NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
603976 | 2nd1 | 26043 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 SER 1 HT1 SER 1 -22.157 2.551 9.587 2 H2 SER 1 HT2 SER 1 -20.734 1.712 9.214 3 H3 SER 1 HT3 SER 1 -22.193 0.872 9.406 4 HA SER 1 HA SER 1 -21.613 1.082 7.092 5 HB2 SER 1 HB2 SER 1 -23.974 2.840 7.738 6 HB3 SER 1 HB1 SER 1 -23.755 1.822 6.316 7 HG SER 1 HG SER 1 -24.005 0.011 7.577 8 H GLU 2 HN GLU 2 -21.423 4.005 8.896 9 HA GLU 2 HA GLU 2 -21.178 5.817 6.759 10 HB2 GLU 2 HB2 GLU 2 -20.511 5.822 9.640 11 HB3 GLU 2 HB1 GLU 2 -19.673 6.988 8.630 12 HG2 GLU 2 HG2 GLU 2 -21.601 8.058 9.508 13 HG3 GLU 2 HG1 GLU 2 -21.891 7.746 7.799 14 H GLU 3 HN GLU 3 -19.036 3.447 8.017 15 HA GLU 3 HA GLU 3 -16.549 4.533 7.363 16 HB2 GLU 3 HB2 GLU 3 -17.423 1.638 7.286 17 HB3 GLU 3 HB1 GLU 3 -15.756 2.186 7.245 18 HG2 GLU 3 HG2 GLU 3 -16.189 1.491 9.455 19 HG3 GLU 3 HG1 GLU 3 -16.154 3.252 9.482 20 H GLU 4 HN GLU 4 -19.029 3.156 5.362 21 HA GLU 4 HA GLU 4 -17.338 2.666 3.099 22 HB2 GLU 4 HB2 GLU 4 -20.349 2.811 3.317 23 HB3 GLU 4 HB1 GLU 4 -19.464 2.263 1.901 24 HG2 GLU 4 HG2 GLU 4 -19.442 0.965 4.615 25 HG3 GLU 4 HG1 GLU 4 -20.299 0.387 3.187 26 H ASP 5 HN ASP 5 -19.156 5.378 4.299 27 HA ASP 5 HA ASP 5 -18.871 6.751 1.733 28 HB2 ASP 5 HB2 ASP 5 -21.100 6.800 2.773 29 HB3 ASP 5 HB1 ASP 5 -20.418 7.605 4.174 30 H LYS 6 HN LYS 6 -17.778 6.793 5.017 31 HA LYS 6 HA LYS 6 -16.505 9.292 5.076 32 HB2 LYS 6 HB2 LYS 6 -16.883 7.820 7.058 33 HB3 LYS 6 HB1 LYS 6 -15.627 6.746 6.461 34 HG2 LYS 6 HG2 LYS 6 -14.726 8.125 8.195 35 HG3 LYS 6 HG1 LYS 6 -13.998 8.591 6.659 36 HD2 LYS 6 HD2 LYS 6 -15.472 10.509 6.510 37 HD3 LYS 6 HD1 LYS 6 -16.305 10.016 7.985 38 HE2 LYS 6 HE2 LYS 6 -14.187 10.263 9.223 39 HE3 LYS 6 HE1 LYS 6 -13.412 10.834 7.748 40 HZ1 LYS 6 HZ1 LYS 6 -14.927 12.705 7.713 41 HZ2 LYS 6 HZ2 LYS 6 -14.092 12.659 9.180 42 HZ3 LYS 6 HZ3 LYS 6 -15.701 12.147 9.109 43 H CYS 7 HN CYS 7 -15.491 6.165 3.853 44 HA CYS 7 HA CYS 7 -12.839 7.083 3.185 45 HB2 CYS 7 HB2 CYS 7 -14.253 4.545 2.359 46 HB3 CYS 7 HB1 CYS 7 -12.521 4.866 2.234 47 HG CYS 7 HG CYS 7 -14.363 4.249 5.036 48 H LYS 8 HN LYS 8 -12.297 8.068 1.348 49 HA LYS 8 HA LYS 8 -14.298 8.289 -0.759 50 HB2 LYS 8 HB2 LYS 8 -11.919 9.860 0.064 51 HB3 LYS 8 HB1 LYS 8 -12.298 9.837 -1.653 52 HG2 LYS 8 HG2 LYS 8 -13.279 11.736 -0.334 53 HG3 LYS 8 HG1 LYS 8 -14.408 10.801 -1.314 54 HD2 LYS 8 HD2 LYS 8 -15.069 9.534 0.684 55 HD3 LYS 8 HD1 LYS 8 -13.962 10.500 1.652 56 HE2 LYS 8 HE2 LYS 8 -15.224 12.516 1.084 57 HE3 LYS 8 HE1 LYS 8 -16.325 11.549 0.103 58 HZ1 LYS 8 HZ1 LYS 8 -16.920 10.314 2.129 59 HZ2 LYS 8 HZ2 LYS 8 -17.299 11.957 2.236 60 HZ3 LYS 8 HZ3 LYS 8 -15.943 11.354 3.041 61 HA PRO 9 HA PRO 9 -12.635 5.134 -3.168 62 HB2 PRO 9 HB2 PRO 9 -13.430 5.996 -5.646 63 HB3 PRO 9 HB1 PRO 9 -14.503 5.229 -4.474 64 HG2 PRO 9 HG2 PRO 9 -14.176 8.109 -5.150 65 HG3 PRO 9 HG1 PRO 9 -15.645 7.213 -4.729 66 HD2 PRO 9 HD2 PRO 9 -14.321 8.844 -2.984 67 HD3 PRO 9 HD1 PRO 9 -15.274 7.446 -2.458 68 H MET 10 HN MET 10 -10.730 4.656 -4.107 69 HA MET 10 HA MET 10 -8.986 6.902 -4.725 70 HB2 MET 10 HB2 MET 10 -8.212 5.095 -3.182 71 HB3 MET 10 HB1 MET 10 -8.284 3.968 -4.533 72 HG2 MET 10 HG2 MET 10 -6.080 4.511 -4.600 73 HG3 MET 10 HG1 MET 10 -6.731 5.763 -5.661 74 HE1 MET 10 HE1 MET 10 -5.612 4.794 -2.196 75 HE2 MET 10 HE2 MET 10 -6.964 5.760 -1.617 76 HE3 MET 10 HE3 MET 10 -5.307 6.309 -1.352 77 H SER 11 HN SER 11 -8.704 7.518 -6.791 78 HA SER 11 HA SER 11 -9.843 5.954 -8.915 79 HB2 SER 11 HB2 SER 11 -9.082 7.883 -10.349 80 HB3 SER 11 HB1 SER 11 -10.139 8.330 -9.011 81 HG SER 11 HG SER 11 -8.304 8.997 -7.845 82 H TYR 12 HN TYR 12 -8.445 5.987 -11.105 83 HA TYR 12 HA TYR 12 -6.472 4.023 -10.745 84 HB2 TYR 12 HB2 TYR 12 -7.230 3.762 -12.848 85 HB3 TYR 12 HB1 TYR 12 -7.715 5.448 -12.983 86 HD1 TYR 12 HD1 TYR 12 -4.674 3.278 -13.131 87 HD2 TYR 12 HD2 TYR 12 -6.577 6.831 -14.456 88 HE1 TYR 12 HE1 TYR 12 -2.843 3.650 -14.724 89 HE2 TYR 12 HE2 TYR 12 -4.752 7.223 -16.051 90 HH TYR 12 HH TYR 12 -2.475 4.852 -16.851 91 H GLU 13 HN GLU 13 -6.157 7.451 -11.606 92 HA GLU 13 HA GLU 13 -3.376 7.609 -11.797 93 HB2 GLU 13 HB2 GLU 13 -5.458 9.614 -10.903 94 HB3 GLU 13 HB1 GLU 13 -3.774 10.048 -11.162 95 HG2 GLU 13 HG2 GLU 13 -5.280 8.676 -13.340 96 HG3 GLU 13 HG1 GLU 13 -5.546 10.403 -13.058 97 H GLU 14 HN GLU 14 -5.467 7.530 -9.022 98 HA GLU 14 HA GLU 14 -3.497 8.424 -7.156 99 HB2 GLU 14 HB2 GLU 14 -6.253 7.297 -6.957 100 HB3 GLU 14 HB1 GLU 14 -5.284 7.578 -5.518 101 HG2 GLU 14 HG2 GLU 14 -5.124 9.945 -6.105 102 HG3 GLU 14 HG1 GLU 14 -6.094 9.652 -7.547 103 H LYS 15 HN LYS 15 -5.095 5.301 -7.834 104 HA LYS 15 HA LYS 15 -3.671 3.722 -6.041 105 HB2 LYS 15 HB2 LYS 15 -4.763 3.020 -8.759 106 HB3 LYS 15 HB1 LYS 15 -4.065 1.836 -7.660 107 HG2 LYS 15 HG2 LYS 15 -5.810 1.898 -6.230 108 HG3 LYS 15 HG1 LYS 15 -6.246 3.551 -6.649 109 HD2 LYS 15 HD2 LYS 15 -7.433 2.935 -8.470 110 HD3 LYS 15 HD1 LYS 15 -6.436 1.516 -8.786 111 HE2 LYS 15 HE2 LYS 15 -7.437 0.442 -6.814 112 HE3 LYS 15 HE1 LYS 15 -8.518 1.819 -6.622 113 HZ1 LYS 15 HZ1 LYS 15 -9.398 1.333 -8.850 114 HZ2 LYS 15 HZ2 LYS 15 -9.618 0.032 -7.795 115 HZ3 LYS 15 HZ3 LYS 15 -8.390 -0.025 -8.963 116 H ARG 16 HN ARG 16 -2.777 4.890 -9.241 117 HA ARG 16 HA ARG 16 -0.344 3.489 -9.519 118 HB2 ARG 16 HB2 ARG 16 -1.350 4.698 -11.394 119 HB3 ARG 16 HB1 ARG 16 -1.075 6.222 -10.564 120 HG2 ARG 16 HG2 ARG 16 1.358 5.642 -10.561 121 HG3 ARG 16 HG1 ARG 16 0.966 4.339 -11.664 122 HD2 ARG 16 HD2 ARG 16 1.729 6.277 -12.885 123 HD3 ARG 16 HD1 ARG 16 0.033 5.968 -13.206 124 HE ARG 16 HE ARG 16 0.889 8.009 -11.272 125 HH11 ARG 16 HH11 ARG 16 -0.938 7.055 -14.093 126 HH12 ARG 16 HH12 ARG 16 -1.836 8.542 -14.180 127 HH21 ARG 16 HH21 ARG 16 -0.251 9.977 -11.392 128 HH22 ARG 16 HH22 ARG 16 -1.434 10.212 -12.650 129 H GLN 17 HN GLN 17 -0.944 6.804 -8.367 130 HA GLN 17 HA GLN 17 1.629 7.418 -7.536 131 HB2 GLN 17 HB2 GLN 17 -0.278 9.013 -7.690 132 HB3 GLN 17 HB1 GLN 17 -0.935 8.311 -6.219 133 HG2 GLN 17 HG2 GLN 17 0.186 10.289 -5.590 134 HG3 GLN 17 HG1 GLN 17 1.197 8.938 -5.082 135 HE21 GLN 17 HE21 GLN 17 1.867 11.743 -5.650 136 HE22 GLN 17 HE22 GLN 17 3.118 11.683 -6.842 137 H LEU 18 HN LEU 18 -0.979 5.841 -5.837 138 HA LEU 18 HA LEU 18 0.151 5.473 -3.323 139 HB2 LEU 18 HB2 LEU 18 -2.202 4.914 -4.402 140 HB3 LEU 18 HB1 LEU 18 -1.483 3.337 -4.590 141 HG LEU 18 HG LEU 18 -2.037 4.792 -2.022 142 HD11 LEU 18 HD11 LEU 18 -3.279 2.513 -1.766 143 HD12 LEU 18 HD12 LEU 18 -3.233 2.535 -3.524 144 HD13 LEU 18 HD13 LEU 18 -4.009 3.849 -2.644 145 HD21 LEU 18 HD21 LEU 18 -0.153 3.700 -1.352 146 HD22 LEU 18 HD22 LEU 18 -0.308 2.445 -2.577 147 HD23 LEU 18 HD23 LEU 18 -1.330 2.407 -1.142 148 H SER 19 HN SER 19 0.225 3.311 -6.148 149 HA SER 19 HA SER 19 1.785 1.325 -4.913 150 HB2 SER 19 HB2 SER 19 1.818 0.283 -6.998 151 HB3 SER 19 HB1 SER 19 0.369 1.279 -7.093 152 HG SER 19 HG SER 19 1.785 2.902 -8.108 153 H LEU 20 HN LEU 20 2.561 4.373 -6.247 154 HA LEU 20 HA LEU 20 5.378 3.812 -6.569 155 HB2 LEU 20 HB2 LEU 20 3.787 6.342 -6.850 156 HB3 LEU 20 HB1 LEU 20 5.492 6.214 -7.206 157 HG LEU 20 HG LEU 20 3.227 4.879 -8.647 158 HD11 LEU 20 HD11 LEU 20 3.755 7.256 -9.109 159 HD12 LEU 20 HD12 LEU 20 3.892 6.191 -10.504 160 HD13 LEU 20 HD13 LEU 20 5.344 6.744 -9.666 161 HD21 LEU 20 HD21 LEU 20 5.009 3.283 -8.460 162 HD22 LEU 20 HD22 LEU 20 6.189 4.479 -8.992 163 HD23 LEU 20 HD23 LEU 20 4.950 3.903 -10.109 164 H ASP 21 HN ASP 21 3.246 5.445 -4.279 165 HA ASP 21 HA ASP 21 5.410 6.397 -2.644 166 HB2 ASP 21 HB2 ASP 21 3.728 7.077 -1.054 167 HB3 ASP 21 HB1 ASP 21 3.321 7.605 -2.663 168 H ILE 22 HN ILE 22 3.347 3.550 -2.633 169 HA ILE 22 HA ILE 22 4.377 2.361 -0.310 170 HB ILE 22 HB ILE 22 2.995 1.442 -2.742 171 HG12 ILE 22 HG12 ILE 22 2.631 0.769 0.162 172 HG13 ILE 22 HG11 ILE 22 1.896 2.160 -0.625 173 HG21 ILE 22 HG21 ILE 22 4.417 -0.538 -0.995 174 HG22 ILE 22 HG22 ILE 22 4.811 -0.173 -2.668 175 HG23 ILE 22 HG23 ILE 22 3.266 -0.916 -2.268 176 HD11 ILE 22 HD11 ILE 22 1.421 -0.709 -1.401 177 HD12 ILE 22 HD12 ILE 22 0.615 0.713 -2.057 178 HD13 ILE 22 HD13 ILE 22 0.362 0.256 -0.375 179 H ASN 23 HN ASN 23 5.563 2.516 -3.601 180 HA ASN 23 HA ASN 23 7.661 0.640 -3.283 181 HB2 ASN 23 HB2 ASN 23 6.633 1.376 -5.446 182 HB3 ASN 23 HB1 ASN 23 7.450 2.917 -5.251 183 HD21 ASN 23 HD21 ASN 23 9.649 3.050 -5.651 184 HD22 ASN 23 HD22 ASN 23 10.550 1.751 -6.352 185 H LYS 24 HN LYS 24 7.228 3.841 -2.240 186 HA LYS 24 HA LYS 24 10.016 4.558 -2.085 187 HB2 LYS 24 HB2 LYS 24 7.435 5.797 -1.263 188 HB3 LYS 24 HB1 LYS 24 8.925 6.398 -0.555 189 HG2 LYS 24 HG2 LYS 24 9.760 7.028 -2.708 190 HG3 LYS 24 HG1 LYS 24 8.405 6.234 -3.517 191 HD2 LYS 24 HD2 LYS 24 6.857 7.827 -2.680 192 HD3 LYS 24 HD1 LYS 24 8.037 8.485 -1.549 193 HE2 LYS 24 HE2 LYS 24 8.305 8.629 -4.552 194 HE3 LYS 24 HE1 LYS 24 7.614 9.907 -3.551 195 HZ1 LYS 24 HZ1 LYS 24 10.361 8.839 -3.232 196 HZ2 LYS 24 HZ2 LYS 24 9.695 10.167 -2.431 197 HZ3 LYS 24 HZ3 LYS 24 9.982 10.240 -4.096 198 H LEU 25 HN LEU 25 7.749 2.859 -0.148 199 HA LEU 25 HA LEU 25 8.853 3.441 2.407 200 HB2 LEU 25 HB2 LEU 25 7.052 1.238 1.440 201 HB3 LEU 25 HB1 LEU 25 7.567 1.388 3.109 202 HG LEU 25 HG LEU 25 5.773 3.217 1.546 203 HD11 LEU 25 HD11 LEU 25 5.563 1.839 4.191 204 HD12 LEU 25 HD12 LEU 25 4.811 1.284 2.696 205 HD13 LEU 25 HD13 LEU 25 4.300 2.802 3.438 206 HD21 LEU 25 HD21 LEU 25 7.092 3.762 4.181 207 HD22 LEU 25 HD22 LEU 25 5.814 4.734 3.461 208 HD23 LEU 25 HD23 LEU 25 7.393 4.635 2.685 209 HA PRO 26 HA PRO 26 12.377 0.726 2.291 210 HB2 PRO 26 HB2 PRO 26 12.934 0.790 4.957 211 HB3 PRO 26 HB1 PRO 26 13.382 2.085 3.842 212 HG2 PRO 26 HG2 PRO 26 11.102 1.924 5.758 213 HG3 PRO 26 HG1 PRO 26 12.105 3.317 5.327 214 HD2 PRO 26 HD2 PRO 26 9.591 2.906 4.344 215 HD3 PRO 26 HD1 PRO 26 10.847 3.802 3.470 216 H GLY 27 HN GLY 27 13.036 -1.340 3.261 217 HA2 GLY 27 HA2 GLY 27 11.086 -3.228 2.939 218 HA3 GLY 27 HA1 GLY 27 12.581 -3.519 3.794 219 H GLU 28 HN GLU 28 12.171 -1.906 6.053 220 HA GLU 28 HA GLU 28 10.535 -3.674 7.559 221 HB2 GLU 28 HB2 GLU 28 10.957 -1.901 9.409 222 HB3 GLU 28 HB1 GLU 28 12.265 -2.922 8.852 223 HG2 GLU 28 HG2 GLU 28 11.815 -0.178 7.751 224 HG3 GLU 28 HG1 GLU 28 12.726 -0.461 9.222 225 H LYS 29 HN LYS 29 10.061 -0.375 6.393 226 HA LYS 29 HA LYS 29 7.624 -0.018 7.869 227 HB2 LYS 29 HB2 LYS 29 9.230 1.564 5.966 228 HB3 LYS 29 HB1 LYS 29 7.497 1.892 5.932 229 HG2 LYS 29 HG2 LYS 29 8.770 3.420 7.425 230 HG3 LYS 29 HG1 LYS 29 7.546 2.496 8.294 231 HD2 LYS 29 HD2 LYS 29 9.054 1.549 9.615 232 HD3 LYS 29 HD1 LYS 29 10.078 1.102 8.247 233 HE2 LYS 29 HE2 LYS 29 10.877 3.548 8.282 234 HE3 LYS 29 HE1 LYS 29 10.121 3.644 9.877 235 HZ1 LYS 29 HZ1 LYS 29 12.396 3.111 10.159 236 HZ2 LYS 29 HZ2 LYS 29 12.317 1.841 9.053 237 HZ3 LYS 29 HZ3 LYS 29 11.507 1.719 10.533 238 H LEU 30 HN LEU 30 8.497 -1.262 4.728 239 HA LEU 30 HA LEU 30 5.821 -0.957 3.716 240 HB2 LEU 30 HB2 LEU 30 6.813 -1.047 1.777 241 HB3 LEU 30 HB1 LEU 30 8.344 -1.339 2.556 242 HG LEU 30 HG LEU 30 6.457 -3.469 1.538 243 HD11 LEU 30 HD11 LEU 30 8.055 -1.792 0.107 244 HD12 LEU 30 HD12 LEU 30 7.549 -3.396 -0.410 245 HD13 LEU 30 HD13 LEU 30 9.113 -3.172 0.368 246 HD21 LEU 30 HD21 LEU 30 7.834 -4.219 3.449 247 HD22 LEU 30 HD22 LEU 30 9.279 -3.722 2.573 248 HD23 LEU 30 HD23 LEU 30 8.272 -5.023 1.942 249 H GLY 31 HN GLY 31 7.392 -3.244 5.648 250 HA2 GLY 31 HA2 GLY 31 5.749 -5.500 5.064 251 HA3 GLY 31 HA1 GLY 31 6.573 -5.203 6.582 252 H ARG 32 HN ARG 32 5.163 -2.481 6.669 253 HA ARG 32 HA ARG 32 2.849 -3.334 8.103 254 HB2 ARG 32 HB2 ARG 32 3.964 -1.256 8.712 255 HB3 ARG 32 HB1 ARG 32 3.579 -0.567 7.148 256 HG2 ARG 32 HG2 ARG 32 1.627 0.138 7.912 257 HG3 ARG 32 HG1 ARG 32 1.182 -1.507 8.370 258 HD2 ARG 32 HD2 ARG 32 2.878 0.329 10.047 259 HD3 ARG 32 HD1 ARG 32 1.138 0.119 10.256 260 HE ARG 32 HE ARG 32 2.135 -2.412 10.403 261 HH11 ARG 32 HH11 ARG 32 2.799 0.579 12.089 262 HH12 ARG 32 HH12 ARG 32 3.284 -0.211 13.557 263 HH21 ARG 32 HH21 ARG 32 2.744 -3.453 12.334 264 HH22 ARG 32 HH22 ARG 32 3.253 -2.505 13.696 265 H VAL 33 HN VAL 33 3.310 -1.887 4.867 266 HA VAL 33 HA VAL 33 0.563 -1.646 4.292 267 HB VAL 33 HB VAL 33 1.673 -2.216 1.821 268 HG11 VAL 33 HG11 VAL 33 1.214 0.325 3.349 269 HG12 VAL 33 HG12 VAL 33 0.206 -0.410 2.102 270 HG13 VAL 33 HG13 VAL 33 1.740 0.330 1.672 271 HG21 VAL 33 HG21 VAL 33 3.628 -0.427 3.188 272 HG22 VAL 33 HG22 VAL 33 3.762 -1.232 1.620 273 HG23 VAL 33 HG23 VAL 33 3.905 -2.168 3.110 274 H VAL 34 HN VAL 34 2.820 -4.252 3.454 275 HA VAL 34 HA VAL 34 1.064 -6.152 2.493 276 HB VAL 34 HB VAL 34 2.710 -7.672 2.797 277 HG11 VAL 34 HG11 VAL 34 3.982 -5.771 2.087 278 HG12 VAL 34 HG12 VAL 34 4.942 -6.782 3.163 279 HG13 VAL 34 HG13 VAL 34 4.229 -5.284 3.760 280 HG21 VAL 34 HG21 VAL 34 2.130 -8.078 5.133 281 HG22 VAL 34 HG22 VAL 34 3.195 -6.750 5.611 282 HG23 VAL 34 HG23 VAL 34 3.871 -8.189 4.847 283 H HIS 35 HN HIS 35 1.601 -5.219 5.875 284 HA HIS 35 HA HIS 35 -0.029 -7.293 6.943 285 HB2 HIS 35 HB2 HIS 35 1.778 -6.279 8.248 286 HB3 HIS 35 HB1 HIS 35 0.948 -4.728 8.213 287 HD1 HIS 35 HD1 HIS 35 0.789 -8.127 9.797 288 HD2 HIS 35 HD2 HIS 35 -1.117 -4.437 10.041 289 HE1 HIS 35 HE1 HIS 35 -0.642 -8.238 11.861 290 HE2 HIS 35 HE2 HIS 35 -1.775 -5.995 12.003 291 H ILE 36 HN ILE 36 -0.531 -3.802 6.439 292 HA ILE 36 HA ILE 36 -3.160 -3.640 7.377 293 HB ILE 36 HB ILE 36 -1.891 -2.116 5.086 294 HG12 ILE 36 HG12 ILE 36 -2.280 -1.252 7.951 295 HG13 ILE 36 HG11 ILE 36 -0.800 -2.002 7.374 296 HG21 ILE 36 HG21 ILE 36 -3.718 -0.733 4.988 297 HG22 ILE 36 HG22 ILE 36 -4.121 -0.995 6.689 298 HG23 ILE 36 HG23 ILE 36 -4.519 -2.225 5.495 299 HD11 ILE 36 HD11 ILE 36 -0.670 -0.131 5.704 300 HD12 ILE 36 HD12 ILE 36 -0.430 0.316 7.387 301 HD13 ILE 36 HD13 ILE 36 -1.969 0.641 6.599 302 H ILE 37 HN ILE 37 -1.873 -4.340 4.199 303 HA ILE 37 HA ILE 37 -4.291 -4.706 2.848 304 HB ILE 37 HB ILE 37 -1.485 -5.585 2.388 305 HG12 ILE 37 HG12 ILE 37 -3.177 -3.866 0.626 306 HG13 ILE 37 HG11 ILE 37 -2.434 -3.207 2.073 307 HG21 ILE 37 HG21 ILE 37 -3.852 -6.722 1.201 308 HG22 ILE 37 HG22 ILE 37 -2.168 -7.248 1.090 309 HG23 ILE 37 HG23 ILE 37 -2.777 -6.009 -0.005 310 HD11 ILE 37 HD11 ILE 37 -1.046 -2.737 0.222 311 HD12 ILE 37 HD12 ILE 37 -1.036 -4.440 -0.256 312 HD13 ILE 37 HD13 ILE 37 -0.245 -3.939 1.237 313 H GLN 38 HN GLN 38 -2.058 -7.289 3.969 314 HA GLN 38 HA GLN 38 -3.698 -9.464 3.556 315 HB2 GLN 38 HB2 GLN 38 -1.713 -9.001 5.793 316 HB3 GLN 38 HB1 GLN 38 -2.468 -10.555 5.470 317 HG2 GLN 38 HG2 GLN 38 -1.437 -10.597 3.258 318 HG3 GLN 38 HG1 GLN 38 -0.725 -9.020 3.575 319 HE21 GLN 38 HE21 GLN 38 -1.038 -11.530 5.984 320 HE22 GLN 38 HE22 GLN 38 0.653 -11.852 6.139 321 H SER 39 HN SER 39 -3.772 -7.242 6.323 322 HA SER 39 HA SER 39 -5.564 -8.893 7.847 323 HB2 SER 39 HB2 SER 39 -5.658 -6.956 9.393 324 HB3 SER 39 HB1 SER 39 -4.008 -7.408 8.989 325 HG SER 39 HG SER 39 -3.827 -5.666 7.679 326 H ARG 40 HN ARG 40 -5.896 -5.879 5.996 327 HA ARG 40 HA ARG 40 -8.726 -5.739 6.439 328 HB2 ARG 40 HB2 ARG 40 -6.898 -4.206 4.579 329 HB3 ARG 40 HB1 ARG 40 -8.614 -3.862 4.765 330 HG2 ARG 40 HG2 ARG 40 -8.259 -3.446 7.117 331 HG3 ARG 40 HG1 ARG 40 -6.546 -3.790 6.946 332 HD2 ARG 40 HD2 ARG 40 -6.524 -1.515 6.817 333 HD3 ARG 40 HD1 ARG 40 -6.732 -1.920 5.112 334 HE ARG 40 HE ARG 40 -9.201 -1.613 5.584 335 HH11 ARG 40 HH11 ARG 40 -6.710 0.159 7.287 336 HH12 ARG 40 HH12 ARG 40 -7.783 1.404 7.828 337 HH21 ARG 40 HH21 ARG 40 -10.629 -0.010 6.336 338 HH22 ARG 40 HH22 ARG 40 -10.021 1.315 7.280 339 H GLU 41 HN GLU 41 -6.653 -7.198 4.138 340 HA GLU 41 HA GLU 41 -8.975 -8.040 2.529 341 HB2 GLU 41 HB2 GLU 41 -6.085 -8.227 1.685 342 HB3 GLU 41 HB1 GLU 41 -7.527 -8.319 0.678 343 HG2 GLU 41 HG2 GLU 41 -6.679 -5.846 2.140 344 HG3 GLU 41 HG1 GLU 41 -6.182 -6.238 0.494 345 HA PRO 42 HA PRO 42 -7.250 -11.639 4.958 346 HB2 PRO 42 HB2 PRO 42 -10.044 -12.522 5.135 347 HB3 PRO 42 HB1 PRO 42 -8.888 -12.209 6.430 348 HG2 PRO 42 HG2 PRO 42 -11.003 -10.601 5.966 349 HG3 PRO 42 HG1 PRO 42 -9.460 -9.989 6.586 350 HD2 PRO 42 HD2 PRO 42 -10.558 -9.884 3.802 351 HD3 PRO 42 HD1 PRO 42 -9.671 -8.643 4.713 352 H SER 43 HN SER 43 -8.873 -11.232 2.070 353 HA SER 43 HA SER 43 -9.119 -13.986 1.316 354 HB2 SER 43 HB2 SER 43 -9.406 -12.920 -0.999 355 HB3 SER 43 HB1 SER 43 -10.598 -12.488 0.228 356 HG SER 43 HG SER 43 -9.038 -10.869 -1.156 357 H LEU 44 HN LEU 44 -6.562 -11.720 1.496 358 HA LEU 44 HA LEU 44 -4.902 -13.501 -0.156 359 HB2 LEU 44 HB2 LEU 44 -3.405 -11.586 -0.549 360 HB3 LEU 44 HB1 LEU 44 -5.005 -11.330 -1.175 361 HG LEU 44 HG LEU 44 -5.255 -10.091 1.183 362 HD11 LEU 44 HD11 LEU 44 -3.196 -8.751 1.482 363 HD12 LEU 44 HD12 LEU 44 -2.365 -9.862 0.396 364 HD13 LEU 44 HD13 LEU 44 -3.019 -10.447 1.926 365 HD21 LEU 44 HD21 LEU 44 -5.824 -9.148 -0.961 366 HD22 LEU 44 HD22 LEU 44 -4.119 -8.995 -1.385 367 HD23 LEU 44 HD23 LEU 44 -4.796 -8.015 -0.085 368 H LYS 45 HN LYS 45 -5.626 -13.644 2.723 369 HA LYS 45 HA LYS 45 -3.327 -12.963 4.262 370 HB2 LYS 45 HB2 LYS 45 -4.330 -14.256 6.037 371 HB3 LYS 45 HB1 LYS 45 -5.574 -13.299 5.248 372 HG2 LYS 45 HG2 LYS 45 -6.343 -15.259 4.035 373 HG3 LYS 45 HG1 LYS 45 -5.054 -16.223 4.763 374 HD2 LYS 45 HD2 LYS 45 -7.193 -14.812 6.339 375 HD3 LYS 45 HD1 LYS 45 -7.271 -16.508 5.849 376 HE2 LYS 45 HE2 LYS 45 -5.019 -16.775 6.966 377 HE3 LYS 45 HE1 LYS 45 -5.294 -15.189 7.684 378 HZ1 LYS 45 HZ1 LYS 45 -5.989 -16.937 9.186 379 HZ2 LYS 45 HZ2 LYS 45 -7.046 -17.563 8.023 380 HZ3 LYS 45 HZ3 LYS 45 -7.327 -16.034 8.685 381 H ASN 46 HN ASN 46 -4.022 -15.491 2.071 382 HA ASN 46 HA ASN 46 -2.269 -17.475 3.106 383 HB2 ASN 46 HB2 ASN 46 -2.386 -18.421 0.743 384 HB3 ASN 46 HB1 ASN 46 -3.947 -18.167 1.519 385 HD21 ASN 46 HD21 ASN 46 -5.025 -18.085 -0.405 386 HD22 ASN 46 HD22 ASN 46 -4.908 -16.745 -1.500 387 H SER 47 HN SER 47 -1.724 -14.503 1.639 388 HA SER 47 HA SER 47 0.783 -15.203 0.381 389 HB2 SER 47 HB2 SER 47 -0.572 -12.531 0.794 390 HB3 SER 47 HB1 SER 47 0.870 -12.793 -0.191 391 HG SER 47 HG SER 47 -1.504 -14.263 -0.644 392 H ASN 48 HN ASN 48 2.810 -14.588 1.099 393 HA ASN 48 HA ASN 48 3.005 -14.381 3.981 394 HB2 ASN 48 HB2 ASN 48 5.084 -14.739 1.826 395 HB3 ASN 48 HB1 ASN 48 5.467 -14.641 3.537 396 HD21 ASN 48 HD21 ASN 48 4.949 -16.343 4.888 397 HD22 ASN 48 HD22 ASN 48 4.486 -17.898 4.284 398 HA PRO 49 HA PRO 49 3.444 -10.106 4.314 399 HB2 PRO 49 HB2 PRO 49 5.160 -9.932 6.435 400 HB3 PRO 49 HB1 PRO 49 3.454 -10.361 6.575 401 HG2 PRO 49 HG2 PRO 49 5.846 -12.149 6.513 402 HG3 PRO 49 HG1 PRO 49 4.418 -12.215 7.562 403 HD2 PRO 49 HD2 PRO 49 4.673 -13.833 5.444 404 HD3 PRO 49 HD1 PRO 49 3.097 -13.168 5.921 405 H ASP 50 HN ASP 50 6.340 -11.964 3.816 406 HA ASP 50 HA ASP 50 7.808 -9.503 3.164 407 HB2 ASP 50 HB2 ASP 50 8.837 -12.324 3.545 408 HB3 ASP 50 HB1 ASP 50 9.838 -10.925 3.177 409 H GLU 51 HN GLU 51 5.787 -11.461 1.670 410 HA GLU 51 HA GLU 51 7.167 -11.249 -0.905 411 HB2 GLU 51 HB2 GLU 51 5.814 -13.789 0.054 412 HB3 GLU 51 HB1 GLU 51 6.494 -13.528 -1.539 413 HG2 GLU 51 HG2 GLU 51 8.318 -14.513 -0.764 414 HG3 GLU 51 HG1 GLU 51 8.624 -13.020 0.107 415 H ILE 52 HN ILE 52 5.064 -9.778 0.394 416 HA ILE 52 HA ILE 52 2.527 -10.691 -0.469 417 HB ILE 52 HB ILE 52 3.187 -9.012 1.444 418 HG12 ILE 52 HG12 ILE 52 0.877 -8.184 1.442 419 HG13 ILE 52 HG11 ILE 52 0.691 -8.681 -0.229 420 HG21 ILE 52 HG21 ILE 52 2.588 -7.189 -0.867 421 HG22 ILE 52 HG22 ILE 52 4.134 -7.319 -0.028 422 HG23 ILE 52 HG23 ILE 52 2.718 -6.691 0.817 423 HD11 ILE 52 HD11 ILE 52 1.272 -10.518 2.042 424 HD12 ILE 52 HD12 ILE 52 0.893 -10.970 0.385 425 HD13 ILE 52 HD13 ILE 52 -0.331 -10.205 1.393 426 H GLU 53 HN GLU 53 1.189 -9.907 -1.998 427 HA GLU 53 HA GLU 53 2.399 -8.259 -4.114 428 HB2 GLU 53 HB2 GLU 53 0.330 -10.456 -4.347 429 HB3 GLU 53 HB1 GLU 53 0.786 -9.386 -5.663 430 HG2 GLU 53 HG2 GLU 53 2.738 -11.164 -4.233 431 HG3 GLU 53 HG1 GLU 53 1.848 -11.660 -5.672 432 H ILE 54 HN ILE 54 1.669 -6.289 -3.511 433 HA ILE 54 HA ILE 54 -0.886 -5.802 -2.380 434 HB ILE 54 HB ILE 54 1.009 -3.874 -3.723 435 HG12 ILE 54 HG12 ILE 54 0.804 -4.764 -0.845 436 HG13 ILE 54 HG11 ILE 54 2.161 -5.009 -1.935 437 HG21 ILE 54 HG21 ILE 54 -1.185 -3.359 -1.748 438 HG22 ILE 54 HG22 ILE 54 -1.258 -3.017 -3.473 439 HG23 ILE 54 HG23 ILE 54 -0.106 -2.158 -2.449 440 HD11 ILE 54 HD11 ILE 54 2.683 -3.219 -0.426 441 HD12 ILE 54 HD12 ILE 54 1.180 -2.404 -0.826 442 HD13 ILE 54 HD13 ILE 54 2.448 -2.558 -2.040 443 H ASP 55 HN ASP 55 -2.607 -6.320 -3.609 444 HA ASP 55 HA ASP 55 -2.612 -5.601 -6.446 445 HB2 ASP 55 HB2 ASP 55 -3.270 -7.926 -5.743 446 HB3 ASP 55 HB1 ASP 55 -4.665 -7.227 -4.927 447 H PHE 56 HN PHE 56 -3.061 -3.482 -6.549 448 HA PHE 56 HA PHE 56 -4.667 -2.125 -4.676 449 HB2 PHE 56 HB2 PHE 56 -3.651 -1.250 -7.365 450 HB3 PHE 56 HB1 PHE 56 -4.402 -0.181 -6.185 451 HD1 PHE 56 HD1 PHE 56 -3.306 0.029 -3.924 452 HD2 PHE 56 HD2 PHE 56 -1.350 -1.731 -7.246 453 HE1 PHE 56 HE1 PHE 56 -1.182 0.362 -2.803 454 HE2 PHE 56 HE2 PHE 56 0.816 -1.385 -6.131 455 HZ PHE 56 HZ PHE 56 0.892 -0.335 -3.896 456 H GLU 57 HN GLU 57 -5.567 -3.999 -7.319 457 HA GLU 57 HA GLU 57 -8.014 -2.552 -7.867 458 HB2 GLU 57 HB2 GLU 57 -6.868 -5.152 -8.864 459 HB3 GLU 57 HB1 GLU 57 -8.488 -4.617 -9.300 460 HG2 GLU 57 HG2 GLU 57 -5.924 -3.138 -9.854 461 HG3 GLU 57 HG1 GLU 57 -6.866 -4.064 -11.023 462 H THR 58 HN THR 58 -6.937 -5.357 -6.070 463 HA THR 58 HA THR 58 -9.646 -6.048 -5.307 464 HB THR 58 HB THR 58 -8.590 -7.816 -3.941 465 HG1 THR 58 HG1 THR 58 -6.412 -6.279 -4.261 466 HG21 THR 58 HG21 THR 58 -7.633 -7.631 -6.799 467 HG22 THR 58 HG22 THR 58 -9.159 -8.317 -6.238 468 HG23 THR 58 HG23 THR 58 -7.637 -9.105 -5.828 469 H LEU 59 HN LEU 59 -6.968 -4.233 -4.046 470 HA LEU 59 HA LEU 59 -7.638 -4.213 -1.324 471 HB2 LEU 59 HB2 LEU 59 -6.266 -2.106 -2.954 472 HB3 LEU 59 HB1 LEU 59 -6.336 -2.149 -1.208 473 HG LEU 59 HG LEU 59 -5.019 -4.184 -2.983 474 HD11 LEU 59 HD11 LEU 59 -3.820 -2.305 -0.979 475 HD12 LEU 59 HD12 LEU 59 -3.831 -2.038 -2.720 476 HD13 LEU 59 HD13 LEU 59 -2.974 -3.421 -2.044 477 HD21 LEU 59 HD21 LEU 59 -5.544 -4.121 -0.026 478 HD22 LEU 59 HD22 LEU 59 -4.209 -5.042 -0.731 479 HD23 LEU 59 HD23 LEU 59 -5.867 -5.408 -1.196 480 H LYS 60 HN LYS 60 -9.228 -3.309 -0.263 481 HA LYS 60 HA LYS 60 -11.289 -1.870 -1.577 482 HB2 LYS 60 HB2 LYS 60 -10.680 -2.394 1.325 483 HB3 LYS 60 HB1 LYS 60 -12.104 -1.504 0.804 484 HG2 LYS 60 HG2 LYS 60 -12.955 -3.408 -0.341 485 HG3 LYS 60 HG1 LYS 60 -11.441 -4.278 -0.108 486 HD2 LYS 60 HD2 LYS 60 -13.093 -3.326 2.215 487 HD3 LYS 60 HD1 LYS 60 -13.394 -4.873 1.420 488 HE2 LYS 60 HE2 LYS 60 -10.615 -4.197 2.382 489 HE3 LYS 60 HE1 LYS 60 -11.832 -4.843 3.488 490 HZ1 LYS 60 HZ1 LYS 60 -12.086 -6.716 1.887 491 HZ2 LYS 60 HZ2 LYS 60 -10.576 -6.633 2.641 492 HZ3 LYS 60 HZ3 LYS 60 -10.746 -6.115 1.039 493 HA PRO 61 HA PRO 61 -10.007 2.386 -1.535 494 HB2 PRO 61 HB2 PRO 61 -12.554 2.826 -0.031 495 HB3 PRO 61 HB1 PRO 61 -11.904 3.701 -1.423 496 HG2 PRO 61 HG2 PRO 61 -13.855 1.908 -1.708 497 HG3 PRO 61 HG1 PRO 61 -12.584 2.118 -2.922 498 HD2 PRO 61 HD2 PRO 61 -13.003 -0.099 -0.997 499 HD3 PRO 61 HD1 PRO 61 -12.176 -0.107 -2.568 500 H SER 62 HN SER 62 -11.480 1.090 1.404 501 HA SER 62 HA SER 62 -10.414 2.816 3.292 502 HB2 SER 62 HB2 SER 62 -10.521 0.540 4.712 503 HB3 SER 62 HB1 SER 62 -11.983 1.393 4.208 504 HG SER 62 HG SER 62 -12.414 -0.145 2.805 505 H THR 63 HN THR 63 -9.072 -0.345 2.234 506 HA THR 63 HA THR 63 -6.693 -0.157 3.709 507 HB THR 63 HB THR 63 -6.694 -1.533 1.046 508 HG1 THR 63 HG1 THR 63 -8.016 -3.154 1.811 509 HG21 THR 63 HG21 THR 63 -4.728 -2.146 2.034 510 HG22 THR 63 HG22 THR 63 -5.773 -3.322 2.842 511 HG23 THR 63 HG23 THR 63 -5.347 -1.820 3.657 512 H LEU 64 HN LEU 64 -7.429 0.742 0.347 513 HA LEU 64 HA LEU 64 -4.849 1.520 -0.381 514 HB2 LEU 64 HB2 LEU 64 -7.506 2.534 -1.367 515 HB3 LEU 64 HB1 LEU 64 -5.978 2.877 -2.137 516 HG LEU 64 HG LEU 64 -7.107 0.107 -1.776 517 HD11 LEU 64 HD11 LEU 64 -7.811 2.163 -3.627 518 HD12 LEU 64 HD12 LEU 64 -8.437 0.520 -3.499 519 HD13 LEU 64 HD13 LEU 64 -7.012 0.848 -4.485 520 HD21 LEU 64 HD21 LEU 64 -4.702 1.235 -3.175 521 HD22 LEU 64 HD22 LEU 64 -5.394 -0.329 -3.608 522 HD23 LEU 64 HD23 LEU 64 -4.779 -0.060 -1.978 523 H ARG 65 HN ARG 65 -7.492 3.469 1.015 524 HA ARG 65 HA ARG 65 -6.024 5.893 1.023 525 HB2 ARG 65 HB2 ARG 65 -8.410 4.983 2.615 526 HB3 ARG 65 HB1 ARG 65 -7.710 6.587 2.777 527 HG2 ARG 65 HG2 ARG 65 -8.826 5.431 0.228 528 HG3 ARG 65 HG1 ARG 65 -9.663 6.552 1.295 529 HD2 ARG 65 HD2 ARG 65 -7.951 8.240 0.908 530 HD3 ARG 65 HD1 ARG 65 -7.061 7.123 -0.118 531 HE ARG 65 HE ARG 65 -9.753 7.570 -1.008 532 HH11 ARG 65 HH11 ARG 65 -6.462 8.807 -1.079 533 HH12 ARG 65 HH12 ARG 65 -6.672 9.608 -2.607 534 HH21 ARG 65 HH21 ARG 65 -10.005 8.653 -3.035 535 HH22 ARG 65 HH22 ARG 65 -8.655 9.519 -3.709 536 H GLU 66 HN GLU 66 -6.222 3.197 3.230 537 HA GLU 66 HA GLU 66 -4.806 4.440 5.364 538 HB2 GLU 66 HB2 GLU 66 -6.165 2.489 5.798 539 HB3 GLU 66 HB1 GLU 66 -5.262 1.539 4.627 540 HG2 GLU 66 HG2 GLU 66 -4.599 0.885 6.815 541 HG3 GLU 66 HG1 GLU 66 -3.261 1.756 6.061 542 H LEU 67 HN LEU 67 -3.780 2.015 2.928 543 HA LEU 67 HA LEU 67 -1.065 1.951 3.344 544 HB2 LEU 67 HB2 LEU 67 -2.238 2.115 0.556 545 HB3 LEU 67 HB1 LEU 67 -0.848 1.189 1.109 546 HG LEU 67 HG LEU 67 -3.667 0.587 1.966 547 HD11 LEU 67 HD11 LEU 67 -2.184 -1.142 0.105 548 HD12 LEU 67 HD12 LEU 67 -2.885 0.333 -0.555 549 HD13 LEU 67 HD13 LEU 67 -3.916 -0.855 0.246 550 HD21 LEU 67 HD21 LEU 67 -1.334 -0.148 3.128 551 HD22 LEU 67 HD22 LEU 67 -1.581 -1.464 1.986 552 HD23 LEU 67 HD23 LEU 67 -2.820 -1.092 3.185 553 H GLU 68 HN GLU 68 -2.790 4.197 1.179 554 HA GLU 68 HA GLU 68 -0.658 5.811 0.420 555 HB2 GLU 68 HB2 GLU 68 -2.866 5.868 -0.629 556 HB3 GLU 68 HB1 GLU 68 -3.560 6.561 0.823 557 HG2 GLU 68 HG2 GLU 68 -2.018 8.513 0.485 558 HG3 GLU 68 HG1 GLU 68 -1.640 7.831 -1.102 559 H ARG 69 HN ARG 69 -2.972 6.390 3.098 560 HA ARG 69 HA ARG 69 -1.693 8.812 3.931 561 HB2 ARG 69 HB2 ARG 69 -4.046 8.391 4.503 562 HB3 ARG 69 HB1 ARG 69 -3.540 6.996 5.442 563 HG2 ARG 69 HG2 ARG 69 -2.715 8.268 7.141 564 HG3 ARG 69 HG1 ARG 69 -2.428 9.661 6.125 565 HD2 ARG 69 HD2 ARG 69 -4.230 10.405 7.311 566 HD3 ARG 69 HD1 ARG 69 -5.036 9.580 5.986 567 HE ARG 69 HE ARG 69 -4.648 7.722 8.021 568 HH11 ARG 69 HH11 ARG 69 -6.502 10.616 7.383 569 HH12 ARG 69 HH12 ARG 69 -7.784 10.195 8.471 570 HH21 ARG 69 HH21 ARG 69 -6.329 7.152 9.457 571 HH22 ARG 69 HH22 ARG 69 -7.686 8.212 9.658 572 H TYR 70 HN TYR 70 -1.201 5.467 4.594 573 HA TYR 70 HA TYR 70 0.295 5.781 6.987 574 HB2 TYR 70 HB2 TYR 70 -0.594 3.614 6.604 575 HB3 TYR 70 HB1 TYR 70 0.061 3.560 4.974 576 HD1 TYR 70 HD2 TYR 70 1.339 4.046 8.456 577 HD2 TYR 70 HD1 TYR 70 1.860 2.268 4.642 578 HE1 TYR 70 HE2 TYR 70 3.407 2.986 9.255 579 HE2 TYR 70 HE1 TYR 70 3.911 1.184 5.411 580 HH TYR 70 HH TYR 70 4.841 1.108 8.721 581 H VAL 71 HN VAL 71 1.205 5.293 3.572 582 HA VAL 71 HA VAL 71 3.977 5.367 4.027 583 HB VAL 71 HB VAL 71 4.301 5.732 1.704 584 HG11 VAL 71 HG11 VAL 71 2.554 4.216 0.642 585 HG12 VAL 71 HG12 VAL 71 1.915 4.034 2.278 586 HG13 VAL 71 HG13 VAL 71 3.573 3.552 1.915 587 HG21 VAL 71 HG21 VAL 71 2.671 6.512 0.188 588 HG22 VAL 71 HG22 VAL 71 2.816 7.671 1.504 589 HG23 VAL 71 HG23 VAL 71 1.439 6.568 1.442 590 H THR 72 HN THR 72 1.562 7.892 3.638 591 HA THR 72 HA THR 72 3.373 9.940 3.017 592 HB THR 72 HB THR 72 1.605 11.538 3.537 593 HG1 THR 72 HG1 THR 72 0.479 9.297 4.814 594 HG21 THR 72 HG21 THR 72 1.044 9.079 1.954 595 HG22 THR 72 HG22 THR 72 1.434 10.709 1.387 596 HG23 THR 72 HG23 THR 72 -0.169 10.362 2.044 597 H SER 73 HN SER 73 2.441 8.498 6.015 598 HA SER 73 HA SER 73 3.401 10.533 7.744 599 HB2 SER 73 HB2 SER 73 3.139 8.950 9.495 600 HB3 SER 73 HB1 SER 73 1.876 8.563 8.327 601 HG SER 73 HG SER 73 