 62 39.307 -8.078 -3.891 466 2HD LYS 62 1HD LYS 62 39.247 -7.813 -2.149 467 1HE LYS 62 2HE LYS 62 39.959 -9.931 -1.727 468 2HE LYS 62 1HE LYS 62 38.781 -10.619 -2.861 469 1HZ LYS 62 2HZ LYS 62 40.234 -9.712 -4.676 470 2HZ LYS 62 1HZ LYS 62 41.412 -9.392 -3.494 471 3HZ LYS 62 3HZ LYS 62 40.923 -10.989 -3.791 472 H GLU 63 HN GLU 63 34.405 -9.398 -2.221 473 HA GLU 63 HA GLU 63 33.087 -8.319 0.075 474 1HB GLU 63 2HB GLU 63 34.294 -11.042 -0.512 475 2HB GLU 63 1HB GLU 63 33.167 -10.714 0.805 476 1HG GLU 63 2HG GLU 63 31.502 -9.907 -0.867 477 2HG GLU 63 1HG GLU 63 32.623 -10.344 -2.157 478 H GLY 64 HN GLY 64 33.837 -7.931 2.169 479 1HA GLY 64 1HA GLY 64 35.427 -7.385 3.812 480 2HA GLY 64 2HA GLY 64 36.655 -7.461 2.549 481 H GLU 65 HN GLU 65 34.643 -10.243 2.936 482 HA GLU 65 HA GLU 65 36.119 -11.652 4.953 483 1HB GLU 65 2HB GLU 65 34.446 -12.559 2.588 484 2HB GLU 65 1HB GLU 65 34.955 -13.617 3.904 485 1HG GLU 65 2HG GLU 65 33.804 -12.104 5.518 486 2HG GLU 65 1HG GLU 65 33.232 -11.132 4.162 487 H SER 66 HN SER 66 36.799 -10.959 1.617 488 HA SER 66 HA SER 66 38.732 -13.167 1.309 489 1HB SER 66 2HB SER 66 38.949 -12.244 -0.933 490 2HB SER 66 1HB SER 66 37.237 -12.260 -0.504 491 HG SER 66 HG SER 66 37.217 -10.146 -0.404 492 H ARG 67 HN ARG 67 41.029 -12.687 0.820 493 HA ARG 67 HA ARG 67 41.991 -10.228 2.246 494 1HB ARG 67 2HB ARG 67 43.163 -13.011 1.938 495 2HB ARG 67 1HB ARG 67 43.989 -11.673 2.735 496 1HG ARG 67 2HG ARG 67 42.032 -11.476 4.295 497 2HG ARG 67 1HG ARG 67 41.354 -12.926 3.558 498 1HD ARG 67 2HD ARG 67 43.466 -14.153 4.173 499 2HD ARG 67 1HD ARG 67 43.988 -12.707 5.057 500 HE ARG 67 HE ARG 67 42.097 -14.588 6.048 501 1HH1 ARG 67 1HH1 ARG 67 40.176 -12.432 5.252 502 2HH1 ARG 67 2HH1 ARG 67 40.137 -11.438 6.670 503 1HH2 ARG 67 1HH2 ARG 67 43.040 -12.778 8.012 504 2HH2 ARG 67 2HH2 ARG 67 41.759 -11.633 8.232 505 H ASN 68 HN ASN 68 43.763 -9.099 1.279 506 HA ASN 68 HA ASN 68 44.509 -9.965 -1.492 507 1HB ASN 68 2HB ASN 68 44.199 -7.665 -2.214 508 2HB ASN 68 1HB ASN 68 42.733 -8.176 -1.379 509 1HD2 ASN 68 1HD2 ASN 68 43.630 -5.391 -1.617 510 2HD2 ASN 68 2HD2 ASN 68 43.934 -4.832 -0.044 No H/Q in entry = 510 Start of MODEL 21 1 H1 GLU 1 3H GLU 1 22.939 14.122 5.999 2 H2 GLU 1 2H GLU 1 21.501 15.025 6.047 3 H3 GLU 1 1H GLU 1 22.985 15.768 6.408 4 HA GLU 1 HA GLU 1 23.154 14.765 8.480 5 1HB GLU 1 2HB GLU 1 20.260 15.298 7.746 6 2HB GLU 1 1HB GLU 1 20.822 15.117 9.408 7 1HG GLU 1 2HG GLU 1 22.426 16.985 9.036 8 2HG GLU 1 1HG GLU 1 21.774 17.193 7.411 9 H SER 2 HN SER 2 19.958 13.428 7.950 10 HA SER 2 HA SER 2 21.100 10.672 8.289 11 1HB SER 2 2HB SER 2 19.148 10.223 9.687 12 2HB SER 2 1HB SER 2 19.948 11.679 10.277 13 HG SER 2 HG SER 2 17.723 12.016 10.102 14 H GLY 3 HN GLY 3 19.836 8.958 7.255 15 1HA GLY 3 1HA GLY 3 18.992 8.206 5.151 16 2HA GLY 3 2HA GLY 3 18.575 9.873 4.751 17 H LYS 4 HN LYS 4 16.631 8.136 4.179 18 HA LYS 4 HA LYS 4 14.411 8.966 5.814 19 1HB LYS 4 2HB LYS 4 14.536 8.287 3.336 20 2HB LYS 4 1HB LYS 4 14.514 6.619 3.907 21 1HG LYS 4 2HG LYS 4 12.395 7.097 5.125 22 2HG LYS 4 1HG LYS 4 12.404 8.729 4.456 23 1HD LYS 4 2HD LYS 4 12.327 7.805 2.175 24 2HD LYS 4 1HD LYS 4 12.353 6.167 2.829 25 1HE LYS 4 2HE LYS 4 10.150 6.271 3.520 26 2HE LYS 4 1HE LYS 