3.073 6.839 7.600 602 H CYS 74 HN CYS 74 4.854 8.034 5.872 603 HA CYS 74 HA CYS 74 7.436 8.333 7.232 604 HB2 CYS 74 HB2 CYS 74 6.698 6.033 6.924 605 HB3 CYS 74 HB1 CYS 74 6.521 6.303 5.192 606 HG CYS 74 HG CYS 74 9.448 7.042 5.265 607 H LEU 75 HN LEU 75 5.802 9.138 4.313 608 HA LEU 75 HA LEU 75 8.300 9.694 2.902 609 HB2 LEU 75 HB2 LEU 75 5.460 9.681 1.897 610 HB3 LEU 75 HB1 LEU 75 6.888 9.809 0.914 611 HG LEU 75 HG LEU 75 5.913 7.418 2.427 612 HD11 LEU 75 HD11 LEU 75 5.062 8.030 0.111 613 HD12 LEU 75 HD12 LEU 75 5.738 6.413 0.314 614 HD13 LEU 75 HD13 LEU 75 6.693 7.676 -0.456 615 HD21 LEU 75 HD21 LEU 75 7.936 6.275 1.884 616 HD22 LEU 75 HD22 LEU 75 8.373 7.746 2.739 617 HD23 LEU 75 HD23 LEU 75 8.550 7.660 0.988 618 H ARG 76 HN ARG 76 5.172 11.260 3.555 619 HA ARG 76 HA ARG 76 6.194 13.758 2.524 620 HB2 ARG 76 HB2 ARG 76 3.489 13.034 3.611 621 HB3 ARG 76 HB1 ARG 76 3.910 14.599 2.922 622 HG2 ARG 76 HG2 ARG 76 4.500 13.438 0.810 623 HG3 ARG 76 HG1 ARG 76 3.904 11.946 1.538 624 HD2 ARG 76 HD2 ARG 76 1.743 13.017 1.881 625 HD3 ARG 76 HD1 ARG 76 2.320 14.443 1.027 626 HE ARG 76 HE ARG 76 2.755 12.372 -0.707 627 HH11 ARG 76 HH11 ARG 76 -0.038 13.664 0.956 628 HH12 ARG 76 HH12 ARG 76 -1.163 13.138 -0.256 629 HH21 ARG 76 HH21 ARG 76 1.271 11.644 -2.290 630 HH22 ARG 76 HH22 ARG 76 -0.420 11.976 -2.090 631 H LYS 77 HN LYS 77 6.740 12.275 5.242 632 HA LYS 77 HA LYS 77 6.757 14.746 6.841 633 HB2 LYS 77 HB2 LYS 77 5.127 12.792 7.491 634 HB3 LYS 77 HB1 LYS 77 6.593 12.042 8.112 635 HG2 LYS 77 HG2 LYS 77 5.546 13.166 9.921 636 HG3 LYS 77 HG1 LYS 77 6.975 14.093 9.466 637 HD2 LYS 77 HD2 LYS 77 5.108 15.581 9.916 638 HD3 LYS 77 HD1 LYS 77 5.570 15.661 8.219 639 HE2 LYS 77 HE2 LYS 77 3.127 15.639 8.547 640 HE3 LYS 77 HE1 LYS 77 3.689 14.270 7.598 641 HZ1 LYS 77 HZ1 LYS 77 3.513 12.873 9.549 642 HZ2 LYS 77 HZ2 LYS 77 2.033 13.637 9.257 643 HZ3 LYS 77 HZ3 LYS 77 3.040 14.191 10.495 644 H LYS 78 HN LYS 78 8.513 12.395 5.296 645 HA LYS 78 HA LYS 78 10.976 13.215 6.554 646 HB2 LYS 78 HB2 LYS 78 10.193 11.290 7.942 647 HB3 LYS 78 HB1 LYS 78 10.212 10.287 6.500 648 HG2 LYS 78 HG2 LYS 78 12.229 9.767 7.478 649 HG3 LYS 78 HG1 LYS 78 12.688 11.018 6.322 650 HD2 LYS 78 HD2 LYS 78 13.797 11.516 8.365 651 HD3 LYS 78 HD1 LYS 78 12.486 12.683 8.187 652 HE2 LYS 78 HE2 LYS 78 12.615 11.843 10.476 653 HE3 LYS 78 HE1 LYS 78 11.101 11.368 9.711 654 HZ1 LYS 78 HZ1 LYS 78 12.126 9.553 10.968 655 HZ2 LYS 78 HZ2 LYS 78 13.491 9.627 9.974 656 HZ3 LYS 78 HZ3 LYS 78 12.001 9.177 9.323 657 H ARG 79 HN ARG 79 12.405 13.499 4.929 658 HA ARG 79 HA ARG 79 11.744 12.441 2.325 659 HB2 ARG 79 HB2 ARG 79 13.519 13.823 1.467 660 HB3 ARG 79 HB1 ARG 79 12.570 14.761 2.605 661 HG2 ARG 79 HG2 ARG 79 14.628 15.388 3.284 662 HG3 ARG 79 HG1 ARG 79 14.482 13.927 4.262 663 HD2 ARG 79 HD2 ARG 79 15.669 12.666 2.509 664 HD3 ARG 79 HD1 ARG 79 15.852 14.156 1.585 665 HE ARG 79 HE ARG 79 16.972 14.805 3.936 666 HH11 ARG 79 HH11 ARG 79 17.401 12.058 1.815 667 HH12 ARG 79 HH12 ARG 79 19.056 11.799 2.266 668 HH21 ARG 79 HH21 ARG 79 19.165 14.480 4.517 669 HH22 ARG 79 HH22 ARG 79 20.056 13.175 3.801 670 H LYS 80 HN LYS 80 12.478 10.645 1.463 671 HA LYS 80 HA LYS 80 13.581 8.696 1.147 672 HB2 LYS 80 HB2 LYS 80 16.001 10.317 1.947 673 HB3 LYS 80 HB1 LYS 80 16.010 8.821 1.028 674 HG2 LYS 80 HG2 LYS 80 14.924 11.486 0.151 675 HG3 LYS 80 HG1 LYS 80 16.350 10.659 -0.464 676 HD2 LYS 80 HD2 LYS 80 13.487 9.759 -0.756 677 HD3 LYS 80 HD1 LYS 80 14.506 10.434 -2.022 678 HE2 LYS 80 HE2 LYS 80 16.010 8.510 -1.832 679 HE3 LYS 80 HE1 LYS 80 14.984 7.834 -0.567 680 HZ1 LYS 80 HZ1 LYS 80 14.331 8.212 -3.429 681 HZ2 LYS 80 HZ2 LYS 80 13.145 7.909 -2.267 682 HZ3 LYS 80 HZ3 LYS 80 14.358 6.764 -2.550 683 HA PRO 81 HA PRO 81 13.616 7.673 5.658 684 HB2 PRO 81 HB2 PRO 81 11.903 5.604 5.523 685 HB3 PRO 81 HB1 PRO 81 11.343 7.281 5.550 686 HG2 PRO 81 HG2 PRO 81 11.719 5.455 3.200 687 HG3 PRO 81 HG1 PRO 81 10.339 6.501 3.586 688 HD2 PRO 81 HD2 PRO 81 12.242 7.220 1.817 689 HD3 PRO 81 HD1 PRO 81 11.419 8.403 2.854 690 H GLN 82 HN GLN 82 14.681 6.114 2.873 691 HA GLN 82 HA GLN 82 15.738 3.840 4.394 692 HB2 GLN 82 HB2 GLN 82 16.473 3.132 1.977 693 HB3 GLN 82 HB1 GLN 82 14.822 2.886 2.516 694 HG2 GLN 82 HG2 GLN 82 14.944 3.747 0.232 695 HG3 GLN 82 HG1 GLN 82 14.092 4.844 1.312 696 HE21 GLN 82 HE21 GLN 82 16.988 4.317 -0.538 697 HE22 GLN 82 HE22 GLN 82 17.542 5.955 -0.503 698 H ALA 83 HN ALA 83 16.613 6.871 3.752 699 HA ALA 83 HA ALA 83 19.368 6.368 3.002 700 HB1 ALA 83 HB1 ALA 83 19.611 8.798 3.067 701 HB2 ALA 83 HB2 ALA 83 17.981 8.949 3.722 702 HB3 ALA 83 HB3 ALA 83 18.221 8.324 2.091 703 H1 VAL 201 HT1 VAL 201 -5.094 0.805 -15.767 704 H2 VAL 201 HT2 VAL 201 -6.136 -0.372 -16.385 705 H3 VAL 201 HT3 VAL 201 -4.472 -0.488 -16.656 706 HA VAL 201 HA VAL 201 -5.799 -0.667 -14.019 707 HB VAL 201 HB VAL 201 -4.438 -2.840 -15.626 708 HG11 VAL 201 HG11 VAL 201 -5.941 -2.956 -13.014 709 HG12 VAL 201 HG12 VAL 201 -4.200 -3.145 -13.227 710 HG13 VAL 201 HG13 VAL 201 -5.306 -4.344 -13.898 711 HG21 VAL 201 HG21 VAL 201 -6.673 -3.825 -15.856 712 HG22 VAL 201 HG22 VAL 201 -6.561 -2.252 -16.642 713 HG23 VAL 201 HG23 VAL 201 -7.372 -2.403 -15.084 714 H VAL 202 HN VAL 202 -4.479 -0.431 -12.322 715 HA VAL 202 HA VAL 202 -1.720 0.230 -12.660 716 HB VAL 202 HB VAL 202 -3.350 -0.321 -10.173 717 HG11 VAL 202 HG11 VAL 202 -1.505 0.701 -8.915 718 HG12 VAL 202 HG12 VAL 202 -0.549 0.786 -10.395 719 HG13 VAL 202 HG13 VAL 202 -0.997 -0.783 -9.723 720 HG21 VAL 202 HG21 VAL 202 -2.351 2.266 -11.353 721 HG22 VAL 202 HG22 VAL 202 -3.319 2.089 -9.890 722 HG23 VAL 202 HG23 VAL 202 -4.007 1.667 -11.458 723 HA PRO 203 HA PRO 203 -0.182 -3.945 -12.827 724 HB2 PRO 203 HB2 PRO 203 2.420 -3.304 -12.145 725 HB3 PRO 203 HB1 PRO 203 1.756 -3.222 -13.779 726 HG2 PRO 203 HG2 PRO 203 2.159 -1.042 -11.781 727 HG3 PRO 203 HG1 PRO 203 2.397 -1.013 -13.538 728 HD2 PRO 203 HD2 PRO 203 0.234 0.083 -12.384 729 HD3 PRO 203 HD1 PRO 203 0.140 -0.724 -13.964 730 H LYS 204 HN LYS 204 -0.077 -5.514 -11.382 731 HA LYS 204 HA LYS 204 -0.562 -5.100 -8.656 732 HB2 LYS 204 HB2 LYS 204 0.710 -7.594 -9.778 733 HB3 LYS 204 HB1 LYS 204 -0.382 -7.456 -8.410 734 HG2 LYS 204 HG2 LYS 204 -1.136 -6.999 -11.292 735 HG3 LYS 204 HG1 LYS 204 -1.442 -8.470 -10.374 736 HD2 LYS 204 HD2 LYS 204 -2.837 -7.180 -8.808 737 HD3 LYS 204 HD1 LYS 204 -2.558 -5.731 -9.778 738 HE2 LYS 204 HE2 LYS 204 -3.672 -6.706 -11.666 739 HE3 LYS 204 HE1 LYS 204 -3.793 -8.263 -10.852 740 HZ1 LYS 204 HZ1 LYS 204 -5.893 -7.165 -10.744 741 HZ2 LYS 204 HZ2 LYS 204 -5.201 -5.759 -10.110 742 HZ3 LYS 204 HZ3 LYS 204 -5.231 -7.174 -9.182 743 H LYS 205 HN LYS 205 0.777 -4.701 -6.969 744 HA LYS 205 HA LYS 205 3.499 -4.059 -7.587 745 HB2 LYS 205 HB2 LYS 205 1.881 -2.922 -5.880 746 HB3 LYS 205 HB1 LYS 205 2.448 -4.178 -4.791 747 HG2 LYS 205 HG2 LYS 205 3.786 -2.274 -4.392 748 HG3 LYS 205 HG1 LYS 205 4.786 -3.425 -5.282 749 HD2 LYS 205 HD2 LYS 205 4.286 -2.204 -7.366 750 HD3 LYS 205 HD1 LYS 205 3.352 -1.034 -6.435 751 HE2 LYS 205 HE2 LYS 205 5.479 -0.065 -6.781 752 HE3 LYS 205 HE1 LYS 205 5.447 -0.601 -5.103 753 HZ1 LYS 205 HZ1 LYS 205 6.678 -2.585 -5.774 754 HZ2 LYS 205 HZ2 LYS 205 7.534 -1.172 -6.146 755 HZ3 LYS 205 HZ3 LYS 205 6.730 -2.023 -7.368 756 H LYS 206 HN LYS 206 5.038 -5.495 -7.697 757 HA LYS 206 HA LYS 206 4.835 -8.045 -6.340 758 HB2 LYS 206 HB2 LYS 206 5.606 -7.746 -8.732 759 HB3 LYS 206 HB1 LYS 206 7.057 -6.994 -8.103 760 HG2 LYS 206 HG2 LYS 206 6.304 -9.731 -7.187 761 HG3 LYS 206 HG1 LYS 206 7.043 -9.510 -8.771 762 HD2 LYS 206 HD2 LYS 206 8.215 -8.584 -6.150 763 HD3 LYS 206 HD1 LYS 206 8.694 -10.038 -7.026 764 HE2 LYS 206 HE2 LYS 206 8.938 -7.200 -8.024 765 HE3 LYS 206 HE1 LYS 206 10.254 -8.199 -7.421 766 HZ1 LYS 206 HZ1 LYS 206 10.233 -8.196 -9.815 767 HZ2 LYS 206 HZ2 LYS 206 8.630 -8.735 -9.851 768 HZ3 LYS 206 HZ3 LYS 206 9.850 -9.744 -9.253 769 H ILE 207 HN ILE 207 5.251 -7.874 -4.205 770 HA ILE 207 HA ILE 207 7.577 -6.276 -3.358 771 HB ILE 207 HB ILE 207 5.337 -7.345 -1.631 772 HG12 ILE 207 HG12 ILE 207 4.606 -5.645 -3.344 773 HG13 ILE 207 HG11 ILE 207 4.336 -5.173 -1.671 774 HG21 ILE 207 HG21 ILE 207 6.197 -5.566 -0.046 775 HG22 ILE 207 HG22 ILE 207 7.616 -5.460 -1.091 776 HG23 ILE 207 HG23 ILE 207 7.235 -6.976 -0.275 777 HD11 ILE 207 HD11 ILE 207 6.247 -3.711 -1.736 778 HD12 ILE 207 HD12 ILE 207 5.166 -3.338 -3.075 779 HD13 ILE 207 HD13 ILE 207 6.647 -4.252 -3.364 780 H LYS 208 HN LYS 208 9.068 -7.922 -3.986 781 HA LYS 208 HA LYS 208 8.947 -10.413 -2.425 782 HB2 LYS 208 HB2 LYS 208 9.468 -9.913 -5.154 783 HB3 LYS 208 HB1 LYS 208 10.992 -10.418 -4.449 784 HG2 LYS 208 HG2 LYS 208 10.108 -12.416 -5.141 785 HG3 LYS 208 HG1 LYS 208 9.595 -12.367 -3.456 786 HD2 LYS 208 HD2 LYS 208 7.864 -11.455 -5.751 787 HD3 LYS 208 HD1 LYS 208 7.837 -13.095 -5.105 788 HE2 LYS 208 HE2 LYS 208 7.234 -12.184 -2.899 789 HE3 LYS 208 HE1 LYS 208 7.207 -10.565 -3.592 790 HZ1 LYS 208 HZ1 LYS 208 5.512 -12.755 -4.630 791 HZ2 LYS 208 HZ2 LYS 208 5.345 -11.086 -4.900 792 HZ3 LYS 208 HZ3 LYS 208 5.008 -11.741 -3.373 793 H LYS 209 HN LYS 209 9.768 -8.252 -1.004 794 HA LYS 209 HA LYS 209 11.375 -7.589 0.454 795 HB2 LYS 209 HB2 LYS 209 11.884 -10.011 0.643 796 HB3 LYS 209 HB1 LYS 209 13.038 -9.846 -0.671 797 HG2 LYS 209 HG2 LYS 209 14.187 -9.884 1.446 798 HG3 LYS 209 HG1 LYS 209 14.363 -8.303 0.687 799 HD2 LYS 209 HD2 LYS 209 13.940 -8.072 3.071 800 HD3 LYS 209 HD1 LYS 209 12.598 -7.415 2.137 801 HE2 LYS 209 HE2 LYS 209 11.268 -9.366 2.569 802 HE3 LYS 209 HE1 LYS 209 12.630 -10.180 3.335 803 HZ1 LYS 209 HZ1 LYS 209 11.428 -7.668 4.355 804 HZ2 LYS 209 HZ2 LYS 209 12.567 -8.644 5.134 805 HZ3 LYS 209 HZ3 LYS 209 10.983 -9.207 4.906 806 H GLU 210 HN GLU 210 12.755 -5.941 0.423 807 HA GLU 210 HA GLU 210 14.096 -4.282 -0.333 808 HB2 GLU 210 HB2 GLU 210 15.692 -6.236 -0.504 809 HB3 GLU 210 HB1 GLU 210 15.286 -6.321 -2.210 810 HG2 GLU 210 HG2 GLU 210 17.375 -5.118 -1.818 811 HG3 GLU 210 HG1 GLU 210 16.150 -4.093 -2.566 812 H GLN 211 HN GLN 211 11.993 -3.537 -1.226 813 HA GLN 211 HA GLN 211 12.203 -3.239 -4.146 814 HB2 GLN 211 HB2 GLN 211 9.756 -3.710 -2.453 815 HB3 GLN 211 HB1 GLN 211 9.645 -3.009 -4.061 816 HG2 GLN 211 HG2 GLN 211 10.887 -5.680 -3.437 817 HG3 GLN 211 HG1 GLN 211 9.237 -5.444 -4.010 818 HE21 GLN 211 HE21 GLN 211 8.877 -4.931 -6.138 819 HE22 GLN 211 HE22 GLN 211 10.118 -4.984 -7.345 820 H VAL 212 HN VAL 212 12.979 -1.626 -1.665 821 HA VAL 212 HA VAL 212 11.271 0.696 -1.850 822 HB VAL 212 HB VAL 212 12.077 0.126 0.346 823 HG11 VAL 212 HG11 VAL 212 14.135 -1.028 -0.271 824 HG12 VAL 212 HG12 VAL 212 14.441 0.207 0.951 825 HG13 VAL 212 HG13 VAL 212 14.865 0.509 -0.735 826 HG21 VAL 212 HG21 VAL 212 11.746 2.482 -0.087 827 HG22 VAL 212 HG22 VAL 212 13.396 2.629 -0.693 828 HG23 VAL 212 HG23 VAL 212 13.111 2.260 1.008 829 H GLU 213 HN GLU 213 11.605 2.448 -3.014 830 HA GLU 213 HA GLU 213 14.303 3.007 -4.028 831 HB2 GLU 213 HB2 GLU 213 12.937 1.971 -5.821 832 HB3 GLU 213 HB1 GLU 213 11.755 3.255 -5.638 833 HG2 GLU 213 HG2 GLU 213 13.252 3.587 -7.555 834 HG3 GLU 213 HG1 GLU 213 13.350 4.894 -6.375 Start of MODEL 2 1 H1 SER 1 HT1 SER 1 -19.197 -1.245 9.441 2 H2 SER 1 HT2 SER 1 -20.691 -1.921 9.863 3 H3 SER 1 HT3 SER 1 -20.335 -0.329 10.302 4 HA SER 1 HA SER 1 -20.671 -1.341 7.550 5 HB2 SER 1 HB2 SER 1 -22.772 -1.152 8.879 6 HB3 SER 1 HB1 SER 1 -22.403 0.550 9.153 7 HG SER 1 HG SER 1 -22.251 0.378 6.615 8 H GLU 2 HN GLU 2 -18.842 0.662 9.356 9 HA GLU 2 HA GLU 2 -18.915 2.855 7.427 10 HB2 GLU 2 HB2 GLU 2 -17.697 2.528 10.143 11 HB3 GLU 2 HB1 GLU 2 -17.213 3.831 9.075 12 HG2 GLU 2 HG2 GLU 2 -19.505 4.639 8.991 13 HG3 GLU 2 HG1 GLU 2 -20.011 3.315 10.038 14 H GLU 3 HN GLU 3 -17.405 -0.043 7.720 15 HA GLU 3 HA GLU 3 -14.709 0.324 7.463 16 HB2 GLU 3 HB2 GLU 3 -16.364 -1.699 5.942 17 HB3 GLU 3 HB1 GLU 3 -14.629 -1.790 6.200 18 HG2 GLU 3 HG2 GLU 3 -15.493 -3.240 7.781 19 HG3 GLU 3 HG1 GLU 3 -15.204 -1.765 8.701 20 H GLU 4 HN GLU 4 -17.028 0.238 4.753 21 HA GLU 4 HA GLU 4 -14.894 1.139 2.978 22 HB2 GLU 4 HB2 GLU 4 -16.207 -0.795 2.268 23 HB3 GLU 4 HB1 GLU 4 -17.684 0.149 2.355 24 HG2 GLU 4 HG2 GLU 4 -16.737 1.649 0.598 25 HG3 GLU 4 HG1 GLU 4 -15.396 0.515 0.441 26 H ASP 5 HN ASP 5 -17.931 2.281 4.354 27 HA ASP 5 HA ASP 5 -18.218 4.347 2.360 28 HB2 ASP 5 HB2 ASP 5 -20.188 3.212 3.355 29 HB3 ASP 5 HB1 ASP 5 -19.803 3.965 4.900 30 H LYS 6 HN LYS 6 -16.840 4.102 5.531 31 HA LYS 6 HA LYS 6 -16.768 6.975 5.911 32 HB2 LYS 6 HB2 LYS 6 -16.952 5.249 7.778 33 HB3 LYS 6 HB1 LYS 6 -15.258 4.885 7.483 34 HG2 LYS 6 HG2 LYS 6 -14.663 7.190 8.038 35 HG3 LYS 6 HG1 LYS 6 -16.367 7.556 8.324 36 HD2 LYS 6 HD2 LYS 6 -16.331 5.696 10.045 37 HD3 LYS 6 HD1 LYS 6 -14.575 5.703 9.872 38 HE2 LYS 6 HE2 LYS 6 -15.164 7.070 11.751 39 HE3 LYS 6 HE1 LYS 6 -14.592 8.120 10.455 40 HZ1 LYS 6 HZ1 LYS 6 -16.638 8.909 11.600 41 HZ2 LYS 6 HZ2 LYS 6 -17.459 7.564 10.977 42 HZ3 LYS 6 HZ3 LYS 6 -16.816 8.726 9.927 43 H CYS 7 HN CYS 7 -15.134 4.785 4.105 44 HA CYS 7 HA CYS 7 -12.569 6.191 4.203 45 HB2 CYS 7 HB2 CYS 7 -13.412 3.556 2.986 46 HB3 CYS 7 HB1 CYS 7 -11.793 4.242 2.819 47 HG CYS 7 HG CYS 7 -13.104 2.517 5.322 48 H LYS 8 HN LYS 8 -11.702 7.127 2.333 49 HA LYS 8 HA LYS 8 -13.761 7.981 0.447 50 HB2 LYS 8 HB2 LYS 8 -10.990 8.952 1.088 51 HB3 LYS 8 HB1 LYS 8 -11.771 9.417 -0.413 52 HG2 LYS 8 HG2 LYS 8 -12.060 11.127 1.248 53 HG3 LYS 8 HG1 LYS 8 -13.607 10.404 0.819 54 HD2 LYS 8 HD2 LYS 8 -13.509 9.038 2.869 55 HD3 LYS 8 HD1 LYS 8 -11.966 9.785 3.281 56 HE2 LYS 8 HE2 LYS 8 -14.599 11.222 2.982 57 HE3 LYS 8 HE1 LYS 8 -13.821 10.806 4.507 58 HZ1 LYS 8 HZ1 LYS 8 -13.416 13.106 3.903 59 HZ2 LYS 8 HZ2 LYS 8 -12.710 12.630 2.442 60 HZ3 LYS 8 HZ3 LYS 8 -11.965 12.234 3.908 61 HA PRO 9 HA PRO 9 -12.650 5.152 -2.673 62 HB2 PRO 9 HB2 PRO 9 -13.660 6.518 -4.817 63 HB3 PRO 9 HB1 PRO 9 -14.657 5.619 -3.670 64 HG2 PRO 9 HG2 PRO 9 -14.123 8.548 -3.833 65 HG3 PRO 9 HG1 PRO 9 -15.632 7.704 -3.442 66 HD2 PRO 9 HD2 PRO 9 -14.023 8.835 -1.550 67 HD3 PRO 9 HD1 PRO 9 -15.031 7.414 -1.225 68 H MET 10 HN MET 10 -10.794 4.808 -3.738 69 HA MET 10 HA MET 10 -9.051 7.096 -4.253 70 HB2 MET 10 HB2 MET 10 -8.224 5.146 -2.927 71 HB3 MET 10 HB1 MET 10 -8.394 4.147 -4.366 72 HG2 MET 10 HG2 MET 10 -6.185 4.667 -4.495 73 HG3 MET 10 HG1 MET 10 -6.874 6.001 -5.426 74 HE1 MET 10 HE1 MET 10 -5.588 4.767 -2.095 75 HE2 MET 10 HE2 MET 10 -6.899 5.702 -1.386 76 HE3 MET 10 HE3 MET 10 -5.227 6.217 -1.164 77 H SER 11 HN SER 11 -8.579 7.793 -6.272 78 HA SER 11 HA SER 11 -9.929 6.506 -8.480 79 HB2 SER 11 HB2 SER 11 -9.061 8.484 -9.778 80 HB3 SER 11 HB1 SER 11 -10.071 8.897 -8.394 81 HG SER 11 HG SER 11 -8.169 9.327 -7.208 82 H TYR 12 HN TYR 12 -8.545 6.605 -10.682 83 HA TYR 12 HA TYR 12 -6.777 4.439 -10.461 84 HB2 TYR 12 HB2 TYR 12 -7.544 4.383 -12.574 85 HB3 TYR 12 HB1 TYR 12 -7.860 6.114 -12.606 86 HD1 TYR 12 HD1 TYR 12 -5.072 3.637 -12.916 87 HD2 TYR 12 HD2 TYR 12 -6.539 7.498 -13.923 88 HE1 TYR 12 HE1 TYR 12 -3.173 3.954 -14.441 89 HE2 TYR 12 HE2 TYR 12 -4.643 7.826 -15.448 90 HH TYR 12 HH TYR 12 -2.302 6.940 -15.679 91 H GLU 13 HN GLU 13 -6.082 7.869 -11.146 92 HA GLU 13 HA GLU 13 -3.285 7.510 -11.323 93 HB2 GLU 13 HB2 GLU 13 -5.147 9.808 -11.178 94 HB3 GLU 13 HB1 GLU 13 -3.494 10.125 -10.662 95 HG2 GLU 13 HG2 GLU 13 -4.265 8.917 -13.308 96 HG3 GLU 13 HG1 GLU 13 -3.884 10.626 -13.046 97 H GLU 14 HN GLU 14 -5.420 7.939 -8.635 98 HA GLU 14 HA GLU 14 -3.398 8.639 -6.763 99 HB2 GLU 14 HB2 GLU 14 -6.232 7.693 -6.544 100 HB3 GLU 14 HB1 GLU 14 -5.220 7.838 -5.118 101 HG2 GLU 14 HG2 GLU 14 -4.880 10.218 -5.625 102 HG3 GLU 14 HG1 GLU 14 -5.933 10.051 -7.031 103 H LYS 15 HN LYS 15 -5.114 5.639 -7.578 104 HA LYS 15 HA LYS 15 -3.761 3.911 -5.865 105 HB2 LYS 15 HB2 LYS 15 -4.936 3.424 -8.589 106 HB3 LYS 15 HB1 LYS 15 -4.220 2.141 -7.624 107 HG2 LYS 15 HG2 LYS 15 -5.890 2.150 -6.083 108 HG3 LYS 15 HG1 LYS 15 -6.352 3.814 -6.429 109 HD2 LYS 15 HD2 LYS 15 -7.579 3.255 -8.245 110 HD3 LYS 15 HD1 LYS 15 -6.603 1.834 -8.613 111 HE2 LYS 15 HE2 LYS 15 -7.563 0.747 -6.611 112 HE3 LYS 15 HE1 LYS 15 -8.647 2.122 -6.417 113 HZ1 LYS 15 HZ1 LYS 15 -9.538 1.636 -8.633 114 HZ2 LYS 15 HZ2 LYS 15 -9.751 0.336 -7.579 115 HZ3 LYS 15 HZ3 LYS 15 -8.531 0.280 -8.752 116 H ARG 16 HN ARG 16 -2.865 5.039 -9.115 117 HA ARG 16 HA ARG 16 -0.501 3.511 -9.339 118 HB2 ARG 16 HB2 ARG 16 -1.535 4.696 -11.260 119 HB3 ARG 16 HB1 ARG 16 -0.996 6.219 -10.566 120 HG2 ARG 16 HG2 ARG 16 1.318 5.409 -10.664 121 HG3 ARG 16 HG1 ARG 16 0.749 3.956 -11.453 122 HD2 ARG 16 HD2 ARG 16 1.642 5.517 -13.067 123 HD3 ARG 16 HD1 ARG 16 -0.072 5.283 -13.296 124 HE ARG 16 HE ARG 16 -0.482 7.471 -12.589 125 HH11 ARG 16 HH11 ARG 16 2.933 6.663 -12.490 126 HH12 ARG 16 HH12 ARG 16 3.450 8.317 -12.455 127 HH21 ARG 16 HH21 ARG 16 0.200 9.648 -12.564 128 HH22 ARG 16 HH22 ARG 16 1.904 10.010 -12.484 129 H GLN 17 HN GLN 17 -0.995 6.861 -8.243 130 HA GLN 17 HA GLN 17 1.657 7.404 -7.568 131 HB2 GLN 17 HB2 GLN 17 -0.268 9.042 -7.686 132 HB3 GLN 17 HB1 GLN 17 -0.771 8.450 -6.110 133 HG2 GLN 17 HG2 GLN 17 0.452 10.426 -5.736 134 HG3 GLN 17 HG1 GLN 17 1.496 9.089 -5.259 135 HE21 GLN 17 HE21 GLN 17 0.934 11.597 -7.583 136 HE22 GLN 17 HE22 GLN 17 2.490 11.529 -8.336 137 H LEU 18 HN LEU 18 -0.965 6.005 -5.728 138 HA LEU 18 HA LEU 18 0.151 5.622 -3.235 139 HB2 LEU 18 HB2 LEU 18 -2.175 5.025 -4.316 140 HB3 LEU 18 HB1 LEU 18 -1.429 3.463 -4.540 141 HG LEU 18 HG LEU 18 -2.037 4.849 -1.948 142 HD11 LEU 18 HD11 LEU 18 -3.259 2.609 -1.687 143 HD12 LEU 18 HD12 LEU 18 -3.095 2.492 -3.434 144 HD13 LEU 18 HD13 LEU 18 -3.964 3.847 -2.716 145 HD21 LEU 18 HD21 LEU 18 -0.131 3.814 -1.264 146 HD22 LEU 18 HD22 LEU 18 -0.209 2.589 -2.526 147 HD23 LEU 18 HD23 LEU 18 -1.253 2.465 -1.113 148 H SER 19 HN SER 19 0.273 3.450 -6.044 149 HA SER 19 HA SER 19 1.803 1.438 -4.817 150 HB2 SER 19 HB2 SER 19 1.785 0.390 -6.894 151 HB3 SER 19 HB1 SER 19 0.384 1.452 -7.014 152 HG SER 19 HG SER 19 1.733 2.972 -8.112 153 H LEU 20 HN LEU 20 2.658 4.406 -6.348 154 HA LEU 20 HA LEU 20 5.441 3.741 -6.689 155 HB2 LEU 20 HB2 LEU 20 3.917 6.305 -7.040 156 HB3 LEU 20 HB1 LEU 20 5.596 6.100 -7.473 157 HG LEU 20 HG LEU 20 3.214 4.770 -8.710 158 HD11 LEU 20 HD11 LEU 20 3.765 7.054 -9.389 159 HD12 LEU 20 HD12 LEU 20 3.903 5.893 -10.700 160 HD13 LEU 20 HD13 LEU 20 5.354 6.504 -9.903 161 HD21 LEU 20 HD21 LEU 20 4.912 3.097 -8.497 162 HD22 LEU 20 HD22 LEU 20 6.134 4.193 -9.146 163 HD23 LEU 20 HD23 LEU 20 4.824 3.618 -10.181 164 H ASP 21 HN ASP 21 3.441 5.511 -4.441 165 HA ASP 21 HA ASP 21 5.589 6.481 -2.815 166 HB2 ASP 21 HB2 ASP 21 2.654 6.372 -2.533 167 HB3 ASP 21 HB1 ASP 21 3.677 6.862 -1.199 168 H ILE 22 HN ILE 22 3.478 3.638 -2.733 169 HA ILE 22 HA ILE 22 4.421 2.537 -0.324 170 HB ILE 22 HB ILE 22 3.107 1.509 -2.756 171 HG12 ILE 22 HG12 ILE 22 2.614 1.032 0.169 172 HG13 ILE 22 HG11 ILE 22 1.883 2.320 -0.778 173 HG21 ILE 22 HG21 ILE 22 4.418 -0.408 -0.860 174 HG22 ILE 22 HG22 ILE 22 4.898 -0.120 -2.527 175 HG23 ILE 22 HG23 ILE 22 3.322 -0.823 -2.172 176 HD11 ILE 22 HD11 ILE 22 1.531 -0.603 -1.394 177 HD12 ILE 22 HD12 ILE 22 0.665 0.762 -2.095 178 HD13 ILE 22 HD13 ILE 22 0.423 0.341 -0.402 179 H ASN 23 HN ASN 23 5.695 2.532 -3.581 180 HA ASN 23 HA ASN 23 7.729 0.622 -3.133 181 HB2 ASN 23 HB2 ASN 23 6.797 1.248 -5.357 182 HB3 ASN 23 HB1 ASN 23 7.595 2.805 -5.212 183 HD21 ASN 23 HD21 ASN 23 9.823 2.922 -5.484 184 HD22 ASN 23 HD22 ASN 23 10.753 1.613 -6.119 185 H LYS 24 HN LYS 24 7.365 3.908 -2.291 186 HA LYS 24 HA LYS 24 10.137 4.587 -2.095 187 HB2 LYS 24 HB2 LYS 24 7.567 5.813 -1.235 188 HB3 LYS 24 HB1 LYS 24 9.052 6.381 -0.485 189 HG2 LYS 24 HG2 LYS 24 9.936 7.020 -2.638 190 HG3 LYS 24 HG1 LYS 24 8.531 6.328 -3.453 191 HD2 LYS 24 HD2 LYS 24 7.093 7.987 -2.626 192 HD3 LYS 24 HD1 LYS 24 8.237 8.486 -1.382 193 HE2 LYS 24 HE2 LYS 24 8.574 8.880 -4.361 194 HE3 LYS 24 HE1 LYS 24 8.128 10.120 -3.186 195 HZ1 LYS 24 HZ1 LYS 24 10.690 8.615 -3.223 196 HZ2 LYS 24 HZ2 LYS 24 10.266 9.809 -2.102 197 HZ3 LYS 24 HZ3 LYS 24 10.481 10.215 -3.730 198 H LEU 25 HN LEU 25 7.849 2.963 -0.076 199 HA LEU 25 HA LEU 25 9.048 3.486 2.431 200 HB2 LEU 25 HB2 LEU 25 7.216 1.289 1.506 201 HB3 LEU 25 HB1 LEU 25 7.763 1.445 3.163 202 HG LEU 25 HG LEU 25 5.932 3.258 1.629 203 HD11 LEU 25 HD11 LEU 25 5.794 1.912 4.297 204 HD12 LEU 25 HD12 LEU 25 5.003 1.338 2.828 205 HD13 LEU 25 HD13 LEU 25 4.510 2.868 3.563 206 HD21 LEU 25 HD21 LEU 25 7.308 3.843 4.226 207 HD22 LEU 25 HD22 LEU 25 6.022 4.807 3.510 208 HD23 LEU 25 HD23 LEU 25 7.587 4.688 2.709 209 HA PRO 26 HA PRO 26 12.493 0.620 2.327 210 HB2 PRO 26 HB2 PRO 26 12.950 0.588 5.019 211 HB3 PRO 26 HB1 PRO 26 13.524 1.871 3.952 212 HG2 PRO 26 HG2 PRO 26 11.154 1.818 5.764 213 HG3 PRO 26 HG1 PRO 26 12.264 3.153 5.426 214 HD2 PRO 26 HD2 PRO 26 9.785 2.959 4.319 215 HD3 PRO 26 HD1 PRO 26 11.144 3.755 3.499 216 H GLY 27 HN GLY 27 12.971 -1.521 3.183 217 HA2 GLY 27 HA2 GLY 27 10.929 -3.300 2.863 218 HA3 GLY 27 HA1 GLY 27 12.396 -3.675 3.743 219 H GLU 28 HN GLU 28 12.168 -2.236 6.027 220 HA GLU 28 HA GLU 28 10.404 -3.810 7.541 221 HB2 GLU 28 HB2 GLU 28 10.888 -1.778 9.245 222 HB3 GLU 28 HB1 GLU 28 11.977 -3.125 8.981 223 HG2 GLU 28 HG2 GLU 28 12.174 -0.566 7.443 224 HG3 GLU 28 HG1 GLU 28 12.960 -0.804 8.997 225 H LYS 29 HN LYS 29 10.081 -0.493 6.353 226 HA LYS 29 HA LYS 29 7.699 -0.012 7.864 227 HB2 LYS 29 HB2 LYS 29 9.329 1.476 5.908 228 HB3 LYS 29 HB1 LYS 29 7.625 1.892 5.933 229 HG2 LYS 29 HG2 LYS 29 8.909 3.378 7.345 230 HG3 LYS 29 HG1 LYS 29 7.785 2.423 8.309 231 HD2 LYS 29 HD2 LYS 29 9.434 1.292 9.365 232 HD3 LYS 29 HD1 LYS 29 10.518 1.341 7.967 233 HE2 LYS 29 HE2 LYS 29 11.335 2.701 9.852 234 HE3 LYS 29 HE1 LYS 29 11.029 3.664 8.405 235 HZ1 LYS 29 HZ1 LYS 29 9.241 3.435 10.770 236 HZ2 LYS 29 HZ2 LYS 29 8.892 4.324 9.381 237 HZ3 LYS 29 HZ3 LYS 29 10.186 4.776 10.369 238 H LEU 30 HN LEU 30 8.465 -1.270 4.711 239 HA LEU 30 HA LEU 30 5.760 -0.944 3.768 240 HB2 LEU 30 HB2 LEU 30 6.808 -0.888 1.845 241 HB3 LEU 30 HB1 LEU 30 8.304 -1.438 2.562 242 HG LEU 30 HG LEU 30 6.171 -3.353 1.671 243 HD11 LEU 30 HD11 LEU 30 8.306 -2.010 0.126 244 HD12 LEU 30 HD12 LEU 30 6.604 -2.151 -0.274 245 HD13 LEU 30 HD13 LEU 30 7.659 -3.563 -0.365 246 HD21 LEU 30 HD21 LEU 30 7.978 -4.168 3.176 247 HD22 LEU 30 HD22 LEU 30 9.150 -3.674 1.955 248 HD23 LEU 30 HD23 LEU 30 7.977 -4.938 1.591 249 H GLY 31 HN GLY 31 7.438 -3.281 5.584 250 HA2 GLY 31 HA2 GLY 31 5.770 -5.517 5.053 251 HA3 GLY 31 HA1 GLY 31 6.624 -5.219 6.554 252 H ARG 32 HN ARG 32 5.143 -2.483 6.568 253 HA ARG 32 HA ARG 32 2.863 -3.381 8.058 254 HB2 ARG 32 HB2 ARG 32 3.955 -1.303 8.701 255 HB3 ARG 32 HB1 ARG 32 3.567 -0.596 7.143 256 HG2 ARG 32 HG2 ARG 32 1.656 0.136 7.992 257 HG3 ARG 32 HG1 ARG 32 1.151 -1.538 8.218 258 HD2 ARG 32 HD2 ARG 32 2.770 0.055 10.196 259 HD3 ARG 32 HD1 ARG 32 1.028 -0.225 10.302 260 HE ARG 32 HE ARG 32 2.766 -2.569 10.178 261 HH11 ARG 32 HH11 ARG 32 0.840 -0.405 12.141 262 HH12 ARG 32 HH12 ARG 32 0.726 -1.513 13.471 263 HH21 ARG 32 HH21 ARG 32 2.630 -4.024 11.925 264 HH22 ARG 32 HH22 ARG 32 1.751 -3.570 13.354 265 H VAL 33 HN VAL 33 3.317 -1.899 4.839 266 HA VAL 33 HA VAL 33 0.576 -1.621 4.277 267 HB VAL 33 HB VAL 33 1.692 -2.289 1.814 268 HG11 VAL 33 HG11 VAL 33 1.204 0.308 3.225 269 HG12 VAL 33 HG12 VAL 33 0.173 -0.512 2.052 270 HG13 VAL 33 HG13 VAL 33 1.682 0.224 1.534 271 HG21 VAL 33 HG21 VAL 33 3.595 -0.417 3.156 272 HG22 VAL 33 HG22 VAL 33 3.758 -1.232 1.597 273 HG23 VAL 33 HG23 VAL 33 3.914 -2.151 3.097 274 H VAL 34 HN VAL 34 2.784 -4.272 3.543 275 HA VAL 34 HA VAL 34 0.995 -6.159 2.620 276 HB VAL 34 HB VAL 34 2.622 -7.692 2.927 277 HG11 VAL 34 HG11 VAL 34 3.892 -5.815 2.156 278 HG12 VAL 34 HG12 VAL 34 4.866 -6.815 3.232 279 HG13 VAL 34 HG13 VAL 34 4.179 -5.300 3.816 280 HG21 VAL 34 HG21 VAL 34 2.076 -8.057 5.275 281 HG22 VAL 34 HG22 VAL 34 3.152 -6.726 5.719 282 HG23 VAL 34 HG23 VAL 34 3.813 -8.180 4.969 283 H HIS 35 HN HIS 35 1.571 -5.177 5.985 284 HA HIS 35 HA HIS 35 -0.074 -7.202 7.117 285 HB2 HIS 35 HB2 HIS 35 1.718 -6.134 8.402 286 HB3 HIS 35 HB1 HIS 35 0.882 -4.588 8.303 287 HD1 HIS 35 HD1 HIS 35 0.469 -8.028 9.835 288 HD2 HIS 35 HD2 HIS 35 -0.952 -4.144 10.280 289 HE1 HIS 35 HE1 HIS 35 -0.906 -8.048 11.935 290 HE2 HIS 35 HE2 HIS 35 -1.883 -5.735 12.096 291 H ILE 36 HN ILE 36 -0.569 -3.752 6.447 292 HA ILE 36 HA ILE 36 -3.223 -3.563 7.340 293 HB ILE 36 HB ILE 36 -1.919 -2.094 5.038 294 HG12 ILE 36 HG12 ILE 36 -2.367 -1.118 7.857 295 HG13 ILE 36 HG11 ILE 36 -0.892 -1.950 7.389 296 HG21 ILE 36 HG21 ILE 36 -3.775 -0.659 4.986 297 HG22 ILE 36 HG22 ILE 36 -4.260 -1.110 6.622 298 HG23 ILE 36 HG23 ILE 36 -4.503 -2.233 5.294 299 HD11 ILE 36 HD11 ILE 36 -0.601 -0.172 5.649 300 HD12 ILE 36 HD12 ILE 36 -0.448 0.358 7.317 301 HD13 ILE 36 HD13 ILE 36 -1.920 0.681 6.418 302 H ILE 37 HN ILE 37 -1.857 -4.338 4.208 303 HA ILE 37 HA ILE 37 -4.247 -4.737 2.820 304 HB ILE 37 HB ILE 37 -1.434 -5.626 2.429 305 HG12 ILE 37 HG12 ILE 37 -3.155 -3.929 0.657 306 HG13 ILE 37 HG11 ILE 37 -2.327 -3.264 2.052 307 HG21 ILE 37 HG21 ILE 37 -3.756 -6.849 1.287 308 HG22 ILE 37 HG22 ILE 37 -2.056 -7.299 1.118 309 HG23 ILE 37 HG23 ILE 37 -2.763 -6.102 0.035 310 HD11 ILE 37 HD11 ILE 37 -0.980 -2.825 0.196 311 HD12 ILE 37 HD12 ILE 37 -1.116 -4.492 -0.380 312 HD13 ILE 37 HD13 ILE 37 -0.200 -4.137 1.086 313 H GLN 38 HN GLN 38 -2.067 -7.256 4.148 314 HA GLN 38 HA GLN 38 -3.730 -9.426 3.737 315 HB2 GLN 38 HB2 GLN 38 -1.784 -8.936 6.003 316 HB3 GLN 38 HB1 GLN 38 -2.535 -10.493 5.684 317 HG2 GLN 38 HG2 GLN 38 -1.439 -10.574 3.501 318 HG3 GLN 38 HG1 GLN 38 -0.740 -8.992 3.807 319 HE21 GLN 38 HE21 GLN 38 -1.090 -11.478 6.250 320 HE22 GLN 38 HE22 GLN 38 0.601 -11.798 6.429 321 H SER 39 HN SER 39 -3.948 -7.017 6.298 322 HA SER 39 HA SER 39 -5.802 -8.602 7.852 323 HB2 SER 39 HB2 SER 39 -5.927 -6.612 9.324 324 HB3 SER 39 HB1 SER 39 -4.278 -7.143 9.027 325 HG SER 39 HG SER 39 -3.927 -5.439 7.728 326 H ARG 40 HN ARG 40 -6.019 -5.633 5.889 327 HA ARG 40 HA ARG 40 -8.873 -5.474 6.143 328 HB2 ARG 40 HB2 ARG 40 -6.835 -4.028 4.536 329 HB3 ARG 40 HB1 ARG 40 -8.523 -3.950 4.032 330 HG2 ARG 40 HG2 ARG 40 -8.601 -2.240 5.415 331 HG3 ARG 40 HG1 ARG 40 -8.714 -3.437 6.676 332 HD2 ARG 40 HD2 ARG 40 -6.204 -3.387 6.758 333 HD3 ARG 40 HD1 ARG 40 -6.304 -1.971 5.711 334 HE ARG 40 HE ARG 40 -6.967 -2.132 8.531 335 HH11 ARG 40 HH11 ARG 40 -7.286 -0.247 5.594 336 HH12 ARG 40 HH12 ARG 40 -7.564 1.243 6.433 337 HH21 ARG 40 HH21 ARG 40 -7.328 -0.172 9.627 338 HH22 ARG 40 HH22 ARG 40 -7.570 1.288 8.723 339 H GLU 41 HN GLU 41 -6.665 -7.060 4.038 340 HA GLU 41 HA GLU 41 -8.886 -8.114 2.412 341 HB2 GLU 41 HB2 GLU 41 -5.958 -8.350 1.738 342 HB3 GLU 41 HB1 GLU 41 -7.343 -8.520 0.670 343 HG2 GLU 41 HG2 GLU 41 -6.575 -5.922 1.953 344 HG3 GLU 41 HG1 GLU 41 -5.948 -6.459 0.392 345 HA PRO 42 HA PRO 42 -7.290 -11.467 5.269 346 HB2 PRO 42 HB2 PRO 42 -10.125 -12.295 5.276 347 HB3 PRO 42 HB1 PRO 42 -9.039 -12.003 6.639 348 HG2 PRO 42 HG2 PRO 42 -11.038 -10.313 6.047 349 HG3 PRO 42 HG1 PRO 42 -9.484 -9.737 6.679 350 HD2 PRO 42 HD2 PRO 42 -10.506 -9.723 3.862 351 HD3 PRO 42 HD1 PRO 42 -9.603 -8.470 4.738 352 H SER 43 HN SER 43 -8.909 -11.268 2.311 353 HA SER 43 HA SER 43 -9.094 -14.008 1.627 354 HB2 SER 43 HB2 SER 43 -8.743 -11.625 -0.208 355 HB3 SER 43 HB1 SER 43 -9.388 -13.206 -0.648 356 HG SER 43 HG SER 43 -11.049 -12.755 1.005 357 H LEU 44 HN LEU 44 -6.439 -11.816 1.878 358 HA LEU 44 HA LEU 44 -4.735 -13.794 0.527 359 HB2 LEU 44 HB2 LEU 44 -3.223 -11.938 -0.080 360 HB3 LEU 44 HB1 LEU 44 -4.800 -11.803 -0.799 361 HG LEU 44 HG LEU 44 -5.151 -10.248 1.362 362 HD11 LEU 44 HD11 LEU 44 -3.111 -8.813 1.448 363 HD12 LEU 44 HD12 LEU 44 -2.246 -10.098 0.608 364 HD13 LEU 44 HD13 LEU 44 -2.939 -10.396 2.203 365 HD21 LEU 44 HD21 LEU 44 -5.701 -9.633 -0.891 366 HD22 LEU 44 HD22 LEU 44 -3.997 -9.507 -1.320 367 HD23 LEU 44 HD23 LEU 44 -4.708 -8.363 -0.181 368 H LYS 45 HN LYS 45 -5.554 -13.552 3.372 369 HA LYS 45 HA LYS 45 -3.315 -12.683 4.887 370 HB2 LYS 45 HB2 LYS 45 -4.322 -13.766 6.776 371 HB3 LYS 45 HB1 LYS 45 -5.572 -12.948 5.856 372 HG2 LYS 45 HG2 LYS 45 -6.287 -15.052 4.899 373 HG3 LYS 45 HG1 LYS 45 -4.976 -15.893 5.731 374 HD2 LYS 45 HD2 LYS 45 -7.096 -14.334 7.190 375 HD3 LYS 45 HD1 LYS 45 -7.256 -16.049 6.810 376 HE2 LYS 45 HE2 LYS 45 -6.340 -16.214 8.892 377 HE3 LYS 45 HE1 LYS 45 -4.872 -16.157 7.920 378 HZ1 LYS 45 HZ1 LYS 45 -6.109 -13.844 9.315 379 HZ2 LYS 45 HZ2 LYS 45 -4.698 -13.790 8.391 380 HZ3 LYS 45 HZ3 LYS 45 -4.733 -14.679 9.826 381 H ASN 46 HN ASN 46 -3.917 -15.539 3.066 382 HA ASN 46 HA ASN 46 -2.081 -17.248 4.420 383 HB2 ASN 46 HB2 ASN 46 -3.813 -18.164 2.960 384 HB3 ASN 46 HB1 ASN 46 -3.121 -17.324 1.576 385 HD21 ASN 46 HD21 ASN 46 -1.330 -18.154 0.566 386 HD22 ASN 46 HD22 ASN 46 -0.677 -19.721 0.939 387 H SER 47 HN SER 47 -1.783 -14.726 2.092 388 HA SER 47 HA SER 47 0.680 -15.435 0.925 389 HB2 SER 47 HB2 SER 47 -0.676 -12.760 1.272 390 HB3 SER 47 HB1 SER 47 0.772 -13.001 0.287 391 HG SER 47 HG SER 47 -0.452 -14.535 -0.942 392 H ASN 48 HN ASN 48 2.773 -14.895 1.402 393 HA ASN 48 HA ASN 48 3.385 -14.575 4.173 394 HB2 ASN 48 HB2 ASN 48 5.196 -14.572 1.757 395 HB3 ASN 48 HB1 ASN 48 5.746 -14.634 3.424 396 HD21 ASN 48 HD21 ASN 48 5.477 -16.525 4.610 397 HD22 ASN 48 HD22 ASN 48 5.098 -18.037 3.859 398 HA PRO 49 HA PRO 49 3.356 -10.235 4.452 399 HB2 PRO 49 HB2 PRO 49 5.050 -9.921 6.563 400 HB3 PRO 49 HB1 PRO 49 3.389 -10.495 6.713 401 HG2 PRO 49 HG2 PRO 49 5.928 -12.067 6.648 402 HG3 PRO 49 HG1 PRO 49 4.515 -12.253 7.703 403 HD2 PRO 49 HD2 PRO 49 4.909 -13.845 5.575 404 HD3 PRO 49 HD1 PRO 49 3.282 -13.341 6.077 405 H ASP 50 HN ASP 50 6.380 -11.896 3.977 406 HA ASP 50 HA ASP 50 7.664 -9.349 3.292 407 HB2 ASP 50 HB2 ASP 50 8.854 -12.104 3.671 408 HB3 ASP 50 HB1 ASP 50 9.775 -10.684 3.189 409 H GLU 51 HN GLU 51 5.717 -11.347 1.750 410 HA GLU 51 HA GLU 51 7.112 -10.986 -0.799 411 HB2 GLU 51 HB2 GLU 51 5.829 -13.621 -0.061 412 HB3 GLU 51 HB1 GLU 51 6.725 -13.248 -1.527 413 HG2 GLU 51 HG2 GLU 51 8.712 -12.807 0.043 414 HG3 GLU 51 HG1 GLU 51 7.757 -13.659 1.254 415 H ILE 52 HN ILE 52 4.925 -9.666 0.499 416 HA ILE 52 HA ILE 52 2.437 -10.664 -0.396 417 HB ILE 52 HB ILE 52 3.042 -8.968 1.527 418 HG12 ILE 52 HG12 ILE 52 0.676 -8.259 1.532 419 HG13 ILE 52 HG11 ILE 52 0.509 -8.837 -0.115 420 HG21 ILE 52 HG21 ILE 52 2.330 -7.165 -0.766 421 HG22 ILE 52 HG22 ILE 52 3.876 -7.209 0.079 422 HG23 ILE 52 HG23 ILE 52 2.420 -6.674 0.921 423 HD11 ILE 52 HD11 ILE 52 1.221 -10.518 2.242 424 HD12 ILE 52 HD12 ILE 52 0.918 -11.086 0.604 425 HD13 ILE 52 HD13 ILE 52 -0.388 -10.376 1.549 426 H GLU 53 HN GLU 53 1.036 -9.860 -1.884 427 HA GLU 53 HA GLU 53 2.259 -8.366 -4.114 428 HB2 GLU 53 HB2 GLU 53 0.037 -10.424 -4.176 429 HB3 GLU 53 HB1 GLU 53 0.566 -9.487 -5.561 430 HG2 GLU 53 HG2 GLU 53 2.485 -11.228 -4.066 431 HG3 GLU 53 HG1 GLU 53 1.408 -11.901 -5.292 432 H ILE 54 HN ILE 54 1.631 -6.308 -3.579 433 HA ILE 54 HA ILE 54 -0.942 -5.711 -2.501 434 HB ILE 54 HB ILE 54 1.050 -3.849 -3.805 435 HG12 ILE 54 HG12 ILE 54 0.805 -4.716 -0.922 436 HG13 ILE 54 HG11 ILE 54 2.171 -4.984 -1.998 437 HG21 ILE 54 HG21 ILE 54 -1.133 -3.273 -1.838 438 HG22 ILE 54 HG22 ILE 54 -1.205 -2.947 -3.566 439 HG23 ILE 54 HG23 ILE 54 -0.033 -2.102 -2.555 440 HD11 ILE 54 HD11 ILE 54 2.642 -3.163 -0.450 441 HD12 ILE 54 HD12 ILE 54 1.200 -2.327 -1.000 442 HD13 ILE 54 HD13 ILE 54 2.549 -2.570 -2.105 443 H ASP 55 HN ASP 55 -2.665 -6.101 -3.808 444 HA ASP 55 HA ASP 55 -2.519 -5.221 -6.611 445 HB2 ASP 55 HB2 ASP 55 -3.088 -7.612 -6.298 446 HB3 ASP 55 HB1 ASP 55 -4.467 -7.142 -5.309 447 H PHE 56 HN PHE 56 -3.157 -3.183 -6.709 448 HA PHE 56 HA PHE 56 -4.738 -2.013 -4.677 449 HB2 PHE 56 HB2 PHE 56 -3.793 -0.875 -7.295 450 HB3 PHE 56 HB1 PHE 56 -4.508 0.063 -5.987 451 HD1 PHE 56 HD1 PHE 56 -3.332 0.208 -3.827 452 HD2 PHE 56 HD2 PHE 56 -1.501 -1.512 -7.236 453 HE1 PHE 56 HE1 PHE 56 -1.175 0.463 -2.748 454 HE2 PHE 56 HE2 PHE 56 0.700 -1.254 -6.163 455 HZ PHE 56 HZ PHE 56 0.853 -0.259 -3.908 456 H GLU 57 HN GLU 57 -5.719 -3.741 -7.362 457 HA GLU 57 HA GLU 57 -8.157 -2.227 -7.786 458 HB2 GLU 57 HB2 GLU 57 -7.032 -4.742 -8.983 459 HB3 GLU 57 HB1 GLU 57 -8.694 -4.250 -9.288 460 HG2 GLU 57 HG2 GLU 57 -6.214 -2.672 -9.939 461 HG3 GLU 57 HG1 GLU 57 -7.243 -3.536 -11.076 462 H THR 58 HN THR 58 -7.087 -5.185 -6.229 463 HA THR 58 HA THR 58 -9.795 -5.853 -5.434 464 HB THR 58 HB THR 58 -8.691 -7.758 -4.229 465 HG1 THR 58 HG1 THR 58 -6.355 -6.896 -5.625 466 HG21 THR 58 HG21 THR 58 -8.077 -7.445 -7.168 467 HG22 THR 58 HG22 THR 58 -9.580 -8.050 -6.474 468 HG23 THR 58 HG23 THR 58 -8.089 -8.975 -6.288 469 H LEU 59 HN LEU 59 -6.927 -4.376 -4.075 470 HA LEU 59 HA LEU 59 -7.547 -4.354 -1.360 471 HB2 LEU 59 HB2 LEU 59 -6.254 -2.204 -3.008 472 HB3 LEU 59 HB1 LEU 59 -6.258 -2.273 -1.262 473 HG LEU 59 HG LEU 59 -4.956 -4.234 -3.131 474 HD11 LEU 59 HD11 LEU 59 -3.775 -2.385 -1.087 475 HD12 LEU 59 HD12 LEU 59 -3.812 -2.076 -2.822 476 HD13 LEU 59 HD13 LEU 59 -2.909 -3.450 -2.190 477 HD21 LEU 59 HD21 LEU 59 -5.378 -4.281 -0.158 478 HD22 LEU 59 HD22 LEU 59 -4.062 -5.158 -0.946 479 HD23 LEU 59 HD23 LEU 59 -5.734 -5.535 -1.353 480 H LYS 60 HN LYS 60 -9.250 -3.564 -0.323 481 HA LYS 60 HA LYS 60 -11.261 -2.025 -1.581 482 HB2 LYS 60 HB2 LYS 60 -10.698 -2.634 1.318 483 HB3 LYS 60 HB1 LYS 60 -12.116 -1.741 0.790 484 HG2 LYS 60 HG2 LYS 60 -12.870 -3.651 -0.491 485 HG3 LYS 60 HG1 LYS 60 -11.399 -4.528 -0.072 486 HD2 LYS 60 HD2 LYS 60 -13.415 -3.540 1.938 487 HD3 LYS 60 HD1 LYS 60 -13.386 -5.178 1.284 488 HE2 LYS 60 HE2 LYS 60 -11.034 -5.372 2.124 489 HE3 LYS 60 HE1 LYS 60 -11.256 -3.822 2.931 490 HZ1 LYS 60 HZ1 LYS 60 -13.065 -4.787 4.212 491 HZ2 LYS 60 HZ2 LYS 60 -11.641 -5.674 4.429 492 HZ3 LYS 60 HZ3 LYS 60 -12.862 -6.270 3.425 493 HA PRO 61 HA PRO 61 -10.007 2.243 -1.324 494 HB2 PRO 61 HB2 PRO 61 -12.532 2.577 0.242 495 HB3 PRO 61 HB1 PRO 61 -11.906 3.542 -1.100 496 HG2 PRO 61 HG2 PRO 61 -13.851 1.768 -1.483 497 HG3 PRO 61 HG1 PRO 61 -12.585 2.044 -2.686 498 HD2 PRO 61 HD2 PRO 61 -12.992 -0.275 -0.879 499 HD3 PRO 61 HD1 PRO 61 -12.186 -0.201 -2.460 500 H SER 62 HN SER 62 -11.412 0.745 1.543 501 HA SER 62 HA SER 62 -10.409 2.368 3.544 502 HB2 SER 62 HB2 SER 62 -10.547 -0.620 3.843 503 HB3 SER 62 HB1 SER 62 -10.991 0.633 5.005 504 HG SER 62 HG SER 62 -12.927 0.677 4.181 505 H THR 63 HN THR 63 -8.956 -0.570 2.140 506 HA THR 63 HA THR 63 -6.567 -0.462 3.648 507 HB THR 63 HB THR 63 -6.577 -1.613 0.892 508 HG1 THR 63 HG1 THR 63 -7.877 -3.352 1.567 509 HG21 THR 63 HG21 THR 63 -4.614 -2.216 1.937 510 HG22 THR 63 HG22 THR 63 -5.656 -3.574 2.376 511 HG23 THR 63 HG23 THR 63 -5.376 -2.275 3.530 512 H LEU 64 HN LEU 64 -7.351 0.572 0.327 513 HA LEU 64 HA LEU 64 -4.820 1.425 -0.427 514 HB2 LEU 64 HB2 LEU 64 -7.515 2.471 -1.256 515 HB3 LEU 64 HB1 LEU 64 -6.019 2.871 -2.064 516 HG LEU 64 HG LEU 64 -7.119 0.078 -1.813 517 HD11 LEU 64 HD11 LEU 64 -7.910 2.226 -3.496 518 HD12 LEU 64 HD12 LEU 64 -8.487 0.561 -3.486 519 HD13 LEU 64 HD13 LEU 64 -7.098 1.008 -4.477 520 HD21 LEU 64 HD21 LEU 64 -4.754 1.302 -3.202 521 HD22 LEU 64 HD22 LEU 64 -5.459 -0.230 -3.728 522 HD23 LEU 64 HD23 LEU 64 -4.803 -0.077 -2.098 523 H ARG 65 HN ARG 65 -7.447 3.360 1.030 524 HA ARG 65 HA ARG 65 -5.960 5.759 1.083 525 HB2 ARG 65 HB2 ARG 65 -8.345 4.839 2.661 526 HB3 ARG 65 HB1 ARG 65 -7.626 6.432 2.860 527 HG2 ARG 65 HG2 ARG 65 -8.683 5.362 0.255 528 HG3 ARG 65 HG1 ARG 65 -9.590 6.393 1.358 529 HD2 ARG 65 HD2 ARG 65 -7.941 8.159 1.105 530 HD3 ARG 65 HD1 ARG 65 -6.975 7.131 0.053 531 HE ARG 65 HE ARG 65 -9.659 7.499 -0.887 532 HH11 ARG 65 HH11 ARG 65 -6.442 8.908 -0.833 533 HH12 ARG 65 HH12 ARG 65 -6.668 9.777 -2.321 534 HH21 ARG 65 HH21 ARG 65 -9.943 8.674 -2.853 535 HH22 ARG 65 HH22 ARG 65 -8.633 9.647 -3.454 536 H GLU 66 HN GLU 66 -6.156 3.031 3.280 537 HA GLU 66 HA GLU 66 -4.731 4.288 5.400 538 HB2 GLU 66 HB2 GLU 66 -6.062 2.288 5.786 539 HB3 GLU 66 HB1 GLU 66 -5.074 1.376 4.652 540 HG2 GLU 66 HG2 GLU 66 -4.350 0.737 6.773 541 HG3 GLU 66 HG1 GLU 66 -3.125 1.853 6.171 542 H LEU 67 HN LEU 67 -3.749 1.987 2.848 543 HA LEU 67 HA LEU 67 -1.030 1.872 3.290 544 HB2 LEU 67 HB2 LEU 67 -2.203 2.052 0.502 545 HB3 LEU 67 HB1 LEU 67 -0.816 1.118 1.050 546 HG LEU 67 HG LEU 67 -3.655 0.530 1.854 547 HD11 LEU 67 HD11 LEU 67 -2.071 -1.216 0.074 548 HD12 LEU 67 HD12 LEU 67 -2.811 0.223 -0.626 549 HD13 LEU 67 HD13 LEU 67 -3.815 -0.987 0.175 550 HD21 LEU 67 HD21 LEU 67 -1.331 -0.180 3.088 551 HD22 LEU 67 HD22 LEU 67 -1.610 -1.539 2.011 552 HD23 LEU 67 HD23 LEU 67 -2.845 -1.075 3.180 553 H GLU 68 HN GLU 68 -2.770 4.173 1.196 554 HA GLU 68 HA GLU 68 -0.602 5.755 0.429 555 HB2 GLU 68 HB2 GLU 68 -2.880 5.869 -0.561 556 HB3 GLU 68 HB1 GLU 68 -3.457 6.637 0.908 557 HG2 GLU 68 HG2 GLU 68 -1.799 8.463 0.487 558 HG3 GLU 68 HG1 GLU 68 -1.516 7.737 -1.096 559 H ARG 69 HN ARG 69 -3.000 6.525 2.951 560 HA ARG 69 HA ARG 69 -1.704 8.766 4.004 561 HB2 ARG 69 HB2 ARG 69 -3.707 6.812 5.021 562 HB3 ARG 69 HB1 ARG 69 -3.107 8.052 6.099 563 HG2 ARG 69 HG2 ARG 69 -4.085 8.927 3.450 564 HG3 ARG 69 HG1 ARG 69 -5.293 8.346 4.600 565 HD2 ARG 69 HD2 ARG 69 -5.059 10.732 4.821 566 HD3 ARG 69 HD1 ARG 69 -4.414 9.944 6.260 567 HE ARG 69 HE ARG 69 -2.384 10.443 4.320 568 HH11 ARG 69 HH11 ARG 69 -4.293 11.959 6.837 569 HH12 ARG 69 HH12 ARG 69 -3.111 13.187 7.165 570 HH21 ARG 69 HH21 ARG 69 -0.835 12.052 4.752 571 HH22 ARG 69 HH22 ARG 69 -1.145 13.236 5.983 572 H TYR 70 HN TYR 70 -1.088 5.409 4.472 573 HA TYR 70 HA TYR 70 0.323 5.704 6.944 574 HB2 TYR 70 HB2 TYR 70 -0.587 3.550 6.538 575 HB3 TYR 70 HB1 TYR 70 0.128 3.483 4.935 576 HD1 TYR 70 HD2 TYR 70 1.230 3.922 8.481 577 HD2 TYR 70 HD1 TYR 70 1.971 2.231 4.659 578 HE1 TYR 70 HE2 TYR 70 3.242 2.831 9.373 579 HE2 TYR 70 HE1 TYR 70 3.970 1.121 5.528 580 HH TYR 70 HH TYR 70 5.480 1.145 7.276 581 H VAL 71 HN VAL 71 1.273 5.177 3.551 582 HA VAL 71 HA VAL 71 4.037 5.335 4.064 583 HB VAL 71 HB VAL 71 4.409 5.568 1.744 584 HG11 VAL 71 HG11 VAL 71 2.542 4.037 0.760 585 HG12 VAL 71 HG12 VAL 71 2.121 3.831 2.459 586 HG13 VAL 71 HG13 VAL 71 3.737 3.410 1.889 587 HG21 VAL 71 HG21 VAL 71 2.873 6.286 0.150 588 HG22 VAL 71 HG22 VAL 71 2.853 7.480 1.435 589 HG23 VAL 71 HG23 VAL 71 1.543 6.303 1.291 590 H THR 72 HN THR 72 1.547 7.758 3.568 591 HA THR 72 HA THR 72 3.286 9.863 2.934 592 HB THR 72 HB THR 72 1.436 11.392 3.479 593 HG1 THR 72 HG1 THR 72 0.586 9.988 5.240 594 HG21 THR 72 HG21 THR 72 1.013 8.949 1.831 595 HG22 THR 72 HG22 THR 72 1.382 10.594 1.302 596 HG23 THR 72 HG23 THR 72 -0.231 10.199 1.904 597 H SER 73 HN SER 73 2.364 8.405 5.929 598 HA SER 73 HA SER 73 3.273 10.490 7.636 599 HB2 SER 73 HB2 SER 73 2.945 8.965 9.416 600 HB3 SER 73 HB1 SER 73 1.721 8.541 8.215 601 HG SER 73 HG SER 73 2.955 6.795 7.590 602 H CYS 74 HN CYS 74 4.822 8.051 5.782 603 HA CYS 74 HA CYS 74 7.379 8.503 7.151 604 HB2 CYS 74 HB2 CYS 74 6.852 6.160 6.811 605 HB3 CYS 74 HB1 CYS 74 6.614 6.437 5.087 606 HG CYS 74 HG CYS 74 9.500 7.463 5.224 607 H LEU 75 HN LEU 75 5.696 9.218 4.212 608 HA LEU 75 HA LEU 75 8.172 9.890 2.820 609 HB2 LEU 75 HB2 LEU 75 5.357 9.763 1.752 610 HB3 LEU 75 HB1 LEU 75 6.813 9.893 0.809 611 HG LEU 75 HG LEU 75 5.819 7.520 2.338 612 HD11 LEU 75 HD11 LEU 75 5.074 8.054 -0.036 613 HD12 LEU 75 HD12 LEU 75 5.753 6.453 0.256 614 HD13 LEU 75 HD13 LEU 75 6.733 7.700 -0.508 615 HD21 LEU 75 HD21 LEU 75 7.875 6.377 1.873 616 HD22 LEU 75 HD22 LEU 75 8.242 7.844 2.777 617 HD23 LEU 75 HD23 LEU 75 8.525 7.786 1.037 618 H ARG 76 HN ARG 76 4.963 11.344 3.384 619 HA ARG 76 HA ARG 76 5.919 13.870 2.338 620 HB2 ARG 76 HB2 ARG 76 3.196 13.085 3.334 621 HB3 ARG 76 HB1 ARG 76 3.594 14.604 2.537 622 HG2 ARG 76 HG2 ARG 76 4.287 13.330 0.546 623 HG3 ARG 76 HG1 ARG 76 3.788 11.855 1.370 624 HD2 ARG 76 HD2 ARG 76 2.007 12.461 -0.049 625 HD3 ARG 76 HD1 ARG 76 1.540 12.848 1.602 626 HE ARG 76 HE ARG 76 2.619 15.161 0.603 627 HH11 ARG 76 HH11 ARG 76 -0.030 13.039 -0.249 628 HH12 ARG 76 HH12 ARG 76 -0.964 14.291 -1.004 629 HH21 ARG 76 HH21 ARG 76 1.393 16.818 -0.394 630 HH22 ARG 76 HH22 ARG 76 -0.153 16.443 -1.082 631 H LYS 77 HN LYS 77 5.727 12.308 5.244 632 HA LYS 77 HA LYS 77 6.369 14.725 6.749 633 HB2 LYS 77 HB2 LYS 77 3.906 14.229 7.023 634 HB3 LYS 77 HB1 LYS 77 4.336 12.650 7.648 635 HG2 LYS 77 HG2 LYS 77 5.377 15.105 8.990 636 HG3 LYS 77 HG1 LYS 77 3.719 14.574 9.271 637 HD2 LYS 77 HD2 LYS 77 4.682 12.307 9.851 638 HD3 LYS 77 HD1 LYS 77 6.267 13.078 9.835 639 HE2 LYS 77 HE2 LYS 77 5.468 13.001 12.098 640 HE3 LYS 77 HE1 LYS 77 5.454 14.675 11.548 641 HZ1 LYS 77 HZ1 LYS 77 3.088 12.883 11.631 642 HZ2 LYS 77 HZ2 LYS 77 3.086 14.507 11.165 643 HZ3 LYS 77 HZ3 LYS 77 3.437 14.088 12.763 644 H LYS 78 HN LYS 78 7.862 14.255 8.434 645 HA LYS 78 HA LYS 78 9.609 13.122 9.401 646 HB2 LYS 78 HB2 LYS 78 7.665 11.923 10.438 647 HB3 LYS 78 HB1 LYS 78 7.778 10.721 9.164 648 HG2 LYS 78 HG2 LYS 78 8.835 9.841 11.101 649 HG3 LYS 78 HG1 LYS 78 10.093 10.230 9.930 650 HD2 LYS 78 HD2 LYS 78 10.771 10.927 12.154 651 HD3 LYS 78 HD1 LYS 78 10.528 12.338 11.121 652 HE2 LYS 78 HE2 LYS 78 8.375 12.754 12.118 653 HE3 LYS 78 HE1 LYS 78 8.480 11.264 13.053 654 HZ1 LYS 78 HZ1 LYS 78 10.286 13.601 13.340 655 HZ2 LYS 78 HZ2 LYS 78 10.349 12.182 14.253 656 HZ3 LYS 78 HZ3 LYS 78 9.015 13.209 14.384 657 H ARG 79 HN ARG 79 10.156 13.563 6.877 658 HA ARG 79 HA ARG 79 10.420 11.313 5.187 659 HB2 ARG 79 HB2 ARG 79 11.984 12.792 3.880 660 HB3 ARG 79 HB1 ARG 79 10.373 13.430 4.146 661 HG2 ARG 79 HG2 ARG 79 11.551 15.297 4.618 662 HG3 ARG 79 HG1 ARG 79 11.592 14.565 6.221 663 HD2 ARG 79 HD2 ARG 79 13.796 13.627 5.744 664 HD3 ARG 79 HD1 ARG 79 13.754 14.332 4.127 665 HE ARG 79 HE ARG 79 13.369 16.311 6.138 666 HH11 ARG 79 HH11 ARG 79 15.841 14.386 4.574 667 HH12 ARG 79 HH12 ARG 79 17.107 15.527 4.889 668 HH21 ARG 79 HH21 ARG 79 15.056 17.809 6.563 669 HH22 ARG 79 HH22 ARG 79 16.664 17.454 6.017 670 H LYS 80 HN LYS 80 11.778 9.694 5.205 671 HA LYS 80 HA LYS 80 13.464 8.300 5.777 672 HB2 LYS 80 HB2 LYS 80 14.881 10.858 5.162 673 HB3 LYS 80 HB1 LYS 80 15.801 9.490 5.770 674 HG2 LYS 80 HG2 LYS 80 15.918 9.466 3.392 675 HG3 LYS 80 HG1 LYS 80 14.897 8.125 3.899 676 HD2 LYS 80 HD2 LYS 80 13.846 9.135 2.023 677 HD3 LYS 80 HD1 LYS 80 12.912 9.594 3.445 678 HE2 LYS 80 HE2 LYS 80 13.210 11.498 1.958 679 HE3 LYS 80 HE1 LYS 80 14.045 11.765 3.487 680 HZ1 LYS 80 HZ1 LYS 80 15.340 10.836 0.983 681 HZ2 LYS 80 HZ2 LYS 80 16.123 11.186 2.439 682 HZ3 LYS 80 HZ3 LYS 80 15.380 12.421 1.562 683 HA PRO 81 HA PRO 81 13.550 9.493 10.166 684 HB2 PRO 81 HB2 PRO 81 12.222 7.327 11.110 685 HB3 PRO 81 HB1 PRO 81 11.396 8.733 10.436 686 HG2 PRO 81 HG2 PRO 81 11.748 6.044 9.299 687 HG3 PRO 81 HG1 PRO 81 10.536 7.275 8.922 688 HD2 PRO 81 HD2 PRO 81 12.910 6.631 7.460 689 HD3 PRO 81 HD1 PRO 81 11.712 7.883 7.094 690 H GLN 82 HN GLN 82 15.890 8.815 9.330 691 HA GLN 82 HA GLN 82 16.724 6.205 10.267 692 HB2 GLN 82 HB2 GLN 82 18.987 6.937 9.591 693 HB3 GLN 82 HB1 GLN 82 17.809 7.102 8.298 694 HG2 GLN 82 HG2 GLN 82 17.680 9.471 8.640 695 HG3 GLN 82 HG1 GLN 82 18.711 9.361 10.065 696 HE21 GLN 82 HE21 GLN 82 19.281 7.488 7.178 697 HE22 GLN 82 HE22 GLN 82 20.726 8.312 6.700 698 H ALA 83 HN ALA 83 16.483 9.393 11.529 699 HA ALA 83 HA ALA 83 17.596 8.435 14.051 700 HB1 ALA 83 HB1 ALA 83 19.437 9.607 12.926 701 HB2 ALA 83 HB2 ALA 83 18.914 10.452 14.382 702 HB3 ALA 83 HB3 ALA 83 18.430 11.048 12.796 703 H1 VAL 201 HT1 VAL 201 -6.156 0.123 -14.955 704 H2 VAL 201 HT2 VAL 201 -7.298 -0.964 -15.559 705 H3 VAL 201 HT3 VAL 201 -5.689 -1.058 -16.068 706 HA VAL 201 HA VAL 201 -6.660 -1.545 -13.319 707 HB VAL 201 HB VAL 201 -5.732 -3.442 -15.479 708 HG11 VAL 201 HG11 VAL 201 -5.973 -5.229 -13.816 709 HG12 VAL 201 HG12 VAL 201 -6.273 -4.022 -12.572 710 HG13 VAL 201 HG13 VAL 201 -4.704 -4.090 -13.369 711 HG21 VAL 201 HG21 VAL 201 -8.304 -3.262 -13.921 712 HG22 VAL 201 HG22 VAL 201 -7.915 -4.483 -15.132 713 HG23 VAL 201 HG23 VAL 201 -8.076 -2.793 -15.603 714 H VAL 202 HN VAL 202 -5.166 -1.124 -11.863 715 HA VAL 202 HA VAL 202 -2.451 -0.564 -12.495 716 HB VAL 202 HB VAL 202 -3.671 -1.153 -9.795 717 HG11 VAL 202 HG11 VAL 202 -1.801 0.146 -8.899 718 HG12 VAL 202 HG12 VAL 202 -1.147 0.328 -10.526 719 HG13 VAL 202 HG13 VAL 202 -1.236 -1.270 -9.785 720 HG21 VAL 202 HG21 VAL 202 -3.342 1.476 -11.236 721 HG22 VAL 202 HG22 VAL 202 -3.871 1.289 -9.564 722 HG23 VAL 202 HG23 VAL 202 -4.864 0.658 -10.877 723 HA PRO 203 HA PRO 203 -0.979 -4.808 -12.605 724 HB2 PRO 203 HB2 PRO 203 1.644 -3.499 -12.211 725 HB3 PRO 203 HB1 PRO 203 1.108 -4.575 -13.504 726 HG2 PRO 203 HG2 PRO 203 1.452 -1.963 -13.935 727 HG3 PRO 203 HG1 PRO 203 0.133 -2.861 -14.710 728 HD2 PRO 203 HD2 PRO 203 0.047 -1.022 -12.352 729 HD3 PRO 203 HD1 PRO 203 -1.103 -1.194 -13.695 730 H LYS 204 HN LYS 204 -0.003 -6.288 -11.168 731 HA LYS 204 HA LYS 204 -0.437 -5.723 -8.425 732 HB2 LYS 204 HB2 LYS 204 1.127 -8.039 -9.572 733 HB3 LYS 204 HB1 LYS 204 0.364 -7.960 -7.995 734 HG2 LYS 204 HG2 LYS 204 -1.843 -7.807 -9.152 735 HG3 LYS 204 HG1 LYS 204 -0.996 -8.092 -10.677 736 HD2 LYS 204 HD2 LYS 204 -1.913 -10.175 -9.855 737 HD3 LYS 204 HD1 LYS 204 -0.152 -10.229 -9.775 738 HE2 LYS 204 HE2 LYS 204 -0.227 -9.737 -7.394 739 HE3 LYS 204 HE1 LYS 204 -1.983 -9.604 -7.458 740 HZ1 LYS 204 HZ1 LYS 204 -1.287 -11.752 -6.611 741 HZ2 LYS 204 HZ2 LYS 204 -0.413 -12.061 -8.024 742 HZ3 LYS 204 HZ3 LYS 204 -2.098 -11.935 -8.083 743 H LYS 205 HN LYS 205 0.878 -4.774 -7.000 744 HA LYS 205 HA LYS 205 3.593 -4.136 -7.723 745 HB2 LYS 205 HB2 LYS 205 1.879 -2.781 -6.240 746 HB3 LYS 205 HB1 LYS 205 2.535 -3.775 -4.950 747 HG2 LYS 205 HG2 LYS 205 3.747 -1.744 -4.946 748 HG3 LYS 205 HG1 LYS 205 4.816 -2.979 -5.618 749 HD2 LYS 205 HD2 LYS 205 4.264 -2.219 -7.882 750 HD3 LYS 205 HD1 LYS 205 3.199 -0.987 -7.208 751 HE2 LYS 205 HE2 LYS 205 5.233 0.101 -7.737 752 HE3 LYS 205 HE1 LYS 205 5.205 -0.085 -5.983 753 HZ1 LYS 205 HZ1 LYS 205 6.648 -1.876 -7.863 754 HZ2 LYS 205 HZ2 LYS 205 6.677 -1.966 -6.175 755 HZ3 LYS 205 HZ3 LYS 205 7.367 -0.638 -6.961 756 H LYS 206 HN LYS 206 4.870 -5.859 -7.791 757 HA LYS 206 HA LYS 206 4.600 -8.095 -6.038 758 HB2 LYS 206 HB2 LYS 206 6.708 -7.360 -8.075 759 HB3 LYS 206 HB1 LYS 206 6.634 -8.906 -7.238 760 HG2 LYS 206 HG2 LYS 206 4.558 -9.454 -8.263 761 HG3 LYS 206 HG1 LYS 206 4.389 -7.828 -8.922 762 HD2 LYS 206 HD2 LYS 206 6.661 -9.662 -9.651 763 HD3 LYS 206 HD1 LYS 206 5.140 -9.620 -10.543 764 HE2 LYS 206 HE2 LYS 206 7.019 -7.296 -10.121 765 HE3 LYS 206 HE1 LYS 206 6.831 -8.219 -11.609 766 HZ1 LYS 206 HZ1 LYS 206 4.531 -7.475 -11.732 767 HZ2 LYS 206 HZ2 LYS 206 5.593 -6.162 -11.709 768 HZ3 LYS 206 HZ3 LYS 206 4.728 -6.569 -10.317 769 H ILE 207 HN ILE 207 5.068 -7.762 -3.959 770 HA ILE 207 HA ILE 207 7.454 -6.227 -3.230 771 HB ILE 207 HB ILE 207 5.296 -7.335 -1.433 772 HG12 ILE 207 HG12 ILE 207 4.464 -5.678 -3.124 773 HG13 ILE 207 HG11 ILE 207 4.267 -5.172 -1.452 774 HG21 ILE 207 HG21 ILE 207 6.196 -5.448 0.065 775 HG22 ILE 207 HG22 ILE 207 7.615 -5.493 -0.988 776 HG23 ILE 207 HG23 ILE 207 7.144 -6.931 -0.082 777 HD11 ILE 207 HD11 ILE 207 6.178 -3.700 -1.649 778 HD12 ILE 207 HD12 ILE 207 4.993 -3.350 -2.908 779 HD13 ILE 207 HD13 ILE 207 6.454 -4.257 -3.300 780 H LYS 208 HN LYS 208 9.267 -7.395 -3.081 781 HA LYS 208 HA LYS 208 9.096 -10.068 -1.867 782 HB2 LYS 208 HB2 LYS 208 9.472 -10.125 -4.342 783 HB3 LYS 208 HB1 LYS 208 10.976 -9.254 -4.091 784 HG2 LYS 208 HG2 LYS 208 11.329 -11.656 -4.390 785 HG3 LYS 208 HG1 LYS 208 11.874 -11.097 -2.809 786 HD2 LYS 208 HD2 LYS 208 10.674 -13.238 -2.673 787 HD3 LYS 208 HD1 LYS 208 9.855 -11.963 -1.778 788 HE2 LYS 208 HE2 LYS 208 8.242 -13.291 -3.001 789 HE3 LYS 208 HE1 LYS 208 8.303 -11.658 -3.655 790 HZ1 LYS 208 HZ1 LYS 208 8.222 -13.295 -5.410 791 HZ2 LYS 208 HZ2 LYS 208 9.612 -14.051 -4.823 792 HZ3 LYS 208 HZ3 LYS 208 9.705 -12.484 -5.454 793 H LYS 209 HN LYS 209 9.694 -9.382 0.138 794 HA LYS 209 HA LYS 209 11.004 -8.769 1.862 795 HB2 LYS 209 HB2 LYS 209 13.149 -9.398 -0.149 796 HB3 LYS 209 HB1 LYS 209 13.538 -8.837 1.468 797 HG2 LYS 209 HG2 LYS 209 13.680 -11.113 1.714 798 HG3 LYS 209 HG1 LYS 209 12.025 -10.808 2.232 799 HD2 LYS 209 HD2 LYS 209 11.170 -11.520 0.098 800 HD3 LYS 209 HD1 LYS 209 12.805 -11.661 -0.555 801 HE2 LYS 209 HE2 LYS 209 13.258 -13.377 1.224 802 HE3 LYS 209 HE1 LYS 209 11.540 -13.329 1.611 803 HZ1 LYS 209 HZ1 LYS 209 12.213 -15.146 0.078 804 HZ2 LYS 209 HZ2 LYS 209 12.590 -13.979 -1.086 805 HZ3 LYS 209 HZ3 LYS 209 10.994 -14.147 -0.539 806 H GLU 210 HN GLU 210 13.114 -7.352 -0.606 807 HA GLU 210 HA GLU 210 12.467 -4.707 0.514 808 HB2 GLU 210 HB2 GLU 210 14.758 -5.311 1.021 809 HB3 GLU 210 HB1 GLU 210 15.063 -5.706 -0.666 810 HG2 GLU 210 HG2 GLU 210 14.711 -3.367 -1.277 811 HG3 GLU 210 HG1 GLU 210 14.416 -2.972 0.413 812 H GLN 211 HN GLN 211 11.103 -3.755 -0.858 813 HA GLN 211 HA GLN 211 11.941 -3.589 -3.668 814 HB2 GLN 211 HB2 GLN 211 9.181 -4.033 -2.567 815 HB3 GLN 211 HB1 GLN 211 9.421 -3.295 -4.144 816 HG2 GLN 211 HG2 GLN 211 10.440 -6.000 -3.312 817 HG3 GLN 211 HG1 GLN 211 9.009 -5.699 -4.295 818 HE21 GLN 211 HE21 GLN 211 9.256 -4.968 -6.410 819 HE22 GLN 211 HE22 GLN 211 10.762 -5.091 -7.252 820 H VAL 212 HN VAL 212 13.063 -1.749 -2.684 821 HA VAL 212 HA VAL 212 11.380 0.511 -1.932 822 HB VAL 212 HB VAL 212 13.510 1.623 -1.327 823 HG11 VAL 212 HG11 VAL 212 13.149 -1.118 -0.122 824 HG12 VAL 212 HG12 VAL 212 12.266 0.340 0.335 825 HG13 VAL 212 HG13 VAL 212 14.004 0.235 0.620 826 HG21 VAL 212 HG21 VAL 212 14.762 -1.018 -2.082 827 HG22 VAL 212 HG22 VAL 212 15.585 0.323 -1.285 828 HG23 VAL 212 HG23 VAL 212 14.979 0.511 -2.931 829 H GLU 213 HN GLU 213 12.624 2.678 -2.698 830 HA GLU 213 HA GLU 213 12.119 2.735 -5.526 831 HB2 GLU 213 HB2 GLU 213 11.380 4.515 -3.899 832 HB3 GLU 213 HB1 GLU 213 13.065 4.997 -3.765 833 HG2 GLU 213 HG2 GLU 213 13.070 5.393 -6.225 834 HG3 GLU 213 HG1 GLU 213 11.333 5.089 -6.221 Start of MODEL 3 1 H1 SER 1 HT1 SER 1 -20.913 -2.414 8.425 2 H2 SER 1 HT2 SER 1 -19.243 -2.691 8.348 3 H3 SER 1 HT3 SER 1 -20.321 -3.877 7.816 4 HA SER 1 HA SER 1 -19.255 -2.664 5.985 5 HB2 SER 1 HB2 SER 1 -22.225 -2.148 6.169 6 HB3 SER 1 HB1 SER 1 -21.275 -2.425 4.708 7 HG SER 1 HG SER 1 -22.569 -4.241 5.838 8 H GLU 2 HN GLU 2 -19.316 -0.828 8.424 9 HA GLU 2 HA GLU 2 -20.440 1.595 7.257 10 HB2 GLU 2 HB2 GLU 2 -19.724 0.755 10.036 11 HB3 GLU 2 HB1 GLU 2 -19.949 2.447 9.646 12 HG2 GLU 2 HG2 GLU 2 -21.998 1.534 10.521 13 HG3 GLU 2 HG1 GLU 2 -22.196 1.962 8.816 14 H GLU 3 HN GLU 3 -17.414 0.129 7.915 15 HA GLU 3 HA GLU 3 -15.887 2.546 7.820 16 HB2 GLU 3 HB2 GLU 3 -15.118 -0.347 7.386 17 HB3 GLU 3 HB1 GLU 3 -13.972 0.970 7.204 18 HG2 GLU 3 HG2 GLU 3 -13.797 -0.075 9.397 19 HG3 GLU 3 HG1 GLU 3 -14.285 1.613 9.518 20 H GLU 4 HN GLU 4 -17.507 0.588 5.596 21 HA GLU 4 HA GLU 4 -16.197 1.277 3.198 22 HB2 GLU 4 HB2 GLU 4 -17.825 -0.586 3.474 23 HB3 GLU 4 HB1 GLU 4 -19.112 0.595 3.646 24 HG2 GLU 4 HG2 GLU 4 -18.479 1.433 1.352 25 HG3 GLU 4 HG1 GLU 4 -17.465 -0.004 1.214 26 H ASP 5 HN ASP 5 -18.427 2.996 5.263 27 HA ASP 5 HA ASP 5 -19.090 4.894 3.178 28 HB2 ASP 5 HB2 ASP 5 -20.812 4.134 4.840 29 HB3 ASP 5 HB1 ASP 5 -19.916 5.042 6.047 30 H LYS 6 HN LYS 6 -16.903 4.552 5.804 31 HA LYS 6 HA LYS 6 -16.457 7.398 6.086 32 HB2 LYS 6 HB2 LYS 6 -15.387 4.907 7.401 33 HB3 LYS 6 HB1 LYS 6 -14.384 6.333 7.510 34 HG2 LYS 6 HG2 LYS 6 -16.168 7.500 8.758 35 HG3 LYS 6 HG1 LYS 6 -17.218 6.084 8.561 36 HD2 LYS 6 HD2 LYS 6 -14.550 6.114 9.973 37 HD3 LYS 6 HD1 LYS 6 -16.112 6.233 10.774 38 HE2 LYS 6 HE2 LYS 6 -15.294 3.910 9.045 39 HE3 LYS 6 HE1 LYS 6 -15.062 3.953 10.786 40 HZ1 LYS 6 HZ1 LYS 6 -17.663 4.089 9.359 41 HZ2 LYS 6 HZ2 LYS 6 -17.468 4.232 11.033 42 HZ3 LYS 6 HZ3 LYS 6 -17.068 2.777 10.259 43 H CYS 7 HN CYS 7 -15.065 4.699 4.413 44 HA CYS 7 HA CYS 7 -12.576 6.053 3.851 45 HB2 CYS 7 HB2 CYS 7 -13.683 3.399 2.924 46 HB3 CYS 7 HB1 CYS 7 -12.057 3.988 2.570 47 HG CYS 7 HG CYS 7 -13.327 3.189 5.645 48 H LYS 8 HN LYS 8 -11.856 6.716 1.834 49 HA LYS 8 HA LYS 8 -14.028 7.509 0.021 50 HB2 LYS 8 HB2 LYS 8 -11.291 8.642 0.567 51 HB3 LYS 8 HB1 LYS 8 -12.152 9.034 -0.911 52 HG2 LYS 8 HG2 LYS 8 -12.473 10.771 0.700 53 HG3 LYS 8 HG1 LYS 8 -13.993 9.935 0.394 54 HD2 LYS 8 HD2 LYS 8 -13.746 8.684 2.465 55 HD3 LYS 8 HD1 LYS 8 -12.172 9.428 2.747 56 HE2 LYS 8 HE2 LYS 8 -13.274 11.636 2.854 57 HE3 LYS 8 HE1 LYS 8 -14.835 10.840 2.656 58 HZ1 LYS 8 HZ1 LYS 8 -12.944 10.466 4.914 59 HZ2 LYS 8 HZ2 LYS 8 -14.392 9.611 4.714 60 HZ3 LYS 8 HZ3 LYS 8 -14.426 11.284 4.965 61 HA PRO 9 HA PRO 9 -12.728 4.740 -3.097 62 HB2 PRO 9 HB2 PRO 9 -13.694 6.081 -5.265 63 HB3 PRO 9 HB1 PRO 9 -14.712 5.159 -4.155 64 HG2 PRO 9 HG2 PRO 9 -14.234 8.103 -4.294 65 HG3 PRO 9 HG1 PRO 9 -15.738 7.223 -3.964 66 HD2 PRO 9 HD2 PRO 9 -14.226 8.380 -2.009 67 HD3 PRO 9 HD1 PRO 9 -15.217 6.936 -1.727 68 H MET 10 HN MET 10 -10.844 4.446 -4.148 69 HA MET 10 HA MET 10 -9.184 6.815 -4.609 70 HB2 MET 10 HB2 MET 10 -8.325 4.979 -3.141 71 HB3 MET 10 HB1 MET 10 -8.343 3.914 -4.544 72 HG2 MET 10 HG2 MET 10 -6.168 4.570 -4.562 73 HG3 MET 10 HG1 MET 10 -6.877 5.816 -5.592 74 HE1 MET 10 HE1 MET 10 -5.711 4.797 -2.157 75 HE2 MET 10 HE2 MET 10 -7.106 5.675 -1.538 76 HE3 MET 10 HE3 MET 10 -5.477 6.299 -1.268 77 H SER 11 HN SER 11 -8.916 7.525 -6.654 78 HA SER 11 HA SER 11 -9.938 5.991 -8.859 79 HB2 SER 11 HB2 SER 11 -9.221 7.943 -10.237 80 HB3 SER 11 HB1 SER 11 -10.251 8.388 -8.877 81 HG SER 11 HG SER 11 -8.387 9.023 -7.738 82 H TYR 12 HN TYR 12 -8.412 6.140 -11.003 83 HA TYR 12 HA TYR 12 -6.583 4.069 -10.457 84 HB2 TYR 12 HB2 TYR 12 -6.586 3.657 -12.661 85 HB3 TYR 12 HB1 TYR 12 -7.994 4.710 -12.611 86 HD1 TYR 12 HD1 TYR 12 -4.410 4.566 -13.375 87 HD2 TYR 12 HD2 TYR 12 -8.024 6.740 -13.835 88 HE1 TYR 12 HE1 TYR 12 -3.346 5.945 -15.130 89 HE2 TYR 12 HE2 TYR 12 -6.978 8.139 -15.566 90 HH TYR 12 HH TYR 12 -4.147 7.319 -17.110 91 H GLU 13 HN GLU 13 -5.948 7.388 -11.627 92 HA GLU 13 HA GLU 13 -3.176 7.386 -11.486 93 HB2 GLU 13 HB2 GLU 13 -3.433 9.893 -11.067 94 HB3 GLU 13 HB1 GLU 13 -4.385 9.329 -12.445 95 HG2 GLU 13 HG2 GLU 13 -6.331 9.176 -10.948 96 HG3 GLU 13 HG1 GLU 13 -5.373 9.938 -9.678 97 H GLU 14 HN GLU 14 -5.486 7.632 -8.887 98 HA GLU 14 HA GLU 14 -3.614 8.506 -6.935 99 HB2 GLU 14 HB2 GLU 14 -6.364 7.324 -6.827 100 HB3 GLU 14 HB1 GLU 14 -5.461 7.686 -5.366 101 HG2 GLU 14 HG2 GLU 14 -5.314 10.043 -6.100 102 HG3 GLU 14 HG1 GLU 14 -6.309 9.638 -7.496 103 H LYS 15 HN LYS 15 -5.111 5.382 -7.707 104 HA LYS 15 HA LYS 15 -3.677 3.807 -5.909 105 HB2 LYS 15 HB2 LYS 15 -4.740 3.130 -8.642 106 HB3 LYS 15 HB1 LYS 15 -4.039 1.935 -7.559 107 HG2 LYS 15 HG2 LYS 15 -5.787 1.987 -6.104 108 HG3 LYS 15 HG1 LYS 15 -6.258 3.623 -6.584 109 HD2 LYS 15 HD2 LYS 15 -7.350 2.934 -8.453 110 HD3 LYS 15 HD1 LYS 15 -6.372 1.479 -8.632 111 HE2 LYS 15 HE2 LYS 15 -7.483 0.546 -6.658 112 HE3 LYS 15 HE1 LYS 15 -8.533 1.958 -6.583 113 HZ1 LYS 15 HZ1 LYS 15 -9.615 0.107 -7.704 114 HZ2 LYS 15 HZ2 LYS 15 -8.365 0.024 -8.846 115 HZ3 LYS 15 HZ3 LYS 15 -9.373 1.384 -8.786 116 H ARG 16 HN ARG 16 -2.836 4.995 -9.117 117 HA ARG 16 HA ARG 16 -0.387 3.656 -9.437 118 HB2 ARG 16 HB2 ARG 16 -1.574 4.945 -11.223 119 HB3 ARG 16 HB1 ARG 16 -1.057 6.423 -10.429 120 HG2 ARG 16 HG2 ARG 16 1.294 5.629 -10.706 121 HG3 ARG 16 HG1 ARG 16 0.663 4.347 -11.717 122 HD2 ARG 16 HD2 ARG 16 1.434 6.145 -13.104 123 HD3 ARG 16 HD1 ARG 16 -0.314 6.052 -13.179 124 HE ARG 16 HE ARG 16 0.641 7.913 -11.220 125 HH11 ARG 16 HH11 ARG 16 -0.208 7.490 -14.586 126 HH12 ARG 16 HH12 ARG 16 -0.468 9.182 -14.864 127 HH21 ARG 16 HH21 ARG 16 0.300 10.135 -11.580 128 HH22 ARG 16 HH22 ARG 16 -0.191 10.684 -13.151 129 H GLN 17 HN GLN 17 -1.012 6.953 -8.241 130 HA GLN 17 HA GLN 17 1.578 7.573 -7.441 131 HB2 GLN 17 HB2 GLN 17 -0.359 9.149 -7.578 132 HB3 GLN 17 HB1 GLN 17 -0.974 8.451 -6.088 133 HG2 GLN 17 HG2 GLN 17 0.130 10.444 -5.491 134 HG3 GLN 17 HG1 GLN 17 1.188 9.118 -5.009 135 HE21 GLN 17 HE21 GLN 17 1.754 11.943 -5.622 136 HE22 GLN 17 HE22 GLN 17 2.963 11.919 -6.858 137 H LEU 18 HN LEU 18 -1.008 5.968 -5.734 138 HA LEU 18 HA LEU 18 0.116 5.608 -3.218 139 HB2 LEU 18 HB2 LEU 18 -2.209 4.993 -4.301 140 HB3 LEU 18 HB1 LEU 18 -1.443 3.443 -4.534 141 HG LEU 18 HG LEU 18 -2.028 4.811 -1.926 142 HD11 LEU 18 HD11 LEU 18 -3.252 2.544 -1.694 143 HD12 LEU 18 HD12 LEU 18 -3.161 2.525 -3.451 144 HD13 LEU 18 HD13 LEU 18 -3.982 3.847 -2.622 145 HD21 LEU 18 HD21 LEU 18 -0.119 3.750 -1.288 146 HD22 LEU 18 HD22 LEU 18 -0.240 2.531 -2.555 147 HD23 LEU 18 HD23 LEU 18 -1.258 2.415 -1.121 148 H SER 19 HN SER 19 0.241 3.458 -6.050 149 HA SER 19 HA SER 19 1.807 1.457 -4.861 150 HB2 SER 19 HB2 SER 19 1.882 0.483 -7.008 151 HB3 SER 19 HB1 SER 19 0.372 1.392 -6.986 152 HG SER 19 HG SER 19 1.625 3.142 -7.999 153 H LEU 20 HN LEU 20 2.621 4.430 -6.428 154 HA LEU 20 HA LEU 20 5.411 3.842 -6.767 155 HB2 LEU 20 HB2 LEU 20 3.839 6.394 -6.989 156 HB3 LEU 20 HB1 LEU 20 5.522 6.246 -7.432 157 HG LEU 20 HG LEU 20 3.179 4.901 -8.736 158 HD11 LEU 20 HD11 LEU 20 3.651 7.270 -9.252 159 HD12 LEU 20 HD12 LEU 20 3.745 6.194 -10.640 160 HD13 LEU 20 HD13 LEU 20 5.223 6.780 -9.872 161 HD21 LEU 20 HD21 LEU 20 5.004 3.330 -8.609 162 HD22 LEU 20 HD22 LEU 20 6.117 4.531 -9.267 163 HD23 LEU 20 HD23 LEU 20 4.806 3.900 -10.265 164 H ASP 21 HN ASP 21 3.392 5.433 -4.425 165 HA ASP 21 HA ASP 21 5.581 6.421 -2.847 166 HB2 ASP 21 HB2 ASP 21 2.641 6.479 -2.595 167 HB3 ASP 21 HB1 ASP 21 3.663 6.940 -1.245 168 H ILE 22 HN ILE 22 3.469 3.615 -2.786 169 HA ILE 22 HA ILE 22 4.445 2.518 -0.376 170 HB ILE 22 HB ILE 22 3.067 1.502 -2.770 171 HG12 ILE 22 HG12 ILE 22 2.714 0.953 0.167 172 HG13 ILE 22 HG11 ILE 22 1.926 2.257 -0.714 173 HG21 ILE 22 HG21 ILE 22 4.490 -0.425 -0.973 174 HG22 ILE 22 HG22 ILE 22 4.899 -0.094 -2.650 175 HG23 ILE 22 HG23 ILE 22 3.353 -0.834 -2.250 176 HD11 ILE 22 HD11 ILE 22 1.582 -0.651 -1.395 177 HD12 ILE 22 HD12 ILE 22 0.659 0.723 -2.001 178 HD13 ILE 22 HD13 ILE 22 0.516 0.245 -0.314 179 H ASN 23 HN ASN 23 5.651 2.547 -3.654 180 HA ASN 23 HA ASN 23 7.753 0.704 -3.286 181 HB2 ASN 23 HB2 ASN 23 6.863 1.303 -5.494 182 HB3 ASN 23 HB1 ASN 23 7.455 2.945 -5.292 183 HD21 ASN 23 HD21 ASN 23 9.593 3.386 -5.663 184 HD22 ASN 23 HD22 ASN 23 10.708 2.223 -6.291 185 H LYS 24 HN LYS 24 7.321 3.942 -2.320 186 HA LYS 24 HA LYS 24 10.083 4.674 -2.117 187 HB2 LYS 24 HB2 LYS 24 7.502 5.830 -1.163 188 HB3 LYS 24 HB1 LYS 24 9.027 6.497 -0.605 189 HG2 LYS 24 HG2 LYS 24 9.649 7.046 -2.875 190 HG3 LYS 24 HG1 LYS 24 8.188 6.271 -3.494 191 HD2 LYS 24 HD2 LYS 24 6.801 7.894 -2.344 192 HD3 LYS 24 HD1 LYS 24 8.212 8.651 -1.620 193 HE2 LYS 24 HE2 LYS 24 7.601 10.034 -3.436 194 HE3 LYS 24 HE1 LYS 24 8.976 9.101 -4.024 195 HZ1 LYS 24 HZ1 LYS 24 7.164 9.197 -5.635 196 HZ2 LYS 24 HZ2 LYS 24 6.126 8.438 -4.532 197 HZ3 LYS 24 HZ3 LYS 24 7.471 7.608 -5.143 198 H LEU 25 HN LEU 25 7.800 2.985 -0.132 199 HA LEU 25 HA LEU 25 9.001 3.488 2.393 200 HB2 LEU 25 HB2 LEU 25 7.161 1.309 1.449 201 HB3 LEU 25 HB1 LEU 25 7.729 1.430 3.100 202 HG LEU 25 HG LEU 25 5.869 3.266 1.631 203 HD11 LEU 25 HD11 LEU 25 5.792 1.873 4.281 204 HD12 LEU 25 HD12 LEU 25 4.969 1.322 2.820 205 HD13 LEU 25 HD13 LEU 25 4.488 2.836 3.593 206 HD21 LEU 25 HD21 LEU 25 7.295 3.809 4.210 207 HD22 LEU 25 HD22 LEU 25 5.992 4.783 3.537 208 HD23 LEU 25 HD23 LEU 25 7.542 4.682 2.704 209 HA PRO 26 HA PRO 26 12.405 0.576 2.249 210 HB2 PRO 26 HB2 PRO 26 12.925 0.594 4.927 211 HB3 PRO 26 HB1 PRO 26 13.486 1.855 3.825 212 HG2 PRO 26 HG2 PRO 26 11.161 1.854 5.696 213 HG3 PRO 26 HG1 PRO 26 12.276 3.171 5.307 214 HD2 PRO 26 HD2 PRO 26 9.765 2.974 4.262 215 HD3 PRO 26 HD1 PRO 26 11.109 3.761 3.411 216 H GLY 27 HN GLY 27 12.861 -1.549 3.177 217 HA2 GLY 27 HA2 GLY 27 10.740 -3.264 2.877 218 HA3 GLY 27 HA1 GLY 27 12.226 -3.691 3.701 219 H GLU 28 HN GLU 28 12.168 -2.371 6.022 220 HA GLU 28 HA GLU 28 10.399 -3.856 7.583 221 HB2 GLU 28 HB2 GLU 28 11.006 -1.827 9.264 222 HB3 GLU 28 HB1 GLU 28 12.034 -3.217 8.978 223 HG2 GLU 28 HG2 GLU 28 12.286 -0.712 7.367 224 HG3 GLU 28 HG1 GLU 28 13.062 -0.893 8.932 225 H LYS 29 HN LYS 29 10.104 -0.537 6.402 226 HA LYS 29 HA LYS 29 7.762 0.006 7.960 227 HB2 LYS 29 HB2 LYS 29 9.329 1.429 5.891 228 HB3 LYS 29 HB1 LYS 29 7.641 1.883 6.030 229 HG2 LYS 29 HG2 LYS 29 9.097 3.348 7.327 230 HG3 LYS 29 HG1 LYS 29 7.967 2.475 8.358 231 HD2 LYS 29 HD2 LYS 29 9.602 1.231 9.337 232 HD3 LYS 29 HD1 LYS 29 10.642 1.269 7.908 233 HE2 LYS 29 HE2 LYS 29 11.563 2.574 9.780 234 HE3 LYS 29 HE1 LYS 29 11.238 3.566 8.361 235 HZ1 LYS 29 HZ1 LYS 29 10.517 4.644 10.407 236 HZ2 LYS 29 HZ2 LYS 29 9.490 3.347 10.757 237 HZ3 LYS 29 HZ3 LYS 29 9.192 4.318 9.408 238 H LEU 30 HN LEU 30 8.446 -1.357 4.856 239 HA LEU 30 HA LEU 30 5.748 -0.997 3.923 240 HB2 LEU 30 HB2 LEU 30 6.878 -0.947 2.043 241 HB3 LEU 30 HB1 LEU 30 8.293 -1.682 2.749 242 HG LEU 30 HG LEU 30 5.959 -3.339 1.863 243 HD11 LEU 30 HD11 LEU 30 7.670 -1.702 0.302 244 HD12 LEU 30 HD12 LEU 30 6.315 -2.694 -0.216 245 HD13 LEU 30 HD13 LEU 30 7.934 -3.393 -0.098 246 HD21 LEU 30 HD21 LEU 30 7.754 -4.360 3.259 247 HD22 LEU 30 HD22 LEU 30 8.916 -3.924 2.007 248 HD23 LEU 30 HD23 LEU 30 7.626 -5.072 1.650 249 H GLY 31 HN GLY 31 7.390 -3.336 5.791 250 HA2 GLY 31 HA2 GLY 31 5.711 -5.563 5.316 251 HA3 GLY 31 HA1 GLY 31 6.505 -5.205 6.839 252 H ARG 32 HN ARG 32 5.125 -2.492 6.831 253 HA ARG 32 HA ARG 32 2.758 -3.255 8.213 254 HB2 ARG 32 HB2 ARG 32 3.872 -1.162 8.769 255 HB3 ARG 32 HB1 ARG 32 3.536 -0.538 7.163 256 HG2 ARG 32 HG2 ARG 32 1.653 0.313 7.980 257 HG3 ARG 32 HG1 ARG 32 1.066 -1.341 8.153 258 HD2 ARG 32 HD2 ARG 32 2.640 0.154 10.242 259 HD3 ARG 32 HD1 ARG 32 0.887 -0.055 10.249 260 HE ARG 32 HE ARG 32 2.636 -2.414 10.244 261 HH11 ARG 32 HH11 ARG 32 0.274 -0.412 11.881 262 HH12 ARG 32 HH12 ARG 32 -0.044 -1.588 13.118 263 HH21 ARG 32 HH21 ARG 32 2.219 -3.959 11.865 264 HH22 ARG 32 HH22 ARG 32 1.060 -3.600 13.109 265 H VAL 33 HN VAL 33 3.306 -1.926 4.928 266 HA VAL 33 HA VAL 33 0.563 -1.665 4.327 267 HB VAL 33 HB VAL 33 1.692 -2.360 1.885 268 HG11 VAL 33 HG11 VAL 33 1.213 0.263 3.261 269 HG12 VAL 33 HG12 VAL 33 0.192 -0.562 2.081 270 HG13 VAL 33 HG13 VAL 33 1.716 0.157 1.578 271 HG21 VAL 33 HG21 VAL 33 3.610 -0.495 3.214 272 HG22 VAL 33 HG22 VAL 33 3.765 -1.316 1.654 273 HG23 VAL 33 HG23 VAL 33 3.915 -2.234 3.155 274 H VAL 34 HN VAL 34 2.789 -4.327 3.653 275 HA VAL 34 HA VAL 34 1.003 -6.236 2.748 276 HB VAL 34 HB VAL 34 2.672 -7.717 3.017 277 HG11 VAL 34 HG11 VAL 34 3.939 -5.780 2.372 278 HG12 VAL 34 HG12 VAL 34 4.895 -6.839 3.410 279 HG13 VAL 34 HG13 VAL 34 4.187 -5.363 4.066 280 HG21 VAL 34 HG21 VAL 34 2.065 -8.196 5.325 281 HG22 VAL 34 HG22 VAL 34 3.093 -6.863 5.864 282 HG23 VAL 34 HG23 VAL 34 3.813 -8.270 5.079 283 H HIS 35 HN HIS 35 1.651 -5.279 6.124 284 HA HIS 35 HA HIS 35 -0.035 -7.198 7.321 285 HB2 HIS 35 HB2 HIS 35 1.692 -6.005 8.590 286 HB3 HIS 35 HB1 HIS 35 0.835 -4.486 8.354 287 HD1 HIS 35 HD1 HIS 35 0.787 -7.624 10.374 288 HD2 HIS 35 HD2 HIS 35 -1.424 -4.122 9.999 289 HE1 HIS 35 HE1 HIS 35 -0.741 -7.569 12.368 290 HE2 HIS 35 HE2 HIS 35 -1.939 -5.360 12.210 291 H ILE 36 HN ILE 36 -0.569 -3.774 6.525 292 HA ILE 36 HA ILE 36 -3.235 -3.604 7.362 293 HB ILE 36 HB ILE 36 -1.897 -2.136 5.075 294 HG12 ILE 36 HG12 ILE 36 -2.325 -1.209 7.914 295 HG13 ILE 36 HG11 ILE 36 -0.844 -1.986 7.382 296 HG21 ILE 36 HG21 ILE 36 -3.708 -0.722 4.949 297 HG22 ILE 36 HG22 ILE 36 -4.160 -0.999 6.633 298 HG23 ILE 36 HG23 ILE 36 -4.522 -2.218 5.416 299 HD11 ILE 36 HD11 ILE 36 -0.655 -0.141 5.681 300 HD12 ILE 36 HD12 ILE 36 -0.457 0.334 7.363 301 HD13 ILE 36 HD13 ILE 36 -1.971 0.652 6.532 302 H ILE 37 HN ILE 37 -1.817 -4.409 4.254 303 HA ILE 37 HA ILE 37 -4.197 -4.766 2.826 304 HB ILE 37 HB ILE 37 -1.377 -5.626 2.444 305 HG12 ILE 37 HG12 ILE 37 -3.098 -3.939 0.665 306 HG13 ILE 37 HG11 ILE 37 -2.299 -3.273 2.077 307 HG21 ILE 37 HG21 ILE 37 -3.688 -6.840 1.238 308 HG22 ILE 37 HG22 ILE 37 -1.989 -7.312 1.140 309 HG23 ILE 37 HG23 ILE 37 -2.633 -6.105 0.030 310 HD11 ILE 37 HD11 ILE 37 -0.945 -2.814 0.220 311 HD12 ILE 37 HD12 ILE 37 -1.024 -4.494 -0.327 312 HD13 ILE 37 HD13 ILE 37 -0.148 -4.088 1.149 313 H GLN 38 HN GLN 38 -2.024 -7.364 4.056 314 HA GLN 38 HA GLN 38 -3.713 -9.498 3.525 315 HB2 GLN 38 HB2 GLN 38 -1.770 -9.179 5.827 316 HB3 GLN 38 HB1 GLN 38 -2.524 -10.699 5.375 317 HG2 GLN 38 HG2 GLN 38 -1.403 -10.632 3.218 318 HG3 GLN 38 HG1 GLN 38 -0.713 -9.067 3.630 319 HE21 GLN 38 HE21 GLN 38 -1.098 -11.734 5.855 320 HE22 GLN 38 HE22 GLN 38 0.587 -12.048 6.066 321 H SER 39 HN SER 39 -3.838 -7.260 6.242 322 HA SER 39 HA SER 39 -5.678 -8.881 7.748 323 HB2 SER 39 HB2 SER 39 -5.781 -6.960 9.287 324 HB3 SER 39 HB1 SER 39 -4.122 -7.398 8.906 325 HG SER 39 HG SER 39 -3.915 -5.644 7.637 326 H ARG 40 HN ARG 40 -5.913 -5.889 5.845 327 HA ARG 40 HA ARG 40 -8.763 -5.747 6.202 328 HB2 ARG 40 HB2 ARG 40 -6.892 -4.168 4.422 329 HB3 ARG 40 HB1 ARG 40 -8.610 -3.832 4.605 330 HG2 ARG 40 HG2 ARG 40 -8.297 -3.438 6.940 331 HG3 ARG 40 HG1 ARG 40 -6.592 -3.833 6.833 332 HD2 ARG 40 HD2 ARG 40 -6.475 -1.563 6.738 333 HD3 ARG 40 HD1 ARG 40 -6.673 -1.912 5.020 334 HE ARG 40 HE ARG 40 -9.170 -1.581 5.582 335 HH11 ARG 40 HH11 ARG 40 -6.515 0.244 6.963 336 HH12 ARG 40 HH12 ARG 40 -7.505 1.599 7.395 337 HH21 ARG 40 HH21 ARG 40 -10.477 0.171 6.219 338 HH22 ARG 40 HH22 ARG 40 -9.757 1.559 6.971 339 H GLU 41 HN GLU 41 -6.628 -7.263 4.027 340 HA GLU 41 HA GLU 41 -8.880 -8.075 2.281 341 HB2 GLU 41 HB2 GLU 41 -5.943 -8.335 1.622 342 HB3 GLU 41 HB1 GLU 41 -7.314 -8.429 0.530 343 HG2 GLU 41 HG2 GLU 41 -6.517 -5.925 1.964 344 HG3 GLU 41 HG1 GLU 41 -5.905 -6.383 0.373 345 HA PRO 42 HA PRO 42 -7.304 -11.629 4.933 346 HB2 PRO 42 HB2 PRO 42 -10.141 -12.457 4.807 347 HB3 PRO 42 HB1 PRO 42 -9.080 -12.298 6.208 348 HG2 PRO 42 HG2 PRO 42 -11.050 -10.543 5.745 349 HG3 PRO 42 HG1 PRO 42 -9.495 -10.034 6.432 350 HD2 PRO 42 HD2 PRO 42 -10.504 -9.772 3.625 351 HD3 PRO 42 HD1 PRO 42 -9.579 -8.613 4.602 352 H SER 43 HN SER 43 -8.992 -11.350 1.959 353 HA SER 43 HA SER 43 -9.083 -14.072 1.206 354 HB2 SER 43 HB2 SER 43 -8.860 -11.631 -0.569 355 HB3 SER 43 HB1 SER 43 -9.420 -13.231 -1.058 356 HG SER 43 HG SER 43 -11.074 -12.912 0.655 357 H LEU 44 HN LEU 44 -6.506 -11.771 1.387 358 HA LEU 44 HA LEU 44 -4.763 -13.701 0.015 359 HB2 LEU 44 HB2 LEU 44 -3.208 -11.823 -0.393 360 HB3 LEU 44 HB1 LEU 44 -4.749 -11.617 -1.169 361 HG LEU 44 HG LEU 44 -5.156 -10.223 1.108 362 HD11 LEU 44 HD11 LEU 44 -3.117 -8.794 1.316 363 HD12 LEU 44 HD12 LEU 44 -2.243 -10.017 0.394 364 HD13 LEU 44 HD13 LEU 44 -2.951 -10.429 1.956 365 HD21 LEU 44 HD21 LEU 44 -5.696 -9.450 -1.099 366 HD22 LEU 44 HD22 LEU 44 -3.990 -9.310 -1.517 367 HD23 LEU 44 HD23 LEU 44 -4.693 -8.235 -0.308 368 H LYS 45 HN LYS 45 -5.736 -13.528 2.826 369 HA LYS 45 HA LYS 45 -3.654 -12.885 4.600 370 HB2 LYS 45 HB2 LYS 45 -6.089 -13.838 5.147 371 HB3 LYS 45 HB1 LYS 45 -5.241 -15.388 5.204 372 HG2 LYS 45 HG2 LYS 45 -3.841 -14.668 6.976 373 HG3 LYS 45 HG1 LYS 45 -4.434 -13.003 6.851 374 HD2 LYS 45 HD2 LYS 45 -5.593 -13.874 8.674 375 HD3 LYS 45 HD1 LYS 45 -6.744 -14.053 7.349 376 HE2 LYS 45 HE2 LYS 45 -4.862 -16.273 8.009 377 HE3 LYS 45 HE1 LYS 45 -6.309 -16.038 8.985 378 HZ1 LYS 45 HZ1 LYS 45 -7.635 -16.237 6.958 379 HZ2 LYS 45 HZ2 LYS 45 -6.713 -17.624 7.239 380 HZ3 LYS 45 HZ3 LYS 45 -6.233 -16.519 6.058 381 H ASN 46 HN ASN 46 -4.008 -15.605 2.477 382 HA ASN 46 HA ASN 46 -2.075 -17.275 3.774 383 HB2 ASN 46 HB2 ASN 46 -2.327 -18.715 1.740 384 HB3 ASN 46 HB1 ASN 46 -3.885 -18.259 2.432 385 HD21 ASN 46 HD21 ASN 46 -1.737 -17.964 -0.248 386 HD22 ASN 46 HD22 ASN 46 -2.837 -17.131 -1.305 387 H SER 47 HN SER 47 -1.720 -14.505 2.007 388 HA SER 47 HA SER 47 0.574 -15.257 0.432 389 HB2 SER 47 HB2 SER 47 -0.578 -12.545 1.130 390 HB3 SER 47 HB1 SER 47 0.713 -12.816 -0.043 391 HG SER 47 HG SER 47 -1.462 -14.405 -0.482 392 H ASN 48 HN ASN 48 2.721 -14.554 0.778 393 HA ASN 48 HA ASN 48 3.527 -14.732 3.527 394 HB2 ASN 48 HB2 ASN 48 5.219 -14.148 1.097 395 HB3 ASN 48 HB1 ASN 48 5.801 -14.684 2.664 396 HD21 ASN 48 HD21 ASN 48 5.530 -16.837 3.260 397 HD22 ASN 48 HD22 ASN 48 5.119 -18.064 2.114 398 HA PRO 49 HA PRO 49 3.322 -10.451 4.397 399 HB2 PRO 49 HB2 PRO 49 4.923 -10.384 6.599 400 HB3 PRO 49 HB1 PRO 49 3.275 -11.015 6.604 401 HG2 PRO 49 HG2 PRO 49 5.860 -12.498 6.450 402 HG3 PRO 49 HG1 PRO 49 4.403 -12.869 7.390 403 HD2 PRO 49 HD2 PRO 49 4.982 -14.126 5.072 404 HD3 PRO 49 HD1 PRO 49 3.314 -13.791 5.581 405 H ASP 50 HN ASP 50 6.440 -11.972 3.897 406 HA ASP 50 HA ASP 50 7.633 -9.313 3.548 407 HB2 ASP 50 HB2 ASP 50 8.918 -12.023 3.896 408 HB3 ASP 50 HB1 ASP 50 9.819 -10.561 3.509 409 H GLU 51 HN GLU 51 5.970 -11.338 1.729 410 HA GLU 51 HA GLU 51 7.447 -10.622 -0.698 411 HB2 GLU 51 HB2 GLU 51 6.384 -13.420 -0.210 412 HB3 GLU 51 HB1 GLU 51 7.091 -12.839 -1.702 413 HG2 GLU 51 HG2 GLU 51 8.936 -13.829 -0.937 414 HG3 GLU 51 HG1 GLU 51 9.121 -12.365 0.019 415 H ILE 52 HN ILE 52 5.161 -9.585 0.629 416 HA ILE 52 HA ILE 52 2.737 -10.617 -0.311 417 HB ILE 52 HB ILE 52 3.228 -8.923 1.606 418 HG12 ILE 52 HG12 ILE 52 0.886 -8.206 1.548 419 HG13 ILE 52 HG11 ILE 52 0.777 -8.663 -0.142 420 HG21 ILE 52 HG21 ILE 52 2.580 -7.067 -0.661 421 HG22 ILE 52 HG22 ILE 52 4.150 -7.186 0.128 422 HG23 ILE 52 HG23 ILE 52 2.743 -6.619 1.031 423 HD11 ILE 52 HD11 ILE 52 1.377 -10.543 2.090 424 HD12 ILE 52 HD12 ILE 52 1.051 -10.958 0.409 425 HD13 ILE 52 HD13 ILE 52 -0.225 -10.275 1.414 426 H GLU 53 HN GLU 53 1.269 -9.762 -1.745 427 HA GLU 53 HA GLU 53 2.477 -8.349 -4.034 428 HB2 GLU 53 HB2 GLU 53 1.940 -10.786 -4.424 429 HB3 GLU 53 HB1 GLU 53 0.256 -10.422 -4.096 430 HG2 GLU 53 HG2 GLU 53 1.766 -9.090 -6.326 431 HG3 GLU 53 HG1 GLU 53 1.001 -10.661 -6.513 432 H ILE 54 HN ILE 54 1.826 -6.295 -3.471 433 HA ILE 54 HA ILE 54 -0.779 -5.714 -2.473 434 HB ILE 54 HB ILE 54 1.246 -3.835 -3.701 435 HG12 ILE 54 HG12 ILE 54 0.911 -4.705 -0.825 436 HG13 ILE 54 HG11 ILE 54 2.308 -4.981 -1.856 437 HG21 ILE 54 HG21 ILE 54 -1.026 -3.316 -1.818 438 HG22 ILE 54 HG22 ILE 54 -1.006 -2.934 -3.535 439 HG23 ILE 54 HG23 ILE 54 0.103 -2.116 -2.434 440 HD11 ILE 54 HD11 ILE 54 2.786 -3.157 -0.343 441 HD12 ILE 54 HD12 ILE 54 1.314 -2.340 -0.842 442 HD13 ILE 54 HD13 ILE 54 2.640 -2.538 -1.985 443 H ASP 55 HN ASP 55 -2.410 -6.208 -3.882 444 HA ASP 55 HA ASP 55 -2.192 -5.257 -6.654 445 HB2 ASP 55 HB2 ASP 55 -2.783 -7.649 -6.387 446 HB3 ASP 55 HB1 ASP 55 -4.201 -7.183 -5.449 447 H PHE 56 HN PHE 56 -2.861 -3.247 -6.794 448 HA PHE 56 HA PHE 56 -4.491 -2.059 -4.812 449 HB2 PHE 56 HB2 PHE 56 -3.449 -0.996 -7.421 450 HB3 PHE 56 HB1 PHE 56 -4.250 -0.012 -6.201 451 HD1 PHE 56 HD1 PHE 56 -3.221 0.130 -3.925 452 HD2 PHE 56 HD2 PHE 56 -1.158 -1.522 -7.235 453 HE1 PHE 56 HE1 PHE 56 -1.133 0.423 -2.726 454 HE2 PHE 56 HE2 PHE 56 0.966 -1.224 -6.035 455 HZ PHE 56 HZ PHE 56 0.973 -0.245 -3.773 456 H GLU 57 HN GLU 57 -5.354 -3.813 -7.525 457 HA GLU 57 HA GLU 57 -7.817 -2.376 -8.027 458 HB2 GLU 57 HB2 GLU 57 -6.581 -4.870 -9.147 459 HB3 GLU 57 HB1 GLU 57 -8.253 -4.450 -9.500 460 HG2 GLU 57 HG2 GLU 57 -5.855 -2.727 -10.082 461 HG3 GLU 57 HG1 GLU 57 -6.723 -3.718 -11.254 462 H THR 58 HN THR 58 -6.726 -5.249 -6.342 463 HA THR 58 HA THR 58 -9.452 -5.985 -5.664 464 HB THR 58 HB THR 58 -8.294 -7.844 -4.376 465 HG1 THR 58 HG1 THR 58 -6.039 -6.934 -5.879 466 HG21 THR 58 HG21 THR 58 -7.841 -7.568 -7.348 467 HG22 THR 58 HG22 THR 58 -9.265 -8.245 -6.553 468 HG23 THR 58 HG23 THR 58 -7.716 -9.082 -6.450 469 H LEU 59 HN LEU 59 -6.714 -4.371 -4.238 470 HA LEU 59 HA LEU 59 -7.389 -4.459 -1.549 471 HB2 LEU 59 HB2 LEU 59 -6.136 -2.224 -3.094 472 HB3 LEU 59 HB1 LEU 59 -6.230 -2.303 -1.353 473 HG LEU 59 HG LEU 59 -4.787 -4.253 -3.128 474 HD11 LEU 59 HD11 LEU 59 -3.684 -2.343 -1.102 475 HD12 LEU 59 HD12 LEU 59 -3.744 -2.014 -2.832 476 HD13 LEU 59 HD13 LEU 59 -2.792 -3.365 -2.223 477 HD21 LEU 59 HD21 LEU 59 -5.365 -4.214 -0.179 478 HD22 LEU 59 HD22 LEU 59 -3.939 -5.028 -0.841 479 HD23 LEU 59 HD23 LEU 59 -5.549 -5.531 -1.348 480 H LYS 60 HN LYS 60 -9.062 -3.711 -0.438 481 HA LYS 60 HA LYS 60 -11.218 -2.325 -1.640 482 HB2 LYS 60 HB2 LYS 60 -10.500 -2.715 1.277 483 HB3 LYS 60 HB1 LYS 60 -12.043 -2.088 0.716 484 HG2 LYS 60 HG2 LYS 60 -12.590 -4.176 -0.301 485 HG3 LYS 60 HG1 LYS 60 -10.964 -4.784 -0.039 486 HD2 LYS 60 HD2 LYS 60 -11.553 -4.316 2.491 487 HD3 LYS 60 HD1 LYS 60 -13.204 -4.482 1.901 488 HE2 LYS 60 HE2 LYS 60 -12.329 -6.619 2.709 489 HE3 LYS 60 HE1 LYS 60 -12.684 -6.680 0.991 490 HZ1 LYS 60 HZ1 LYS 60 -10.011 -6.370 2.209 491 HZ2 LYS 60 HZ2 LYS 60 -10.318 -6.324 0.544 492 HZ3 LYS 60 HZ3 LYS 60 -10.609 -7.739 1.421 493 HA PRO 61 HA PRO 61 -9.979 1.971 -1.703 494 HB2 PRO 61 HB2 PRO 61 -12.592 2.331 -0.295 495 HB3 PRO 61 HB1 PRO 61 -11.919 3.224 -1.662 496 HG2 PRO 61 HG2 PRO 61 -13.793 1.346 -1.998 497 HG3 PRO 61 HG1 PRO 61 -12.510 1.634 -3.182 498 HD2 PRO 61 HD2 PRO 61 -12.885 -0.638 -1.342 499 HD3 PRO 61 HD1 PRO 61 -11.951 -0.554 -2.845 500 H SER 62 HN SER 62 -11.392 0.566 1.184 501 HA SER 62 HA SER 62 -10.560 2.453 3.080 502 HB2 SER 62 HB2 SER 62 -10.880 0.535 4.689 503 HB3 SER 62 HB1 SER 62 -12.256 0.709 3.595 504 HG SER 62 HG SER 62 -11.270 -1.478 3.948 505 H THR 63 HN THR 63 -9.008 -0.606 2.060 506 HA THR 63 HA THR 63 -6.695 -0.321 3.632 507 HB THR 63 HB THR 63 -6.579 -1.652 0.940 508 HG1 THR 63 HG1 THR 63 -7.848 -3.322 1.647 509 HG21 THR 63 HG21 THR 63 -4.605 -2.243 1.897 510 HG22 THR 63 HG22 THR 63 -5.601 -3.395 2.796 511 HG23 THR 63 HG23 THR 63 -5.187 -1.843 3.517 512 H LEU 64 HN LEU 64 -7.394 0.624 0.289 513 HA LEU 64 HA LEU 64 -4.830 1.483 -0.401 514 HB2 LEU 64 HB2 LEU 64 -7.511 2.441 -1.383 515 HB3 LEU 64 HB1 LEU 64 -5.985 2.822 -2.147 516 HG LEU 64 HG LEU 64 -7.036 0.021 -1.796 517 HD11 LEU 64 HD11 LEU 64 -7.756 2.086 -3.659 518 HD12 LEU 64 HD12 LEU 64 -8.438 0.474 -3.452 519 HD13 LEU 64 HD13 LEU 64 -7.030 0.711 -4.489 520 HD21 LEU 64 HD21 LEU 64 -4.675 1.241 -3.182 521 HD22 LEU 64 HD22 LEU 64 -5.331 -0.321 -3.674 522 HD23 LEU 64 HD23 LEU 64 -4.719 -0.099 -2.035 523 H ARG 65 HN ARG 65 -7.545 3.345 0.979 524 HA ARG 65 HA ARG 65 -6.158 5.812 1.014 525 HB2 ARG 65 HB2 ARG 65 -8.517 4.817 2.597 526 HB3 ARG 65 HB1 ARG 65 -7.882 6.451 2.744 527 HG2 ARG 65 HG2 ARG 65 -8.881 5.242 0.173 528 HG3 ARG 65 HG1 ARG 65 -9.841 6.265 1.241 529 HD2 ARG 65 HD2 ARG 65 -8.324 8.109 0.907 530 HD3 ARG 65 HD1 ARG 65 -7.245 7.097 -0.042 531 HE ARG 65 HE ARG 65 -9.863 7.182 -1.165 532 HH11 ARG 65 HH11 ARG 65 -6.891 9.016 -0.865 533 HH12 ARG 65 HH12 ARG 65 -7.105 9.849 -2.371 534 HH21 ARG 65 HH21 ARG 65 -10.135 8.311 -3.177 535 HH22 ARG 65 HH22 ARG 65 -8.911 9.440 -3.679 536 H GLU 66 HN GLU 66 -6.155 3.063 3.141 537 HA GLU 66 HA GLU 66 -4.800 4.396 5.283 538 HB2 GLU 66 HB2 GLU 66 -6.117 2.406 5.729 539 HB3 GLU 66 HB1 GLU 66 -5.145 1.468 4.603 540 HG2 GLU 66 HG2 GLU 66 -4.500 0.919 6.828 541 HG3 GLU 66 HG1 GLU 66 -3.191 1.817 6.058 542 H LEU 67 HN LEU 67 -3.752 1.972 2.866 543 HA LEU 67 HA LEU 67 -1.045 1.892 3.301 544 HB2 LEU 67 HB2 LEU 67 -2.199 2.034 0.510 545 HB3 LEU 67 HB1 LEU 67 -0.817 1.108 1.076 546 HG LEU 67 HG LEU 67 -3.652 0.530 1.905 547 HD11 LEU 67 HD11 LEU 67 -2.090 -1.192 0.073 548 HD12 LEU 67 HD12 LEU 67 -2.888 0.233 -0.588 549 HD13 LEU 67 HD13 LEU 67 -3.835 -1.006 0.235 550 HD21 LEU 67 HD21 LEU 67 -1.321 -0.197 3.106 551 HD22 LEU 67 HD22 LEU 67 -1.600 -1.542 2.007 552 HD23 LEU 67 HD23 LEU 67 -2.829 -1.103 3.192 553 H GLU 68 HN GLU 68 -2.758 4.194 1.171 554 HA GLU 68 HA GLU 68 -0.562 5.732 0.382 555 HB2 GLU 68 HB2 GLU 68 -2.838 5.910 -0.601 556 HB3 GLU 68 HB1 GLU 68 -3.396 6.670 0.879 557 HG2 GLU 68 HG2 GLU 68 -1.589 8.415 0.443 558 HG3 GLU 68 HG1 GLU 68 -1.543 7.760 -1.195 559 H ARG 69 HN ARG 69 -2.953 6.587 2.876 560 HA ARG 69 HA ARG 69 -1.645 8.806 3.917 561 HB2 ARG 69 HB2 ARG 69 -3.683 6.893 4.898 562 HB3 ARG 69 HB1 ARG 69 -2.996 8.009 6.061 563 HG2 ARG 69 HG2 ARG 69 -4.008 9.108 3.497 564 HG3 ARG 69 HG1 ARG 69 -5.185 8.563 4.693 565 HD2 ARG 69 HD2 ARG 69 -4.751 10.918 4.999 566 HD3 ARG 69 HD1 ARG 69 -4.115 10.007 6.367 567 HE ARG 69 HE ARG 69 -2.196 10.567 4.276 568 HH11 ARG 69 HH11 ARG 69 -3.646 11.699 7.248 569 HH12 ARG 69 HH12 ARG 69 -2.289 12.686 7.684 570 HH21 ARG 69 HH21 ARG 69 -0.400 11.865 4.853 571 HH22 ARG 69 HH22 ARG 69 -0.450 12.791 6.323 572 H TYR 70 HN TYR 70 -1.085 5.438 4.483 573 HA TYR 70 HA TYR 70 0.360 5.760 6.918 574 HB2 TYR 70 HB2 TYR 70 -0.556 3.602 6.518 575 HB3 TYR 70 HB1 TYR 70 0.172 3.520 4.919 576 HD1 TYR 70 HD2 TYR 70 1.303 4.071 8.442 577 HD2 TYR 70 HD1 TYR 70 1.970 2.192 4.696 578 HE1 TYR 70 HE2 TYR 70 3.316 2.999 9.359 579 HE2 TYR 70 HE1 TYR 70 3.971 1.101 5.591 580 HH TYR 70 HH TYR 70 5.508 1.187 7.316 581 H VAL 71 HN VAL 71 1.318 5.166 3.537 582 HA VAL 71 HA VAL 71 4.082 5.334 4.048 583 HB VAL 71 HB VAL 71 4.455 5.492 1.724 584 HG11 VAL 71 HG11 VAL 71 2.560 3.970 0.774 585 HG12 VAL 71 HG12 VAL 71 2.133 3.817 2.477 586 HG13 VAL 71 HG13 VAL 71 3.742 3.352 1.920 587 HG21 VAL 71 HG21 VAL 71 2.937 6.192 0.104 588 HG22 VAL 71 HG22 VAL 71 2.938 7.424 1.354 589 HG23 VAL 71 HG23 VAL 71 1.605 6.270 1.243 590 H THR 72 HN THR 72 1.601 7.749 3.464 591 HA THR 72 HA THR 72 3.349 9.836 2.795 592 HB THR 72 HB THR 72 1.525 11.393 3.239 593 HG1 THR 72 HG1 THR 72 0.521 9.214 4.665 594 HG21 THR 72 HG21 THR 72 1.076 8.873 1.742 595 HG22 THR 72 HG22 THR 72 1.365 10.502 1.124 596 HG23 THR 72 HG23 THR 72 -0.212 10.077 1.800 597 H SER 73 HN SER 73 2.495 8.426 5.819 598 HA SER 73 HA SER 73 3.348 10.589 7.463 599 HB2 SER 73 HB2 SER 73 3.087 9.110 9.291 600 HB3 SER 73 HB1 SER 73 1.859 8.614 8.125 601 HG SER 73 HG SER 73 3.103 6.869 7.554 602 H CYS 74 HN CYS 74 4.891 8.063 5.710 603 HA CYS 74 HA CYS 74 7.458 8.498 7.051 604 HB2 CYS 74 HB2 CYS 74 6.912 6.176 6.779 605 HB3 CYS 74 HB1 CYS 74 6.559 6.409 5.070 606 HG CYS 74 HG CYS 74 9.489 7.376 5.021 607 H LEU 75 HN LEU 75 5.788 9.191 4.116 608 HA LEU 75 HA LEU 75 8.258 9.874 2.715 609 HB2 LEU 75 HB2 LEU 75 5.443 9.751 1.658 610 HB3 LEU 75 HB1 LEU 75 6.903 9.828 0.717 611 HG LEU 75 HG LEU 75 5.877 7.518 2.320 612 HD11 LEU 75 HD11 LEU 75 5.109 8.026 -0.061 613 HD12 LEU 75 HD12 LEU 75 5.728 6.411 0.274 614 HD13 LEU 75 HD13 LEU 75 6.747 7.594 -0.535 615 HD21 LEU 75 HD21 LEU 75 7.912 6.331 1.785 616 HD22 LEU 75 HD22 LEU 75 8.293 7.772 2.724 617 HD23 LEU 75 HD23 LEU 75 8.569 7.756 0.982 618 H ARG 76 HN ARG 76 5.030 11.251 3.303 619 HA ARG 76 HA ARG 76 5.957 13.801 2.273 620 HB2 ARG 76 HB2 ARG 76 3.190 12.949 3.076 621 HB3 ARG 76 HB1 ARG 76 3.615 14.446 2.252 622 HG2 ARG 76 HG2 ARG 76 4.477 13.127 0.366 623 HG3 ARG 76 HG1 ARG 76 3.975 11.666 1.211 624 HD2 ARG 76 HD2 ARG 76 1.678 12.617 1.249 625 HD3 ARG 76 HD1 ARG 76 2.236 13.839 0.110 626 HE ARG 76 HE ARG 76 2.964 11.355 -0.912 627 HH11 ARG 76 HH11 ARG 76 0.001 13.108 -0.237 628 HH12 ARG 76 HH12 ARG 76 -0.923 12.241 -1.421 629 HH21 ARG 76 HH21 ARG 76 1.753 10.185 -2.431 630 HH22 ARG 76 HH22 ARG 76 0.068 10.574 -2.662 631 H LYS 77 HN LYS 77 6.342 12.423 5.048 632 HA LYS 77 HA LYS 77 6.088 14.899 6.589 633 HB2 LYS 77 HB2 LYS 77 4.148 13.258 6.984 634 HB3 LYS 77 HB1 LYS 77 5.345 12.233 7.763 635 HG2 LYS 77 HG2 LYS 77 4.315 13.445 9.491 636 HG3 LYS 77 HG1 LYS 77 5.888 14.204 9.228 637 HD2 LYS 77 HD2 LYS 77 4.872 15.974 7.942 638 HD3 LYS 77 HD1 LYS 77 3.292 15.197 8.065 639 HE2 LYS 77 HE2 LYS 77 3.460 17.020 9.655 640 HE3 LYS 77 HE1 LYS 77 3.356 15.477 10.498 641 HZ1 LYS 77 HZ1 LYS 77 5.777 15.543 10.769 642 HZ2 LYS 77 HZ2 LYS 77 5.018 16.851 11.515 643 HZ3 LYS 77 HZ3 LYS 77 5.820 17.069 10.042 644 H LYS 78 HN LYS 78 8.161 13.017 5.280 645 HA LYS 78 HA LYS 78 10.244 13.327 7.175 646 HB2 LYS 78 HB2 LYS 78 8.881 11.364 8.080 647 HB3 LYS 78 HB1 LYS 78 9.430 10.460 6.678 648 HG2 LYS 78 HG2 LYS 78 10.867 9.837 8.413 649 HG3 LYS 78 HG1 LYS 78 11.792 11.003 7.463 650 HD2 LYS 78 HD2 LYS 78 11.505 12.699 9.057 651 HD3 LYS 78 HD1 LYS 78 10.179 11.849 9.849 652 HE2 LYS 78 HE2 LYS 78 12.190 11.739 11.202 653 HE3 LYS 78 HE1 LYS 78 11.744 10.136 10.627 654 HZ1 LYS 78 HZ1 LYS 78 14.137 10.606 10.471 655 HZ2 LYS 78 HZ2 LYS 78 13.817 11.846 9.370 656 HZ3 LYS 78 HZ3 LYS 78 13.451 10.243 8.971 657 H ARG 79 HN ARG 79 12.129 13.404 5.980 658 HA ARG 79 HA ARG 79 11.884 12.437 3.225 659 HB2 ARG 79 HB2 ARG 79 13.659 14.098 2.665 660 HB3 ARG 79 HB1 ARG 79 12.155 14.798 3.230 661 HG2 ARG 79 HG2 ARG 79 13.796 16.060 4.281 662 HG3 ARG 79 HG1 ARG 79 13.288 14.919 5.524 663 HD2 ARG 79 HD2 ARG 79 15.219 13.503 4.997 664 HD3 ARG 79 HD1 ARG 79 15.725 14.657 3.766 665 HE ARG 79 HE ARG 79 15.500 16.070 6.139 666 HH11 ARG 79 HH11 ARG 79 17.415 13.440 4.844 667 HH12 ARG 79 HH12 ARG 79 18.786 13.767 5.856 668 HH21 ARG 79 HH21 ARG 79 17.308 16.508 7.473 669 HH22 ARG 79 HH22 ARG 79 18.726 15.516 7.353 670 H LYS 80 HN LYS 80 12.875 11.114 5.761 671 HA LYS 80 HA LYS 80 14.849 9.502 4.510 672 HB2 LYS 80 HB2 LYS 80 16.230 11.511 5.189 673 HB3 LYS 80 HB1 LYS 80 15.843 11.127 6.862 674 HG2 LYS 80 HG2 LYS 80 17.983 10.233 6.447 675 HG3 LYS 80 HG1 LYS 80 16.873 8.860 6.454 676 HD2 LYS 80 HD2 LYS 80 16.791 8.987 3.973 677 HD3 LYS 80 HD1 LYS 80 18.011 10.258 4.034 678 HE2 LYS 80 HE2 LYS 80 18.320 7.411 4.977 679 HE3 LYS 80 HE1 LYS 80 19.048 8.128 3.543 680 HZ1 LYS 80 HZ1 LYS 80 20.672 8.049 5.256 681 HZ2 LYS 80 HZ2 LYS 80 19.646 8.788 6.378 682 HZ3 LYS 80 HZ3 LYS 80 20.239 9.672 5.058 683 HA PRO 81 HA PRO 81 12.596 7.376 7.841 684 HB2 PRO 81 HB2 PRO 81 12.233 5.049 6.529 685 HB3 PRO 81 HB1 PRO 81 11.203 6.457 6.247 686 HG2 PRO 81 HG2 PRO 81 13.467 5.404 4.612 687 HG3 PRO 81 HG1 PRO 81 11.931 6.110 4.082 688 HD2 PRO 81 HD2 PRO 81 14.335 7.461 4.152 689 HD3 PRO 81 HD1 PRO 81 12.742 8.239 4.198 690 H GLN 82 HN GLN 82 15.261 6.150 5.880 691 HA GLN 82 HA GLN 82 16.045 4.328 8.035 692 HB2 GLN 82 HB2 GLN 82 17.006 4.524 5.177 693 HB3 GLN 82 HB1 GLN 82 17.563 3.340 6.350 694 HG2 GLN 82 HG2 GLN 82 14.754 3.606 5.305 695 HG3 GLN 82 HG1 GLN 82 15.931 2.386 4.823 696 HE21 GLN 82 HE21 GLN 82 16.490 0.755 6.286 697 HE22 GLN 82 HE22 GLN 82 15.498 0.381 7.653 698 H ALA 83 HN ALA 83 17.143 5.515 9.489 699 HA ALA 83 HA ALA 83 18.846 6.635 10.467 700 HB1 ALA 83 HB1 ALA 83 20.381 5.927 7.971 701 HB2 ALA 83 HB2 ALA 83 20.208 4.899 9.394 702 HB3 ALA 83 HB3 ALA 83 21.067 6.435 9.514 703 H1 VAL 201 HT1 VAL 201 -6.772 0.970 -13.869 704 H2 VAL 201 HT2 VAL 201 -7.244 0.362 -15.371 705 H3 VAL 201 HT3 VAL 201 -6.024 1.531 -15.277 706 HA VAL 201 HA VAL 201 -5.862 -1.218 -14.189 707 HB VAL 201 HB VAL 201 -4.411 0.003 -16.550 708 HG11 VAL 201 HG11 VAL 201 -4.406 -2.815 -15.475 709 HG12 VAL 201 HG12 VAL 201 -3.081 -1.658 -15.361 710 HG13 VAL 201 HG13 VAL 201 -3.585 -2.268 -16.937 711 HG21 VAL 201 HG21 VAL 201 -6.726 -0.374 -17.128 712 HG22 VAL 201 HG22 VAL 201 -6.651 -2.013 -16.483 713 HG23 VAL 201 HG23 VAL 201 -5.715 -1.586 -17.915 714 H VAL 202 HN VAL 202 -4.146 -1.588 -12.855 715 HA VAL 202 HA VAL 202 -2.170 0.555 -12.505 716 HB VAL 202 HB VAL 202 -3.723 -0.731 -10.247 717 HG11 VAL 202 HG11 VAL 202 -1.493 1.296 -10.106 718 HG12 VAL 202 HG12 VAL 202 -1.352 -0.408 -9.678 719 HG13 VAL 202 HG13 VAL 202 -2.407 0.651 -8.743 720 HG21 VAL 202 HG21 VAL 202 -3.600 2.152 -11.120 721 HG22 VAL 202 HG22 VAL 202 -4.544 1.497 -9.781 722 HG23 VAL 202 HG23 VAL 202 -4.935 1.047 -11.439 723 HA PRO 