4 10.234 8.010 3.859 27 1HZ LYS 4 2HZ LYS 4 10.611 7.068 1.098 28 2HZ LYS 4 1HZ LYS 4 9.030 7.139 1.717 29 3HZ LYS 4 3HZ LYS 4 9.979 8.544 1.654 30 H ALA 5 HN ALA 5 13.264 7.798 7.395 31 HA ALA 5 HA ALA 5 14.667 5.913 9.018 32 1HB ALA 5 2HB ALA 5 12.112 7.278 8.877 33 2HB ALA 5 3HB ALA 5 12.980 6.702 10.300 34 3HB ALA 5 1HB ALA 5 11.893 5.618 9.431 35 H THR 6 HN THR 6 12.738 5.499 6.146 36 HA THR 6 HA THR 6 12.686 2.534 6.585 37 HB THR 6 HB THR 6 11.094 3.941 4.475 38 HG1 THR 6 1HG THR 6 10.268 5.188 5.934 39 1HG2 THR 6 1HG2 THR 6 11.171 1.386 5.761 40 2HG2 THR 6 3HG2 THR 6 9.613 2.136 6.106 41 3HG2 THR 6 2HG2 THR 6 10.133 1.912 4.436 42 H SER 7 HN SER 7 13.232 1.199 4.708 43 HA SER 7 HA SER 7 14.555 2.546 2.417 44 1HB SER 7 2HB SER 7 16.367 2.428 3.951 45 2HB SER 7 1HB SER 7 15.880 0.832 4.525 46 HG SER 7 HG SER 7 17.521 1.459 2.517 47 H TYR 8 HN TYR 8 14.209 1.350 0.569 48 HA TYR 8 HA TYR 8 12.468 -0.808 0.351 49 1HB TYR 8 2HB TYR 8 14.926 -0.080 -1.273 50 2HB TYR 8 1HB TYR 8 13.690 -1.209 -1.824 51 HD1 TYR 8 HD1 TYR 8 11.813 0.912 0.078 52 HD2 TYR 8 HD2 TYR 8 14.078 0.975 -3.575 53 HE1 TYR 8 HE1 TYR 8 10.444 2.809 -0.739 54 HE2 TYR 8 HE2 TYR 8 12.706 2.874 -4.388 55 HH TYR 8 HH TYR 8 11.322 4.698 -3.396 56 H ALA 9 HN ALA 9 16.032 -0.989 0.688 57 HA ALA 9 HA ALA 9 16.519 -3.700 0.504 58 1HB ALA 9 3HB ALA 9 18.445 -2.634 1.081 59 2HB ALA 9 1HB ALA 9 17.955 -2.950 2.746 60 3HB ALA 9 2HB ALA 9 17.579 -1.399 1.994 61 H GLU 10 HN GLU 10 15.024 -2.009 3.241 62 HA GLU 10 HA GLU 10 14.730 -4.514 4.782 63 1HB GLU 10 2HB GLU 10 15.288 -2.272 5.772 64 2HB GLU 10 1HB GLU 10 13.693 -1.704 5.279 65 1HG GLU 10 2HG GLU 10 12.722 -3.649 6.603 66 2HG GLU 10 1HG GLU 10 14.341 -3.902 7.258 67 H LEU 11 HN LEU 11 12.833 -2.416 2.706 68 HA LEU 11 HA LEU 11 10.237 -3.523 3.445 69 1HB LEU 11 2HB LEU 11 10.999 -1.241 2.341 70 2HB LEU 11 1HB LEU 11 10.855 -2.158 0.843 71 HG LEU 11 HG LEU 11 8.535 -2.848 2.139 72 1HD1 LEU 11 1HD1 LEU 11 9.519 -0.620 3.543 73 2HD1 LEU 11 3HD1 LEU 11 8.257 0.019 2.490 74 3HD1 LEU 11 2HD1 LEU 11 7.886 -1.280 3.623 75 1HD2 LEU 11 3HD2 LEU 11 9.325 -0.911 0.026 76 2HD2 LEU 11 2HD2 LEU 11 8.201 -2.268 -0.056 77 3HD2 LEU 11 1HD2 LEU 11 7.691 -0.742 0.667 78 H CYS 12 HN CYS 12 12.064 -3.650 0.379 79 HA CYS 12 HA CYS 12 10.597 -5.888 -0.676 80 1HB CYS 12 2HB CYS 12 13.105 -4.371 -1.277 81 2HB CYS 12 1HB CYS 12 12.861 -5.916 -2.091 82 H ASN 13 HN ASN 13 12.930 -5.683 1.781 83 HA ASN 13 HA ASN 13 14.622 -7.856 1.608 84 1HB ASN 13 2HB ASN 13 14.163 -6.173 3.497 85 2HB ASN 13 1HB ASN 13 12.898 -7.275 4.026 86 1HD2 ASN 13 1HD2 ASN 13 15.045 -6.846 5.769 87 2HD2 ASN 13 2HD2 ASN 13 16.032 -8.225 5.822 88 H GLU 14 HN GLU 14 11.216 -7.985 2.696 89 HA GLU 14 HA GLU 14 10.917 -10.704 3.211 90 1HB GLU 14 2HB GLU 14 9.216 -8.523 2.077 91 2HB GLU 14 1HB GLU 14 8.577 -10.165 2.018 92 1HG GLU 14 2HG GLU 14 9.035 -10.379 4.468 93 2HG GLU 14 1HG GLU 14 9.534 -8.688 4.489 94 H TYR 15 HN TYR 15 11.478 -9.159 0.118 95 HA TYR 15 HA TYR 15 10.753 -11.598 -1.397 96 1HB TYR 15 2HB TYR 15 11.759 -8.835 -2.141 97 2HB TYR 15 1HB TYR 15 11.349 -10.081 -3.319 98 HD1 TYR 15 HD1 TYR 15 9.008 -10.917 -3.501 99 HD2 TYR 15 HD2 TYR 15 10.060 -7.632 -0.947 100 HE1 TYR 15 HE1 TYR 15 6.618 -10.286 -3.323 101 HE2 TYR 15 HE2 TYR 15 7.671 -6.994 -0.780 102 HH TYR 15 HH TYR 15 5.340 -8.519 -1.083 103 H ARG 16 HN ARG 16 13.521 -10.271 0.136 104 HA ARG 16 HA ARG 16 15.615 -11.044 -1.639 105 1HB ARG 16 2HB ARG 16 15.255 -10.506 1.270 106 2HB ARG 16 1HB ARG 16 16.725 -11.356 0.796 107 1HG ARG 16 2HG ARG 16 17.277 -9.583 -0.792 108 2HG ARG 16 1HG ARG 16 15.765 -8.752 -0.427 109 1HD ARG 16 2HD ARG 16 16.827 -9.043 2.083 110 2HD ARG 16 1HD ARG 16 18.287 -8.808 1.103 111 HE ARG 16 HE ARG 16 15.971 -6.982 0.665 112 1HH1 ARG 16 1HH1 ARG 16 17.252 -6.134 3.151 113 2HH1 ARG 16 2HH1 ARG 16 18.536 -5.103 2.613 114 1HH2 ARG 16 1HH2 ARG 16 18.469 -6.274 -0.650 115 2HH2 ARG 16 2HH2 ARG 16 19.226 -5.183 0.463 116 H LYS 17 HN LYS 17 13.580 -12.908 0.529 117 HA LYS 17 HA LYS 17 15.245 -15.313 0.460 118 1HB LYS 17 2HB LYS 17 12.294 -15.082 1.107 119 2HB LYS 17 1HB LYS 17 13.460 -16.233 1.761 120 1HG LYS 17 2HG LYS 17 14.695 -14.192 2.715 121 2HG LYS 17 1HG LYS 17 13.239 -13.272 2.334 122 1HD LYS 17 2HD LYS 17 12.910 -15.838 3.829 123 2HD LYS 17 1HD LYS 17 13.556 -14.453 4.709 124 1HE LYS 17 2HE LYS 17 11.597 -13.181 4.388 125 2HE LYS 17 1HE LYS 17 11.076 -14.164 3.007 126 1HZ LYS 17 3HZ LYS 17 10.920 -16.072 4.550 127 2HZ LYS 17 2HZ LYS 17 11.264 -15.033 5.849 128 3HZ LYS 17 1HZ LYS 17 9.837 -14.829 4.947 129 H LEU 18 HN LEU 18 13.500 -13.741 -1.862 130 HA LEU 18 HA LEU 18 12.601 -16.245 -3.225 131 1HB LEU 18 2HB LEU 18 11.839 -13.316 -3.515 132 2HB LEU 18 1HB LEU 18 11.172 -14.617 -4.499 133 HG LEU 18 HG LEU 18 10.471 -15.727 -2.299 134 1HD1 LEU 18 1HD1 LEU 18 11.781 -13.315 -1.315 135 2HD1 LEU 18 3HD1 LEU 18 10.139 -13.475 -0.702 136 3HD1 LEU 18 2HD1 LEU 18 11.308 -14.768 -0.439 137 1HD2 LEU 18 1HD2 LEU 18 8.904 -14.518 -3.814 138 2HD2 LEU 18 3HD2 LEU 18 8.451 -14.348 -2.118 139 3HD2 LEU 18 2HD2 LEU 18 9.260 -13.021 -2.952 140 H VAL 19 HN VAL 19 14.798 -13.557 -3.315 141 HA VAL 19 HA VAL 19 15.412 -13.770 -6.182 142 HB VAL 19 HB VAL 19 16.987 -12.393 -3.990 143 1HG1 VAL 19 3HG1 VAL 19 16.702 -12.144 -6.970 144 2HG1 VAL 19 2HG1 VAL 19 17.161 -10.730 -6.021 145 3HG1 VAL 19 1HG1 VAL 19 18.169 -12.177 -5.991 146 1HG2 VAL 19 1HG2 VAL 19 14.250 -11.969 -4.626 147 2HG2 VAL 19 3HG2 VAL 19 15.285 -10.976 -3.598 148 3HG2 VAL 19 2HG2 VAL 19 15.153 -10.624 -5.323 149 H ARG 20 HN ARG 20 16.696 -15.430 -6.929 150 HA ARG 20 HA ARG 20 18.410 -16.936 -5.054 151 1HB ARG 20 2HB ARG 20 17.639 -17.184 -7.974 152 2HB ARG 20 1HB ARG 20 18.749 -18.304 -7.183 153 1HG ARG 20 2HG ARG 20 16.783 -19.433 -6.781 154 2HG ARG 20 1HG ARG 20 16.757 -18.360 -5.380 155 1HD ARG 20 2HD ARG 20 15.333 -16.763 -6.604 156 2HD ARG 20 1HD ARG 20 15.390 -17.803 -8.041 157 HE ARG 20 HE ARG 20 13.667 -18.235 -5.805 158 1HH1 ARG 20 1HH1 ARG 20 15.544 -20.414 -5.158 159 2HH1 ARG 20 2HH1 ARG 20 14.970 -21.727 -6.132 160 1HH2 ARG 20 1HH2 ARG 20 13.078 -19.702 -8.216 161 2HH2 ARG 20 2HH2 ARG 20 13.574 -21.323 -7.861 162 H ASN 21 HN ASN 21 19.488 -16.550 -8.339 163 HA ASN 21 HA ASN 21 21.853 -14.992 -7.348 164 1HB ASN 21 2HB ASN 21 21.526 -17.111 -9.496 165 2HB ASN 21 1HB ASN 21 23.018 -16.209 -9.234 166 1HD2 ASN 21 1HD2 ASN 21 21.473 -19.072 -8.401 167 2HD2 ASN 21 2HD2 ASN 21 22.299 -19.411 -6.958 168 H GLY 22 HN GLY 22 19.622 -13.536 -8.137 169 1HA GLY 22 1HA GLY 22 20.488 -12.473 -10.794 170 2HA GLY 22 2HA GLY 22 19.781 -11.482 -9.516 171 H LYS 23 HN LYS 23 17.907 -13.896 -9.014 172 HA LYS 23 HA LYS 23 15.934 -13.145 -11.139 173 1HB LYS 23 2HB LYS 23 16.316 -15.945 -10.055 174 2HB LYS 23 1HB LYS 23 15.430 -15.453 -11.498 175 1HG LYS 23 2HG LYS 23 17.565 -14.695 -12.521 176 2HG LYS 23 1HG LYS 23 18.431 -15.260 -11.093 177 1HD LYS 23 2HD LYS 23 17.522 -17.554 -11.509 178 2HD LYS 23 1HD LYS 23 16.792 -16.958 -13.000 179 1HE LYS 23 2HE LYS 23 18.775 -17.082 -14.104 180 2HE LYS 23 1HE LYS 23 19.627 -16.241 -12.796 181 1HZ LYS 23 3HZ LYS 23 19.508 -18.316 -11.498 182 2HZ LYS 23 2HZ LYS 23 18.807 -19.104 -12.830 183 3HZ LYS 23 1HZ LYS 23 20.399 -18.515 -12.927 184 H LEU 24 HN LEU 24 14.105 -12.400 -10.146 185 HA LEU 24 HA LEU 24 13.636 -13.058 -7.283 186 1HB LEU 24 2HB LEU 24 13.543 -10.747 -8.727 187 2HB LEU 24 1HB LEU 24 11.850 -11.234 -8.791 188 HG LEU 24 HG LEU 24 13.542 -10.719 -6.335 189 1HD1 LEU 24 2HD1 LEU 24 10.935 -9.600 -7.403 190 2HD1 LEU 24 1HD1 LEU 24 11.589 -9.223 -5.809 191 3HD1 LEU 24 3HD1 LEU 24 12.471 -8.747 -7.260 192 1HD2 LEU 24 3HD2 LEU 24 12.246 -12.816 -6.046 193 2HD2 LEU 24 2HD2 LEU 24 11.646 -11.523 -5.008 194 3HD2 LEU 24 1HD2 LEU 24 10.776 -11.946 -6.482 195 H ALA 25 HN ALA 25 12.092 -14.547 -6.728 196 HA ALA 25 HA ALA 25 10.223 -15.505 -8.856 197 1HB ALA 25 1HB ALA 25 11.741 -17.141 -7.835 198 2HB ALA 25 3HB ALA 25 11.172 -16.692 -6.228 199 3HB ALA 25 2HB ALA 25 10.081 -17.496 -7.356 200 H CYS 26 HN CYS 26 8.029 -15.180 -8.592 201 HA CYS 26 HA CYS 26 6.898 -14.664 -5.912 202 1HB CYS 26 2HB CYS 26 7.785 -12.590 -7.658 203 2HB CYS 26 1HB CYS 26 6.022 -12.546 -7.643 204 H THR 27 HN THR 27 4.409 -13.914 -6.441 205 HA THR 27 HA THR 27 3.404 -15.939 -8.409 206 HB THR 27 HB THR 27 1.315 -15.660 -6.901 207 HG1 THR 27 1HG THR 27 3.163 -14.740 -5.012 208 1HG2 THR 27 1HG2 THR 27 3.905 -16.761 -5.776 209 2HG2 THR 27 3HG2 THR 27 2.295 -17.147 -5.168 210 3HG2 THR 27 2HG2 THR 27 2.759 -17.629 -6.799 211 H ARG 28 HN ARG 28 0.997 -15.212 -9.070 212 HA ARG 28 HA ARG 28 1.303 -12.635 -10.464 213 1HB ARG 28 2HB ARG 28 -0.855 -14.769 -10.396 214 2HB ARG 28 1HB ARG 28 -0.848 -13.395 -11.502 215 1HG ARG 28 2HG ARG 28 1.324 -14.144 -12.414 216 2HG ARG 28 1HG ARG 28 1.312 -15.520 -11.310 217 1HD ARG 28 2HD ARG 28 0.482 -16.272 -13.481 218 2HD ARG 28 1HD ARG 28 -0.893 -16.222 -12.360 219 HE ARG 28 HE ARG 28 -0.296 -13.824 -14.036 220 1HH1 ARG 28 1HH1 ARG 28 -2.696 -15.001 -12.189 221 2HH1 ARG 28 2HH1 ARG 28 -3.923 -15.047 -13.411 222 1HH2 ARG 28 1HH2 ARG 28 -1.713 -14.503 -16.027 223 2HH2 ARG 28 2HH2 ARG 28 -3.367 -14.765 -15.583 224 H GLU 29 HN GLU 29 1.217 -12.052 -7.775 225 HA GLU 29 HA GLU 29 -1.310 -11.715 -6.539 226 1HB GLU 29 2HB GLU 29 0.901 -11.408 -5.477 227 2HB GLU 29 1HB GLU 29 1.174 -9.970 -6.462 228 1HG GLU 29 2HG GLU 29 -0.905 -8.971 -5.454 229 2HG GLU 29 1HG GLU 29 -0.986 -10.360 -4.370 230 H ASN 30 HN ASN 30 -2.912 -10.137 -6.742 231 HA ASN 30 HA ASN 30 -2.737 -8.369 -9.123 232 1HB ASN 30 2HB ASN 30 -4.991 -9.100 -7.225 233 2HB ASN 30 1HB ASN 30 -5.179 -8.158 -8.704 234 1HD2 ASN 30 1HD2 ASN 30 -5.801 -11.161 -7.655 235 2HD2 ASN 30 2HD2 ASN 30 -5.450 -12.070 -9.044 