203 HA PRO 203 0.573 -3.032 -12.807 724 HB2 PRO 203 HB2 PRO 203 2.339 -0.910 -11.673 725 HB3 PRO 203 HB1 PRO 203 2.646 -2.037 -12.999 726 HG2 PRO 203 HG2 PRO 203 2.050 0.517 -13.482 727 HG3 PRO 203 HG1 PRO 203 1.439 -0.781 -14.523 728 HD2 PRO 203 HD2 PRO 203 0.007 0.850 -12.492 729 HD3 PRO 203 HD1 PRO 203 -0.600 0.116 -13.992 730 H LYS 204 HN LYS 204 0.452 -4.530 -11.260 731 HA LYS 204 HA LYS 204 0.121 -3.851 -8.498 732 HB2 LYS 204 HB2 LYS 204 0.071 -6.269 -8.110 733 HB3 LYS 204 HB1 LYS 204 -0.997 -5.811 -9.427 734 HG2 LYS 204 HG2 LYS 204 0.648 -6.582 -11.048 735 HG3 LYS 204 HG1 LYS 204 1.748 -7.011 -9.736 736 HD2 LYS 204 HD2 LYS 204 0.076 -8.601 -8.881 737 HD3 LYS 204 HD1 LYS 204 -0.986 -8.191 -10.228 738 HE2 LYS 204 HE2 LYS 204 1.774 -9.380 -10.483 739 HE3 LYS 204 HE1 LYS 204 0.263 -10.281 -10.603 740 HZ1 LYS 204 HZ1 LYS 204 1.184 -8.124 -12.419 741 HZ2 LYS 204 HZ2 LYS 204 -0.337 -8.856 -12.501 742 HZ3 LYS 204 HZ3 LYS 204 1.056 -9.769 -12.785 743 H LYS 205 HN LYS 205 1.519 -4.543 -6.766 744 HA LYS 205 HA LYS 205 4.305 -4.110 -7.562 745 HB2 LYS 205 HB2 LYS 205 2.874 -3.693 -4.942 746 HB3 LYS 205 HB1 LYS 205 4.612 -3.524 -5.131 747 HG2 LYS 205 HG2 LYS 205 2.558 -1.933 -6.649 748 HG3 LYS 205 HG1 LYS 205 3.403 -1.372 -5.206 749 HD2 LYS 205 HD2 LYS 205 4.751 -2.205 -7.775 750 HD3 LYS 205 HD1 LYS 205 4.383 -0.538 -7.332 751 HE2 LYS 205 HE2 LYS 205 5.847 -0.641 -5.448 752 HE3 LYS 205 HE1 LYS 205 6.074 -2.376 -5.651 753 HZ1 LYS 205 HZ1 LYS 205 7.943 -1.030 -6.495 754 HZ2 LYS 205 HZ2 LYS 205 6.908 -0.347 -7.641 755 HZ3 LYS 205 HZ3 LYS 205 7.237 -2.004 -7.686 756 H LYS 206 HN LYS 206 5.509 -5.836 -7.727 757 HA LYS 206 HA LYS 206 4.963 -8.250 -6.246 758 HB2 LYS 206 HB2 LYS 206 7.312 -7.568 -8.030 759 HB3 LYS 206 HB1 LYS 206 6.903 -9.168 -7.429 760 HG2 LYS 206 HG2 LYS 206 4.737 -8.987 -8.666 761 HG3 LYS 206 HG1 LYS 206 5.349 -7.499 -9.388 762 HD2 LYS 206 HD2 LYS 206 6.665 -10.207 -9.597 763 HD3 LYS 206 HD1 LYS 206 5.673 -9.459 -10.848 764 HE2 LYS 206 HE2 LYS 206 8.226 -8.296 -9.734 765 HE3 LYS 206 HE1 LYS 206 8.106 -9.205 -11.239 766 HZ1 LYS 206 HZ1 LYS 206 6.567 -7.505 -12.065 767 HZ2 LYS 206 HZ2 LYS 206 8.081 -6.857 -11.688 768 HZ3 LYS 206 HZ3 LYS 206 6.775 -6.615 -10.642 769 H ILE 207 HN ILE 207 5.151 -7.279 -4.161 770 HA ILE 207 HA ILE 207 7.518 -6.005 -3.246 771 HB ILE 207 HB ILE 207 5.309 -7.300 -1.645 772 HG12 ILE 207 HG12 ILE 207 4.489 -5.618 -3.260 773 HG13 ILE 207 HG11 ILE 207 4.266 -5.118 -1.590 774 HG21 ILE 207 HG21 ILE 207 7.055 -5.024 -0.764 775 HG22 ILE 207 HG22 ILE 207 7.489 -6.709 -0.466 776 HG23 ILE 207 HG23 ILE 207 6.000 -6.049 0.212 777 HD11 ILE 207 HD11 ILE 207 6.302 -3.718 -1.800 778 HD12 ILE 207 HD12 ILE 207 4.988 -3.239 -2.871 779 HD13 ILE 207 HD13 ILE 207 6.361 -4.142 -3.511 780 H LYS 208 HN LYS 208 9.278 -6.807 -2.272 781 HA LYS 208 HA LYS 208 9.298 -9.570 -1.330 782 HB2 LYS 208 HB2 LYS 208 11.265 -8.386 -3.296 783 HB3 LYS 208 HB1 LYS 208 11.594 -9.842 -2.371 784 HG2 LYS 208 HG2 LYS 208 9.311 -9.495 -4.302 785 HG3 LYS 208 HG1 LYS 208 10.829 -10.324 -4.649 786 HD2 LYS 208 HD2 LYS 208 10.361 -11.985 -2.962 787 HD3 LYS 208 HD1 LYS 208 8.915 -11.112 -2.453 788 HE2 LYS 208 HE2 LYS 208 9.369 -12.419 -5.132 789 HE3 LYS 208 HE1 LYS 208 8.316 -13.007 -3.846 790 HZ1 LYS 208 HZ1 LYS 208 6.964 -11.899 -5.415 791 HZ2 LYS 208 HZ2 LYS 208 7.981 -10.552 -5.469 792 HZ3 LYS 208 HZ3 LYS 208 7.071 -10.867 -4.079 793 H LYS 209 HN LYS 209 11.967 -9.702 -0.606 794 HA LYS 209 HA LYS 209 12.011 -8.362 1.838 795 HB2 LYS 209 HB2 LYS 209 14.382 -9.385 0.267 796 HB3 LYS 209 HB1 LYS 209 14.359 -9.039 1.989 797 HG2 LYS 209 HG2 LYS 209 12.720 -10.819 2.326 798 HG3 LYS 209 HG1 LYS 209 12.748 -11.166 0.597 799 HD2 LYS 209 HD2 LYS 209 15.109 -11.360 2.465 800 HD3 LYS 209 HD1 LYS 209 14.160 -12.722 1.869 801 HE2 LYS 209 HE2 LYS 209 14.808 -12.147 -0.429 802 HE3 LYS 209 HE1 LYS 209 15.773 -10.806 0.184 803 HZ1 LYS 209 HZ1 LYS 209 16.217 -13.674 0.793 804 HZ2 LYS 209 HZ2 LYS 209 17.144 -12.390 1.381 805 HZ3 LYS 209 HZ3 LYS 209 17.135 -12.738 -0.273 806 H GLU 210 HN GLU 210 13.539 -7.570 -1.233 807 HA GLU 210 HA GLU 210 14.309 -4.944 -0.157 808 HB2 GLU 210 HB2 GLU 210 16.148 -6.365 -1.029 809 HB3 GLU 210 HB1 GLU 210 15.349 -6.408 -2.592 810 HG2 GLU 210 HG2 GLU 210 15.598 -3.965 -2.757 811 HG3 GLU 210 HG1 GLU 210 16.472 -3.976 -1.226 812 H GLN 211 HN GLN 211 13.713 -3.081 -1.285 813 HA GLN 211 HA GLN 211 12.236 -3.376 -3.777 814 HB2 GLN 211 HB2 GLN 211 10.519 -3.493 -1.978 815 HB3 GLN 211 HB1 GLN 211 11.032 -1.902 -1.429 816 HG2 GLN 211 HG2 GLN 211 9.082 -1.619 -2.764 817 HG3 GLN 211 HG1 GLN 211 10.464 -1.012 -3.686 818 HE21 GLN 211 HE21 GLN 211 11.166 -2.130 -5.489 819 HE22 GLN 211 HE22 GLN 211 10.206 -3.346 -6.258 820 H VAL 212 HN VAL 212 13.546 -1.197 -1.313 821 HA VAL 212 HA VAL 212 13.646 0.994 -3.207 822 HB VAL 212 HB VAL 212 14.653 2.300 -1.368 823 HG11 VAL 212 HG11 VAL 212 12.154 0.798 -0.604 824 HG12 VAL 212 HG12 VAL 212 12.237 2.241 -1.614 825 HG13 VAL 212 HG13 VAL 212 12.683 2.330 0.090 826 HG21 VAL 212 HG21 VAL 212 15.848 0.455 -0.258 827 HG22 VAL 212 HG22 VAL 212 14.303 -0.198 0.284 828 HG23 VAL 212 HG23 VAL 212 14.846 1.374 0.865 829 H GLU 213 HN GLU 213 15.631 2.148 -3.651 830 HA GLU 213 HA GLU 213 17.796 0.280 -4.198 831 HB2 GLU 213 HB2 GLU 213 17.424 3.150 -5.074 832 HB3 GLU 213 HB1 GLU 213 18.665 2.048 -5.653 833 HG2 GLU 213 HG2 GLU 213 16.914 0.598 -6.586 834 HG3 GLU 213 HG1 GLU 213 15.696 1.753 -6.049 Start of MODEL 4 1 H1 SER 1 HT1 SER 1 -23.134 2.945 8.944 2 H2 SER 1 HT2 SER 1 -24.582 2.482 8.198 3 H3 SER 1 HT3 SER 1 -24.030 4.076 8.052 4 HA SER 1 HA SER 1 -22.614 1.700 7.001 5 HB2 SER 1 HB2 SER 1 -24.174 3.790 5.477 6 HB3 SER 1 HB1 SER 1 -23.422 2.337 4.817 7 HG SER 1 HG SER 1 -24.897 1.174 6.313 8 H GLU 2 HN GLU 2 -22.138 4.477 8.450 9 HA GLU 2 HA GLU 2 -20.749 6.004 6.492 10 HB2 GLU 2 HB2 GLU 2 -20.916 6.254 9.491 11 HB3 GLU 2 HB1 GLU 2 -20.094 7.398 8.453 12 HG2 GLU 2 HG2 GLU 2 -22.174 8.367 8.851 13 HG3 GLU 2 HG1 GLU 2 -22.315 7.661 7.242 14 H GLU 3 HN GLU 3 -19.863 3.538 8.764 15 HA GLU 3 HA GLU 3 -17.111 4.092 8.959 16 HB2 GLU 3 HB2 GLU 3 -18.605 1.475 9.169 17 HB3 GLU 3 HB1 GLU 3 -16.896 1.658 9.532 18 HG2 GLU 3 HG2 GLU 3 -19.140 3.098 10.923 19 HG3 GLU 3 HG1 GLU 3 -18.267 1.699 11.548 20 H GLU 4 HN GLU 4 -18.994 2.663 6.424 21 HA GLU 4 HA GLU 4 -16.580 1.764 5.054 22 HB2 GLU 4 HB2 GLU 4 -18.567 0.249 5.232 23 HB3 GLU 4 HB1 GLU 4 -19.458 1.374 4.216 24 HG2 GLU 4 HG2 GLU 4 -18.613 -0.493 2.924 25 HG3 GLU 4 HG1 GLU 4 -17.871 1.022 2.414 26 H ASP 5 HN ASP 5 -19.073 4.210 4.903 27 HA ASP 5 HA ASP 5 -18.322 4.992 2.220 28 HB2 ASP 5 HB2 ASP 5 -20.665 5.081 2.752 29 HB3 ASP 5 HB1 ASP 5 -20.359 6.123 4.125 30 H LYS 6 HN LYS 6 -17.446 5.798 5.421 31 HA LYS 6 HA LYS 6 -16.593 8.465 5.003 32 HB2 LYS 6 HB2 LYS 6 -16.429 6.514 7.132 33 HB3 LYS 6 HB1 LYS 6 -14.871 7.313 6.950 34 HG2 LYS 6 HG2 LYS 6 -17.537 8.657 7.402 35 HG3 LYS 6 HG1 LYS 6 -16.241 8.465 8.586 36 HD2 LYS 6 HD2 LYS 6 -14.772 9.851 7.230 37 HD3 LYS 6 HD1 LYS 6 -16.027 10.011 6.002 38 HE2 LYS 6 HE2 LYS 6 -17.473 11.112 7.668 39 HE3 LYS 6 HE1 LYS 6 -16.163 11.006 8.844 40 HZ1 LYS 6 HZ1 LYS 6 -16.195 13.174 7.834 41 HZ2 LYS 6 HZ2 LYS 6 -16.106 12.507 6.283 42 HZ3 LYS 6 HZ3 LYS 6 -14.798 12.354 7.344 43 H CYS 7 HN CYS 7 -15.247 5.408 4.155 44 HA CYS 7 HA CYS 7 -12.616 6.436 3.612 45 HB2 CYS 7 HB2 CYS 7 -13.918 3.846 2.727 46 HB3 CYS 7 HB1 CYS 7 -12.201 4.236 2.595 47 HG CYS 7 HG CYS 7 -13.084 4.654 5.714 48 H LYS 8 HN LYS 8 -12.078 7.564 1.861 49 HA LYS 8 HA LYS 8 -14.093 8.021 -0.178 50 HB2 LYS 8 HB2 LYS 8 -11.432 9.257 0.467 51 HB3 LYS 8 HB1 LYS 8 -12.144 9.503 -1.118 52 HG2 LYS 8 HG2 LYS 8 -12.648 11.358 0.329 53 HG3 LYS 8 HG1 LYS 8 -14.114 10.489 -0.105 54 HD2 LYS 8 HD2 LYS 8 -14.159 9.413 2.066 55 HD3 LYS 8 HD1 LYS 8 -12.610 10.139 2.488 56 HE2 LYS 8 HE2 LYS 8 -15.167 11.637 1.928 57 HE3 LYS 8 HE1 LYS 8 -14.487 11.327 3.524 58 HZ1 LYS 8 HZ1 LYS 8 -12.530 12.620 2.882 59 HZ2 LYS 8 HZ2 LYS 8 -13.940 13.544 2.778 60 HZ3 LYS 8 HZ3 LYS 8 -13.224 12.942 1.374 61 HA PRO 9 HA PRO 9 -12.732 5.020 -3.010 62 HB2 PRO 9 HB2 PRO 9 -13.648 6.192 -5.314 63 HB3 PRO 9 HB1 PRO 9 -14.671 5.313 -4.176 64 HG2 PRO 9 HG2 PRO 9 -14.297 8.247 -4.519 65 HG3 PRO 9 HG1 PRO 9 -15.767 7.340 -4.121 66 HD2 PRO 9 HD2 PRO 9 -14.299 8.713 -2.272 67 HD3 PRO 9 HD1 PRO 9 -15.256 7.278 -1.867 68 H MET 10 HN MET 10 -10.775 4.669 -3.861 69 HA MET 10 HA MET 10 -9.091 6.951 -4.513 70 HB2 MET 10 HB2 MET 10 -8.239 5.071 -3.085 71 HB3 MET 10 HB1 MET 10 -8.348 4.024 -4.496 72 HG2 MET 10 HG2 MET 10 -6.158 4.615 -4.616 73 HG3 MET 10 HG1 MET 10 -6.878 5.901 -5.588 74 HE1 MET 10 HE1 MET 10 -5.584 4.793 -2.226 75 HE2 MET 10 HE2 MET 10 -6.928 5.695 -1.540 76 HE3 MET 10 HE3 MET 10 -5.274 6.270 -1.322 77 H SER 11 HN SER 11 -8.852 7.646 -6.523 78 HA SER 11 HA SER 11 -10.032 6.186 -8.697 79 HB2 SER 11 HB2 SER 11 -8.691 8.860 -8.451 80 HB3 SER 11 HB1 SER 11 -9.247 8.235 -10.008 81 HG SER 11 HG SER 11 -11.241 7.897 -8.352 82 H TYR 12 HN TYR 12 -8.666 6.279 -10.904 83 HA TYR 12 HA TYR 12 -6.814 4.204 -10.568 84 HB2 TYR 12 HB2 TYR 12 -7.564 3.944 -12.656 85 HB3 TYR 12 HB1 TYR 12 -8.057 5.628 -12.771 86 HD1 TYR 12 HD1 TYR 12 -4.976 3.508 -12.969 87 HD2 TYR 12 HD2 TYR 12 -7.030 6.973 -14.329 88 HE1 TYR 12 HE1 TYR 12 -3.189 3.914 -14.606 89 HE2 TYR 12 HE2 TYR 12 -5.251 7.391 -15.968 90 HH TYR 12 HH TYR 12 -2.945 6.870 -16.348 91 H GLU 13 HN GLU 13 -6.142 7.526 -11.703 92 HA GLU 13 HA GLU 13 -3.402 7.532 -11.736 93 HB2 GLU 13 HB2 GLU 13 -5.315 9.677 -10.785 94 HB3 GLU 13 HB1 GLU 13 -3.617 9.979 -11.119 95 HG2 GLU 13 HG2 GLU 13 -5.434 8.823 -13.207 96 HG3 GLU 13 HG1 GLU 13 -5.345 10.561 -12.926 97 H GLU 14 HN GLU 14 -5.522 7.745 -8.940 98 HA GLU 14 HA GLU 14 -3.535 8.541 -7.086 99 HB2 GLU 14 HB2 GLU 14 -6.299 7.408 -6.832 100 HB3 GLU 14 HB1 GLU 14 -5.307 7.724 -5.421 101 HG2 GLU 14 HG2 GLU 14 -5.156 10.092 -6.115 102 HG3 GLU 14 HG1 GLU 14 -6.241 9.735 -7.459 103 H LYS 15 HN LYS 15 -5.105 5.449 -7.807 104 HA LYS 15 HA LYS 15 -3.697 3.851 -6.004 105 HB2 LYS 15 HB2 LYS 15 -4.830 3.178 -8.708 106 HB3 LYS 15 HB1 LYS 15 -4.130 1.975 -7.632 107 HG2 LYS 15 HG2 LYS 15 -5.842 2.055 -6.161 108 HG3 LYS 15 HG1 LYS 15 -6.268 3.714 -6.575 109 HD2 LYS 15 HD2 LYS 15 -7.467 3.113 -8.403 110 HD3 LYS 15 HD1 LYS 15 -6.522 1.652 -8.684 111 HE2 LYS 15 HE2 LYS 15 -7.553 0.687 -6.655 112 HE3 LYS 15 HE1 LYS 15 -8.608 2.094 -6.555 113 HZ1 LYS 15 HZ1 LYS 15 -9.716 0.268 -7.663 114 HZ2 LYS 15 HZ2 LYS 15 -8.471 0.158 -8.810 115 HZ3 LYS 15 HZ3 LYS 15 -9.460 1.531 -8.760 116 H ARG 16 HN ARG 16 -2.803 4.983 -9.237 117 HA ARG 16 HA ARG 16 -0.398 3.522 -9.469 118 HB2 ARG 16 HB2 ARG 16 -1.325 4.696 -11.400 119 HB3 ARG 16 HB1 ARG 16 -1.044 6.240 -10.606 120 HG2 ARG 16 HG2 ARG 16 1.372 5.610 -10.498 121 HG3 ARG 16 HG1 ARG 16 0.994 4.282 -11.574 122 HD2 ARG 16 HD2 ARG 16 1.866 6.179 -12.799 123 HD3 ARG 16 HD1 ARG 16 0.195 5.865 -13.215 124 HE ARG 16 HE ARG 16 1.027 8.014 -11.386 125 HH11 ARG 16 HH11 ARG 16 -0.981 6.778 -13.963 126 HH12 ARG 16 HH12 ARG 16 -1.925 8.233 -14.111 127 HH21 ARG 16 HH21 ARG 16 -0.189 9.939 -11.574 128 HH22 ARG 16 HH22 ARG 16 -1.461 10.042 -12.759 129 H GLN 17 HN GLN 17 -0.970 6.856 -8.347 130 HA GLN 17 HA GLN 17 1.619 7.455 -7.536 131 HB2 GLN 17 HB2 GLN 17 -0.199 9.111 -7.638 132 HB3 GLN 17 HB1 GLN 17 -0.979 8.334 -6.268 133 HG2 GLN 17 HG2 GLN 17 0.106 10.161 -5.335 134 HG3 GLN 17 HG1 GLN 17 1.174 8.802 -5.000 135 HE21 GLN 17 HE21 GLN 17 0.833 10.429 -8.081 136 HE22 GLN 17 HE22 GLN 17 2.438 11.072 -8.127 137 H LEU 18 HN LEU 18 -0.978 5.846 -5.853 138 HA LEU 18 HA LEU 18 0.147 5.488 -3.331 139 HB2 LEU 18 HB2 LEU 18 -2.203 4.931 -4.412 140 HB3 LEU 18 HB1 LEU 18 -1.481 3.357 -4.611 141 HG LEU 18 HG LEU 18 -2.068 4.784 -2.038 142 HD11 LEU 18 HD11 LEU 18 -3.307 2.539 -1.771 143 HD12 LEU 18 HD12 LEU 18 -3.172 2.450 -3.521 144 HD13 LEU 18 HD13 LEU 18 -4.012 3.803 -2.767 145 HD21 LEU 18 HD21 LEU 18 -0.162 3.728 -1.364 146 HD22 LEU 18 HD22 LEU 18 -0.289 2.475 -2.595 147 HD23 LEU 18 HD23 LEU 18 -1.316 2.412 -1.164 148 H SER 19 HN SER 19 0.223 3.321 -6.159 149 HA SER 19 HA SER 19 1.772 1.325 -4.935 150 HB2 SER 19 HB2 SER 19 1.843 0.312 -7.034 151 HB3 SER 19 HB1 SER 19 0.388 1.306 -7.135 152 HG SER 19 HG SER 19 1.721 2.933 -8.159 153 H LEU 20 HN LEU 20 2.593 4.370 -6.295 154 HA LEU 20 HA LEU 20 5.405 3.777 -6.591 155 HB2 LEU 20 HB2 LEU 20 3.833 6.313 -6.897 156 HB3 LEU 20 HB1 LEU 20 5.546 6.187 -7.219 157 HG LEU 20 HG LEU 20 3.291 4.905 -8.713 158 HD11 LEU 20 HD11 LEU 20 3.961 7.239 -9.200 159 HD12 LEU 20 HD12 LEU 20 4.095 6.143 -10.568 160 HD13 LEU 20 HD13 LEU 20 5.541 6.637 -9.684 161 HD21 LEU 20 HD21 LEU 20 4.959 3.209 -8.461 162 HD22 LEU 20 HD22 LEU 20 6.233 4.328 -8.941 163 HD23 LEU 20 HD23 LEU 20 5.012 3.825 -10.111 164 H ASP 21 HN ASP 21 3.273 5.374 -4.306 165 HA ASP 21 HA ASP 21 5.434 6.379 -2.698 166 HB2 ASP 21 HB2 ASP 21 3.758 7.097 -1.120 167 HB3 ASP 21 HB1 ASP 21 3.332 7.579 -2.738 168 H ILE 22 HN ILE 22 3.351 3.540 -2.594 169 HA ILE 22 HA ILE 22 4.378 2.401 -0.255 170 HB ILE 22 HB ILE 22 3.054 1.403 -2.699 171 HG12 ILE 22 HG12 ILE 22 2.603 0.841 0.216 172 HG13 ILE 22 HG11 ILE 22 1.884 2.191 -0.651 173 HG21 ILE 22 HG21 ILE 22 4.460 -0.488 -0.839 174 HG22 ILE 22 HG22 ILE 22 4.849 -0.212 -2.532 175 HG23 ILE 22 HG23 ILE 22 3.310 -0.942 -2.088 176 HD11 ILE 22 HD11 ILE 22 1.463 -0.697 -1.387 177 HD12 ILE 22 HD12 ILE 22 0.624 0.712 -2.031 178 HD13 ILE 22 HD13 ILE 22 0.383 0.237 -0.352 179 H ASN 23 HN ASN 23 5.578 2.497 -3.537 180 HA ASN 23 HA ASN 23 7.698 0.661 -3.206 181 HB2 ASN 23 HB2 ASN 23 6.687 1.397 -5.370 182 HB3 ASN 23 HB1 ASN 23 7.454 2.959 -5.150 183 HD21 ASN 23 HD21 ASN 23 9.703 3.128 -5.382 184 HD22 ASN 23 HD22 ASN 23 10.618 1.899 -6.183 185 H LYS 24 HN LYS 24 7.244 3.916 -2.257 186 HA LYS 24 HA LYS 24 10.021 4.649 -2.113 187 HB2 LYS 24 HB2 LYS 24 7.434 5.905 -1.341 188 HB3 LYS 24 HB1 LYS 24 8.932 6.565 -0.704 189 HG2 LYS 24 HG2 LYS 24 9.716 7.079 -2.899 190 HG3 LYS 24 HG1 LYS 24 8.373 6.202 -3.640 191 HD2 LYS 24 HD2 LYS 24 6.796 7.804 -2.905 192 HD3 LYS 24 HD1 LYS 24 7.952 8.551 -1.806 193 HE2 LYS 24 HE2 LYS 24 8.199 8.551 -4.815 194 HE3 LYS 24 HE1 LYS 24 7.528 9.872 -3.858 195 HZ1 LYS 24 HZ1 LYS 24 9.667 10.049 -2.721 196 HZ2 LYS 24 HZ2 LYS 24 9.824 10.297 -4.384 197 HZ3 LYS 24 HZ3 LYS 24 10.301 8.828 -3.701 198 H LEU 25 HN LEU 25 7.831 2.946 -0.132 199 HA LEU 25 HA LEU 25 8.965 3.624 2.403 200 HB2 LEU 25 HB2 LEU 25 7.195 1.358 1.514 201 HB3 LEU 25 HB1 LEU 25 7.734 1.562 3.170 202 HG LEU 25 HG LEU 25 5.863 3.299 1.595 203 HD11 LEU 25 HD11 LEU 25 5.748 1.998 4.286 204 HD12 LEU 25 HD12 LEU 25 4.973 1.381 2.827 205 HD13 LEU 25 HD13 LEU 25 4.443 2.910 3.534 206 HD21 LEU 25 HD21 LEU 25 7.220 3.965 4.182 207 HD22 LEU 25 HD22 LEU 25 5.907 4.881 3.454 208 HD23 LEU 25 HD23 LEU 25 7.473 4.795 2.652 209 HA PRO 26 HA PRO 26 12.428 0.770 2.384 210 HB2 PRO 26 HB2 PRO 26 12.780 0.677 5.101 211 HB3 PRO 26 HB1 PRO 26 13.431 1.952 4.072 212 HG2 PRO 26 HG2 PRO 26 11.030 1.968 5.824 213 HG3 PRO 26 HG1 PRO 26 12.163 3.277 5.472 214 HD2 PRO 26 HD2 PRO 26 9.682 3.082 4.342 215 HD3 PRO 26 HD1 PRO 26 11.053 3.890 3.558 216 H GLY 27 HN GLY 27 12.772 -1.420 2.964 217 HA2 GLY 27 HA2 GLY 27 10.634 -3.083 2.682 218 HA3 GLY 27 HA1 GLY 27 12.141 -3.582 3.418 219 H GLU 28 HN GLU 28 12.138 -2.254 5.796 220 HA GLU 28 HA GLU 28 10.471 -3.866 7.367 221 HB2 GLU 28 HB2 GLU 28 11.099 -2.121 9.187 222 HB3 GLU 28 HB1 GLU 28 12.333 -3.174 8.518 223 HG2 GLU 28 HG2 GLU 28 11.856 -0.470 7.375 224 HG3 GLU 28 HG1 GLU 28 12.789 -0.667 8.845 225 H LYS 29 HN LYS 29 10.075 -0.506 6.326 226 HA LYS 29 HA LYS 29 7.702 -0.092 7.886 227 HB2 LYS 29 HB2 LYS 29 9.298 1.453 5.958 228 HB3 LYS 29 HB1 LYS 29 7.585 1.817 5.941 229 HG2 LYS 29 HG2 LYS 29 8.861 3.322 7.387 230 HG3 LYS 29 HG1 LYS 29 7.647 2.411 8.279 231 HD2 LYS 29 HD2 LYS 29 9.180 1.305 9.498 232 HD3 LYS 29 HD1 LYS 29 10.329 1.198 8.157 233 HE2 LYS 29 HE2 LYS 29 11.144 2.625 9.990 234 HE3 LYS 29 HE1 LYS 29 10.964 3.504 8.474 235 HZ1 LYS 29 HZ1 LYS 29 9.066 3.545 10.760 236 HZ2 LYS 29 HZ2 LYS 29 8.842 4.366 9.301 237 HZ3 LYS 29 HZ3 LYS 29 10.119 4.791 10.322 238 H LEU 30 HN LEU 30 8.444 -1.315 4.719 239 HA LEU 30 HA LEU 30 5.742 -0.979 3.803 240 HB2 LEU 30 HB2 LEU 30 6.741 -1.002 1.870 241 HB3 LEU 30 HB1 LEU 30 8.251 -1.516 2.568 242 HG LEU 30 HG LEU 30 6.079 -3.389 1.626 243 HD11 LEU 30 HD11 LEU 30 7.450 -1.768 0.057 244 HD12 LEU 30 HD12 LEU 30 7.071 -3.423 -0.413 245 HD13 LEU 30 HD13 LEU 30 8.666 -3.030 0.230 246 HD21 LEU 30 HD21 LEU 30 7.659 -4.306 3.338 247 HD22 LEU 30 HD22 LEU 30 8.984 -3.946 2.233 248 HD23 LEU 30 HD23 LEU 30 7.747 -5.115 1.775 249 H GLY 31 HN GLY 31 7.420 -3.339 5.610 250 HA2 GLY 31 HA2 GLY 31 5.722 -5.550 5.140 251 HA3 GLY 31 HA1 GLY 31 6.569 -5.232 6.641 252 H ARG 32 HN ARG 32 5.154 -2.495 6.678 253 HA ARG 32 HA ARG 32 2.823 -3.303 8.114 254 HB2 ARG 32 HB2 ARG 32 3.929 -1.189 8.661 255 HB3 ARG 32 HB1 ARG 32 3.518 -0.557 7.076 256 HG2 ARG 32 HG2 ARG 32 1.632 0.218 7.956 257 HG3 ARG 32 HG1 ARG 32 1.115 -1.456 8.167 258 HD2 ARG 32 HD2 ARG 32 2.682 0.169 10.162 259 HD3 ARG 32 HD1 ARG 32 0.968 -0.246 10.278 260 HE ARG 32 HE ARG 32 3.133 -2.253 10.303 261 HH11 ARG 32 HH11 ARG 32 0.078 -1.038 11.522 262 HH12 ARG 32 HH12 ARG 32 -0.100 -2.314 12.683 263 HH21 ARG 32 HH21 ARG 32 2.896 -3.919 11.819 264 HH22 ARG 32 HH22 ARG 32 1.507 -3.952 12.861 265 H VAL 33 HN VAL 33 3.319 -1.950 4.844 266 HA VAL 33 HA VAL 33 0.563 -1.678 4.285 267 HB VAL 33 HB VAL 33 1.718 -2.283 1.818 268 HG11 VAL 33 HG11 VAL 33 1.158 0.281 3.267 269 HG12 VAL 33 HG12 VAL 33 0.134 -0.560 2.103 270 HG13 VAL 33 HG13 VAL 33 1.615 0.218 1.572 271 HG21 VAL 33 HG21 VAL 33 3.549 -0.394 3.249 272 HG22 VAL 33 HG22 VAL 33 3.742 -1.114 1.651 273 HG23 VAL 33 HG23 VAL 33 3.929 -2.109 3.096 274 H VAL 34 HN VAL 34 2.806 -4.308 3.477 275 HA VAL 34 HA VAL 34 1.017 -6.222 2.600 276 HB VAL 34 HB VAL 34 2.693 -7.708 2.851 277 HG11 VAL 34 HG11 VAL 34 4.028 -5.877 2.142 278 HG12 VAL 34 HG12 VAL 34 4.941 -6.810 3.329 279 HG13 VAL 34 HG13 VAL 34 4.178 -5.293 3.801 280 HG21 VAL 34 HG21 VAL 34 2.094 -8.153 5.181 281 HG22 VAL 34 HG22 VAL 34 3.179 -6.849 5.686 282 HG23 VAL 34 HG23 VAL 34 3.835 -8.282 4.893 283 H HIS 35 HN HIS 35 1.650 -5.197 5.941 284 HA HIS 35 HA HIS 35 0.048 -7.194 7.160 285 HB2 HIS 35 HB2 HIS 35 1.842 -5.986 8.352 286 HB3 HIS 35 HB1 HIS 35 0.911 -4.499 8.235 287 HD1 HIS 35 HD1 HIS 35 1.229 -7.627 10.199 288 HD2 HIS 35 HD2 HIS 35 -1.351 -4.375 9.952 289 HE1 HIS 35 HE1 HIS 35 -0.187 -7.723 12.274 290 HE2 HIS 35 HE2 HIS 35 -1.602 -5.642 12.191 291 H ILE 36 HN ILE 36 -0.529 -3.751 6.463 292 HA ILE 36 HA ILE 36 -3.169 -3.599 7.379 293 HB ILE 36 HB ILE 36 -1.895 -2.108 5.069 294 HG12 ILE 36 HG12 ILE 36 -2.292 -1.186 7.912 295 HG13 ILE 36 HG11 ILE 36 -0.813 -1.954 7.363 296 HG21 ILE 36 HG21 ILE 36 -3.723 -0.727 4.946 297 HG22 ILE 36 HG22 ILE 36 -4.134 -0.965 6.648 298 HG23 ILE 36 HG23 ILE 36 -4.523 -2.214 5.468 299 HD11 ILE 36 HD11 ILE 36 -0.670 -0.119 5.646 300 HD12 ILE 36 HD12 ILE 36 -0.431 0.362 7.322 301 HD13 ILE 36 HD13 ILE 36 -1.967 0.674 6.526 302 H ILE 37 HN ILE 37 -1.857 -4.345 4.209 303 HA ILE 37 HA ILE 37 -4.273 -4.718 2.862 304 HB ILE 37 HB ILE 37 -1.471 -5.609 2.399 305 HG12 ILE 37 HG12 ILE 37 -3.195 -3.908 0.643 306 HG13 ILE 37 HG11 ILE 37 -2.414 -3.236 2.066 307 HG21 ILE 37 HG21 ILE 37 -3.859 -6.736 1.209 308 HG22 ILE 37 HG22 ILE 37 -2.188 -7.309 1.158 309 HG23 ILE 37 HG23 ILE 37 -2.734 -6.081 0.018 310 HD11 ILE 37 HD11 ILE 37 -1.052 -2.781 0.199 311 HD12 ILE 37 HD12 ILE 37 -1.099 -4.471 -0.314 312 HD13 ILE 37 HD13 ILE 37 -0.247 -4.023 1.163 313 H GLN 38 HN GLN 38 -2.064 -7.338 3.965 314 HA GLN 38 HA GLN 38 -3.752 -9.479 3.576 315 HB2 GLN 38 HB2 GLN 38 -1.750 -9.047 5.805 316 HB3 GLN 38 HB1 GLN 38 -2.541 -10.584 5.496 317 HG2 GLN 38 HG2 GLN 38 -1.539 -10.622 3.257 318 HG3 GLN 38 HG1 GLN 38 -0.739 -9.100 3.622 319 HE21 GLN 38 HE21 GLN 38 -1.212 -11.673 5.944 320 HE22 GLN 38 HE22 GLN 38 0.454 -12.108 6.087 321 H SER 39 HN SER 39 -3.744 -7.270 6.366 322 HA SER 39 HA SER 39 -5.565 -8.865 7.898 323 HB2 SER 39 HB2 SER 39 -5.635 -6.913 9.422 324 HB3 SER 39 HB1 SER 39 -3.989 -7.380 9.015 325 HG SER 39 HG SER 39 -3.816 -5.660 7.663 326 H ARG 40 HN ARG 40 -5.867 -5.901 5.977 327 HA ARG 40 HA ARG 40 -8.704 -5.739 6.425 328 HB2 ARG 40 HB2 ARG 40 -6.852 -4.198 4.598 329 HB3 ARG 40 HB1 ARG 40 -8.572 -3.864 4.739 330 HG2 ARG 40 HG2 ARG 40 -8.281 -3.432 7.092 331 HG3 ARG 40 HG1 ARG 40 -6.565 -3.777 6.979 332 HD2 ARG 40 HD2 ARG 40 -6.538 -1.499 6.839 333 HD3 ARG 40 HD1 ARG 40 -6.686 -1.915 5.130 334 HE ARG 40 HE ARG 40 -9.190 -1.622 5.571 335 HH11 ARG 40 HH11 ARG 40 -6.677 0.247 7.159 336 HH12 ARG 40 HH12 ARG 40 -7.733 1.563 7.554 337 HH21 ARG 40 HH21 ARG 40 -10.584 0.101 6.141 338 HH22 ARG 40 HH22 ARG 40 -9.947 1.478 6.982 339 H GLU 41 HN GLU 41 -6.642 -7.322 4.253 340 HA GLU 41 HA GLU 41 -8.929 -8.123 2.573 341 HB2 GLU 41 HB2 GLU 41 -6.020 -8.269 1.781 342 HB3 GLU 41 HB1 GLU 41 -7.435 -8.440 0.748 343 HG2 GLU 41 HG2 GLU 41 -6.654 -5.903 2.145 344 HG3 GLU 41 HG1 GLU 41 -6.205 -6.316 0.489 345 HA PRO 42 HA PRO 42 -7.269 -11.685 5.065 346 HB2 PRO 42 HB2 PRO 42 -10.098 -12.514 5.134 347 HB3 PRO 42 HB1 PRO 42 -8.962 -12.300 6.468 348 HG2 PRO 42 HG2 PRO 42 -10.989 -10.586 6.050 349 HG3 PRO 42 HG1 PRO 42 -9.417 -10.048 6.674 350 HD2 PRO 42 HD2 PRO 42 -10.522 -9.852 3.894 351 HD3 PRO 42 HD1 PRO 42 -9.590 -8.657 4.822 352 H SER 43 HN SER 43 -9.039 -11.287 2.207 353 HA SER 43 HA SER 43 -9.261 -13.966 1.336 354 HB2 SER 43 HB2 SER 43 -8.945 -11.480 -0.365 355 HB3 SER 43 HB1 SER 43 -9.656 -13.017 -0.858 356 HG SER 43 HG SER 43 -10.784 -10.928 0.480 357 H LEU 44 HN LEU 44 -6.624 -11.716 1.509 358 HA LEU 44 HA LEU 44 -4.968 -13.591 -0.036 359 HB2 LEU 44 HB2 LEU 44 -3.461 -11.709 -0.503 360 HB3 LEU 44 HB1 LEU 44 -5.059 -11.448 -1.129 361 HG LEU 44 HG LEU 44 -5.280 -10.124 1.181 362 HD11 LEU 44 HD11 LEU 44 -3.167 -8.845 1.436 363 HD12 LEU 44 HD12 LEU 44 -2.381 -10.018 0.390 364 HD13 LEU 44 HD13 LEU 44 -3.054 -10.526 1.938 365 HD21 LEU 44 HD21 LEU 44 -5.812 -9.233 -0.996 366 HD22 LEU 44 HD22 LEU 44 -4.103 -9.140 -1.415 367 HD23 LEU 44 HD23 LEU 44 -4.757 -8.102 -0.149 368 H LYS 45 HN LYS 45 -5.696 -13.670 2.838 369 HA LYS 45 HA LYS 45 -3.369 -12.978 4.332 370 HB2 LYS 45 HB2 LYS 45 -4.350 -14.105 6.164 371 HB3 LYS 45 HB1 LYS 45 -5.674 -13.354 5.292 372 HG2 LYS 45 HG2 LYS 45 -6.172 -15.532 4.243 373 HG3 LYS 45 HG1 LYS 45 -4.886 -16.253 5.215 374 HD2 LYS 45 HD2 LYS 45 -7.290 -14.845 6.365 375 HD3 LYS 45 HD1 LYS 45 -7.157 -16.590 6.155 376 HE2 LYS 45 HE2 LYS 45 -6.468 -16.380 8.330 377 HE3 LYS 45 HE1 LYS 45 -4.932 -16.274 7.472 378 HZ1 LYS 45 HZ1 LYS 45 -6.516 -13.959 8.448 379 HZ2 LYS 45 HZ2 LYS 45 -5.032 -13.866 7.652 380 HZ3 LYS 45 HZ3 LYS 45 -5.126 -14.574 9.182 381 H ASN 46 HN ASN 46 -4.023 -15.455 2.106 382 HA ASN 46 HA ASN 46 -2.309 -17.454 3.183 383 HB2 ASN 46 HB2 ASN 46 -2.435 -18.476 0.893 384 HB3 ASN 46 HB1 ASN 46 -4.022 -18.067 1.544 385 HD21 ASN 46 HD21 ASN 46 -5.199 -16.402 0.607 386 HD22 ASN 46 HD22 ASN 46 -4.784 -15.741 -0.944 387 H SER 47 HN SER 47 -1.832 -14.674 1.071 388 HA SER 47 HA SER 47 0.792 -15.433 0.283 389 HB2 SER 47 HB2 SER 47 0.871 -12.764 -0.124 390 HB3 SER 47 HB1 SER 47 0.135 -13.910 -1.245 391 HG SER 47 HG SER 47 -1.334 -12.693 0.848 392 H ASN 48 HN ASN 48 2.725 -15.038 1.149 393 HA ASN 48 HA ASN 48 2.821 -14.606 3.953 394 HB2 ASN 48 HB2 ASN 48 5.069 -14.816 1.942 395 HB3 ASN 48 HB1 ASN 48 5.234 -14.966 3.688 396 HD21 ASN 48 HD21 ASN 48 4.584 -16.845 4.697 397 HD22 ASN 48 HD22 ASN 48 4.164 -18.280 3.827 398 HA PRO 49 HA PRO 49 3.243 -10.285 4.257 399 HB2 PRO 49 HB2 PRO 49 4.907 -10.132 6.438 400 HB3 PRO 49 HB1 PRO 49 3.174 -10.449 6.521 401 HG2 PRO 49 HG2 PRO 49 5.455 -12.368 6.641 402 HG3 PRO 49 HG1 PRO 49 3.952 -12.339 7.581 403 HD2 PRO 49 HD2 PRO 49 4.291 -14.021 5.515 404 HD3 PRO 49 HD1 PRO 49 2.715 -13.289 5.876 405 H ASP 50 HN ASP 50 6.100 -12.229 3.926 406 HA ASP 50 HA ASP 50 7.698 -9.856 3.286 407 HB2 ASP 50 HB2 ASP 50 8.481 -12.746 3.701 408 HB3 ASP 50 HB1 ASP 50 9.606 -11.494 3.198 409 H GLU 51 HN GLU 51 5.566 -11.610 1.699 410 HA GLU 51 HA GLU 51 7.013 -11.478 -0.845 411 HB2 GLU 51 HB2 GLU 51 5.391 -13.913 -0.080 412 HB3 GLU 51 HB1 GLU 51 6.406 -13.703 -1.499 413 HG2 GLU 51 HG2 GLU 51 8.372 -13.566 0.021 414 HG3 GLU 51 HG1 GLU 51 7.305 -13.972 1.355 415 H ILE 52 HN ILE 52 4.973 -9.829 0.365 416 HA ILE 52 HA ILE 52 2.395 -10.729 -0.386 417 HB ILE 52 HB ILE 52 3.104 -9.059 1.491 418 HG12 ILE 52 HG12 ILE 52 0.810 -8.218 1.562 419 HG13 ILE 52 HG11 ILE 52 0.582 -8.634 -0.126 420 HG21 ILE 52 HG21 ILE 52 2.462 -7.212 -0.787 421 HG22 ILE 52 HG22 ILE 52 4.044 -7.391 -0.028 422 HG23 ILE 52 HG23 ILE 52 2.689 -6.736 0.893 423 HD11 ILE 52 HD11 ILE 52 1.130 -10.578 2.065 424 HD12 ILE 52 HD12 ILE 52 0.747 -10.962 0.390 425 HD13 ILE 52 HD13 ILE 52 -0.462 -10.208 1.423 426 H GLU 53 HN GLU 53 0.958 -9.891 -1.766 427 HA GLU 53 HA GLU 53 2.033 -8.527 -4.147 428 HB2 GLU 53 HB2 GLU 53 -0.279 -10.475 -3.898 429 HB3 GLU 53 HB1 GLU 53 0.142 -9.613 -5.369 430 HG2 GLU 53 HG2 GLU 53 2.079 -11.416 -3.981 431 HG3 GLU 53 HG1 GLU 53 0.903 -12.032 -5.148 432 H ILE 54 HN ILE 54 1.530 -6.413 -3.581 433 HA ILE 54 HA ILE 54 -0.987 -5.745 -2.415 434 HB ILE 54 HB ILE 54 1.017 -3.941 -3.770 435 HG12 ILE 54 HG12 ILE 54 0.781 -4.799 -0.885 436 HG13 ILE 54 HG11 ILE 54 2.139 -5.066 -1.973 437 HG21 ILE 54 HG21 ILE 54 -1.175 -3.327 -1.824 438 HG22 ILE 54 HG22 ILE 54 -1.179 -2.951 -3.543 439 HG23 ILE 54 HG23 ILE 54 -0.018 -2.169 -2.470 440 HD11 ILE 54 HD11 ILE 54 2.665 -3.257 -0.446 441 HD12 ILE 54 HD12 ILE 54 1.185 -2.425 -0.906 442 HD13 ILE 54 HD13 ILE 54 2.481 -2.626 -2.081 443 H ASP 55 HN ASP 55 -2.707 -6.217 -3.694 444 HA ASP 55 HA ASP 55 -2.602 -5.506 -6.537 445 HB2 ASP 55 HB2 ASP 55 -3.282 -7.837 -5.810 446 HB3 ASP 55 HB1 ASP 55 -4.737 -7.115 -5.130 447 H PHE 56 HN PHE 56 -3.042 -3.384 -6.637 448 HA PHE 56 HA PHE 56 -4.636 -2.029 -4.760 449 HB2 PHE 56 HB2 PHE 56 -3.552 -1.158 -7.419 450 HB3 PHE 56 HB1 PHE 56 -4.316 -0.074 -6.264 451 HD1 PHE 56 HD1 PHE 56 -3.289 0.090 -3.959 452 HD2 PHE 56 HD2 PHE 56 -1.267 -1.665 -7.244 453 HE1 PHE 56 HE1 PHE 56 -1.187 0.400 -2.787 454 HE2 PHE 56 HE2 PHE 56 0.877 -1.352 -6.074 455 HZ PHE 56 HZ PHE 56 0.904 -0.307 -3.836 456 H GLU 57 HN GLU 57 -5.543 -3.764 -7.510 457 HA GLU 57 HA GLU 57 -7.925 -2.215 -8.038 458 HB2 GLU 57 HB2 GLU 57 -6.770 -4.735 -9.183 459 HB3 GLU 57 HB1 GLU 57 -8.413 -4.236 -9.570 460 HG2 GLU 57 HG2 GLU 57 -5.955 -2.556 -10.009 461 HG3 GLU 57 HG1 GLU 57 -6.757 -3.523 -11.247 462 H THR 58 HN THR 58 -7.013 -5.055 -6.239 463 HA THR 58 HA THR 58 -9.828 -5.577 -5.643 464 HB THR 58 HB THR 58 -8.952 -7.668 -4.547 465 HG1 THR 58 HG1 THR 58 -6.551 -7.024 -5.946 466 HG21 THR 58 HG21 THR 58 -8.334 -7.247 -7.470 467 HG22 THR 58 HG22 THR 58 -9.895 -7.708 -6.790 468 HG23 THR 58 HG23 THR 58 -8.525 -8.814 -6.685 469 H LEU 59 HN LEU 59 -6.936 -4.290 -4.222 470 HA LEU 59 HA LEU 59 -7.610 -4.370 -1.507 471 HB2 LEU 59 HB2 LEU 59 -6.169 -2.241 -3.050 472 HB3 LEU 59 HB1 LEU 59 -6.307 -2.283 -1.312 473 HG LEU 59 HG LEU 59 -4.965 -4.357 -3.022 474 HD11 LEU 59 HD11 LEU 59 -3.860 -2.362 -1.070 475 HD12 LEU 59 HD12 LEU 59 -3.689 -2.308 -2.824 476 HD13 LEU 59 HD13 LEU 59 -2.947 -3.614 -1.902 477 HD21 LEU 59 HD21 LEU 59 -5.598 -4.230 -0.085 478 HD22 LEU 59 HD22 LEU 59 -4.237 -5.169 -0.712 479 HD23 LEU 59 HD23 LEU 59 -5.875 -5.543 -1.240 480 H LYS 60 HN LYS 60 -9.245 -3.544 -0.447 481 HA LYS 60 HA LYS 60 -11.272 -2.064 -1.746 482 HB2 LYS 60 HB2 LYS 60 -10.747 -2.735 1.141 483 HB3 LYS 60 HB1 LYS 60 -12.158 -1.817 0.633 484 HG2 LYS 60 HG2 LYS 60 -12.907 -3.672 -0.735 485 HG3 LYS 60 HG1 LYS 60 -11.441 -4.568 -0.347 486 HD2 LYS 60 HD2 LYS 60 -13.193 -3.635 1.873 487 HD3 LYS 60 HD1 LYS 60 -13.684 -5.038 0.929 488 HE2 LYS 60 HE2 LYS 60 -12.437 -5.687 2.929 489 HE3 LYS 60 HE1 LYS 60 -11.590 -6.150 1.456 490 HZ1 LYS 60 HZ1 LYS 60 -10.194 -5.149 3.247 491 HZ2 LYS 60 HZ2 LYS 60 -10.967 -3.672 2.956 492 HZ3 LYS 60 HZ3 LYS 60 -10.048 -4.408 1.733 493 HA PRO 61 HA PRO 61 -10.041 2.171 -1.672 494 HB2 PRO 61 HB2 PRO 61 -12.588 2.598 -0.164 495 HB3 PRO 61 HB1 PRO 61 -11.940 3.482 -1.549 496 HG2 PRO 61 HG2 PRO 61 -13.877 1.658 -1.834 497 HG3 PRO 61 HG1 PRO 61 -12.627 1.918 -3.056 498 HD2 PRO 61 HD2 PRO 61 -13.003 -0.358 -1.215 499 HD3 PRO 61 HD1 PRO 61 -12.124 -0.287 -2.754 500 H SER 62 HN SER 62 -11.501 0.926 1.286 501 HA SER 62 HA SER 62 -10.482 2.727 3.126 502 HB2 SER 62 HB2 SER 62 -10.868 -0.213 3.655 503 HB3 SER 62 HB1 SER 62 -11.120 1.139 4.760 504 HG SER 62 HG SER 62 -12.999 1.588 3.829 505 H THR 63 HN THR 63 -9.092 -0.414 2.074 506 HA THR 63 HA THR 63 -6.759 -0.229 3.655 507 HB THR 63 HB THR 63 -6.689 -1.587 0.979 508 HG1 THR 63 HG1 THR 63 -7.947 -3.277 1.770 509 HG21 THR 63 HG21 THR 63 -4.741 -2.229 1.956 510 HG22 THR 63 HG22 THR 63 -5.781 -3.363 2.827 511 HG23 THR 63 HG23 THR 63 -5.332 -1.834 3.575 512 H LEU 64 HN LEU 64 -7.438 0.687 0.296 513 HA LEU 64 HA LEU 64 -4.860 1.491 -0.414 514 HB2 LEU 64 HB2 LEU 64 -7.528 2.502 -1.379 515 HB3 LEU 64 HB1 LEU 64 -6.002 2.850 -2.155 516 HG LEU 64 HG LEU 64 -7.115 0.075 -1.798 517 HD11 LEU 64 HD11 LEU 64 -7.802 2.160 -3.648 518 HD12 LEU 64 HD12 LEU 64 -8.517 0.561 -3.443 519 HD13 LEU 64 HD13 LEU 64 -7.113 0.775 -4.490 520 HD21 LEU 64 HD21 LEU 64 -4.733 1.235 -3.206 521 HD22 LEU 64 HD22 LEU 64 -5.435 -0.311 -3.689 522 HD23 LEU 64 HD23 LEU 64 -4.801 -0.104 -2.056 523 H ARG 65 HN ARG 65 -7.537 3.422 0.939 524 HA ARG 65 HA ARG 65 -6.107 5.859 0.978 525 HB2 ARG 65 HB2 ARG 65 -8.482 4.906 2.565 526 HB3 ARG 65 HB1 ARG 65 -7.827 6.533 2.692 527 HG2 ARG 65 HG2 ARG 65 -8.886 5.294 0.159 528 HG3 ARG 65 HG1 ARG 65 -9.779 6.391 1.202 529 HD2 ARG 65 HD2 ARG 65 -8.176 8.156 0.796 530 HD3 ARG 65 HD1 ARG 65 -7.184 7.071 -0.169 531 HE ARG 65 HE ARG 65 -9.838 7.257 -1.193 532 HH11 ARG 65 HH11 ARG 65 -6.777 8.962 -1.065 533 HH12 ARG 65 HH12 ARG 65 -7.018 9.765 -2.584 534 HH21 ARG 65 HH21 ARG 65 -10.146 8.352 -3.208 535 HH22 ARG 65 HH22 ARG 65 -8.904 9.421 -3.789 536 H GLU 66 HN GLU 66 -6.176 3.120 3.120 537 HA GLU 66 HA GLU 66 -4.813 4.416 5.266 538 HB2 GLU 66 HB2 GLU 66 -6.147 2.426 5.687 539 HB3 GLU 66 HB1 GLU 66 -5.148 1.490 4.579 540 HG2 GLU 66 HG2 GLU 66 -4.561 0.984 6.853 541 HG3 GLU 66 HG1 GLU 66 -3.227 1.819 6.053 542 H LEU 67 HN LEU 67 -3.765 1.990 2.857 543 HA LEU 67 HA LEU 67 -1.064 1.906 3.279 544 HB2 LEU 67 HB2 LEU 67 -2.227 2.081 0.490 545 HB3 LEU 67 HB1 LEU 67 -0.849 1.137 1.048 546 HG LEU 67 HG LEU 67 -3.688 0.579 1.883 547 HD11 LEU 67 HD11 LEU 67 -2.184 -1.180 0.055 548 HD12 LEU 67 HD12 LEU 67 -2.896 0.283 -0.622 549 HD13 LEU 67 HD13 LEU 67 -3.919 -0.906 0.185 550 HD21 LEU 67 HD21 LEU 67 -1.358 -0.189 3.069 551 HD22 LEU 67 HD22 LEU 67 -1.667 -1.521 1.964 552 HD23 LEU 67 HD23 LEU 67 -2.882 -1.069 3.158 553 H GLU 68 HN GLU 68 -2.772 4.233 1.185 554 HA GLU 68 HA GLU 68 -0.584 5.796 0.434 555 HB2 GLU 68 HB2 GLU 68 -2.818 5.957 -0.597 556 HB3 GLU 68 HB1 GLU 68 -3.453 6.651 0.886 557 HG2 GLU 68 HG2 GLU 68 -1.704 8.479 0.553 558 HG3 GLU 68 HG1 GLU 68 -1.583 7.869 -1.099 559 H ARG 69 HN ARG 69 -2.988 6.585 2.968 560 HA ARG 69 HA ARG 69 -1.657 8.827 3.999 561 HB2 ARG 69 HB2 ARG 69 -3.859 7.100 4.792 562 HB3 ARG 69 HB1 ARG 69 -3.012 7.797 6.166 563 HG2 ARG 69 HG2 ARG 69 -3.763 9.624 3.961 564 HG3 ARG 69 HG1 ARG 69 -5.057 9.001 4.981 565 HD2 ARG 69 HD2 ARG 69 -4.261 11.104 5.865 566 HD3 ARG 69 HD1 ARG 69 -3.850 9.794 6.968 567 HE ARG 69 HE ARG 69 -1.750 10.497 5.114 568 HH11 ARG 69 HH11 ARG 69 -3.174 11.120 8.253 569 HH12 ARG 69 HH12 ARG 69 -1.732 11.830 8.908 570 HH21 ARG 69 HH21 ARG 69 0.148 11.436 5.976 571 HH22 ARG 69 HH22 ARG 69 0.149 12.016 7.615 572 H TYR 70 HN TYR 70 -1.111 5.463 4.536 573 HA TYR 70 HA TYR 70 0.375 5.749 6.949 574 HB2 TYR 70 HB2 TYR 70 -0.526 3.594 6.488 575 HB3 TYR 70 HB1 TYR 70 0.181 3.576 4.878 576 HD1 TYR 70 HD2 TYR 70 1.384 4.040 8.388 577 HD2 TYR 70 HD1 TYR 70 1.946 2.220 4.597 578 HE1 TYR 70 HE2 TYR 70 3.402 2.930 9.240 579 HE2 TYR 70 HE1 TYR 70 3.955 1.094 5.424 580 HH TYR 70 HH TYR 70 5.527 1.137 7.125 581 H VAL 71 HN VAL 71 1.310 5.252 3.539 582 HA VAL 71 HA VAL 71 4.077 5.451 3.993 583 HB VAL 71 HB VAL 71 4.387 5.734 1.666 584 HG11 VAL 71 HG11 VAL 71 2.637 4.184 0.644 585 HG12 VAL 71 HG12 VAL 71 2.027 4.025 2.294 586 HG13 VAL 71 HG13 VAL 71 3.684 3.554 1.911 587 HG21 VAL 71 HG21 VAL 71 2.737 6.447 0.128 588 HG22 VAL 71 HG22 VAL 71 2.895 7.651 1.401 589 HG23 VAL 71 HG23 VAL 71 1.519 6.547 1.393 590 H THR 72 HN THR 72 1.562 7.857 3.544 591 HA THR 72 HA THR 72 3.234 9.997 2.864 592 HB THR 72 HB THR 72 1.414 11.498 3.480 593 HG1 THR 72 HG1 THR 72 0.450 9.202 4.813 594 HG21 THR 72 HG21 THR 72 1.030 9.090 1.855 595 HG22 THR 72 HG22 THR 72 0.895 10.792 1.409 596 HG23 THR 72 HG23 THR 72 -0.436 9.991 2.237 597 H SER 73 HN SER 73 2.430 8.550 5.919 598 HA SER 73 HA SER 73 3.353 10.626 7.588 599 HB2 SER 73 HB2 SER 73 3.235 9.053 9.353 600 HB3 SER 73 HB1 SER 73 1.992 8.539 8.210 601 HG SER 73 HG SER 73 3.225 6.861 7.580 602 H CYS 74 HN CYS 74 4.920 8.164 5.717 603 HA CYS 74 HA CYS 74 7.527 8.717 6.937 604 HB2 CYS 74 HB2 CYS 74 7.074 6.374 6.689 605 HB3 CYS 74 HB1 CYS 74 6.643 6.589 4.994 606 HG CYS 74 HG CYS 74 9.505 7.668 4.776 607 H LEU 75 HN LEU 75 5.730 9.325 4.039 608 HA LEU 75 HA LEU 75 8.138 10.088 2.569 609 HB2 LEU 75 HB2 LEU 75 5.316 9.823 1.570 610 HB3 LEU 75 HB1 LEU 75 6.760 9.961 0.604 611 HG LEU 75 HG LEU 75 5.883 7.618 2.252 612 HD11 LEU 75 HD11 LEU 75 5.003 8.110 -0.090 613 HD12 LEU 75 HD12 LEU 75 5.682 6.510 0.212 614 HD13 LEU 75 HD13 LEU 75 6.631 7.722 -0.642 615 HD21 LEU 75 HD21 LEU 75 7.944 6.521 1.707 616 HD22 LEU 75 HD22 LEU 75 8.324 8.037 2.522 617 HD23 LEU 75 HD23 LEU 75 8.494 7.910 0.771 618 H ARG 76 HN ARG 76 4.977 11.403 3.508 619 HA ARG 76 HA ARG 76 5.731 13.918 2.222 620 HB2 ARG 76 HB2 ARG 76 3.043 12.803 2.945 621 HB3 ARG 76 HB1 ARG 76 3.291 14.451 2.372 622 HG2 ARG 76 HG2 ARG 76 4.357 13.503 0.335 623 HG3 ARG 76 HG1 ARG 76 3.906 11.897 0.925 624 HD2 ARG 76 HD2 ARG 76 1.621 12.415 0.822 625 HD3 ARG 76 HD1 ARG 76 1.932 14.110 0.492 626 HE ARG 76 HE ARG 76 2.474 13.591 -1.709 627 HH11 ARG 76 HH11 ARG 76 1.775 10.647 0.061 628 HH12 ARG 76 HH12 ARG 76 1.519 9.702 -1.366 629 HH21 ARG 76 HH21 ARG 76 2.159 12.329 -3.581 630 HH22 ARG 76 HH22 ARG 76 1.740 10.652 -3.425 631 H LYS 77 HN LYS 77 6.025 12.626 5.105 632 HA LYS 77 HA LYS 77 5.867 15.239 6.425 633 HB2 LYS 77 HB2 LYS 77 3.885 13.798 7.052 634 HB3 LYS 77 HB1 LYS 77 5.018 12.636 7.725 635 HG2 LYS 77 HG2 LYS 77 5.781 14.281 9.340 636 HG3 LYS 77 HG1 LYS 77 4.684 15.479 8.651 637 HD2 LYS 77 HD2 LYS 77 2.771 14.230 9.330 638 HD3 LYS 77 HD1 LYS 77 3.767 12.844 9.785 639 HE2 LYS 77 HE2 LYS 77 3.793 15.558 11.101 640 HE3 LYS 77 HE1 LYS 77 3.042 14.099 11.747 641 HZ1 LYS 77 HZ1 LYS 77 5.239 13.056 11.787 642 HZ2 LYS 77 HZ2 LYS 77 5.189 14.444 12.746 643 HZ3 LYS 77 HZ3 LYS 77 5.940 14.493 11.236 644 H LYS 78 HN LYS 78 7.764 13.031 5.274 645 HA LYS 78 HA LYS 78 9.944 13.461 7.080 646 HB2 LYS 78 HB2 LYS 78 8.727 11.587 8.155 647 HB3 LYS 78 HB1 LYS 78 8.860 10.658 6.670 648 HG2 LYS 78 HG2 LYS 78 10.531 9.807 8.054 649 HG3 LYS 78 HG1 LYS 78 11.384 10.889 6.953 650 HD2 LYS 78 HD2 LYS 78 12.231 11.269 9.152 651 HD3 LYS 78 HD1 LYS 78 11.241 12.660 8.711 652 HE2 LYS 78 HE2 LYS 78 9.380 11.760 10.007 653 HE3 LYS 78 HE1 LYS 78 10.342 10.343 10.423 654 HZ1 LYS 78 HZ1 LYS 78 10.963 13.144 11.177 655 HZ2 LYS 78 HZ2 LYS 78 11.895 11.793 11.573 656 HZ3 LYS 78 HZ3 LYS 78 10.338 11.959 12.208 657 H ARG 79 HN ARG 79 11.973 12.465 6.091 658 HA ARG 79 HA ARG 79 11.599 12.153 3.188 659 HB2 ARG 79 HB2 ARG 79 13.774 13.359 2.901 660 HB3 ARG 79 HB1 ARG 79 12.458 14.350 3.505 661 HG2 ARG 79 HG2 ARG 79 14.012 15.056 4.962 662 HG3 ARG 79 HG1 ARG 79 13.576 13.588 5.834 663 HD2 ARG 79 HD2 ARG 79 15.420 12.403 4.689 664 HD3 ARG 79 HD1 ARG 79 15.872 13.914 3.905 665 HE ARG 79 HE ARG 79 15.784 13.964 6.804 666 HH11 ARG 79 HH11 ARG 79 17.733 13.596 3.921 667 HH12 ARG 79 HH12 ARG 79 19.232 13.918 4.732 668 HH21 ARG 79 HH21 ARG 79 17.757 14.384 7.885 669 HH22 ARG 79 HH22 ARG 79 19.246 14.361 6.995 670 H LYS 80 HN LYS 80 11.639 9.967 4.782 671 HA LYS 80 HA LYS 80 12.592 7.921 5.041 672 HB2 LYS 80 HB2 LYS 80 14.569 9.068 3.086 673 HB3 LYS 80 HB1 LYS 80 14.806 7.484 3.802 674 HG2 LYS 80 HG2 LYS 80 12.727 6.704 2.829 675 HG3 LYS 80 HG1 LYS 80 12.422 8.311 2.160 676 HD2 LYS 80 HD2 LYS 80 14.343 8.163 0.742 677 HD3 LYS 80 HD1 LYS 80 14.874 6.679 1.533 678 HE2 LYS 80 HE2 LYS 80 12.266 6.900 0.048 679 HE3 LYS 80 HE1 LYS 80 13.771 6.418 -0.732 680 HZ1 LYS 80 HZ1 LYS 80 12.514 5.026 1.568 681 HZ2 LYS 80 HZ2 LYS 80 13.926 4.550 0.776 682 HZ3 LYS 80 HZ3 LYS 80 12.444 4.510 -0.039 683 HA PRO 81 HA PRO 81 15.112 9.120 8.629 684 HB2 PRO 81 HB2 PRO 81 14.556 6.213 9.105 685 HB3 PRO 81 HB1 PRO 81 14.414 7.563 10.238 686 HG2 PRO 81 HG2 PRO 81 12.235 6.516 9.197 687 HG3 PRO 81 HG1 PRO 81 12.386 8.278 9.312 688 HD2 PRO 81 HD2 PRO 81 12.744 6.502 6.915 689 HD3 PRO 81 HD1 PRO 81 11.912 8.068 7.046 690 H GLN 82 HN GLN 82 17.178 9.303 7.993 691 HA GLN 82 HA GLN 82 18.483 7.237 6.464 692 HB2 GLN 82 HB2 GLN 82 19.468 9.892 7.516 693 HB3 GLN 82 HB1 GLN 82 20.424 8.815 6.509 694 HG2 GLN 82 HG2 GLN 82 17.803 10.066 5.721 695 HG3 GLN 82 HG1 GLN 82 19.398 10.638 5.235 696 HE21 GLN 82 HE21 GLN 82 20.476 7.948 4.897 697 HE22 GLN 82 HE22 GLN 82 19.779 7.335 3.437 698 H ALA 83 HN ALA 83 19.514 5.594 7.278 699 HA ALA 83 HA ALA 83 21.059 5.907 9.734 700 HB1 ALA 83 HB1 ALA 83 18.866 4.954 10.375 701 HB2 ALA 83 HB2 ALA 83 20.215 3.865 10.695 702 HB3 ALA 83 HB3 ALA 83 19.176 3.594 9.298 703 H1 VAL 201 HT1 VAL 201 -6.078 -2.501 -15.900 704 H2 VAL 201 HT2 VAL 201 -6.003 -3.045 -14.303 705 H3 VAL 201 HT3 VAL 201 -4.594 -2.944 -15.225 706 HA VAL 201 HA VAL 201 -4.781 -0.555 -15.331 707 HB VAL 201 HB VAL 201 -7.135 -0.909 -13.458 708 HG11 VAL 201 HG11 VAL 201 -5.890 1.092 -12.965 709 HG12 VAL 201 HG12 VAL 201 -7.401 1.531 -13.760 710 HG13 VAL 201 HG13 VAL 201 -5.888 1.555 -14.665 711 HG21 VAL 201 HG21 VAL 201 -7.095 -0.038 -16.345 712 HG22 VAL 201 HG22 VAL 201 -8.502 0.008 -15.284 713 HG23 VAL 201 HG23 VAL 201 -7.773 -1.538 -15.714 714 H VAL 202 HN VAL 202 -3.131 0.111 -14.139 715 HA VAL 202 HA VAL 202 -1.672 0.426 -12.445 716 HB VAL 202 HB VAL 202 -3.961 -0.487 -10.696 717 HG11 VAL 202 HG11 VAL 202 -1.307 0.709 -9.894 718 HG12 VAL 202 HG12 VAL 202 -1.855 -0.933 -9.559 719 HG13 VAL 202 HG13 VAL 202 -2.674 0.439 -8.814 720 HG21 VAL 202 HG21 VAL 202 -2.809 2.264 -11.139 721 HG22 VAL 202 HG22 VAL 202 -4.238 1.850 -10.190 722 HG23 VAL 202 HG23 VAL 202 -4.252 1.645 -11.941 723 HA PRO 203 HA PRO 203 -0.039 -3.771 -12.481 724 HB2 PRO 203 HB2 PRO 203 2.537 -2.996 -12.042 725 HB3 PRO 203 HB1 PRO 203 1.780 -2.982 -13.637 726 HG2 PRO 203 HG2 PRO 203 2.214 -0.725 -11.725 727 HG3 PRO 203 HG1 PRO 203 2.408 -0.754 -13.487 728 HD2 PRO 203 HD2 PRO 203 0.235 0.308 -12.277 729 HD3 PRO 203 HD1 PRO 203 0.152 -0.478 -13.867 730 H LYS 204 HN LYS 204 0.133 -5.112 -10.799 731 HA LYS 204 HA LYS 204 -0.172 -4.145 -8.152 732 HB2 LYS 204 HB2 LYS 204 -0.066 -6.509 -7.492 733 HB3 LYS 204 HB1 LYS 204 -1.154 -6.265 -8.849 734 HG2 LYS 204 HG2 LYS 204 0.640 -7.041 -10.373 735 HG3 LYS 204 HG1 LYS 204 1.642 -7.377 -8.959 736 HD2 LYS 204 HD2 LYS 204 0.727 -9.444 -9.317 737 HD3 LYS 204 HD1 LYS 204 -0.452 -8.766 -8.200 738 HE2 LYS 204 HE2 LYS 204 -0.704 -8.810 -11.205 739 HE3 LYS 204 HE1 LYS 204 -1.508 -9.916 -10.099 740 HZ1 LYS 204 HZ1 LYS 204 -2.975 -8.146 -10.813 741 HZ2 LYS 204 HZ2 LYS 204 -1.922 -6.978 -10.211 742 HZ3 LYS 204 HZ3 LYS 204 -2.706 -8.040 -9.148 743 H LYS 205 HN LYS 205 1.245 -4.172 -6.426 744 HA LYS 205 HA LYS 205 4.016 -3.854 -7.220 745 HB2 LYS 205 HB2 LYS 205 2.981 -2.149 -5.794 746 HB3 LYS 205 HB1 LYS 205 2.661 -3.360 -4.563 747 HG2 LYS 205 HG2 LYS 205 4.586 -2.001 -3.981 748 HG3 LYS 205 HG1 LYS 205 5.049 -3.683 -4.232 749 HD2 LYS 205 HD2 LYS 205 6.687 -2.216 -5.248 750 HD3 LYS 205 HD1 LYS 205 5.825 -3.106 -6.502 751 HE2 LYS 205 HE2 LYS 205 4.404 -1.157 -6.907 752 HE3 LYS 205 HE1 LYS 205 5.259 -0.270 -5.646 753 HZ1 LYS 205 HZ1 LYS 205 6.060 0.283 -7.869 754 HZ2 LYS 205 HZ2 LYS 205 6.493 -1.333 -8.134 755 HZ3 LYS 205 HZ3 LYS 205 7.283 -0.425 -6.935 756 H LYS 206 HN LYS 206 4.987 -5.756 -7.475 757 HA LYS 206 HA LYS 206 4.694 -7.926 -5.596 758 HB2 LYS 206 HB2 LYS 206 6.615 -7.522 -7.893 759 HB3 LYS 206 HB1 LYS 206 6.462 -9.004 -6.967 760 HG2 LYS 206 HG2 LYS 206 4.195 -9.302 -7.759 761 HG3 LYS 206 HG1 LYS 206 4.277 -7.766 -8.626 762 HD2 LYS 206 HD2 LYS 206 6.165 -10.054 -9.133 763 HD3 LYS 206 HD1 LYS 206 4.664 -9.828 -10.026 764 HE2 LYS 206 HE2 LYS 206 5.413 -7.715 -10.870 765 HE3 LYS 206 HE1 LYS 206 6.839 -7.754 -9.836 766 HZ1 LYS 206 HZ1 LYS 206 7.641 -9.661 -11.060 767 HZ2 LYS 206 HZ2 LYS 206 7.359 -8.369 -12.113 768 HZ3 LYS 206 HZ3 LYS 206 6.264 -9.655 -12.041 769 H ILE 207 HN ILE 207 5.546 -7.577 -3.625 770 HA ILE 207 HA ILE 207 8.267 -6.478 -3.527 771 HB ILE 207 HB ILE 207 7.464 -5.695 -1.138 772 HG12 ILE 207 HG12 ILE 207 4.911 -5.567 -2.751 773 HG13 ILE 207 HG11 ILE 207 5.201 -6.710 -1.444 774 HG21 ILE 207 HG21 ILE 207 6.803 -3.512 -2.254 775 HG22 ILE 207 HG22 ILE 207 6.981 -4.356 -3.791 776 HG23 ILE 207 HG23 ILE 207 8.367 -4.179 -2.717 777 HD11 ILE 207 HD11 ILE 207 5.152 -3.713 -1.194 778 HD12 ILE 207 HD12 ILE 207 5.446 -4.856 0.118 779 HD13 ILE 207 HD13 ILE 207 3.881 -4.826 -0.690 780 H LYS 208 HN LYS 208 9.481 -8.171 -3.210 781 HA LYS 208 HA LYS 208 8.809 -9.997 -1.010 782 HB2 LYS 208 HB2 LYS 208 8.921 -11.207 -3.067 783 HB3 LYS 208 HB1 LYS 208 10.421 -10.418 -3.526 784 HG2 LYS 208 HG2 LYS 208 11.683 -11.662 -2.009 785 HG3 LYS 208 HG1 LYS 208 10.250 -12.177 -1.104 786 HD2 LYS 208 HD2 LYS 208 9.521 -13.510 -3.018 787 HD3 LYS 208 HD1 LYS 208 10.931 -12.976 -3.935 788 HE2 LYS 208 HE2 LYS 208 11.285 -15.201 -3.026 789 HE3 LYS 208 HE1 LYS 208 12.398 -14.047 -2.300 790 HZ1 LYS 208 HZ1 LYS 208 9.901 -15.085 -1.059 791 HZ2 LYS 208 HZ2 LYS 208 10.954 -13.954 -0.356 792 HZ3 LYS 208 HZ3 LYS 208 11.483 -15.529 -0.648 793 H LYS 209 HN LYS 209 11.866 -9.154 -2.651 794 HA LYS 209 HA LYS 209 13.026 -8.737 0.015 795 HB2 LYS 209 HB2 LYS 209 14.253 -9.529 -2.616 796 HB3 LYS 209 HB1 LYS 209 15.233 -8.946 -1.276 797 HG2 LYS 209 HG2 LYS 209 14.467 -10.766 0.122 798 HG3 LYS 209 HG1 LYS 209 13.393 -11.327 -1.158 799 HD2 LYS 209 HD2 LYS 209 15.448 -12.655 -1.045 800 HD3 LYS 209 HD1 LYS 209 15.307 -11.803 -2.583 801 HE2 LYS 209 HE2 LYS 209 17.586 -11.706 -1.682 802 HE3 LYS 209 HE1 LYS 209 16.862 -10.106 -1.811 803 HZ1 LYS 209 HZ1 LYS 209 17.084 -11.711 0.677 804 HZ2 LYS 209 HZ2 LYS 209 16.379 -10.180 0.558 805 HZ3 LYS 209 HZ3 LYS 209 18.033 -10.370 0.273 806 H GLU 210 HN GLU 210 13.632 -7.451 -3.268 807 HA GLU 210 HA GLU 210 14.482 -4.949 -2.114 808 HB2 GLU 210 HB2 GLU 210 14.838 -4.256 -4.480 809 HB3 GLU 210 HB1 GLU 210 15.703 -5.716 -4.031 810 HG2 GLU 210 HG2 GLU 210 13.984 -7.063 -5.138 811 HG3 GLU 210 HG1 GLU 210 13.143 -5.586 -5.606 812 H GLN 211 HN GLN 211 13.193 -3.346 -1.616 813 HA GLN 211 HA GLN 211 10.410 -3.464 -2.323 814 HB2 GLN 211 HB2 GLN 211 10.116 -1.585 -0.826 815 HB3 GLN 211 HB1 GLN 211 11.113 -2.808 -0.060 816 HG2 GLN 211 HG2 GLN 211 12.216 -0.347 -1.391 817 HG3 GLN 211 HG1 GLN 211 11.815 -0.441 0.320 818 HE21 GLN 211 HE21 GLN 211 14.364 0.077 -0.936 819 HE22 GLN 211 HE22 GLN 211 15.447 -1.152 -0.380 820 H VAL 212 HN VAL 212 13.179 -1.895 -3.567 821 HA VAL 212 HA VAL 212 11.653 0.207 -4.868 822 HB VAL 212 HB VAL 212 14.583 -0.464 -5.192 823 HG11 VAL 212 HG11 VAL 212 13.693 0.848 -7.035 824 HG12 VAL 212 HG12 VAL 212 14.763 1.833 -6.038 825 HG13 VAL 212 HG13 VAL 212 13.015 2.014 -5.898 826 HG21 VAL 212 HG21 VAL 212 14.995 1.392 -3.638 827 HG22 VAL 212 HG22 VAL 212 14.102 0.077 -2.874 828 HG23 VAL 212 HG23 VAL 212 13.259 1.542 -3.374 829 H GLU 213 HN GLU 213 10.362 -0.662 -6.380 830 HA GLU 213 HA GLU 213 11.399 -2.624 -8.264 831 HB2 GLU 213 HB2 GLU 213 9.170 -2.975 -7.329 832 HB3 GLU 213 HB1 GLU 213 8.650 -1.409 -7.931 833 HG2 GLU 213 HG2 GLU 213 8.928 -2.189 -10.223 834 HG3 GLU 213 HG1 GLU 213 9.471 -3.758 -9.625 Start of MODEL 5 1 H1 SER 1 HT1 SER 1 -19.880 -0.562 10.578 2 H2 SER 1 HT2 SER 1 -18.368 -1.319 10.641 3 H3 SER 1 HT3 SER 1 -19.774 -2.246 10.506 4 HA SER 1 HA SER 1 -18.599 -2.101 8.405 5 HB2 SER 1 HB2 SER 1 -21.202 -0.575 8.387 6 HB3 SER 1 HB1 SER 1 -20.516 -1.500 7.050 7 HG SER 1 HG SER 1 -21.677 -3.063 7.852 8 H GLU 2 HN GLU 2 -18.382 0.625 10.178 9 HA GLU 2 HA GLU 2 -18.436 2.644 8.209 10 HB2 GLU 2 HB2 GLU 2 -17.093 2.539 10.898 11 HB3 GLU 2 HB1 GLU 2 -17.179 3.963 9.881 12 HG2 GLU 2 HG2 GLU 2 -19.641 3.837 9.963 13 HG3 GLU 2 HG1 GLU 2 -19.494 2.491 11.092 14 H GLU 3 HN GLU 3 -15.952 0.393 9.216 15 HA GLU 3 HA GLU 3 -13.780 1.788 8.021 16 HB2 GLU 3 HB2 GLU 3 -14.088 -1.153 8.646 17 HB3 GLU 3 HB1 GLU 3 -12.593 -0.398 8.119 18 HG2 GLU 3 HG2 GLU 3 -14.085 0.101 10.678 19 HG3 GLU 3 HG1 GLU 3 -12.512 -0.667 10.483 20 H GLU 4 HN GLU 4 -16.409 0.107 6.718 21 HA GLU 4 HA GLU 4 -15.051 -0.287 4.156 22 HB2 GLU 4 HB2 GLU 4 -17.862 -1.038 4.989 23 HB3 GLU 4 HB1 GLU 4 -17.096 -1.451 3.464 24 HG2 GLU 4 HG2 GLU 4 -16.166 -2.373 6.173 25 HG3 GLU 4 HG1 GLU 4 -17.145 -3.319 5.054 26 H ASP 5 HN ASP 5 -17.370 1.778 5.758 27 HA ASP 5 HA ASP 5 -18.336 2.789 3.196 28 HB2 ASP 5 HB2 ASP 5 -20.078 2.071 4.685 29 HB3 ASP 5 HB1 ASP 5 -19.465 3.104 5.967 30 H LYS 6 HN LYS 6 -16.813 3.955 6.165 31 HA LYS 6 HA LYS 6 -17.085 6.716 5.425 32 HB2 LYS 6 HB2 LYS 6 -16.934 5.935 7.793 33 HB3 LYS 6 HB1 LYS 6 -15.252 5.514 7.510 34 HG2 LYS 6 HG2 LYS 6 -14.717 7.837 7.061 35 HG3 LYS 6 HG1 LYS 6 -16.411 8.279 7.269 36 HD2 LYS 6 HD2 LYS 6 -16.312 7.494 9.599 37 HD3 LYS 6 HD1 LYS 6 -14.602 7.111 9.380 38 HE2 LYS 6 HE2 LYS 6 -14.877 9.263 10.490 39 HE3 LYS 6 HE1 LYS 6 -14.132 9.460 8.905 40 HZ1 LYS 6 HZ1 LYS 6 -16.253 10.146 8.013 41 HZ2 LYS 6 HZ2 LYS 6 -15.859 11.115 9.336 42 HZ3 LYS 6 HZ3 LYS 6 -17.010 9.891 9.501 43 H CYS 7 HN CYS 7 -15.075 4.266 4.417 44 HA CYS 7 HA CYS 7 -12.699 5.805 3.962 45 HB2 CYS 7 HB2 CYS 7 -13.567 3.100 2.940 46 HB3 CYS 7 HB1 CYS 7 -11.955 3.790 2.730 47 HG CYS 7 HG CYS 7 -12.755 1.829 5.034 48 H LYS 8 HN LYS 8 -12.024 6.757 2.118 49 HA LYS 8 HA LYS 8 -14.104 7.420 0.207 50 HB2 LYS 8 HB2 LYS 8 -11.413 8.536 0.892 51 HB3 LYS 8 HB1 LYS 8 -12.118 8.904 -0.674 52 HG2 LYS 8 HG2 LYS 8 -12.521 10.603 1.114 53 HG3 LYS 8 HG1 LYS 8 -13.960 9.995 0.296 54 HD2 LYS 8 HD2 LYS 8 -14.513 8.599 2.137 55 HD3 LYS 8 HD1 LYS 8 -12.960 8.899 2.908 56 HE2 LYS 8 HE2 LYS 8 -13.587 11.268 3.182 57 HE3 LYS 8 HE1 LYS 8 -15.158 10.914 2.460 58 HZ1 LYS 8 HZ1 LYS 8 -15.621 9.400 4.267 59 HZ2 LYS 8 HZ2 LYS 8 -15.246 10.928 4.882 60 HZ3 LYS 8 HZ3 LYS 8 -14.100 9.687 4.946 61 HA PRO 9 HA PRO 9 -12.766 4.664 -2.889 62 HB2 PRO 9 HB2 PRO 9 -13.856 5.866 -5.059 63 HB3 PRO 9 HB1 PRO 9 -14.815 5.007 -3.851 64 HG2 PRO 9 HG2 PRO 9 -14.390 7.937 -4.207 65 HG3 PRO 9 HG1 PRO 9 -15.858 7.065 -3.731 66 HD2 PRO 9 HD2 PRO 9 -14.193 8.371 -1.969 67 HD3 PRO 9 HD1 PRO 9 -15.242 7.020 -1.509 68 H MET 10 HN MET 10 -10.680 4.564 -3.404 69 HA MET 10 HA MET 10 -9.136 6.864 -4.133 70 HB2 MET 10 HB2 MET 10 -8.264 4.883 -2.851 71 HB3 MET 10 HB1 MET 10 -8.346 3.959 -4.349 72 HG2 MET 10 HG2 MET 10 -6.144 4.610 -4.285 73 HG3 MET 10 HG1 MET 10 -6.872 5.851 -5.309 74 HE1 MET 10 HE1 MET 10 -6.087 4.818 -1.798 75 HE2 MET 10 HE2 MET 10 -5.445 6.258 -1.005 76 HE3 MET 10 HE3 MET 10 -4.486 5.422 -2.227 77 H SER 11 HN SER 11 -8.676 7.606 -6.137 78 HA SER 11 HA SER 11 -10.007 6.329 -8.366 79 HB2 SER 11 HB2 SER 11 -9.187 8.368 -9.624 80 HB3 SER 11 HB1 SER 11 -10.246 8.698 -8.255 81 HG SER 11 HG SER 11 -8.327 9.118 -7.010 82 H TYR 12 HN TYR 12 -8.676 6.463 -10.580 83 HA TYR 12 HA TYR 12 -6.838 4.381 -10.428 84 HB2 TYR 12 HB2 TYR 12 -7.684 4.415 -12.529 85 HB3 TYR 12 HB1 TYR 12 -7.848 6.165 -12.559 86 HD1 TYR 12 HD1 TYR 12 -5.304 3.448 -12.858 87 HD2 TYR 12 HD2 TYR 12 -6.352 7.451 -13.818 88 HE1 TYR 12 HE1 TYR 12 -3.356 3.587 -14.335 89 HE2 TYR 12 HE2 TYR 12 -4.397 7.604 -15.303 90 HH TYR 12 HH TYR 12 -2.175 6.491 -15.547 91 H GLU 13 HN GLU 13 -6.211 7.842 -10.973 92 HA GLU 13 HA GLU 13 -3.412 7.552 -11.192 93 HB2 GLU 13 HB2 GLU 13 -5.313 9.818 -10.843 94 HB3 GLU 13 HB1 GLU 13 -3.610 10.114 -10.517 95 HG2 GLU 13 HG2 GLU 13 -4.578 8.856 -13.063 96 HG3 GLU 13 HG1 GLU 13 -4.399 10.613 -12.865 97 H GLU 14 HN GLU 14 -5.537 7.866 -8.478 98 HA GLU 14 HA GLU 14 -3.527 8.565 -6.601 99 HB2 GLU 14 HB2 GLU 14 -6.331 7.530 -6.401 100 HB3 GLU 14 HB1 GLU 14 -5.329 7.699 -4.970 101 HG2 GLU 14 HG2 GLU 14 -5.056 10.095 -5.496 102 HG3 GLU 14 HG1 GLU 14 -6.138 9.890 -6.871 103 H LYS 15 HN LYS 15 -5.170 5.544 -7.482 104 HA LYS 15 HA LYS 15 -3.738 3.799 -5.851 105 HB2 LYS 15 HB2 LYS 15 -4.875 3.360 -8.602 106 HB3 LYS 15 HB1 LYS 15 -4.143 2.080 -7.645 107 HG2 LYS 15 HG2 LYS 15 -5.843 2.021 -6.132 108 HG3 LYS 15 HG1 LYS 15 -6.363 3.671 -6.485 109 HD2 LYS 15 HD2 LYS 15 -7.535 3.068 -8.313 110 HD3 LYS 15 HD1 LYS 15 -6.461 1.731 -8.711 111 HE2 LYS 15 HE2 LYS 15 -7.390 0.505 -6.770 112 HE3 LYS 15 HE1 LYS 15 -8.569 1.797 -6.555 113 HZ1 LYS 15 HZ1 LYS 15 -8.270 0.071 -8.968 114 HZ2 LYS 15 HZ2 LYS 15 -9.389 1.334 -8.799 115 HZ3 LYS 15 HZ3 LYS 15 -9.507 -0.032 -7.814 116 H ARG 16 HN ARG 16 -2.912 5.133 -9.037 117 HA ARG 16 HA ARG 16 -0.518 3.678 -9.396 118 HB2 ARG 16 HB2 ARG 16 -1.585 4.921 -11.242 119 HB3 ARG 16 HB1 ARG 16 -1.140 6.431 -10.455 120 HG2 ARG 16 HG2 ARG 16 1.228 5.723 -10.578 121 HG3 ARG 16 HG1 ARG 16 0.716 4.340 -11.518 122 HD2 ARG 16 HD2 ARG 16 1.557 6.142 -12.928 123 HD3 ARG 16 HD1 ARG 16 -0.124 5.790 -13.231 124 HE ARG 16 HE ARG 16 -0.735 7.845 -12.354 125 HH11 ARG 16 HH11 ARG 16 2.726 7.317 -12.094 126 HH12 ARG 16 HH12 ARG 16 3.087 8.995 -11.835 127 HH21 ARG 16 HH21 ARG 16 -0.266 10.041 -12.055 128 HH22 ARG 16 HH22 ARG 16 1.378 10.549 -11.808 129 H GLN 17 HN GLN 17 -1.038 6.985 -8.158 130 HA GLN 17 HA GLN 17 1.615 7.511 -7.490 131 HB2 GLN 17 HB2 GLN 17 -0.230 9.187 -7.511 132 HB3 GLN 17 HB1 GLN 17 -0.828 8.487 -6.011 133 HG2 GLN 17 HG2 GLN 17 0.430 10.403 -5.427 134 HG3 GLN 17 HG1 GLN 17 1.399 8.995 -4.996 135 HE21 GLN 17 HE21 GLN 17 1.090 11.712 -7.118 136 HE22 GLN 17 HE22 GLN 17 2.679 11.622 -7.791 137 H LEU 18 HN LEU 18 -0.921 5.879 -5.757 138 HA LEU 18 HA LEU 18 0.279 5.480 -3.268 139 HB2 LEU 18 HB2 LEU 18 -2.108 4.950 -4.258 140 HB3 LEU 18 HB1 LEU 18 -1.398 3.388 -4.563 141 HG LEU 18 HG LEU 18 -1.934 4.694 -1.920 142 HD11 LEU 18 HD11 LEU 18 -3.087 2.443 -1.664 143 HD12 LEU 18 HD12 LEU 18 -2.906 2.294 -3.405 144 HD13 LEU 18 HD13 LEU 18 -3.832 3.630 -2.723 145 HD21 LEU 18 HD21 LEU 18 0.030 3.721 -1.306 146 HD22 LEU 18 HD22 LEU 18 -0.039 2.511 -2.584 147 HD23 LEU 18 HD23 LEU 18 -1.039 2.331 -1.144 148 H SER 19 HN SER 19 0.208 3.332 -6.112 149 HA SER 19 HA SER 19 1.811 1.318 -5.038 150 HB2 SER 19 HB2 SER 19 1.906 0.440 -7.224 151 HB3 SER 19 HB1 SER 19 0.380 1.319 -7.157 152 HG SER 19 HG SER 19 1.635 3.144 -8.074 153 H LEU 20 HN LEU 20 2.597 4.415 -6.240 154 HA LEU 20 HA LEU 20 5.407 3.838 -6.635 155 HB2 LEU 20 HB2 LEU 20 3.820 6.372 -6.855 156 HB3 LEU 20 HB1 LEU 20 5.505 6.223 -7.297 157 HG LEU 20 HG LEU 20 3.153 4.915 -8.613 158 HD11 LEU 20 HD11 LEU 20 3.652 7.249 -9.157 159 HD12 LEU 20 HD12 LEU 20 3.808 6.168 -10.534 160 HD13 LEU 20 HD13 LEU 20 5.249 6.761 -9.706 161 HD21 LEU 20 HD21 LEU 20 4.873 3.271 -8.517 162 HD22 LEU 20 HD22 LEU 20 6.086 4.431 -9.059 163 HD23 LEU 20 HD23 LEU 20 4.806 3.913 -10.157 164 H ASP 21 HN ASP 21 3.298 5.334 -4.269 165 HA ASP 21 HA ASP 21 5.501 6.325 -2.689 166 HB2 ASP 21 HB2 ASP 21 3.844 7.048 -1.080 167 HB3 ASP 21 HB1 ASP 21 3.468 7.599 -2.687 168 H ILE 22 HN ILE 22 3.348 3.531 -2.571 169 HA ILE 22 HA ILE 22 4.450 2.325 -0.292 170 HB ILE 22 HB ILE 22 2.995 1.420 -2.687 171 HG12 ILE 22 HG12 ILE 22 2.758 0.689 0.216 172 HG13 ILE 22 HG11 ILE 22 1.944 2.059 -0.534 173 HG21 ILE 22 HG21 ILE 22 4.498 -0.583 -1.036 174 HG22 ILE 22 HG22 ILE 22 4.842 -0.173 -2.711 175 HG23 ILE 22 HG23 ILE 22 3.315 -0.944 -2.287 176 HD11 ILE 22 HD11 ILE 22 1.572 -0.735 -1.542 177 HD12 ILE 22 HD12 ILE 22 0.549 0.679 -1.789 178 HD13 ILE 22 HD13 ILE 22 0.618 -0.093 -0.206 179 H ASN 23 HN ASN 23 5.506 2.536 -3.602 180 HA ASN 23 HA ASN 23 7.605 0.662 -3.483 181 HB2 ASN 23 HB2 ASN 23 6.420 1.620 -5.507 182 HB3 ASN 23 HB1 ASN 23 7.369 3.074 -5.273 183 HD21 ASN 23 HD21 ASN 23 9.561 3.052 -5.767 184 HD22 ASN 23 HD22 ASN 23 10.271 1.761 -6.684 185 H LYS 24 HN LYS 24 7.241 3.815 -2.258 186 HA LYS 24 HA LYS 24 10.048 4.505 -2.169 187 HB2 LYS 24 HB2 LYS 24 7.502 5.777 -1.275 188 HB3 LYS 24 HB1 LYS 24 9.037 6.393 -0.687 189 HG2 LYS 24 HG2 LYS 24 9.731 6.934 -2.912 190 HG3 LYS 24 HG1 LYS 24 8.320 6.127 -3.599 191 HD2 LYS 24 HD2 LYS 24 6.840 7.750 -2.656 192 HD3 LYS 24 HD1 LYS 24 8.135 8.487 -1.720 193 HE2 LYS 24 HE2 LYS 24 7.608 9.849 -3.660 194 HE3 LYS 24 HE1 LYS 24 9.224 9.170 -3.834 195 HZ1 LYS 24 HZ1 LYS 24 6.754 8.145 -5.123 196 HZ2 LYS 24 HZ2 LYS 24 8.289 7.450 -5.271 197 HZ3 LYS 24 HZ3 LYS 24 7.999 8.997 -5.889 198 H LEU 25 HN LEU 25 7.810 2.810 -0.208 199 HA LEU 25 HA LEU 25 8.925 3.477 2.332 200 HB2 LEU 25 HB2 LEU 25 7.074 1.290 1.437 201 HB3 LEU 25 HB1 LEU 25 7.633 1.433 3.091 202 HG LEU 25 HG LEU 25 5.812 3.270 1.575 203 HD11 LEU 25 HD11 LEU 25 5.711 1.915 4.241 204 HD12 LEU 25 HD12 LEU 25 4.854 1.391 2.791 205 HD13 LEU 25 HD13 LEU 25 4.435 2.921 3.568 206 HD21 LEU 25 HD21 LEU 25 7.234 3.857 4.148 207 HD22 LEU 25 HD22 LEU 25 5.949 4.831 3.443 208 HD23 LEU 25 HD23 LEU 25 7.501 4.691 2.621 209 HA PRO 26 HA PRO 26 12.406 0.689 2.315 210 HB2 PRO 26 HB2 PRO 26 12.832 0.746 5.024 211 HB3 PRO 26 HB1 PRO 26 13.424 1.980 3.908 212 HG2 PRO 26 HG2 PRO 26 11.052 2.024 5.709 213 HG3 PRO 26 HG1 PRO 26 12.158 3.339 5.290 214 HD2 PRO 26 HD2 PRO 26 9.675 3.074 4.206 215 HD3 PRO 26 HD1 PRO 26 11.027 3.830 3.342 216 H GLY 27 HN GLY 27 12.900 -1.423 3.161 217 HA2 GLY 27 HA2 GLY 27 10.848 -3.203 2.866 218 HA3 GLY 27 HA1 GLY 27 12.346 -3.586 3.690 219 H GLU 28 HN GLU 28 12.196 -2.193 5.999 220 HA GLU 28 HA GLU 28 10.492 -3.760 7.567 221 HB2 GLU 28 HB2 GLU 28 10.990 -1.702 9.235 222 HB3 GLU 28 HB1 GLU 28 12.095 -3.032 8.954 223 HG2 GLU 28 HG2 GLU 28 12.212 -0.524 7.340 224 HG3 GLU 28 HG1 GLU 28 12.992 -0.656 8.907 225 H LYS 29 HN LYS 29 10.080 -0.463 6.358 226 HA LYS 29 HA LYS 29 7.705 0.011 7.891 227 HB2 LYS 29 HB2 LYS 29 9.277 1.477 5.864 228 HB3 LYS 29 HB1 LYS 29 7.570 1.878 5.937 229 HG2 LYS 29 HG2 LYS 29 8.909 3.401 7.277 230 HG3 LYS 29 HG1 LYS 29 7.800 2.476 8.285 231 HD2 LYS 29 HD2 LYS 29 9.468 1.332 9.313 232 HD3 LYS 29 HD1 LYS 29 10.530 1.386 7.900 233 HE2 LYS 29 HE2 LYS 29 11.371 2.755 9.768 234 HE3 LYS 29 HE1 LYS 29 11.032 3.712 8.327 235 HZ1 LYS 29 HZ1 LYS 29 8.921 4.375 9.343 236 HZ2 LYS 29 HZ2 LYS 29 10.230 4.817 10.310 237 HZ3 LYS 29 HZ3 LYS 29 9.289 3.478 10.728 238 H LEU 30 HN LEU 30 8.453 -1.313 4.773 239 HA LEU 30 HA LEU 30 5.751 -1.004 3.836 240 HB2 LEU 30 HB2 LEU 30 6.843 -0.946 1.937 241 HB3 LEU 30 HB1 LEU 30 8.306 -1.569 2.658 242 HG LEU 30 HG LEU 30 6.090 -3.364 1.726 243 HD11 LEU 30 HD11 LEU 30 8.310 -2.102 0.236 244 HD12 LEU 30 HD12 LEU 30 6.613 -2.189 -0.204 245 HD13 LEU 30 HD13 LEU 30 7.627 -3.630 -0.279 246 HD21 LEU 30 HD21 LEU 30 7.806 -4.294 3.259 247 HD22 LEU 30 HD22 LEU 30 9.041 -3.842 2.083 248 HD23 LEU 30 HD23 LEU 30 7.819 -5.042 