236 H ASP 31 HN ASP 31 -1.026 -7.384 -7.257 237 HA ASP 31 HA ASP 31 -2.520 -5.056 -6.095 238 1HB ASP 31 2HB ASP 31 -1.617 -7.010 -4.571 239 2HB ASP 31 1HB ASP 31 -0.056 -6.230 -4.830 240 HA PRO 32 HA PRO 32 0.868 -3.739 -9.026 241 1HB PRO 32 2HB PRO 32 -0.877 -1.563 -9.728 242 2HB PRO 32 1HB PRO 32 -0.384 -2.929 -10.731 243 1HG PRO 32 2HG PRO 32 -2.960 -2.442 -9.572 244 2HG PRO 32 1HG PRO 32 -2.457 -3.824 -10.547 245 1HD PRO 32 2HD PRO 32 -2.990 -3.746 -7.703 246 2HD PRO 32 1HD PRO 32 -2.538 -5.150 -8.696 247 H ILE 33 HN ILE 33 2.212 -1.878 -8.749 248 HA ILE 33 HA ILE 33 1.420 0.185 -6.772 249 HB ILE 33 HB ILE 33 3.116 -0.366 -5.215 250 1HG1 ILE 33 2HG1 ILE 33 4.970 -0.653 -6.766 251 2HG1 ILE 33 1HG1 ILE 33 4.880 -2.066 -5.715 252 1HG2 ILE 33 3HG2 ILE 33 1.247 -1.977 -5.171 253 2HG2 ILE 33 2HG2 ILE 33 2.108 -3.005 -6.316 254 3HG2 ILE 33 1HG2 ILE 33 2.761 -2.748 -4.698 255 1HD1 ILE 33 1HD1 ILE 33 3.383 -3.075 -7.591 256 2HD1 ILE 33 3HD1 ILE 33 4.079 -1.811 -8.605 257 3HD1 ILE 33 2HD1 ILE 33 5.125 -3.014 -7.851 258 H GLN 34 HN GLN 34 3.901 1.338 -6.401 259 HA GLN 34 HA GLN 34 4.766 2.016 -9.195 260 1HB GLN 34 2HB GLN 34 4.472 3.765 -6.731 261 2HB GLN 34 1HB GLN 34 5.041 4.321 -8.305 262 1HG GLN 34 2HG GLN 34 2.901 3.718 -9.326 263 2HG GLN 34 1HG GLN 34 2.332 3.053 -7.795 264 1HE2 GLN 34 1HE2 GLN 34 1.092 5.303 -9.251 265 2HE2 GLN 34 2HE2 GLN 34 1.188 6.654 -8.227 266 H GLY 35 HN GLY 35 7.027 2.456 -9.461 267 1HA GLY 35 1HA GLY 35 9.194 1.449 -8.965 268 2HA GLY 35 2HA GLY 35 8.722 1.361 -7.268 269 HA PRO 36 HA PRO 36 10.941 5.047 -6.447 270 1HB PRO 36 2HB PRO 36 13.489 4.373 -7.598 271 2HB PRO 36 1HB PRO 36 13.004 4.285 -5.903 272 1HG PRO 36 2HG PRO 36 13.464 2.111 -7.721 273 2HG PRO 36 1HG PRO 36 12.975 2.022 -6.028 274 1HD PRO 36 2HD PRO 36 11.376 1.466 -8.368 275 2HD PRO 36 1HD PRO 36 10.885 1.368 -6.661 276 H ASP 37 HN ASP 37 11.204 3.847 -9.739 277 HA ASP 37 HA ASP 37 12.221 6.310 -10.899 278 1HB ASP 37 2HB ASP 37 10.812 3.871 -12.022 279 2HB ASP 37 1HB ASP 37 11.561 5.121 -13.015 280 H GLY 38 HN GLY 38 9.040 5.034 -10.153 281 1HA GLY 38 1HA GLY 38 7.866 7.527 -11.317 282 2HA GLY 38 2HA GLY 38 7.281 6.787 -9.828 283 H LYS 39 HN LYS 39 8.226 4.580 -12.280 284 HA LYS 39 HA LYS 39 5.639 4.436 -13.640 285 1HB LYS 39 2HB LYS 39 7.868 3.925 -14.657 286 2HB LYS 39 1HB LYS 39 8.004 2.533 -13.583 287 1HG LYS 39 2HG LYS 39 5.852 1.662 -14.547 288 2HG LYS 39 1HG LYS 39 5.892 2.987 -15.710 289 1HD LYS 39 2HD LYS 39 8.171 2.186 -16.429 290 2HD LYS 39 1HD LYS 39 7.943 0.778 -15.391 291 1HE LYS 39 2HE LYS 39 5.596 1.131 -17.038 292 2HE LYS 39 1HE LYS 39 7.043 1.087 -18.062 293 1HZ LYS 39 2HZ LYS 39 7.792 -0.859 -16.765 294 2HZ LYS 39 1HZ LYS 39 6.315 -0.853 -15.926 295 3HZ LYS 39 3HZ LYS 39 6.339 -1.158 -17.594 296 H VAL 40 HN VAL 40 4.328 2.411 -13.599 297 HA VAL 40 HA VAL 40 4.196 1.286 -10.836 298 HB VAL 40 HB VAL 40 2.225 1.358 -13.145 299 1HG1 VAL 40 1HG1 VAL 40 2.255 -0.417 -11.045 300 2HG1 VAL 40 3HG1 VAL 40 1.262 0.892 -10.401 301 3HG1 VAL 40 2HG1 VAL 40 0.802 0.094 -11.905 302 1HG2 VAL 40 2HG2 VAL 40 3.000 3.299 -11.158 303 2HG2 VAL 40 1HG2 VAL 40 1.815 3.461 -12.455 304 3HG2 VAL 40 3HG2 VAL 40 1.326 2.814 -10.889 305 H HIS 41 HN HIS 41 4.012 -1.018 -10.566 306 HA HIS 41 HA HIS 41 4.916 -2.614 -12.942 307 1HB HIS 41 2HB HIS 41 5.440 -3.073 -9.988 308 2HB HIS 41 1HB HIS 41 6.163 -3.958 -11.331 309 HD1 HIS 41 HD1 HIS 41 7.826 -2.587 -12.891 310 HD2 HIS 41 HD2 HIS 41 6.677 -0.624 -9.397 311 HE1 HIS 41 HE1 HIS 41 9.436 -0.655 -12.592 312 H GLY 42 HN GLY 42 4.439 -5.115 -12.275 313 1HA GLY 42 1HA GLY 42 2.708 -6.701 -12.169 314 2HA GLY 42 2HA GLY 42 1.565 -5.361 -12.251 315 H ASN 43 HN ASN 43 4.057 -6.315 -9.858 316 HA ASN 43 HA ASN 43 2.034 -5.866 -7.709 317 1HB ASN 43 2HB ASN 43 2.790 -8.073 -6.736 318 2HB ASN 43 1HB ASN 43 1.914 -8.221 -8.258 319 1HD2 ASN 43 1HD2 ASN 43 3.620 -10.317 -7.564 320 2HD2 ASN 43 2HD2 ASN 43 5.002 -10.296 -8.549 321 H THR 44 HN THR 44 3.510 -6.642 -5.553 322 HA THR 44 HA THR 44 5.420 -4.507 -5.233 323 HB THR 44 HB THR 44 4.713 -6.996 -3.658 324 HG1 THR 44 1HG THR 44 4.002 -4.277 -3.624 325 1HG2 THR 44 3HG2 THR 44 6.516 -4.683 -2.895 326 2HG2 THR 44 2HG2 THR 44 5.919 -5.903 -1.770 327 3HG2 THR 44 1HG2 THR 44 6.997 -6.370 -3.085 328 H CYS 45 HN CYS 45 5.703 -7.859 -6.249 329 HA CYS 45 HA CYS 45 8.533 -8.150 -5.730 330 1HB CYS 45 2HB CYS 45 6.990 -9.502 -7.950 331 2HB CYS 45 1HB CYS 45 8.325 -10.144 -6.995 332 H SER 46 HN SER 46 6.780 -7.580 -8.821 333 HA SER 46 HA SER 46 8.912 -7.062 -10.527 334 1HB SER 46 2HB SER 46 6.326 -5.485 -10.243 335 2HB SER 46 1HB SER 46 7.311 -5.581 -11.702 336 HG SER 46 HG SER 46 6.980 -8.008 -11.235 337 H MET 47 HN MET 47 7.523 -4.963 -8.046 338 HA MET 47 HA MET 47 9.161 -2.635 -8.610 339 1HB MET 47 2HB MET 47 6.931 -2.940 -7.298 340 2HB MET 47 1HB MET 47 7.957 -3.435 -5.955 341 1HG MET 47 2HG MET 47 9.199 -1.296 -6.141 342 2HG MET 47 1HG MET 47 8.111 -0.792 -7.434 343 1HE MET 47 3HE MET 47 8.758 -1.649 -3.898 344 2HE MET 47 2HE MET 47 7.300 -1.294 -2.975 345 3HE MET 47 1HE MET 47 7.376 -2.751 -3.962 346 H CYS 48 HN CYS 48 9.343 -5.416 -6.451 347 HA CYS 48 HA CYS 48 11.786 -4.616 -5.106 348 1HB CYS 48 2HB CYS 48 10.091 -7.096 -5.376 349 2HB CYS 48 1HB CYS 48 11.616 -7.166 -4.500 350 H GLU 49 HN GLU 49 11.020 -6.455 -8.019 351 HA GLU 49 HA GLU 49 13.542 -7.758 -8.406 352 1HB GLU 49 2HB GLU 49 11.474 -6.660 -10.347 353 2HB GLU 49 1HB GLU 49 12.764 -7.774 -10.795 354 1HG GLU 49 2HG GLU 49 11.890 -9.410 -9.155 355 2HG GLU 49 1HG GLU 49 10.571 -8.310 -8.775 356 H VAL 50 HN VAL 50 12.338 -4.558 -9.447 357 HA VAL 50 HA VAL 50 14.623 -3.703 -10.915 358 HB VAL 50 HB VAL 50 12.731 -2.134 -9.127 359 1HG1 VAL 50 2HG1 VAL 50 14.516 -1.349 -11.444 360 2HG1 VAL 50 1HG1 VAL 50 13.220 -0.321 -10.832 361 3HG1 VAL 50 3HG1 VAL 50 14.579 -0.743 -9.787 362 1HG2 VAL 50 3HG2 VAL 50 12.496 -3.272 -11.896 363 2HG2 VAL 50 2HG2 VAL 50 11.316 -3.279 -10.585 364 3HG2 VAL 50 1HG2 VAL 50 11.632 -1.791 -11.479 365 H PHE 51 HN PHE 51 13.749 -3.216 -7.505 366 HA PHE 51 HA PHE 51 16.137 -1.908 -6.669 367 1HB PHE 51 2HB PHE 51 14.121 -1.964 -5.325 368 2HB PHE 51 1HB PHE 51 14.148 -3.726 -5.279 369 HD1 PHE 51 HD1 PHE 51 16.682 -1.019 -4.692 370 HD2 PHE 51 HD2 PHE 51 14.753 -4.553 -3.198 371 HE1 PHE 51 HE1 PHE 51 18.110 -0.940 -2.663 372 HE2 PHE 51 HE2 PHE 51 16.181 -4.476 -1.168 373 HZ PHE 51 HZ PHE 51 17.859 -2.669 -0.902 374 H PHE 52 HN PHE 52 15.234 -5.346 -6.699 375 HA PHE 52 HA PHE 52 17.666 -6.379 -5.604 376 1HB PHE 52 2HB PHE 52 15.372 -7.365 -7.271 377 2HB PHE 52 1HB PHE 52 16.769 -8.418 -7.064 378 HD1 PHE 52 HD1 PHE 52 17.624 -7.653 -4.302 379 HD2 PHE 52 HD2 PHE 52 13.713 -8.383 -5.926 380 HE1 PHE 52 HE1 PHE 52 16.801 -8.260 -2.049 381 HE2 PHE 52 HE2 PHE 52 12.895 -8.992 -3.672 382 HZ PHE 52 HZ PHE 52 14.433 -8.931 -1.729 383 H GLN 53 HN GLN 53 16.697 -5.489 -8.887 384 HA GLN 53 HA GLN 53 18.888 -6.667 -10.306 385 1HB GLN 53 2HB GLN 53 16.660 -5.601 -11.090 386 2HB GLN 53 1HB GLN 53 17.513 -4.062 -10.983 387 1HG GLN 53 2HG GLN 53 19.349 -5.300 -12.401 388 2HG GLN 53 1HG GLN 53 18.024 -6.387 -12.819 389 1HE2 GLN 53 1HE2 GLN 53 16.243 -5.510 -14.090 390 2HE2 GLN 53 2HE2 GLN 53 16.362 -4.004 -14.866 391 H ALA 54 HN ALA 54 18.428 -3.351 -9.040 392 HA ALA 54 HA ALA 54 20.928 -2.257 -9.776 393 1HB ALA 54 3HB ALA 54 18.890 -1.820 -7.618 394 2HB ALA 54 1HB ALA 54 19.368 -0.746 -8.932 395 3HB ALA 54 2HB ALA 54 20.413 -0.937 -7.524 396 H GLU 55 HN GLU 55 20.028 -4.095 -6.846 397 HA GLU 55 HA GLU 55 22.535 -3.888 -5.492 398 1HB GLU 55 2HB GLU 55 20.317 -5.956 -5.527 399 2HB GLU 55 1HB GLU 55 21.649 -5.994 -4.370 400 1HG GLU 55 2HG GLU 55 19.830 -3.600 -4.756 401 2HG GLU 55 1HG GLU 55 19.572 -4.833 -3.521 402 H GLU 56 HN GLU 56 21.500 -5.849 -8.199 403 HA GLU 56 HA GLU 56 23.351 -7.995 -8.072 404 1HB GLU 56 2HB GLU 56 21.411 -7.695 -9.633 405 2HB GLU 56 1HB GLU 56 22.345 -6.478 -10.502 406 1HG GLU 56 2HG GLU 56 24.117 -8.189 -10.912 407 2HG GLU 56 1HG GLU 56 23.092 -9.395 -10.132 408 H GLU 57 HN GLU 57 23.754 -4.651 -9.171 409 HA GLU 57 HA GLU 57 26.295 -4.935 -10.455 410 1HB GLU 57 2HB GLU 57 25.071 -2.613 -8.927 411 2HB GLU 57 1HB GLU 57 26.377 -2.487 -10.105 412 1HG GLU 57 2HG GLU 57 23.631 -3.614 -10.724 413 2HG GLU 57 1HG GLU 57 24.115 -1.952 -11.060 414 H GLU 58 HN GLU 58 25.429 -4.149 -7.076 415 HA GLU 58 HA GLU 58 27.982 -3.654 -6.011 416 1HB GLU 58 2HB GLU 58 25.815 -3.426 -4.839 417 2HB GLU 58 1HB GLU 58 25.647 -5.182 -4.812 418 1HG GLU 58 2HG GLU 58 26.530 -4.602 -2.675 419 2HG GLU 58 1HG GLU 58 27.903 -5.224 -3.592 420 H LYS 59 HN LYS 59 26.441 -6.749 -6.798 421 HA LYS 59 HA LYS 59 28.485 -8.401 -5.554 422 1HB LYS 59 2HB LYS 59 26.385 -8.920 -7.685 423 2HB LYS 59 1HB LYS 59 27.295 -10.178 -6.850 424 1HG LYS 59 2HG LYS 59 26.403 -9.329 -4.678 425 2HG LYS 59 1HG LYS 59 25.425 -8.162 -5.568 426 1HD LYS 59 2HD LYS 59 24.360 -10.070 -6.795 427 2HD LYS 59 1HD LYS 59 25.260 -11.185 -5.768 428 1HE LYS 59 2HE LYS 59 24.067 -9.398 -3.965 429 2HE LYS 59 1HE LYS 59 22.810 -9.727 -5.172 430 1HZ LYS 59 3HZ LYS 59 24.505 -11.904 -4.115 431 2HZ LYS 59 2HZ LYS 59 23.129 -11.400 -3.256 432 3HZ LYS 59 1HZ LYS 59 22.973 -12.008 -4.835 433 H LYS 60 HN LYS 60 28.401 -6.527 -8.401 434 HA LYS 60 HA LYS 60 29.726 -7.947 -10.383 435 1HB LYS 60 2HB LYS 60 30.574 -5.768 -11.071 436 2HB LYS 60 1HB LYS 60 28.964 -5.550 -10.385 437 1HG LYS 60 2HG LYS 60 30.111 -5.056 -8.165 438 2HG LYS 60 1HG LYS 60 31.629 -4.997 -9.059 439 1HD LYS 60 2HD LYS 60 30.516 -3.283 -10.584 440 2HD LYS 60 1HD LYS 60 29.206 -3.216 -9.404 441 1HE LYS 60 2HE LYS 60 31.209 -2.855 -7.690 442 2HE LYS 60 1HE LYS 60 32.041 -2.270 -9.143 443 1HZ LYS 60 1HZ LYS 60 29.680 -1.142 -9.490 444 2HZ LYS 60 3HZ LYS 60 