1.662 249 H GLY 31 HN GLY 31 7.398 -3.278 5.737 250 HA2 GLY 31 HA2 GLY 31 5.749 -5.542 5.220 251 HA3 GLY 31 HA1 GLY 31 6.601 -5.222 6.717 252 H ARG 32 HN ARG 32 5.127 -2.494 6.727 253 HA ARG 32 HA ARG 32 2.811 -3.367 8.172 254 HB2 ARG 32 HB2 ARG 32 3.839 -1.309 8.861 255 HB3 ARG 32 HB1 ARG 32 3.631 -0.610 7.268 256 HG2 ARG 32 HG2 ARG 32 1.632 0.151 7.830 257 HG3 ARG 32 HG1 ARG 32 1.098 -1.473 8.264 258 HD2 ARG 32 HD2 ARG 32 2.700 0.311 10.081 259 HD3 ARG 32 HD1 ARG 32 0.938 0.216 10.106 260 HE ARG 32 HE ARG 32 2.536 -2.216 10.511 261 HH11 ARG 32 HH11 ARG 32 0.301 0.179 11.747 262 HH12 ARG 32 HH12 ARG 32 -0.092 -0.733 13.167 263 HH21 ARG 32 HH21 ARG 32 2.022 -3.418 12.383 264 HH22 ARG 32 HH22 ARG 32 0.902 -2.771 13.539 265 H VAL 33 HN VAL 33 3.311 -1.931 4.937 266 HA VAL 33 HA VAL 33 0.572 -1.666 4.333 267 HB VAL 33 HB VAL 33 1.712 -2.344 1.890 268 HG11 VAL 33 HG11 VAL 33 1.225 0.258 3.297 269 HG12 VAL 33 HG12 VAL 33 0.210 -0.553 2.104 270 HG13 VAL 33 HG13 VAL 33 1.730 0.177 1.616 271 HG21 VAL 33 HG21 VAL 33 3.624 -0.488 3.243 272 HG22 VAL 33 HG22 VAL 33 3.784 -1.301 1.680 273 HG23 VAL 33 HG23 VAL 33 3.927 -2.226 3.177 274 H VAL 34 HN VAL 34 2.802 -4.318 3.631 275 HA VAL 34 HA VAL 34 1.047 -6.213 2.681 276 HB VAL 34 HB VAL 34 2.658 -7.755 3.057 277 HG11 VAL 34 HG11 VAL 34 3.936 -5.877 2.273 278 HG12 VAL 34 HG12 VAL 34 4.894 -6.877 3.363 279 HG13 VAL 34 HG13 VAL 34 4.212 -5.356 3.933 280 HG21 VAL 34 HG21 VAL 34 2.086 -8.099 5.387 281 HG22 VAL 34 HG22 VAL 34 3.103 -6.723 5.839 282 HG23 VAL 34 HG23 VAL 34 3.837 -8.167 5.139 283 H HIS 35 HN HIS 35 1.523 -5.202 6.053 284 HA HIS 35 HA HIS 35 -0.149 -7.225 7.154 285 HB2 HIS 35 HB2 HIS 35 1.601 -6.140 8.489 286 HB3 HIS 35 HB1 HIS 35 0.764 -4.599 8.348 287 HD1 HIS 35 HD1 HIS 35 0.256 -8.041 9.866 288 HD2 HIS 35 HD2 HIS 35 -1.086 -4.129 10.286 289 HE1 HIS 35 HE1 HIS 35 -1.173 -8.036 11.935 290 HE2 HIS 35 HE2 HIS 35 -2.125 -5.705 12.057 291 H ILE 36 HN ILE 36 -0.619 -3.787 6.423 292 HA ILE 36 HA ILE 36 -3.297 -3.598 7.253 293 HB ILE 36 HB ILE 36 -1.950 -2.110 4.986 294 HG12 ILE 36 HG12 ILE 36 -2.404 -1.162 7.813 295 HG13 ILE 36 HG11 ILE 36 -0.935 -2.000 7.343 296 HG21 ILE 36 HG21 ILE 36 -3.788 -0.668 4.930 297 HG22 ILE 36 HG22 ILE 36 -4.278 -1.100 6.568 298 HG23 ILE 36 HG23 ILE 36 -4.541 -2.228 5.247 299 HD11 ILE 36 HD11 ILE 36 -0.642 -0.196 5.609 300 HD12 ILE 36 HD12 ILE 36 -0.449 0.291 7.287 301 HD13 ILE 36 HD13 ILE 36 -1.933 0.658 6.427 302 H ILE 37 HN ILE 37 -1.836 -4.405 4.171 303 HA ILE 37 HA ILE 37 -4.198 -4.783 2.716 304 HB ILE 37 HB ILE 37 -1.390 -5.747 2.372 305 HG12 ILE 37 HG12 ILE 37 -2.983 -3.930 0.597 306 HG13 ILE 37 HG11 ILE 37 -2.216 -3.323 2.054 307 HG21 ILE 37 HG21 ILE 37 -3.691 -6.922 1.241 308 HG22 ILE 37 HG22 ILE 37 -1.996 -7.269 0.879 309 HG23 ILE 37 HG23 ILE 37 -2.858 -6.032 -0.034 310 HD11 ILE 37 HD11 ILE 37 -0.794 -2.869 0.233 311 HD12 ILE 37 HD12 ILE 37 -0.886 -4.547 -0.324 312 HD13 ILE 37 HD13 ILE 37 -0.057 -4.163 1.185 313 H GLN 38 HN GLN 38 -2.052 -7.299 4.112 314 HA GLN 38 HA GLN 38 -3.672 -9.484 3.675 315 HB2 GLN 38 HB2 GLN 38 -1.818 -8.918 5.996 316 HB3 GLN 38 HB1 GLN 38 -2.578 -10.481 5.738 317 HG2 GLN 38 HG2 GLN 38 -1.430 -10.684 3.591 318 HG3 GLN 38 HG1 GLN 38 -0.713 -9.100 3.837 319 HE21 GLN 38 HE21 GLN 38 -1.166 -11.467 6.376 320 HE22 GLN 38 HE22 GLN 38 0.512 -11.802 6.624 321 H SER 39 HN SER 39 -4.019 -7.060 6.214 322 HA SER 39 HA SER 39 -5.960 -8.621 7.683 323 HB2 SER 39 HB2 SER 39 -6.149 -6.553 9.090 324 HB3 SER 39 HB1 SER 39 -4.519 -7.198 8.957 325 HG SER 39 HG SER 39 -3.960 -5.589 7.594 326 H ARG 40 HN ARG 40 -6.039 -5.673 5.695 327 HA ARG 40 HA ARG 40 -8.892 -5.415 5.803 328 HB2 ARG 40 HB2 ARG 40 -6.704 -4.082 4.375 329 HB3 ARG 40 HB1 ARG 40 -8.246 -4.120 3.533 330 HG2 ARG 40 HG2 ARG 40 -8.615 -2.267 4.645 331 HG3 ARG 40 HG1 ARG 40 -9.045 -3.319 5.955 332 HD2 ARG 40 HD2 ARG 40 -6.848 -3.074 6.915 333 HD3 ARG 40 HD1 ARG 40 -6.332 -2.131 5.512 334 HE ARG 40 HE ARG 40 -8.490 -0.773 6.480 335 HH11 ARG 40 HH11 ARG 40 -5.507 -1.859 7.948 336 HH12 ARG 40 HH12 ARG 40 -5.354 -0.467 8.964 337 HH21 ARG 40 HH21 ARG 40 -8.298 1.053 7.824 338 HH22 ARG 40 HH22 ARG 40 -6.935 1.200 8.889 339 H GLU 41 HN GLU 41 -6.631 -7.123 3.832 340 HA GLU 41 HA GLU 41 -8.788 -8.180 2.121 341 HB2 GLU 41 HB2 GLU 41 -5.846 -8.448 1.560 342 HB3 GLU 41 HB1 GLU 41 -7.189 -8.587 0.439 343 HG2 GLU 41 HG2 GLU 41 -6.308 -6.037 1.746 344 HG3 GLU 41 HG1 GLU 41 -5.820 -6.570 0.134 345 HA PRO 42 HA PRO 42 -7.338 -11.564 4.969 346 HB2 PRO 42 HB2 PRO 42 -10.139 -12.449 4.822 347 HB3 PRO 42 HB1 PRO 42 -9.154 -12.096 6.243 348 HG2 PRO 42 HG2 PRO 42 -11.179 -10.494 5.468 349 HG3 PRO 42 HG1 PRO 42 -9.713 -9.861 6.240 350 HD2 PRO 42 HD2 PRO 42 -10.479 -9.874 3.344 351 HD3 PRO 42 HD1 PRO 42 -9.692 -8.597 4.296 352 H SER 43 HN SER 43 -8.751 -11.305 1.926 353 HA SER 43 HA SER 43 -8.914 -14.019 1.156 354 HB2 SER 43 HB2 SER 43 -8.760 -12.988 -1.179 355 HB3 SER 43 HB1 SER 43 -10.087 -12.425 -0.160 356 HG SER 43 HG SER 43 -7.898 -11.066 -1.130 357 H LEU 44 HN LEU 44 -6.273 -11.849 1.612 358 HA LEU 44 HA LEU 44 -4.490 -13.837 0.389 359 HB2 LEU 44 HB2 LEU 44 -2.927 -11.965 -0.088 360 HB3 LEU 44 HB1 LEU 44 -4.432 -11.870 -0.954 361 HG LEU 44 HG LEU 44 -4.999 -10.309 1.166 362 HD11 LEU 44 HD11 LEU 44 -3.048 -8.834 1.445 363 HD12 LEU 44 HD12 LEU 44 -2.069 -9.996 0.559 364 HD13 LEU 44 HD13 LEU 44 -2.791 -10.446 2.103 365 HD21 LEU 44 HD21 LEU 44 -4.643 -8.452 -0.366 366 HD22 LEU 44 HD22 LEU 44 -5.367 -9.822 -1.208 367 HD23 LEU 44 HD23 LEU 44 -3.648 -9.478 -1.399 368 H LYS 45 HN LYS 45 -5.509 -13.666 3.118 369 HA LYS 45 HA LYS 45 -3.486 -12.767 4.882 370 HB2 LYS 45 HB2 LYS 45 -4.616 -14.053 6.593 371 HB3 LYS 45 HB1 LYS 45 -5.798 -13.206 5.610 372 HG2 LYS 45 HG2 LYS 45 -6.284 -15.260 4.403 373 HG3 LYS 45 HG1 LYS 45 -5.063 -16.111 5.349 374 HD2 LYS 45 HD2 LYS 45 -7.418 -14.735 6.610 375 HD3 LYS 45 HD1 LYS 45 -7.466 -16.417 6.079 376 HE2 LYS 45 HE2 LYS 45 -6.847 -16.711 8.258 377 HE3 LYS 45 HE1 LYS 45 -5.263 -16.577 7.496 378 HZ1 LYS 45 HZ1 LYS 45 -6.698 -14.323 8.791 379 HZ2 LYS 45 HZ2 LYS 45 -5.121 -14.297 8.184 380 HZ3 LYS 45 HZ3 LYS 45 -5.490 -15.240 9.535 381 H ASN 46 HN ASN 46 -3.813 -15.641 2.967 382 HA ASN 46 HA ASN 46 -1.963 -17.214 4.494 383 HB2 ASN 46 HB2 ASN 46 -3.705 -18.249 3.083 384 HB3 ASN 46 HB1 ASN 46 -2.932 -17.585 1.649 385 HD21 ASN 46 HD21 ASN 46 -2.633 -19.891 4.259 386 HD22 ASN 46 HD22 ASN 46 -1.411 -20.869 3.509 387 H SER 47 HN SER 47 -1.686 -14.718 2.210 388 HA SER 47 HA SER 47 0.818 -15.392 1.058 389 HB2 SER 47 HB2 SER 47 -0.549 -12.714 1.400 390 HB3 SER 47 HB1 SER 47 0.869 -12.989 0.383 391 HG SER 47 HG SER 47 -0.719 -13.289 -1.033 392 H ASN 48 HN ASN 48 2.880 -14.658 1.565 393 HA ASN 48 HA ASN 48 3.358 -14.420 4.397 394 HB2 ASN 48 HB2 ASN 48 5.270 -14.474 2.058 395 HB3 ASN 48 HB1 ASN 48 5.748 -14.530 3.745 396 HD21 ASN 48 HD21 ASN 48 5.442 -16.407 4.921 397 HD22 ASN 48 HD22 ASN 48 5.048 -17.918 4.173 398 HA PRO 49 HA PRO 49 3.523 -10.059 4.653 399 HB2 PRO 49 HB2 PRO 49 5.271 -9.824 6.744 400 HB3 PRO 49 HB1 PRO 49 3.570 -10.258 6.918 401 HG2 PRO 49 HG2 PRO 49 5.976 -12.021 6.888 402 HG3 PRO 49 HG1 PRO 49 4.541 -12.090 7.929 403 HD2 PRO 49 HD2 PRO 49 4.849 -13.739 5.830 404 HD3 PRO 49 HD1 PRO 49 3.257 -13.115 6.306 405 H ASP 50 HN ASP 50 6.389 -11.895 4.088 406 HA ASP 50 HA ASP 50 7.871 -9.454 3.412 407 HB2 ASP 50 HB2 ASP 50 8.824 -12.305 3.746 408 HB3 ASP 50 HB1 ASP 50 9.853 -10.965 3.265 409 H GLU 51 HN GLU 51 5.786 -11.413 1.908 410 HA GLU 51 HA GLU 51 7.153 -11.175 -0.672 411 HB2 GLU 51 HB2 GLU 51 5.850 -13.746 0.251 412 HB3 GLU 51 HB1 GLU 51 6.632 -13.469 -1.298 413 HG2 GLU 51 HG2 GLU 51 8.771 -13.122 -0.117 414 HG3 GLU 51 HG1 GLU 51 7.963 -13.510 1.399 415 H ILE 52 HN ILE 52 5.024 -9.744 0.593 416 HA ILE 52 HA ILE 52 2.502 -10.764 -0.147 417 HB ILE 52 HB ILE 52 3.158 -9.006 1.671 418 HG12 ILE 52 HG12 ILE 52 0.826 -8.251 1.716 419 HG13 ILE 52 HG11 ILE 52 0.606 -8.799 0.066 420 HG21 ILE 52 HG21 ILE 52 2.483 -7.281 -0.688 421 HG22 ILE 52 HG22 ILE 52 4.027 -7.331 0.159 422 HG23 ILE 52 HG23 ILE 52 2.589 -6.719 0.976 423 HD11 ILE 52 HD11 ILE 52 1.286 -10.547 2.384 424 HD12 ILE 52 HD12 ILE 52 0.914 -11.071 0.745 425 HD13 ILE 52 HD13 ILE 52 -0.330 -10.313 1.734 426 H GLU 53 HN GLU 53 1.038 -10.036 -1.588 427 HA GLU 53 HA GLU 53 2.126 -8.743 -4.000 428 HB2 GLU 53 HB2 GLU 53 -0.169 -10.684 -3.635 429 HB3 GLU 53 HB1 GLU 53 0.114 -9.808 -5.128 430 HG2 GLU 53 HG2 GLU 53 2.215 -11.569 -3.921 431 HG3 GLU 53 HG1 GLU 53 0.943 -12.217 -4.960 432 H ILE 54 HN ILE 54 1.695 -6.586 -3.520 433 HA ILE 54 HA ILE 54 -0.826 -5.790 -2.411 434 HB ILE 54 HB ILE 54 1.260 -4.068 -3.753 435 HG12 ILE 54 HG12 ILE 54 0.999 -4.707 -0.811 436 HG13 ILE 54 HG11 ILE 54 2.228 -5.371 -1.878 437 HG21 ILE 54 HG21 ILE 54 -0.956 -3.420 -1.846 438 HG22 ILE 54 HG22 ILE 54 -0.846 -2.960 -3.543 439 HG23 ILE 54 HG23 ILE 54 0.284 -2.285 -2.370 440 HD11 ILE 54 HD11 ILE 54 2.686 -3.249 -0.365 441 HD12 ILE 54 HD12 ILE 54 1.979 -2.437 -1.754 442 HD13 ILE 54 HD13 ILE 54 3.405 -3.440 -1.963 443 H ASP 55 HN ASP 55 -2.508 -6.246 -3.726 444 HA ASP 55 HA ASP 55 -2.299 -5.586 -6.573 445 HB2 ASP 55 HB2 ASP 55 -2.972 -7.911 -5.924 446 HB3 ASP 55 HB1 ASP 55 -4.410 -7.232 -5.168 447 H PHE 56 HN PHE 56 -2.762 -3.470 -6.730 448 HA PHE 56 HA PHE 56 -4.410 -2.117 -4.888 449 HB2 PHE 56 HB2 PHE 56 -3.275 -1.240 -7.528 450 HB3 PHE 56 HB1 PHE 56 -4.077 -0.162 -6.393 451 HD1 PHE 56 HD1 PHE 56 -3.111 -0.010 -4.054 452 HD2 PHE 56 HD2 PHE 56 -0.987 -1.694 -7.313 453 HE1 PHE 56 HE1 PHE 56 -1.038 0.304 -2.830 454 HE2 PHE 56 HE2 PHE 56 1.123 -1.366 -6.088 455 HZ PHE 56 HZ PHE 56 1.084 -0.353 -3.837 456 H GLU 57 HN GLU 57 -5.230 -3.911 -7.610 457 HA GLU 57 HA GLU 57 -7.598 -2.374 -8.266 458 HB2 GLU 57 HB2 GLU 57 -6.370 -4.889 -9.345 459 HB3 GLU 57 HB1 GLU 57 -7.978 -4.373 -9.839 460 HG2 GLU 57 HG2 GLU 57 -5.464 -2.741 -10.126 461 HG3 GLU 57 HG1 GLU 57 -6.235 -3.671 -11.412 462 H THR 58 HN THR 58 -6.730 -4.993 -6.233 463 HA THR 58 HA THR 58 -9.574 -5.624 -5.827 464 HB THR 58 HB THR 58 -8.710 -7.678 -4.648 465 HG1 THR 58 HG1 THR 58 -6.267 -6.960 -5.944 466 HG21 THR 58 HG21 THR 58 -7.992 -7.310 -7.558 467 HG22 THR 58 HG22 THR 58 -9.566 -7.795 -6.922 468 HG23 THR 58 HG23 THR 58 -8.174 -8.865 -6.745 469 H LEU 59 HN LEU 59 -6.751 -4.298 -4.328 470 HA LEU 59 HA LEU 59 -7.324 -4.474 -1.620 471 HB2 LEU 59 HB2 LEU 59 -6.140 -2.170 -3.137 472 HB3 LEU 59 HB1 LEU 59 -6.101 -2.356 -1.400 473 HG LEU 59 HG LEU 59 -4.758 -4.114 -3.435 474 HD11 LEU 59 HD11 LEU 59 -3.602 -2.464 -1.212 475 HD12 LEU 59 HD12 LEU 59 -3.696 -1.941 -2.894 476 HD13 LEU 59 HD13 LEU 59 -2.729 -3.349 -2.460 477 HD21 LEU 59 HD21 LEU 59 -5.061 -4.438 -0.462 478 HD22 LEU 59 HD22 LEU 59 -3.848 -5.284 -1.428 479 HD23 LEU 59 HD23 LEU 59 -5.562 -5.559 -1.731 480 H LYS 60 HN LYS 60 -8.896 -3.718 -0.382 481 HA LYS 60 HA LYS 60 -11.129 -2.297 -1.269 482 HB2 LYS 60 HB2 LYS 60 -9.919 -2.521 1.487 483 HB3 LYS 60 HB1 LYS 60 -11.479 -1.784 1.177 484 HG2 LYS 60 HG2 LYS 60 -12.312 -3.920 0.363 485 HG3 LYS 60 HG1 LYS 60 -10.731 -4.646 0.650 486 HD2 LYS 60 HD2 LYS 60 -10.915 -4.200 2.994 487 HD3 LYS 60 HD1 LYS 60 -12.421 -3.324 2.762 488 HE2 LYS 60 HE2 LYS 60 -13.458 -5.407 1.946 489 HE3 LYS 60 HE1 LYS 60 -11.951 -6.261 2.277 490 HZ1 LYS 60 HZ1 LYS 60 -13.489 -4.786 4.347 491 HZ2 LYS 60 HZ2 LYS 60 -12.181 -5.838 4.590 492 HZ3 LYS 60 HZ3 LYS 60 -13.666 -6.445 4.052 493 HA PRO 61 HA PRO 61 -9.911 2.054 -1.415 494 HB2 PRO 61 HB2 PRO 61 -12.483 2.375 0.059 495 HB3 PRO 61 HB1 PRO 61 -11.890 3.232 -1.369 496 HG2 PRO 61 HG2 PRO 61 -13.762 1.327 -1.549 497 HG3 PRO 61 HG1 PRO 61 -12.543 1.589 -2.806 498 HD2 PRO 61 HD2 PRO 61 -12.768 -0.604 -0.822 499 HD3 PRO 61 HD1 PRO 61 -12.009 -0.604 -2.426 500 H SER 62 HN SER 62 -11.316 0.520 1.417 501 HA SER 62 HA SER 62 -10.447 2.177 3.461 502 HB2 SER 62 HB2 SER 62 -10.442 -0.834 3.636 503 HB3 SER 62 HB1 SER 62 -10.871 0.334 4.887 504 HG SER 62 HG SER 62 -12.839 0.073 4.219 505 H THR 63 HN THR 63 -8.825 -0.585 1.962 506 HA THR 63 HA THR 63 -6.481 -0.473 3.541 507 HB THR 63 HB THR 63 -6.415 -1.590 0.773 508 HG1 THR 63 HG1 THR 63 -7.693 -3.375 1.432 509 HG21 THR 63 HG21 THR 63 -4.514 -2.332 1.777 510 HG22 THR 63 HG22 THR 63 -5.608 -3.566 2.414 511 HG23 THR 63 HG23 THR 63 -5.203 -2.163 3.396 512 H LEU 64 HN LEU 64 -7.216 0.516 0.200 513 HA LEU 64 HA LEU 64 -4.702 1.450 -0.494 514 HB2 LEU 64 HB2 LEU 64 -7.405 2.392 -1.397 515 HB3 LEU 64 HB1 LEU 64 -5.908 2.843 -2.176 516 HG LEU 64 HG LEU 64 -6.947 0.021 -1.934 517 HD11 LEU 64 HD11 LEU 64 -7.874 2.028 -3.577 518 HD12 LEU 64 HD12 LEU 64 -8.064 0.297 -3.837 519 HD13 LEU 64 HD13 LEU 64 -6.723 1.161 -4.589 520 HD21 LEU 64 HD21 LEU 64 -4.542 1.245 -3.254 521 HD22 LEU 64 HD22 LEU 64 -5.185 -0.332 -3.720 522 HD23 LEU 64 HD23 LEU 64 -4.602 -0.070 -2.076 523 H ARG 65 HN ARG 65 -7.408 3.278 0.938 524 HA ARG 65 HA ARG 65 -6.063 5.754 1.006 525 HB2 ARG 65 HB2 ARG 65 -8.322 4.669 2.673 526 HB3 ARG 65 HB1 ARG 65 -7.739 6.325 2.786 527 HG2 ARG 65 HG2 ARG 65 -8.849 5.053 0.294 528 HG3 ARG 65 HG1 ARG 65 -9.749 6.102 1.386 529 HD2 ARG 65 HD2 ARG 65 -8.112 7.904 0.942 530 HD3 ARG 65 HD1 ARG 65 -7.314 6.851 -0.226 531 HE ARG 65 HE ARG 65 -10.094 7.135 -0.784 532 HH11 ARG 65 HH11 ARG 65 -6.992 8.709 -1.137 533 HH12 ARG 65 HH12 ARG 65 -7.466 9.625 -2.535 534 HH21 ARG 65 HH21 ARG 65 -10.739 8.394 -2.609 535 HH22 ARG 65 HH22 ARG 65 -9.594 9.469 -3.341 536 H GLU 66 HN GLU 66 -6.151 3.021 3.231 537 HA GLU 66 HA GLU 66 -4.729 4.328 5.321 538 HB2 GLU 66 HB2 GLU 66 -6.050 2.349 5.783 539 HB3 GLU 66 HB1 GLU 66 -5.092 1.399 4.655 540 HG2 GLU 66 HG2 GLU 66 -4.358 0.824 6.810 541 HG3 GLU 66 HG1 GLU 66 -3.113 1.852 6.106 542 H LEU 67 HN LEU 67 -3.715 1.986 2.814 543 HA LEU 67 HA LEU 67 -1.003 1.866 3.282 544 HB2 LEU 67 HB2 LEU 67 -2.104 2.076 0.471 545 HB3 LEU 67 HB1 LEU 67 -0.743 1.120 1.049 546 HG LEU 67 HG LEU 67 -3.616 0.551 1.751 547 HD11 LEU 67 HD11 LEU 67 -1.992 -1.202 0.011 548 HD12 LEU 67 HD12 LEU 67 -2.682 0.255 -0.702 549 HD13 LEU 67 HD13 LEU 67 -3.736 -0.944 0.047 550 HD21 LEU 67 HD21 LEU 67 -1.314 -0.214 3.034 551 HD22 LEU 67 HD22 LEU 67 -1.640 -1.564 1.956 552 HD23 LEU 67 HD23 LEU 67 -2.865 -1.045 3.114 553 H GLU 68 HN GLU 68 -2.683 4.213 1.166 554 HA GLU 68 HA GLU 68 -0.463 5.768 0.480 555 HB2 GLU 68 HB2 GLU 68 -2.651 5.954 -0.635 556 HB3 GLU 68 HB1 GLU 68 -3.337 6.646 0.826 557 HG2 GLU 68 HG2 GLU 68 -1.558 8.455 0.580 558 HG3 GLU 68 HG1 GLU 68 -1.370 7.856 -1.069 559 H ARG 69 HN ARG 69 -2.946 6.560 2.923 560 HA ARG 69 HA ARG 69 -1.688 8.794 4.025 561 HB2 ARG 69 HB2 ARG 69 -3.654 6.797 5.039 562 HB3 ARG 69 HB1 ARG 69 -3.095 8.073 6.099 563 HG2 ARG 69 HG2 ARG 69 -3.980 8.995 3.475 564 HG3 ARG 69 HG1 ARG 69 -5.246 8.215 4.428 565 HD2 ARG 69 HD2 ARG 69 -5.207 10.620 4.818 566 HD3 ARG 69 HD1 ARG 69 -4.779 9.737 6.281 567 HE ARG 69 HE ARG 69 -2.616 10.550 6.136 568 HH11 ARG 69 HH11 ARG 69 -4.496 11.513 3.347 569 HH12 ARG 69 HH12 ARG 69 -3.362 12.720 2.835 570 HH21 ARG 69 HH21 ARG 69 -1.115 12.139 5.470 571 HH22 ARG 69 HH22 ARG 69 -1.432 13.072 4.039 572 H TYR 70 HN TYR 70 -1.085 5.436 4.498 573 HA TYR 70 HA TYR 70 0.380 5.708 6.933 574 HB2 TYR 70 HB2 TYR 70 -0.545 3.568 6.500 575 HB3 TYR 70 HB1 TYR 70 0.154 3.524 4.887 576 HD1 TYR 70 HD2 TYR 70 1.329 3.970 8.403 577 HD2 TYR 70 HD1 TYR 70 1.949 2.212 4.593 578 HE1 TYR 70 HE2 TYR 70 3.345 2.865 9.261 579 HE2 TYR 70 HE1 TYR 70 3.954 1.087 5.425 580 HH TYR 70 HH TYR 70 5.482 1.065 7.135 581 H VAL 71 HN VAL 71 1.296 5.242 3.511 582 HA VAL 71 HA VAL 71 4.068 5.376 3.987 583 HB VAL 71 HB VAL 71 4.405 5.693 1.667 584 HG11 VAL 71 HG11 VAL 71 2.735 4.140 0.596 585 HG12 VAL 71 HG12 VAL 71 1.990 4.010 2.189 586 HG13 VAL 71 HG13 VAL 71 3.663 3.504 1.949 587 HG21 VAL 71 HG21 VAL 71 2.772 6.425 0.122 588 HG22 VAL 71 HG22 VAL 71 2.921 7.616 1.409 589 HG23 VAL 71 HG23 VAL 71 1.542 6.513 1.375 590 H THR 72 HN THR 72 1.593 7.828 3.556 591 HA THR 72 HA THR 72 3.343 9.923 2.917 592 HB THR 72 HB THR 72 1.494 11.454 3.476 593 HG1 THR 72 HG1 THR 72 -0.548 10.231 3.967 594 HG21 THR 72 HG21 THR 72 1.044 9.011 1.837 595 HG22 THR 72 HG22 THR 72 1.456 10.640 1.291 596 HG23 THR 72 HG23 THR 72 -0.168 10.290 1.891 597 H SER 73 HN SER 73 2.366 8.509 5.933 598 HA SER 73 HA SER 73 3.315 10.549 7.637 599 HB2 SER 73 HB2 SER 73 3.098 8.973 9.391 600 HB3 SER 73 HB1 SER 73 1.851 8.531 8.217 601 HG SER 73 HG SER 73 3.083 6.831 7.539 602 H CYS 74 HN CYS 74 4.853 8.086 5.758 603 HA CYS 74 HA CYS 74 7.447 8.540 7.050 604 HB2 CYS 74 HB2 CYS 74 6.904 6.208 6.748 605 HB3 CYS 74 HB1 CYS 74 6.578 6.469 5.035 606 HG CYS 74 HG CYS 74 9.491 7.481 5.061 607 H LEU 75 HN LEU 75 5.724 9.251 4.132 608 HA LEU 75 HA LEU 75 8.188 9.965 2.731 609 HB2 LEU 75 HB2 LEU 75 5.381 9.735 1.674 610 HB3 LEU 75 HB1 LEU 75 6.830 9.909 0.725 611 HG LEU 75 HG LEU 75 5.969 7.520 2.320 612 HD11 LEU 75 HD11 LEU 75 5.092 8.029 -0.015 613 HD12 LEU 75 HD12 LEU 75 5.802 6.438 0.261 614 HD13 LEU 75 HD13 LEU 75 6.729 7.686 -0.569 615 HD21 LEU 75 HD21 LEU 75 8.045 6.456 1.759 616 HD22 LEU 75 HD22 LEU 75 8.401 7.954 2.616 617 HD23 LEU 75 HD23 LEU 75 8.587 7.876 0.864 618 H ARG 76 HN ARG 76 5.255 11.399 3.997 619 HA ARG 76 HA ARG 76 5.950 13.923 2.691 620 HB2 ARG 76 HB2 ARG 76 3.365 12.998 3.899 621 HB3 ARG 76 HB1 ARG 76 3.644 14.635 3.315 622 HG2 ARG 76 HG2 ARG 76 4.191 13.665 1.086 623 HG3 ARG 76 HG1 ARG 76 3.709 12.094 1.729 624 HD2 ARG 76 HD2 ARG 76 1.880 13.058 0.502 625 HD3 ARG 76 HD1 ARG 76 1.508 12.981 2.218 626 HE ARG 76 HE ARG 76 2.379 15.464 2.062 627 HH11 ARG 76 HH11 ARG 76 0.254 13.735 -0.124 628 HH12 ARG 76 HH12 ARG 76 -0.625 15.158 -0.588 629 HH21 ARG 76 HH21 ARG 76 1.221 17.335 1.441 630 HH22 ARG 76 HH22 ARG 76 -0.085 17.201 0.306 631 H LYS 77 HN LYS 77 5.230 12.491 5.829 632 HA LYS 77 HA LYS 77 5.855 14.985 7.204 633 HB2 LYS 77 HB2 LYS 77 4.024 13.244 7.854 634 HB3 LYS 77 HB1 LYS 77 5.358 12.366 8.589 635 HG2 LYS 77 HG2 LYS 77 5.899 14.499 9.830 636 HG3 LYS 77 HG1 LYS 77 4.338 15.100 9.280 637 HD2 LYS 77 HD2 LYS 77 4.829 12.655 10.976 638 HD3 LYS 77 HD1 LYS 77 4.120 14.178 11.507 639 HE2 LYS 77 HE2 LYS 77 2.945 12.237 9.522 640 HE3 LYS 77 HE1 LYS 77 2.383 12.529 11.167 641 HZ1 LYS 77 HZ1 LYS 77 0.985 13.700 9.657 642 HZ2 LYS 77 HZ2 LYS 77 2.302 14.432 8.891 643 HZ3 LYS 77 HZ3 LYS 77 1.914 14.845 10.484 644 H LYS 78 HN LYS 78 7.629 12.759 5.755 645 HA LYS 78 HA LYS 78 9.980 13.192 7.362 646 HB2 LYS 78 HB2 LYS 78 8.928 11.234 8.453 647 HB3 LYS 78 HB1 LYS 78 8.887 10.396 6.913 648 HG2 LYS 78 HG2 LYS 78 10.723 9.468 7.963 649 HG3 LYS 78 HG1 LYS 78 11.445 10.697 6.925 650 HD2 LYS 78 HD2 LYS 78 12.513 10.876 9.035 651 HD3 LYS 78 HD1 LYS 78 11.401 12.240 8.917 652 HE2 LYS 78 HE2 LYS 78 9.773 11.057 10.287 653 HE3 LYS 78 HE1 LYS 78 10.838 9.654 10.364 654 HZ1 LYS 78 HZ1 LYS 78 11.039 10.943 12.364 655 HZ2 LYS 78 HZ2 LYS 78 11.388 12.346 11.488 656 HZ3 LYS 78 HZ3 LYS 78 12.484 11.058 11.494 657 H ARG 79 HN ARG 79 11.919 12.584 6.108 658 HA ARG 79 HA ARG 79 11.363 11.723 3.378 659 HB2 ARG 79 HB2 ARG 79 12.803 13.517 2.448 660 HB3 ARG 79 HB1 ARG 79 11.310 14.104 3.154 661 HG2 ARG 79 HG2 ARG 79 12.798 15.652 3.926 662 HG3 ARG 79 HG1 ARG 79 12.812 14.498 5.260 663 HD2 ARG 79 HD2 ARG 79 15.076 15.211 4.639 664 HD3 ARG 79 HD1 ARG 79 14.839 13.482 4.385 665 HE ARG 79 HE ARG 79 14.278 14.908 2.006 666 HH11 ARG 79 HH11 ARG 79 16.946 13.852 4.001 667 HH12 ARG 79 HH12 ARG 79 18.081 13.822 2.690 668 HH21 ARG 79 HH21 ARG 79 15.767 14.856 0.272 669 HH22 ARG 79 HH22 ARG 79 17.416 14.393 0.572 670 H LYS 80 HN LYS 80 12.934 10.571 2.411 671 HA LYS 80 HA LYS 80 14.582 9.011 2.367 672 HB2 LYS 80 HB2 LYS 80 15.840 11.591 3.002 673 HB3 LYS 80 HB1 LYS 80 16.830 10.189 3.374 674 HG2 LYS 80 HG2 LYS 80 17.336 10.983 1.164 675 HG3 LYS 80 HG1 LYS 80 16.564 9.406 1.062 676 HD2 LYS 80 HD2 LYS 80 14.411 10.565 0.591 677 HD3 LYS 80 HD1 LYS 80 15.296 12.090 0.539 678 HE2 LYS 80 HE2 LYS 80 15.772 9.705 -1.248 679 HE3 LYS 80 HE1 LYS 80 14.930 11.182 -1.707 680 HZ1 LYS 80 HZ1 LYS 80 16.971 12.419 -1.345 681 HZ2 LYS 80 HZ2 LYS 80 17.221 11.185 -2.473 682 HZ3 LYS 80 HZ3 LYS 80 17.782 11.008 -0.887 683 HA PRO 81 HA PRO 81 14.306 7.915 6.850 684 HB2 PRO 81 HB2 PRO 81 13.017 5.546 6.509 685 HB3 PRO 81 HB1 PRO 81 12.167 7.086 6.668 686 HG2 PRO 81 HG2 PRO 81 12.736 5.474 4.232 687 HG3 PRO 81 HG1 PRO 81 11.318 6.460 4.622 688 HD2 PRO 81 HD2 PRO 81 13.365 7.238 2.938 689 HD3 PRO 81 HD1 PRO 81 12.263 8.351 3.768 690 H GLN 82 HN GLN 82 14.647 5.407 4.329 691 HA GLN 82 HA GLN 82 17.258 4.694 5.485 692 HB2 GLN 82 HB2 GLN 82 15.169 2.747 4.476 693 HB3 GLN 82 HB1 GLN 82 16.776 2.321 5.039 694 HG2 GLN 82 HG2 GLN 82 14.646 3.605 6.732 695 HG3 GLN 82 HG1 GLN 82 15.007 1.881 6.696 696 HE21 GLN 82 HE21 GLN 82 15.134 3.814 8.889 697 HE22 GLN 82 HE22 GLN 82 16.752 3.736 9.492 698 H ALA 83 HN ALA 83 16.574 6.407 3.276 699 HA ALA 83 HA ALA 83 17.281 4.809 0.920 700 HB1 ALA 83 HB1 ALA 83 16.429 6.730 -0.384 701 HB2 ALA 83 HB2 ALA 83 16.004 7.532 1.129 702 HB3 ALA 83 HB3 ALA 83 15.212 6.023 0.679 703 H1 VAL 201 HT1 VAL 201 -2.384 0.232 -17.598 704 H2 VAL 201 HT2 VAL 201 -3.183 1.567 -16.942 705 H3 VAL 201 HT3 VAL 201 -4.036 0.449 -17.875 706 HA VAL 201 HA VAL 201 -4.483 0.179 -15.518 707 HB VAL 201 HB VAL 201 -3.974 -2.236 -15.345 708 HG11 VAL 201 HG11 VAL 201 -5.906 -1.493 -16.636 709 HG12 VAL 201 HG12 VAL 201 -5.195 -2.943 -17.344 710 HG13 VAL 201 HG13 VAL 201 -4.903 -1.368 -18.081 711 HG21 VAL 201 HG21 VAL 201 -1.731 -2.232 -16.296 712 HG22 VAL 201 HG22 VAL 201 -2.387 -1.800 -17.874 713 HG23 VAL 201 HG23 VAL 201 -2.770 -3.364 -17.159 714 H VAL 202 HN VAL 202 -3.649 -0.677 -13.474 715 HA VAL 202 HA VAL 202 -0.958 0.367 -12.989 716 HB VAL 202 HB VAL 202 -3.160 -0.272 -11.016 717 HG11 VAL 202 HG11 VAL 202 -1.775 0.904 -9.377 718 HG12 VAL 202 HG12 VAL 202 -0.506 1.101 -10.586 719 HG13 VAL 202 HG13 VAL 202 -0.940 -0.511 -10.019 720 HG21 VAL 202 HG21 VAL 202 -3.337 2.176 -10.794 721 HG22 VAL 202 HG22 VAL 202 -3.732 1.619 -12.417 722 HG23 VAL 202 HG23 VAL 202 -2.165 2.363 -12.097 723 HA PRO 203 HA PRO 203 0.465 -3.837 -12.873 724 HB2 PRO 203 HB2 PRO 203 2.963 -3.271 -11.918 725 HB3 PRO 203 HB1 PRO 203 2.492 -3.076 -13.610 726 HG2 PRO 203 HG2 PRO 203 2.667 -1.020 -11.444 727 HG3 PRO 203 HG1 PRO 203 3.190 -0.914 -13.135 728 HD2 PRO 203 HD2 PRO 203 0.889 0.189 -12.291 729 HD3 PRO 203 HD1 PRO 203 1.043 -0.531 -13.907 730 H LYS 204 HN LYS 204 1.277 -5.361 -11.318 731 HA LYS 204 HA LYS 204 0.252 -4.782 -8.647 732 HB2 LYS 204 HB2 LYS 204 1.233 -7.440 -9.690 733 HB3 LYS 204 HB1 LYS 204 0.144 -7.142 -8.340 734 HG2 LYS 204 HG2 LYS 204 -1.515 -6.248 -9.978 735 HG3 LYS 204 HG1 LYS 204 -0.435 -6.783 -11.273 736 HD2 LYS 204 HD2 LYS 204 -0.598 -9.079 -10.459 737 HD3 LYS 204 HD1 LYS 204 -1.667 -8.549 -9.158 738 HE2 LYS 204 HE2 LYS 204 -2.216 -8.374 -12.117 739 HE3 LYS 204 HE1 LYS 204 -2.960 -9.499 -10.981 740 HZ1 LYS 204 HZ1 LYS 204 -3.265 -6.548 -11.025 741 HZ2 LYS 204 HZ2 LYS 204 -3.861 -7.543 -9.788 742 HZ3 LYS 204 HZ3 LYS 204 -4.456 -7.701 -11.367 743 H LYS 205 HN LYS 205 1.542 -4.755 -6.838 744 HA LYS 205 HA LYS 205 4.372 -4.492 -7.385 745 HB2 LYS 205 HB2 LYS 205 2.682 -3.895 -4.980 746 HB3 LYS 205 HB1 LYS 205 4.436 -3.867 -4.897 747 HG2 LYS 205 HG2 LYS 205 2.765 -2.206 -6.771 748 HG3 LYS 205 HG1 LYS 205 3.467 -1.639 -5.253 749 HD2 LYS 205 HD2 LYS 205 5.709 -2.122 -6.118 750 HD3 LYS 205 HD1 LYS 205 5.002 -2.687 -7.632 751 HE2 LYS 205 HE2 LYS 205 4.053 -0.464 -8.011 752 HE3 LYS 205 HE1 LYS 205 4.780 0.097 -6.503 753 HZ1 LYS 205 HZ1 LYS 205 6.324 -0.982 -8.805 754 HZ2 LYS 205 HZ2 LYS 205 6.957 -0.256 -7.413 755 HZ3 LYS 205 HZ3 LYS 205 6.073 0.665 -8.525 756 H LYS 206 HN LYS 206 5.575 -6.185 -7.430 757 HA LYS 206 HA LYS 206 4.999 -8.540 -5.842 758 HB2 LYS 206 HB2 LYS 206 5.891 -8.364 -8.315 759 HB3 LYS 206 HB1 LYS 206 7.452 -8.183 -7.535 760 HG2 LYS 206 HG2 LYS 206 5.640 -10.489 -6.920 761 HG3 LYS 206 HG1 LYS 206 6.752 -10.514 -8.290 762 HD2 LYS 206 HD2 LYS 206 8.610 -10.048 -6.705 763 HD3 LYS 206 HD1 LYS 206 7.460 -10.201 -5.378 764 HE2 LYS 206 HE2 LYS 206 6.978 -12.494 -6.039 765 HE3 LYS 206 HE1 LYS 206 8.083 -12.346 -7.404 766 HZ1 LYS 206 HZ1 LYS 206 8.805 -12.221 -4.531 767 HZ2 LYS 206 HZ2 LYS 206 9.887 -11.967 -5.806 768 HZ3 LYS 206 HZ3 LYS 206 9.161 -13.477 -5.603 769 H ILE 207 HN ILE 207 5.368 -7.925 -3.750 770 HA ILE 207 HA ILE 207 7.690 -6.340 -3.058 771 HB ILE 207 HB ILE 207 5.506 -7.459 -1.300 772 HG12 ILE 207 HG12 ILE 207 4.706 -5.899 -3.077 773 HG13 ILE 207 HG11 ILE 207 4.445 -5.300 -1.444 774 HG21 ILE 207 HG21 ILE 207 6.262 -5.533 0.199 775 HG22 ILE 207 HG22 ILE 207 7.728 -5.515 -0.787 776 HG23 ILE 207 HG23 ILE 207 7.294 -6.964 0.117 777 HD11 ILE 207 HD11 ILE 207 6.270 -3.772 -1.650 778 HD12 ILE 207 HD12 ILE 207 5.217 -3.583 -3.050 779 HD13 ILE 207 HD13 ILE 207 6.736 -4.464 -3.204 780 H LYS 208 HN LYS 208 9.566 -7.454 -2.974 781 HA LYS 208 HA LYS 208 9.585 -10.038 -1.574 782 HB2 LYS 208 HB2 LYS 208 10.557 -9.848 -3.906 783 HB3 LYS 208 HB1 LYS 208 11.809 -8.822 -3.224 784 HG2 LYS 208 HG2 LYS 208 12.678 -11.033 -3.443 785 HG3 LYS 208 HG1 LYS 208 12.454 -10.694 -1.726 786 HD2 LYS 208 HD2 LYS 208 10.330 -11.937 -1.778 787 HD3 LYS 208 HD1 LYS 208 10.597 -12.300 -3.483 788 HE2 LYS 208 HE2 LYS 208 12.687 -13.456 -2.876 789 HE3 LYS 208 HE1 LYS 208 12.347 -13.145 -1.177 790 HZ1 LYS 208 HZ1 LYS 208 10.667 -14.764 -3.015 791 HZ2 LYS 208 HZ2 LYS 208 10.320 -14.461 -1.389 792 HZ3 LYS 208 HZ3 LYS 208 11.684 -15.370 -1.807 793 H LYS 209 HN LYS 209 9.188 -8.123 0.140 794 HA LYS 209 HA LYS 209 9.857 -7.279 2.126 795 HB2 LYS 209 HB2 LYS 209 11.117 -9.360 2.429 796 HB3 LYS 209 HB1 LYS 209 12.487 -8.661 1.574 797 HG2 LYS 209 HG2 LYS 209 12.642 -6.923 3.328 798 HG3 LYS 209 HG1 LYS 209 11.347 -7.738 4.201 799 HD2 LYS 209 HD2 LYS 209 12.741 -9.764 4.334 800 HD3 LYS 209 HD1 LYS 209 14.045 -8.901 3.512 801 HE2 LYS 209 HE2 LYS 209 14.397 -8.923 5.922 802 HE3 LYS 209 HE1 LYS 209 14.132 -7.283 5.334 803 HZ1 LYS 209 HZ1 LYS 209 12.115 -8.999 6.679 804 HZ2 LYS 209 HZ2 LYS 209 11.828 -7.444 6.078 805 HZ3 LYS 209 HZ3 LYS 209 12.907 -7.667 7.359 806 H GLU 210 HN GLU 210 12.783 -7.097 0.098 807 HA GLU 210 HA GLU 210 13.468 -4.528 1.153 808 HB2 GLU 210 HB2 GLU 210 14.611 -6.189 -1.090 809 HB3 GLU 210 HB1 GLU 210 15.293 -4.651 -0.576 810 HG2 GLU 210 HG2 GLU 210 14.921 -6.988 1.274 811 HG3 GLU 210 HG1 GLU 210 16.397 -6.703 0.351 812 H GLN 211 HN GLN 211 13.249 -2.545 0.265 813 HA GLN 211 HA GLN 211 11.316 -2.170 -1.806 814 HB2 GLN 211 HB2 GLN 211 11.768 0.218 -1.533 815 HB3 GLN 211 HB1 GLN 211 11.538 -0.559 0.026 816 HG2 GLN 211 HG2 GLN 211 13.886 -0.520 0.466 817 HG3 GLN 211 HG1 GLN 211 14.232 0.043 -1.168 818 HE21 GLN 211 HE21 GLN 211 14.900 1.249 1.407 819 HE22 GLN 211 HE22 GLN 211 14.194 2.828 1.387 820 H VAL 212 HN VAL 212 11.666 -1.156 -3.844 821 HA VAL 212 HA VAL 212 14.214 -2.006 -4.992 822 HB VAL 212 HB VAL 212 13.094 -1.808 -7.183 823 HG11 VAL 212 HG11 VAL 212 11.633 -3.485 -5.143 824 HG12 VAL 212 HG12 VAL 212 13.104 -3.935 -6.003 825 HG13 VAL 212 HG13 VAL 212 11.594 -3.731 -6.888 826 HG21 VAL 212 HG21 VAL 212 11.490 -0.051 -6.619 827 HG22 VAL 212 HG22 VAL 212 10.640 -1.166 -5.547 828 HG23 VAL 212 HG23 VAL 212 10.676 -1.467 -7.285 829 H GLU 213 HN GLU 213 13.066 0.768 -3.730 830 HA GLU 213 HA GLU 213 14.572 2.413 -5.639 831 HB2 GLU 213 HB2 GLU 213 12.483 3.100 -3.593 832 HB3 GLU 213 HB1 GLU 213 13.611 4.325 -4.155 833 HG2 GLU 213 HG2 GLU 213 12.879 3.790 -6.490 834 HG3 GLU 213 HG1 GLU 213 11.616 2.782 -5.786 Start of MODEL 6 1 H1 SER 1 HT1 SER 1 -24.781 6.995 4.530 2 H2 SER 1 HT2 SER 1 -25.039 5.807 5.713 3 H3 SER 1 HT3 SER 1 -26.145 5.996 4.449 4 HA SER 1 HA SER 1 -24.640 4.061 4.201 