29.673 -1.206 -7.796 445 3HZ LYS 60 2HZ LYS 60 30.917 -0.381 -8.607 446 H LYS 61 HN LYS 61 31.014 -6.890 -7.290 447 HA LYS 61 HA LYS 61 33.816 -7.170 -7.912 448 1HB LYS 61 2HB LYS 61 32.309 -7.445 -5.290 449 2HB LYS 61 1HB LYS 61 34.028 -7.091 -5.463 450 1HG LYS 61 2HG LYS 61 31.782 -5.353 -6.533 451 2HG LYS 61 1HG LYS 61 32.686 -5.035 -5.052 452 1HD LYS 61 2HD LYS 61 34.793 -5.010 -6.421 453 2HD LYS 61 1HD LYS 61 33.798 -5.146 -7.870 454 1HE LYS 61 2HE LYS 61 33.397 -2.915 -7.835 455 2HE LYS 61 1HE LYS 61 32.786 -3.024 -6.173 456 1HZ LYS 61 1HZ LYS 61 35.678 -3.247 -6.706 457 2HZ LYS 61 3HZ LYS 61 34.961 -1.711 -6.637 458 3HZ LYS 61 2HZ LYS 61 34.887 -2.743 -5.289 459 H LYS 62 HN LYS 62 35.149 -8.990 -7.734 460 HA LYS 62 HA LYS 62 34.118 -11.590 -8.139 461 1HB LYS 62 2HB LYS 62 36.733 -10.634 -6.926 462 2HB LYS 62 1HB LYS 62 36.454 -12.263 -7.543 463 1HG LYS 62 2HG LYS 62 35.904 -11.286 -9.770 464 2HG LYS 62 1HG LYS 62 36.294 -9.687 -9.138 465 1HD LYS 62 2HD LYS 62 38.589 -10.508 -8.592 466 2HD LYS 62 1HD LYS 62 38.185 -12.049 -9.348 467 1HE LYS 62 2HE LYS 62 39.199 -10.915 -11.136 468 2HE LYS 62 1HE LYS 62 37.496 -10.488 -11.392 469 1HZ LYS 62 3HZ LYS 62 37.907 -8.552 -9.883 470 2HZ LYS 62 2HZ LYS 62 39.566 -8.911 -9.954 471 3HZ LYS 62 1HZ LYS 62 38.731 -8.466 -11.364 472 H GLU 63 HN GLU 63 34.604 -9.797 -5.169 473 HA GLU 63 HA GLU 63 34.329 -10.437 -2.899 474 1HB GLU 63 2HB GLU 63 32.175 -11.969 -4.391 475 2HB GLU 63 1HB GLU 63 32.164 -11.676 -2.652 476 1HG GLU 63 2HG GLU 63 32.150 -9.250 -3.044 477 2HG GLU 63 1HG GLU 63 32.217 -9.519 -4.786 478 H GLY 64 HN GLY 64 33.551 -12.789 -1.697 479 1HA GLY 64 1HA GLY 64 34.700 -15.179 -2.749 480 2HA GLY 64 2HA GLY 64 34.360 -14.892 -1.043 481 H GLU 65 HN GLU 65 36.812 -15.744 -2.968 482 HA GLU 65 HA GLU 65 38.868 -15.103 -1.058 483 1HB GLU 65 2HB GLU 65 38.955 -16.021 -3.950 484 2HB GLU 65 1HB GLU 65 40.321 -16.081 -2.837 485 1HG GLU 65 2HG GLU 65 39.046 -17.565 -1.338 486 2HG GLU 65 1HG GLU 65 37.666 -17.494 -2.434 487 H SER 66 HN SER 66 37.632 -13.459 -3.892 488 HA SER 66 HA SER 66 38.370 -11.490 -4.998 489 1HB SER 66 2HB SER 66 37.971 -11.204 -2.208 490 2HB SER 66 1HB SER 66 39.399 -10.246 -2.602 491 HG SER 66 HG SER 66 37.012 -9.459 -2.915 492 H ARG 67 HN ARG 67 40.246 -12.911 -5.881 493 HA ARG 67 HA ARG 67 42.841 -12.991 -4.790 494 1HB ARG 67 2HB ARG 67 41.885 -12.705 -7.657 495 2HB ARG 67 1HB ARG 67 43.508 -13.219 -7.195 496 1HG ARG 67 2HG ARG 67 42.495 -15.110 -5.913 497 2HG ARG 67 1HG ARG 67 40.909 -14.626 -6.513 498 1HD ARG 67 2HD ARG 67 43.272 -15.457 -8.240 499 2HD ARG 67 1HD ARG 67 41.815 -16.422 -7.935 500 HE ARG 67 HE ARG 67 40.763 -14.052 -8.827 501 1HH1 ARG 67 1HH1 ARG 67 43.276 -13.424 -10.255 502 2HH1 ARG 67 2HH1 ARG 67 43.048 -14.192 -11.791 503 1HH2 ARG 67 1HH2 ARG 67 40.452 -16.211 -10.693 504 2HH2 ARG 67 2HH2 ARG 67 41.448 -15.770 -12.038 505 H ASN 68 HN ASN 68 41.271 -10.409 -6.672 506 HA ASN 68 HA ASN 68 43.698 -8.701 -6.319 507 1HB ASN 68 2HB ASN 68 41.220 -8.474 -8.059 508 2HB ASN 68 1HB ASN 68 42.569 -7.339 -8.082 509 1HD2 ASN 68 1HD2 ASN 68 41.758 -8.991 -10.362 510 2HD2 ASN 68 2HD2 ASN 68 43.054 -10.031 -10.709 No H/Q in entry = 510
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