5 HB2 SER 1 HB2 SER 1 -24.339 6.178 2.071 6 HB3 SER 1 HB1 SER 1 -24.329 4.427 1.841 7 HG SER 1 HG SER 1 -26.480 4.345 2.150 8 H GLU 2 HN GLU 2 -23.124 6.042 5.882 9 HA GLU 2 HA GLU 2 -20.638 6.249 4.359 10 HB2 GLU 2 HB2 GLU 2 -21.453 7.608 6.920 11 HB3 GLU 2 HB1 GLU 2 -19.916 7.825 6.104 12 HG2 GLU 2 HG2 GLU 2 -21.094 9.659 5.398 13 HG3 GLU 2 HG1 GLU 2 -21.361 8.521 4.080 14 H GLU 3 HN GLU 3 -21.880 3.970 6.274 15 HA GLU 3 HA GLU 3 -19.886 3.574 8.218 16 HB2 GLU 3 HB2 GLU 3 -21.761 1.609 6.907 17 HB3 GLU 3 HB1 GLU 3 -20.666 1.176 8.215 18 HG2 GLU 3 HG2 GLU 3 -22.872 3.215 8.330 19 HG3 GLU 3 HG1 GLU 3 -22.858 1.630 9.099 20 H GLU 4 HN GLU 4 -20.232 2.073 5.002 21 HA GLU 4 HA GLU 4 -17.461 1.151 5.211 22 HB2 GLU 4 HB2 GLU 4 -19.091 -0.514 4.518 23 HB3 GLU 4 HB1 GLU 4 -19.630 0.515 3.203 24 HG2 GLU 4 HG2 GLU 4 -17.244 0.366 2.331 25 HG3 GLU 4 HG1 GLU 4 -17.039 -0.959 3.476 26 H ASP 5 HN ASP 5 -19.455 3.465 3.578 27 HA ASP 5 HA ASP 5 -17.556 3.857 1.421 28 HB2 ASP 5 HB2 ASP 5 -20.011 3.868 1.026 29 HB3 ASP 5 HB1 ASP 5 -20.126 5.329 2.001 30 H LYS 6 HN LYS 6 -17.596 4.896 4.533 31 HA LYS 6 HA LYS 6 -17.002 7.652 4.200 32 HB2 LYS 6 HB2 LYS 6 -17.601 6.586 6.405 33 HB3 LYS 6 HB1 LYS 6 -15.999 5.864 6.427 34 HG2 LYS 6 HG2 LYS 6 -16.023 7.840 7.804 35 HG3 LYS 6 HG1 LYS 6 -15.003 8.117 6.390 36 HD2 LYS 6 HD2 LYS 6 -16.964 9.239 5.306 37 HD3 LYS 6 HD1 LYS 6 -17.821 9.100 6.839 38 HE2 LYS 6 HE2 LYS 6 -16.875 11.301 6.667 39 HE3 LYS 6 HE1 LYS 6 -16.013 10.405 7.913 40 HZ1 LYS 6 HZ1 LYS 6 -14.229 9.993 6.347 41 HZ2 LYS 6 HZ2 LYS 6 -14.508 11.653 6.483 42 HZ3 LYS 6 HZ3 LYS 6 -15.066 10.814 5.128 43 H CYS 7 HN CYS 7 -15.138 4.695 4.092 44 HA CYS 7 HA CYS 7 -12.614 5.925 3.667 45 HB2 CYS 7 HB2 CYS 7 -13.652 3.220 2.780 46 HB3 CYS 7 HB1 CYS 7 -11.964 3.724 2.729 47 HG CYS 7 HG CYS 7 -13.227 4.124 5.759 48 H LYS 8 HN LYS 8 -12.270 7.292 2.056 49 HA LYS 8 HA LYS 8 -14.051 7.624 -0.080 50 HB2 LYS 8 HB2 LYS 8 -11.570 8.853 0.796 51 HB3 LYS 8 HB1 LYS 8 -11.922 8.981 -0.930 52 HG2 LYS 8 HG2 LYS 8 -13.351 10.578 -0.471 53 HG3 LYS 8 HG1 LYS 8 -14.346 9.416 0.351 54 HD2 LYS 8 HD2 LYS 8 -13.900 11.317 1.797 55 HD3 LYS 8 HD1 LYS 8 -13.201 9.827 2.429 56 HE2 LYS 8 HE2 LYS 8 -11.006 10.496 1.577 57 HE3 LYS 8 HE1 LYS 8 -11.707 11.980 0.935 58 HZ1 LYS 8 HZ1 LYS 8 -11.551 11.207 3.798 59 HZ2 LYS 8 HZ2 LYS 8 -12.310 12.598 3.212 60 HZ3 LYS 8 HZ3 LYS 8 -10.644 12.409 3.030 61 HA PRO 9 HA PRO 9 -12.717 4.714 -3.013 62 HB2 PRO 9 HB2 PRO 9 -13.780 5.857 -5.243 63 HB3 PRO 9 HB1 PRO 9 -14.741 4.997 -4.037 64 HG2 PRO 9 HG2 PRO 9 -14.421 7.915 -4.481 65 HG3 PRO 9 HG1 PRO 9 -15.835 7.012 -3.915 66 HD2 PRO 9 HD2 PRO 9 -14.114 8.469 -2.289 67 HD3 PRO 9 HD1 PRO 9 -15.174 7.167 -1.720 68 H MET 10 HN MET 10 -10.647 4.539 -3.622 69 HA MET 10 HA MET 10 -9.082 6.853 -4.254 70 HB2 MET 10 HB2 MET 10 -8.183 4.883 -3.019 71 HB3 MET 10 HB1 MET 10 -8.289 3.950 -4.509 72 HG2 MET 10 HG2 MET 10 -6.089 4.609 -4.524 73 HG3 MET 10 HG1 MET 10 -6.850 5.872 -5.496 74 HE1 MET 10 HE1 MET 10 -5.937 4.753 -2.059 75 HE2 MET 10 HE2 MET 10 -5.389 6.190 -1.197 76 HE3 MET 10 HE3 MET 10 -4.358 5.451 -2.421 77 H SER 11 HN SER 11 -8.698 7.713 -6.157 78 HA SER 11 HA SER 11 -9.973 6.636 -8.477 79 HB2 SER 11 HB2 SER 11 -8.332 9.094 -7.947 80 HB3 SER 11 HB1 SER 11 -8.958 8.713 -9.551 81 HG SER 11 HG SER 11 -11.015 8.441 -8.057 82 H TYR 12 HN TYR 12 -8.645 6.659 -10.663 83 HA TYR 12 HA TYR 12 -6.906 4.462 -10.430 84 HB2 TYR 12 HB2 TYR 12 -7.735 4.302 -12.503 85 HB3 TYR 12 HB1 TYR 12 -8.123 6.018 -12.569 86 HD1 TYR 12 HD1 TYR 12 -5.168 3.723 -12.881 87 HD2 TYR 12 HD2 TYR 12 -7.059 7.320 -14.135 88 HE1 TYR 12 HE1 TYR 12 -3.401 4.059 -14.557 89 HE2 TYR 12 HE2 TYR 12 -5.300 7.666 -15.813 90 HH TYR 12 HH TYR 12 -2.986 7.006 -16.217 91 H GLU 13 HN GLU 13 -6.116 7.796 -11.479 92 HA GLU 13 HA GLU 13 -3.365 7.641 -11.566 93 HB2 GLU 13 HB2 GLU 13 -5.149 9.884 -10.581 94 HB3 GLU 13 HB1 GLU 13 -3.438 10.092 -10.921 95 HG2 GLU 13 HG2 GLU 13 -5.327 9.065 -13.014 96 HG3 GLU 13 HG1 GLU 13 -5.147 10.795 -12.709 97 H GLU 14 HN GLU 14 -5.453 7.829 -8.754 98 HA GLU 14 HA GLU 14 -3.417 8.512 -6.897 99 HB2 GLU 14 HB2 GLU 14 -6.223 7.490 -6.630 100 HB3 GLU 14 HB1 GLU 14 -5.192 7.704 -5.225 101 HG2 GLU 14 HG2 GLU 14 -4.921 10.095 -5.892 102 HG3 GLU 14 HG1 GLU 14 -6.114 9.819 -7.160 103 H LYS 15 HN LYS 15 -5.128 5.500 -7.668 104 HA LYS 15 HA LYS 15 -3.760 3.787 -5.953 105 HB2 LYS 15 HB2 LYS 15 -4.949 3.289 -8.670 106 HB3 LYS 15 HB1 LYS 15 -4.205 2.009 -7.720 107 HG2 LYS 15 HG2 LYS 15 -5.862 1.967 -6.184 108 HG3 LYS 15 HG1 LYS 15 -6.325 3.643 -6.455 109 HD2 LYS 15 HD2 LYS 15 -7.605 3.150 -8.256 110 HD3 LYS 15 HD1 LYS 15 -6.630 1.755 -8.713 111 HE2 LYS 15 HE2 LYS 15 -7.518 0.595 -6.696 112 HE3 LYS 15 HE1 LYS 15 -8.635 1.938 -6.473 113 HZ1 LYS 15 HZ1 LYS 15 -9.709 0.149 -7.642 114 HZ2 LYS 15 HZ2 LYS 15 -8.504 0.129 -8.832 115 HZ3 LYS 15 HZ3 LYS 15 -9.535 1.467 -8.686 116 H ARG 16 HN ARG 16 -2.821 5.019 -9.134 117 HA ARG 16 HA ARG 16 -0.463 3.463 -9.386 118 HB2 ARG 16 HB2 ARG 16 -1.409 4.608 -11.328 119 HB3 ARG 16 HB1 ARG 16 -1.063 6.163 -10.581 120 HG2 ARG 16 HG2 ARG 16 1.336 5.449 -10.506 121 HG3 ARG 16 HG1 ARG 16 0.886 4.122 -11.554 122 HD2 ARG 16 HD2 ARG 16 1.786 5.952 -12.842 123 HD3 ARG 16 HD1 ARG 16 0.083 5.731 -13.185 124 HE ARG 16 HE ARG 16 1.075 7.822 -11.373 125 HH11 ARG 16 HH11 ARG 16 -0.955 6.756 -14.012 126 HH12 ARG 16 HH12 ARG 16 -1.818 8.263 -14.131 127 HH21 ARG 16 HH21 ARG 16 -0.021 9.813 -11.542 128 HH22 ARG 16 HH22 ARG 16 -1.271 10.012 -12.737 129 H GLN 17 HN GLN 17 -0.970 6.812 -8.281 130 HA GLN 17 HA GLN 17 1.657 7.366 -7.558 131 HB2 GLN 17 HB2 GLN 17 -0.213 9.018 -7.645 132 HB3 GLN 17 HB1 GLN 17 -0.801 8.354 -6.126 133 HG2 GLN 17 HG2 GLN 17 0.461 10.316 -5.642 134 HG3 GLN 17 HG1 GLN 17 1.384 8.914 -5.105 135 HE21 GLN 17 HE21 GLN 17 1.194 11.502 -7.396 136 HE22 GLN 17 HE22 GLN 17 2.797 11.336 -8.018 137 H LEU 18 HN LEU 18 -0.918 5.814 -5.804 138 HA LEU 18 HA LEU 18 0.250 5.426 -3.309 139 HB2 LEU 18 HB2 LEU 18 -2.115 4.893 -4.343 140 HB3 LEU 18 HB1 LEU 18 -1.408 3.322 -4.608 141 HG LEU 18 HG LEU 18 -1.992 4.669 -1.996 142 HD11 LEU 18 HD11 LEU 18 -3.181 2.433 -1.742 143 HD12 LEU 18 HD12 LEU 18 -2.957 2.260 -3.475 144 HD13 LEU 18 HD13 LEU 18 -3.884 3.615 -2.834 145 HD21 LEU 18 HD21 LEU 18 -0.043 3.678 -1.341 146 HD22 LEU 18 HD22 LEU 18 -0.121 2.442 -2.592 147 HD23 LEU 18 HD23 LEU 18 -1.144 2.315 -1.162 148 H SER 19 HN SER 19 0.275 3.271 -6.152 149 HA SER 19 HA SER 19 1.874 1.282 -4.996 150 HB2 SER 19 HB2 SER 19 1.964 0.324 -7.135 151 HB3 SER 19 HB1 SER 19 0.455 1.233 -7.139 152 HG SER 19 HG SER 19 1.811 3.000 -8.082 153 H LEU 20 HN LEU 20 2.629 4.369 -6.234 154 HA LEU 20 HA LEU 20 5.451 3.819 -6.589 155 HB2 LEU 20 HB2 LEU 20 3.845 6.334 -6.875 156 HB3 LEU 20 HB1 LEU 20 5.547 6.205 -7.256 157 HG LEU 20 HG LEU 20 3.254 4.873 -8.654 158 HD11 LEU 20 HD11 LEU 20 3.821 7.230 -9.166 159 HD12 LEU 20 HD12 LEU 20 3.926 6.137 -10.540 160 HD13 LEU 20 HD13 LEU 20 5.396 6.680 -9.727 161 HD21 LEU 20 HD21 LEU 20 4.950 3.226 -8.495 162 HD22 LEU 20 HD22 LEU 20 6.202 4.379 -8.959 163 HD23 LEU 20 HD23 LEU 20 4.981 3.878 -10.132 164 H ASP 21 HN ASP 21 3.292 5.352 -4.282 165 HA ASP 21 HA ASP 21 5.460 6.361 -2.669 166 HB2 ASP 21 HB2 ASP 21 3.777 7.046 -1.071 167 HB3 ASP 21 HB1 ASP 21 3.399 7.592 -2.677 168 H ILE 22 HN ILE 22 3.442 3.492 -2.672 169 HA ILE 22 HA ILE 22 4.507 2.321 -0.349 170 HB ILE 22 HB ILE 22 3.106 1.390 -2.761 171 HG12 ILE 22 HG12 ILE 22 2.842 0.588 0.123 172 HG13 ILE 22 HG11 ILE 22 2.083 2.022 -0.560 173 HG21 ILE 22 HG21 ILE 22 4.638 -0.601 -1.116 174 HG22 ILE 22 HG22 ILE 22 4.978 -0.166 -2.785 175 HG23 ILE 22 HG23 ILE 22 3.465 -0.968 -2.376 176 HD11 ILE 22 HD11 ILE 22 1.600 -0.775 -1.544 177 HD12 ILE 22 HD12 ILE 22 0.731 0.688 -2.000 178 HD13 ILE 22 HD13 ILE 22 0.589 0.054 -0.362 179 H ASN 23 HN ASN 23 5.649 2.491 -3.661 180 HA ASN 23 HA ASN 23 7.876 0.802 -3.437 181 HB2 ASN 23 HB2 ASN 23 6.814 2.622 -5.354 182 HB3 ASN 23 HB1 ASN 23 8.515 3.010 -5.142 183 HD21 ASN 23 HD21 ASN 23 10.082 1.482 -5.681 184 HD22 ASN 23 HD22 ASN 23 9.717 0.133 -6.700 185 H LYS 24 HN LYS 24 7.323 4.089 -2.483 186 HA LYS 24 HA LYS 24 10.037 4.826 -2.060 187 HB2 LYS 24 HB2 LYS 24 7.393 5.952 -1.267 188 HB3 LYS 24 HB1 LYS 24 8.875 6.649 -0.632 189 HG2 LYS 24 HG2 LYS 24 9.615 7.213 -2.840 190 HG3 LYS 24 HG1 LYS 24 8.267 6.333 -3.563 191 HD2 LYS 24 HD2 LYS 24 6.682 7.893 -2.668 192 HD3 LYS 24 HD1 LYS 24 7.929 8.708 -1.728 193 HE2 LYS 24 HE2 LYS 24 7.338 9.986 -3.723 194 HE3 LYS 24 HE1 LYS 24 9.008 9.437 -3.807 195 HZ1 LYS 24 HZ1 LYS 24 8.250 7.596 -5.227 196 HZ2 LYS 24 HZ2 LYS 24 7.945 9.110 -5.915 197 HZ3 LYS 24 HZ3 LYS 24 6.683 8.235 -5.207 198 H LEU 25 HN LEU 25 7.839 2.934 -0.240 199 HA LEU 25 HA LEU 25 8.989 3.490 2.337 200 HB2 LEU 25 HB2 LEU 25 7.114 1.341 1.379 201 HB3 LEU 25 HB1 LEU 25 7.687 1.450 3.031 202 HG LEU 25 HG LEU 25 5.862 3.329 1.569 203 HD11 LEU 25 HD11 LEU 25 5.742 1.908 4.199 204 HD12 LEU 25 HD12 LEU 25 4.913 1.397 2.727 205 HD13 LEU 25 HD13 LEU 25 4.464 2.911 3.521 206 HD21 LEU 25 HD21 LEU 25 7.288 3.822 4.159 207 HD22 LEU 25 HD22 LEU 25 6.000 4.821 3.496 208 HD23 LEU 25 HD23 LEU 25 7.548 4.708 2.663 209 HA PRO 26 HA PRO 26 12.385 0.571 2.058 210 HB2 PRO 26 HB2 PRO 26 12.987 0.554 4.720 211 HB3 PRO 26 HB1 PRO 26 13.515 1.829 3.617 212 HG2 PRO 26 HG2 PRO 26 11.245 1.806 5.556 213 HG3 PRO 26 HG1 PRO 26 12.350 3.128 5.151 214 HD2 PRO 26 HD2 PRO 26 9.810 2.949 4.176 215 HD3 PRO 26 HD1 PRO 26 11.130 3.740 3.293 216 H GLY 27 HN GLY 27 12.925 -1.535 3.097 217 HA2 GLY 27 HA2 GLY 27 10.854 -3.307 2.777 218 HA3 GLY 27 HA1 GLY 27 12.330 -3.680 3.642 219 H GLU 28 HN GLU 28 12.250 -2.467 5.948 220 HA GLU 28 HA GLU 28 10.448 -3.954 7.456 221 HB2 GLU 28 HB2 GLU 28 11.074 -1.904 9.157 222 HB3 GLU 28 HB1 GLU 28 12.015 -3.364 8.927 223 HG2 GLU 28 HG2 GLU 28 12.467 -0.889 7.306 224 HG3 GLU 28 HG1 GLU 28 13.229 -1.151 8.868 225 H LYS 29 HN LYS 29 10.159 -0.631 6.305 226 HA LYS 29 HA LYS 29 7.802 -0.088 7.844 227 HB2 LYS 29 HB2 LYS 29 9.383 1.332 5.772 228 HB3 LYS 29 HB1 LYS 29 7.705 1.815 5.957 229 HG2 LYS 29 HG2 LYS 29 9.214 3.232 7.249 230 HG3 LYS 29 HG1 LYS 29 8.098 2.354 8.291 231 HD2 LYS 29 HD2 LYS 29 9.739 1.054 9.191 232 HD3 LYS 29 HD1 LYS 29 10.743 1.125 7.738 233 HE2 LYS 29 HE2 LYS 29 11.714 2.352 9.650 234 HE3 LYS 29 HE1 LYS 29 11.411 3.379 8.247 235 HZ1 LYS 29 HZ1 LYS 29 9.656 3.169 10.641 236 HZ2 LYS 29 HZ2 LYS 29 9.405 4.183 9.313 237 HZ3 LYS 29 HZ3 LYS 29 10.735 4.432 10.324 238 H LEU 30 HN LEU 30 8.509 -1.430 4.719 239 HA LEU 30 HA LEU 30 5.828 -1.052 3.765 240 HB2 LEU 30 HB2 LEU 30 6.826 -1.180 1.836 241 HB3 LEU 30 HB1 LEU 30 8.335 -1.630 2.583 242 HG LEU 30 HG LEU 30 6.223 -3.547 1.576 243 HD11 LEU 30 HD11 LEU 30 7.807 -2.018 0.092 244 HD12 LEU 30 HD12 LEU 30 7.410 -3.677 -0.354 245 HD13 LEU 30 HD13 LEU 30 8.944 -3.320 0.435 246 HD21 LEU 30 HD21 LEU 30 7.568 -4.458 3.459 247 HD22 LEU 30 HD22 LEU 30 9.030 -4.119 2.535 248 HD23 LEU 30 HD23 LEU 30 7.859 -5.291 1.933 249 H GLY 31 HN GLY 31 7.401 -3.362 5.695 250 HA2 GLY 31 HA2 GLY 31 5.692 -5.574 5.270 251 HA3 GLY 31 HA1 GLY 31 6.511 -5.203 6.773 252 H ARG 32 HN ARG 32 5.168 -2.468 6.744 253 HA ARG 32 HA ARG 32 2.815 -3.190 8.172 254 HB2 ARG 32 HB2 ARG 32 3.938 -1.097 8.684 255 HB3 ARG 32 HB1 ARG 32 3.605 -0.497 7.069 256 HG2 ARG 32 HG2 ARG 32 1.701 0.346 7.827 257 HG3 ARG 32 HG1 ARG 32 1.140 -1.298 8.131 258 HD2 ARG 32 HD2 ARG 32 2.741 0.360 10.067 259 HD3 ARG 32 HD1 ARG 32 0.991 0.146 10.124 260 HE ARG 32 HE ARG 32 2.743 -2.207 10.277 261 HH11 ARG 32 HH11 ARG 32 0.435 -0.054 11.795 262 HH12 ARG 32 HH12 ARG 32 0.144 -1.105 13.141 263 HH21 ARG 32 HH21 ARG 32 2.370 -3.593 12.049 264 HH22 ARG 32 HH22 ARG 32 1.252 -3.122 13.290 265 H VAL 33 HN VAL 33 3.324 -1.903 4.867 266 HA VAL 33 HA VAL 33 0.573 -1.661 4.289 267 HB VAL 33 HB VAL 33 1.686 -2.346 1.843 268 HG11 VAL 33 HG11 VAL 33 1.183 0.251 3.257 269 HG12 VAL 33 HG12 VAL 33 0.190 -0.553 2.040 270 HG13 VAL 33 HG13 VAL 33 1.714 0.194 1.579 271 HG21 VAL 33 HG21 VAL 33 3.612 -0.474 3.155 272 HG22 VAL 33 HG22 VAL 33 3.759 -1.308 1.605 273 HG23 VAL 33 HG23 VAL 33 3.918 -2.211 3.113 274 H VAL 34 HN VAL 34 2.807 -4.324 3.604 275 HA VAL 34 HA VAL 34 1.014 -6.235 2.742 276 HB VAL 34 HB VAL 34 2.647 -7.755 3.047 277 HG11 VAL 34 HG11 VAL 34 3.934 -5.881 2.291 278 HG12 VAL 34 HG12 VAL 34 4.893 -6.896 3.367 279 HG13 VAL 34 HG13 VAL 34 4.215 -5.379 3.955 280 HG21 VAL 34 HG21 VAL 34 2.098 -8.144 5.384 281 HG22 VAL 34 HG22 VAL 34 3.147 -6.800 5.849 282 HG23 VAL 34 HG23 VAL 34 3.840 -8.239 5.101 283 H HIS 35 HN HIS 35 1.643 -5.180 6.068 284 HA HIS 35 HA HIS 35 -0.025 -7.074 7.346 285 HB2 HIS 35 HB2 HIS 35 1.744 -5.846 8.525 286 HB3 HIS 35 HB1 HIS 35 0.886 -4.336 8.263 287 HD1 HIS 35 HD1 HIS 35 1.240 -7.071 10.634 288 HD2 HIS 35 HD2 HIS 35 -1.623 -4.194 9.750 289 HE1 HIS 35 HE1 HIS 35 -0.252 -6.959 12.652 290 HE2 HIS 35 HE2 HIS 35 -1.841 -5.067 12.172 291 H ILE 36 HN ILE 36 -0.555 -3.674 6.445 292 HA ILE 36 HA ILE 36 -3.215 -3.479 7.318 293 HB ILE 36 HB ILE 36 -1.936 -2.012 4.998 294 HG12 ILE 36 HG12 ILE 36 -2.195 -1.069 7.848 295 HG13 ILE 36 HG11 ILE 36 -0.774 -1.927 7.277 296 HG21 ILE 36 HG21 ILE 36 -3.831 -0.811 4.818 297 HG22 ILE 36 HG22 ILE 36 -3.926 -0.596 6.567 298 HG23 ILE 36 HG23 ILE 36 -4.577 -2.052 5.825 299 HD11 ILE 36 HD11 ILE 36 -0.589 -0.107 5.525 300 HD12 ILE 36 HD12 ILE 36 -0.237 0.345 7.186 301 HD13 ILE 36 HD13 ILE 36 -1.780 0.769 6.468 302 H ILE 37 HN ILE 37 -1.816 -4.331 4.213 303 HA ILE 37 HA ILE 37 -4.206 -4.727 2.800 304 HB ILE 37 HB ILE 37 -1.395 -5.635 2.418 305 HG12 ILE 37 HG12 ILE 37 -3.083 -3.938 0.619 306 HG13 ILE 37 HG11 ILE 37 -2.305 -3.262 2.038 307 HG21 ILE 37 HG21 ILE 37 -3.733 -6.838 1.280 308 HG22 ILE 37 HG22 ILE 37 -2.037 -7.299 1.100 309 HG23 ILE 37 HG23 ILE 37 -2.742 -6.093 0.026 310 HD11 ILE 37 HD11 ILE 37 -0.917 -2.824 0.202 311 HD12 ILE 37 HD12 ILE 37 -0.998 -4.508 -0.335 312 HD13 ILE 37 HD13 ILE 37 -0.143 -4.096 1.151 313 H GLN 38 HN GLN 38 -2.019 -7.269 4.108 314 HA GLN 38 HA GLN 38 -3.660 -9.442 3.723 315 HB2 GLN 38 HB2 GLN 38 -1.765 -8.874 6.012 316 HB3 GLN 38 HB1 GLN 38 -2.582 -10.416 5.822 317 HG2 GLN 38 HG2 GLN 38 -1.470 -10.598 3.556 318 HG3 GLN 38 HG1 GLN 38 -0.583 -9.156 3.993 319 HE21 GLN 38 HE21 GLN 38 -1.205 -12.501 5.155 320 HE22 GLN 38 HE22 GLN 38 0.358 -12.671 5.872 321 H SER 39 HN SER 39 -3.878 -7.057 6.349 322 HA SER 39 HA SER 39 -5.769 -8.613 7.851 323 HB2 SER 39 HB2 SER 39 -5.936 -6.594 9.289 324 HB3 SER 39 HB1 SER 39 -4.281 -7.124 9.023 325 HG SER 39 HG SER 39 -3.940 -5.458 7.647 326 H ARG 40 HN ARG 40 -6.001 -5.724 5.785 327 HA ARG 40 HA ARG 40 -8.858 -5.585 6.004 328 HB2 ARG 40 HB2 ARG 40 -6.826 -4.202 4.362 329 HB3 ARG 40 HB1 ARG 40 -8.482 -4.243 3.759 330 HG2 ARG 40 HG2 ARG 40 -8.610 -2.389 4.964 331 HG3 ARG 40 HG1 ARG 40 -8.943 -3.500 6.261 332 HD2 ARG 40 HD2 ARG 40 -6.454 -3.525 6.674 333 HD3 ARG 40 HD1 ARG 40 -6.385 -2.143 5.575 334 HE ARG 40 HE ARG 40 -8.180 -1.255 7.274 335 HH11 ARG 40 HH11 ARG 40 -5.226 -2.977 7.939 336 HH12 ARG 40 HH12 ARG 40 -5.021 -2.290 9.518 337 HH21 ARG 40 HH21 ARG 40 -7.949 -0.372 9.372 338 HH22 ARG 40 HH22 ARG 40 -6.584 -0.826 10.339 339 H GLU 41 HN GLU 41 -6.597 -7.179 3.932 340 HA GLU 41 HA GLU 41 -8.782 -8.256 2.277 341 HB2 GLU 41 HB2 GLU 41 -5.835 -8.416 1.670 342 HB3 GLU 41 HB1 GLU 41 -7.181 -8.629 0.568 343 HG2 GLU 41 HG2 GLU 41 -6.439 -6.029 1.864 344 HG3 GLU 41 HG1 GLU 41 -5.924 -6.537 0.253 345 HA PRO 42 HA PRO 42 -7.196 -11.640 5.084 346 HB2 PRO 42 HB2 PRO 42 -9.984 -12.567 5.076 347 HB3 PRO 42 HB1 PRO 42 -8.943 -12.170 6.445 348 HG2 PRO 42 HG2 PRO 42 -11.025 -10.616 5.735 349 HG3 PRO 42 HG1 PRO 42 -9.534 -9.944 6.421 350 HD2 PRO 42 HD2 PRO 42 -10.431 -10.044 3.564 351 HD3 PRO 42 HD1 PRO 42 -9.639 -8.724 4.451 352 H SER 43 HN SER 43 -8.715 -11.479 2.079 353 HA SER 43 HA SER 43 -8.831 -14.250 1.448 354 HB2 SER 43 HB2 SER 43 -8.844 -13.303 -0.945 355 HB3 SER 43 HB1 SER 43 -10.169 -12.828 0.118 356 HG SER 43 HG SER 43 -8.323 -11.280 -1.094 357 H LEU 44 HN LEU 44 -6.295 -11.975 1.742 358 HA LEU 44 HA LEU 44 -4.475 -13.866 0.428 359 HB2 LEU 44 HB2 LEU 44 -3.006 -11.950 -0.086 360 HB3 LEU 44 HB1 LEU 44 -4.556 -11.852 -0.862 361 HG LEU 44 HG LEU 44 -5.030 -10.347 1.315 362 HD11 LEU 44 HD11 LEU 44 -3.037 -8.858 1.490 363 HD12 LEU 44 HD12 LEU 44 -2.111 -10.098 0.649 364 HD13 LEU 44 HD13 LEU 44 -2.840 -10.451 2.215 365 HD21 LEU 44 HD21 LEU 44 -5.540 -9.700 -0.937 366 HD22 LEU 44 HD22 LEU 44 -3.828 -9.538 -1.326 367 HD23 LEU 44 HD23 LEU 44 -4.584 -8.423 -0.189 368 H LYS 45 HN LYS 45 -5.433 -13.688 3.236 369 HA LYS 45 HA LYS 45 -3.343 -12.767 4.896 370 HB2 LYS 45 HB2 LYS 45 -4.369 -14.060 6.672 371 HB3 LYS 45 HB1 LYS 45 -5.589 -13.189 5.762 372 HG2 LYS 45 HG2 LYS 45 -6.230 -15.202 4.611 373 HG3 LYS 45 HG1 LYS 45 -4.923 -16.097 5.388 374 HD2 LYS 45 HD2 LYS 45 -7.076 -14.731 6.975 375 HD3 LYS 45 HD1 LYS 45 -7.270 -16.372 6.353 376 HE2 LYS 45 HE2 LYS 45 -6.412 -16.822 8.431 377 HE3 LYS 45 HE1 LYS 45 -4.932 -16.729 7.476 378 HZ1 LYS 45 HZ1 LYS 45 -6.049 -14.521 9.116 379 HZ2 LYS 45 HZ2 LYS 45 -4.608 -14.473 8.237 380 HZ3 LYS 45 HZ3 LYS 45 -4.754 -15.509 9.558 381 H ASN 46 HN ASN 46 -3.724 -15.694 3.059 382 HA ASN 46 HA ASN 46 -1.849 -17.253 4.549 383 HB2 ASN 46 HB2 ASN 46 -3.596 -18.286 3.154 384 HB3 ASN 46 HB1 ASN 46 -2.845 -17.617 1.713 385 HD21 ASN 46 HD21 ASN 46 -1.059 -18.593 0.861 386 HD22 ASN 46 HD22 ASN 46 -0.445 -20.112 1.429 387 H SER 47 HN SER 47 -1.537 -14.735 2.314 388 HA SER 47 HA SER 47 0.848 -15.410 0.982 389 HB2 SER 47 HB2 SER 47 -0.264 -12.701 1.731 390 HB3 SER 47 HB1 SER 47 1.060 -12.957 0.592 391 HG SER 47 HG SER 47 -1.501 -14.145 0.300 392 H ASN 48 HN ASN 48 2.996 -14.844 1.378 393 HA ASN 48 HA ASN 48 3.780 -14.838 4.142 394 HB2 ASN 48 HB2 ASN 48 5.561 -14.321 1.774 395 HB3 ASN 48 HB1 ASN 48 6.027 -14.953 3.341 396 HD21 ASN 48 HD21 ASN 48 5.692 -17.124 3.788 397 HD22 ASN 48 HD22 ASN 48 5.305 -18.268 2.548 398 HA PRO 49 HA PRO 49 3.577 -10.503 4.814 399 HB2 PRO 49 HB2 PRO 49 5.507 -10.331 6.782 400 HB3 PRO 49 HB1 PRO 49 3.833 -10.823 7.049 401 HG2 PRO 49 HG2 PRO 49 6.274 -12.507 6.730 402 HG3 PRO 49 HG1 PRO 49 4.895 -12.711 7.826 403 HD2 PRO 49 HD2 PRO 49 5.149 -14.178 5.594 404 HD3 PRO 49 HD1 PRO 49 3.561 -13.641 6.180 405 H ASP 50 HN ASP 50 6.645 -12.010 4.021 406 HA ASP 50 HA ASP 50 7.751 -9.369 3.363 407 HB2 ASP 50 HB2 ASP 50 9.108 -12.049 3.677 408 HB3 ASP 50 HB1 ASP 50 9.926 -10.608 3.088 409 H GLU 51 HN GLU 51 5.864 -11.427 1.854 410 HA GLU 51 HA GLU 51 7.137 -10.979 -0.741 411 HB2 GLU 51 HB2 GLU 51 6.311 -13.677 0.304 412 HB3 GLU 51 HB1 GLU 51 6.416 -13.340 -1.402 413 HG2 GLU 51 HG2 GLU 51 8.735 -12.863 -1.247 414 HG3 GLU 51 HG1 GLU 51 8.676 -13.005 0.492 415 H ILE 52 HN ILE 52 4.968 -9.772 0.662 416 HA ILE 52 HA ILE 52 2.456 -10.721 -0.198 417 HB ILE 52 HB ILE 52 3.127 -8.976 1.658 418 HG12 ILE 52 HG12 ILE 52 0.792 -8.172 1.648 419 HG13 ILE 52 HG11 ILE 52 0.591 -8.819 0.029 420 HG21 ILE 52 HG21 ILE 52 2.459 -7.223 -0.684 421 HG22 ILE 52 HG22 ILE 52 4.008 -7.295 0.150 422 HG23 ILE 52 HG23 ILE 52 2.579 -6.684 0.985 423 HD11 ILE 52 HD11 ILE 52 1.352 -10.444 2.397 424 HD12 ILE 52 HD12 ILE 52 0.857 -11.027 0.812 425 HD13 ILE 52 HD13 ILE 52 -0.306 -10.220 1.860 426 H GLU 53 HN GLU 53 1.067 -9.928 -1.737 427 HA GLU 53 HA GLU 53 2.348 -8.480 -3.963 428 HB2 GLU 53 HB2 GLU 53 0.111 -10.518 -4.114 429 HB3 GLU 53 HB1 GLU 53 0.808 -9.659 -5.478 430 HG2 GLU 53 HG2 GLU 53 2.391 -11.484 -3.693 431 HG3 GLU 53 HG1 GLU 53 1.582 -12.025 -5.166 432 H ILE 54 HN ILE 54 1.702 -6.438 -3.521 433 HA ILE 54 HA ILE 54 -0.865 -5.804 -2.451 434 HB ILE 54 HB ILE 54 1.167 -3.983 -3.758 435 HG12 ILE 54 HG12 ILE 54 0.863 -4.803 -0.866 436 HG13 ILE 54 HG11 ILE 54 2.241 -5.103 -1.916 437 HG21 ILE 54 HG21 ILE 54 -1.058 -3.368 -1.851 438 HG22 ILE 54 HG22 ILE 54 -1.061 -3.030 -3.578 439 HG23 ILE 54 HG23 ILE 54 0.088 -2.212 -2.519 440 HD11 ILE 54 HD11 ILE 54 2.736 -3.258 -0.402 441 HD12 ILE 54 HD12 ILE 54 1.285 -2.429 -0.939 442 HD13 ILE 54 HD13 ILE 54 2.621 -2.672 -2.059 443 H ASP 55 HN ASP 55 -2.564 -6.248 -3.770 444 HA ASP 55 HA ASP 55 -2.375 -5.503 -6.600 445 HB2 ASP 55 HB2 ASP 55 -3.035 -7.852 -6.059 446 HB3 ASP 55 HB1 ASP 55 -4.467 -7.223 -5.251 447 H PHE 56 HN PHE 56 -2.880 -3.420 -6.748 448 HA PHE 56 HA PHE 56 -4.501 -2.088 -4.866 449 HB2 PHE 56 HB2 PHE 56 -3.392 -1.175 -7.503 450 HB3 PHE 56 HB1 PHE 56 -4.171 -0.115 -6.337 451 HD1 PHE 56 HD1 PHE 56 -3.164 0.046 -4.040 452 HD2 PHE 56 HD2 PHE 56 -1.107 -1.701 -7.306 453 HE1 PHE 56 HE1 PHE 56 -1.074 0.352 -2.841 454 HE2 PHE 56 HE2 PHE 56 1.024 -1.395 -6.107 455 HZ PHE 56 HZ PHE 56 1.029 -0.359 -3.865 456 H GLU 57 HN GLU 57 -5.433 -3.906 -7.517 457 HA GLU 57 HA GLU 57 -7.795 -2.314 -8.096 458 HB2 GLU 57 HB2 GLU 57 -6.650 -4.838 -9.251 459 HB3 GLU 57 HB1 GLU 57 -8.260 -4.276 -9.686 460 HG2 GLU 57 HG2 GLU 57 -5.738 -2.666 -10.011 461 HG3 GLU 57 HG1 GLU 57 -6.490 -3.623 -11.284 462 H THR 58 HN THR 58 -6.854 -5.124 -6.290 463 HA THR 58 HA THR 58 -9.657 -5.753 -5.731 464 HB THR 58 HB THR 58 -8.678 -7.759 -4.534 465 HG1 THR 58 HG1 THR 58 -6.320 -6.994 -5.953 466 HG21 THR 58 HG21 THR 58 -8.101 -7.411 -7.480 467 HG22 THR 58 HG22 THR 58 -9.623 -7.952 -6.765 468 HG23 THR 58 HG23 THR 58 -8.180 -8.959 -6.636 469 H LEU 59 HN LEU 59 -6.798 -4.406 -4.274 470 HA LEU 59 HA LEU 59 -7.426 -4.467 -1.568 471 HB2 LEU 59 HB2 LEU 59 -6.157 -2.256 -3.150 472 HB3 LEU 59 HB1 LEU 59 -6.181 -2.356 -1.406 473 HG LEU 59 HG LEU 59 -4.816 -4.253 -3.295 474 HD11 LEU 59 HD11 LEU 59 -3.716 -2.433 -1.179 475 HD12 LEU 59 HD12 LEU 59 -3.707 -2.096 -2.910 476 HD13 LEU 59 HD13 LEU 59 -2.803 -3.467 -2.273 477 HD21 LEU 59 HD21 LEU 59 -5.246 -4.379 -0.324 478 HD22 LEU 59 HD22 LEU 59 -3.965 -5.264 -1.155 479 HD23 LEU 59 HD23 LEU 59 -5.652 -5.591 -1.543 480 H LYS 60 HN LYS 60 -9.041 -3.667 -0.442 481 HA LYS 60 HA LYS 60 -11.139 -2.223 -1.690 482 HB2 LYS 60 HB2 LYS 60 -10.563 -2.958 1.169 483 HB3 LYS 60 HB1 LYS 60 -11.996 -2.050 0.706 484 HG2 LYS 60 HG2 LYS 60 -12.736 -3.870 -0.694 485 HG3 LYS 60 HG1 LYS 60 -11.249 -4.755 -0.363 486 HD2 LYS 60 HD2 LYS 60 -13.168 -3.926 1.807 487 HD3 LYS 60 HD1 LYS 60 -13.304 -5.454 0.932 488 HE2 LYS 60 HE2 LYS 60 -10.750 -4.641 2.352 489 HE3 LYS 60 HE1 LYS 60 -12.038 -5.582 3.120 490 HZ1 LYS 60 HZ1 LYS 60 -10.414 -7.064 2.277 491 HZ2 LYS 60 HZ2 LYS 60 -10.417 -6.334 0.751 492 HZ3 LYS 60 HZ3 LYS 60 -11.771 -7.205 1.275 493 HA PRO 61 HA PRO 61 -10.028 2.043 -1.388 494 HB2 PRO 61 HB2 PRO 61 -12.571 2.369 0.148 495 HB3 PRO 61 HB1 PRO 61 -11.960 3.298 -1.226 496 HG2 PRO 61 HG2 PRO 61 -13.879 1.466 -1.532 497 HG3 PRO 61 HG1 PRO 61 -12.637 1.745 -2.761 498 HD2 PRO 61 HD2 PRO 61 -12.960 -0.536 -0.896 499 HD3 PRO 61 HD1 PRO 61 -12.176 -0.481 -2.486 500 H SER 62 HN SER 62 -11.468 0.618 1.523 501 HA SER 62 HA SER 62 -10.461 2.302 3.472 502 HB2 SER 62 HB2 SER 62 -10.679 -0.697 3.774 503 HB3 SER 62 HB1 SER 62 -10.912 0.539 5.014 504 HG SER 62 HG SER 62 -12.877 0.932 4.288 505 H THR 63 HN THR 63 -8.959 -0.590 2.050 506 HA THR 63 HA THR 63 -6.578 -0.470 3.590 507 HB THR 63 HB THR 63 -6.579 -1.632 0.824 508 HG1 THR 63 HG1 THR 63 -7.827 -3.400 1.542 509 HG21 THR 63 HG21 THR 63 -4.611 -2.271 1.821 510 HG22 THR 63 HG22 THR 63 -5.656 -3.575 2.399 511 HG23 THR 63 HG23 THR 63 -5.307 -2.203 3.446 512 H LEU 64 HN LEU 64 -7.307 0.485 0.224 513 HA LEU 64 HA LEU 64 -4.782 1.404 -0.462 514 HB2 LEU 64 HB2 LEU 64 -7.474 2.340 -1.404 515 HB3 LEU 64 HB1 LEU 64 -5.967 2.806 -2.153 516 HG LEU 64 HG LEU 64 -7.028 -0.012 -1.975 517 HD11 LEU 64 HD11 LEU 64 -7.946 1.965 -3.565 518 HD12 LEU 64 HD12 LEU 64 -7.938 0.259 -4.010 519 HD13 LEU 64 HD13 LEU 64 -6.643 1.322 -4.558 520 HD21 LEU 64 HD21 LEU 64 -4.582 1.186 -3.256 521 HD22 LEU 64 HD22 LEU 64 -5.197 -0.428 -3.624 522 HD23 LEU 64 HD23 LEU 64 -4.639 -0.050 -1.995 523 H ARG 65 HN ARG 65 -7.492 3.240 0.933 524 HA ARG 65 HA ARG 65 -6.136 5.708 0.934 525 HB2 ARG 65 HB2 ARG 65 -8.455 4.711 2.566 526 HB3 ARG 65 HB1 ARG 65 -7.849 6.360 2.654 527 HG2 ARG 65 HG2 ARG 65 -8.935 5.020 0.184 528 HG3 ARG 65 HG1 ARG 65 -9.798 6.180 1.191 529 HD2 ARG 65 HD2 ARG 65 -8.097 7.875 0.672 530 HD3 ARG 65 HD1 ARG 65 -7.263 6.714 -0.354 531 HE ARG 65 HE ARG 65 -9.946 6.964 -1.186 532 HH11 ARG 65 HH11 ARG 65 -6.928 8.749 -1.175 533 HH12 ARG 65 HH12 ARG 65 -7.271 9.600 -2.649 534 HH21 ARG 65 HH21 ARG 65 -10.411 8.133 -3.126 535 HH22 ARG 65 HH22 ARG 65 -9.238 9.250 -3.746 536 H GLU 66 HN GLU 66 -6.163 3.012 3.213 537 HA GLU 66 HA GLU 66 -4.743 4.496 5.204 538 HB2 GLU 66 HB2 GLU 66 -6.059 2.634 5.946 539 HB3 GLU 66 HB1 GLU 66 -5.190 1.528 4.881 540 HG2 GLU 66 HG2 GLU 66 -3.265 1.605 6.159 541 HG3 GLU 66 HG1 GLU 66 -3.734 3.101 6.965 542 H LEU 67 HN LEU 67 -3.776 1.982 2.847 543 HA LEU 67 HA LEU 67 -1.067 1.860 3.295 544 HB2 LEU 67 HB2 LEU 67 -2.186 2.070 0.485 545 HB3 LEU 67 HB1 LEU 67 -0.812 1.125 1.050 546 HG LEU 67 HG LEU 67 -3.666 0.536 1.809 547 HD11 LEU 67 HD11 LEU 67 -2.074 -1.186 0.010 548 HD12 LEU 67 HD12 LEU 67 -2.800 0.269 -0.673 549 HD13 LEU 67 HD13 LEU 67 -3.818 -0.950 0.095 550 HD21 LEU 67 HD21 LEU 67 -1.349 -0.213 3.041 551 HD22 LEU 67 HD22 LEU 67 -1.637 -1.547 1.935 552 HD23 LEU 67 HD23 LEU 67 -2.871 -1.095 3.110 553 H GLU 68 HN GLU 68 -2.736 4.196 1.175 554 HA GLU 68 HA GLU 68 -0.522 5.739 0.465 555 HB2 GLU 68 HB2 GLU 68 -2.735 5.882 -0.622 556 HB3 GLU 68 HB1 GLU 68 -3.386 6.649 0.820 557 HG2 GLU 68 HG2 GLU 68 -1.699 8.469 0.491 558 HG3 GLU 68 HG1 GLU 68 -1.331 7.741 -1.075 559 H ARG 69 HN ARG 69 -2.969 6.526 2.962 560 HA ARG 69 HA ARG 69 -1.636 8.780 3.987 561 HB2 ARG 69 HB2 ARG 69 -3.790 6.981 4.924 562 HB3 ARG 69 HB1 ARG 69 -3.085 8.085 6.091 563 HG2 ARG 69 HG2 ARG 69 -3.929 9.204 3.482 564 HG3 ARG 69 HG1 ARG 69 -5.194 8.716 4.613 565 HD2 ARG 69 HD2 ARG 69 -4.678 11.041 4.954 566 HD3 ARG 69 HD1 ARG 69 -4.131 10.109 6.345 567 HE ARG 69 HE ARG 69 -1.862 10.231 5.149 568 HH11 ARG 69 HH11 ARG 69 -4.294 12.753 5.048 569 HH12 ARG 69 HH12 ARG 69 -3.140 14.028 4.825 570 HH21 ARG 69 HH21 ARG 69 -0.349 11.907 4.887 571 HH22 ARG 69 HH22 ARG 69 -0.894 13.549 4.753 572 H TYR 70 HN TYR 70 -1.113 5.422 4.513 573 HA TYR 70 HA TYR 70 0.344 5.726 6.953 574 HB2 TYR 70 HB2 TYR 70 -0.520 3.544 6.553 575 HB3 TYR 70 HB1 TYR 70 0.162 3.503 4.932 576 HD1 TYR 70 HD2 TYR 70 1.398 4.059 8.420 577 HD2 TYR 70 HD1 TYR 70 1.977 2.217 4.640 578 HE1 TYR 70 HE2 TYR 70 3.485 3.058 9.249 579 HE2 TYR 70 HE1 TYR 70 4.049 1.200 5.445 580 HH TYR 70 HH TYR 70 4.970 1.223 8.764 581 H VAL 71 HN VAL 71 1.268 5.218 3.537 582 HA VAL 71 HA VAL 71 4.036 5.367 4.000 583 HB VAL 71 HB VAL 71 4.364 5.683 1.678 584 HG11 VAL 71 HG11 VAL 71 2.674 4.138 0.611 585 HG12 VAL 71 HG12 VAL 71 1.953 3.999 2.218 586 HG13 VAL 71 HG13 VAL 71 3.624 3.499 1.948 587 HG21 VAL 71 HG21 VAL 71 2.727 6.416 0.136 588 HG22 VAL 71 HG22 VAL 71 2.891 7.611 1.417 589 HG23 VAL 71 HG23 VAL 71 1.504 6.519 1.395 590 H THR 72 HN THR 72 1.557 7.816 3.569 591 HA THR 72 HA THR 72 3.279 9.929 2.934 592 HB THR 72 HB THR 72 1.445 11.450 3.563 593 HG1 THR 72 HG1 THR 72 0.667 9.994 5.319 594 HG21 THR 72 HG21 THR 72 1.014 9.055 1.855 595 HG22 THR 72 HG22 THR 72 1.296 10.731 1.373 596 HG23 THR 72 HG23 THR 72 -0.276 10.248 2.020 597 H SER 73 HN SER 73 2.353 8.499 5.962 598 HA SER 73 HA SER 73 3.321 10.554 7.652 599 HB2 SER 73 HB2 SER 73 3.050 9.004 9.424 600 HB3 SER 73 HB1 SER 73 1.805 8.581 8.243 601 HG SER 73 HG SER 73 3.053 6.864 7.556 602 H CYS 74 HN CYS 74 4.831 8.098 5.781 603 HA CYS 74 HA CYS 74 7.425 8.467 7.114 604 HB2 CYS 74 HB2 CYS 74 6.813 6.156 6.811 605 HB3 CYS 74 HB1 CYS 74 6.482 6.424 5.101 606 HG CYS 74 HG CYS 74 9.377 7.281 4.944 607 H LEU 75 HN LEU 75 5.723 9.229 4.207 608 HA LEU 75 HA LEU 75 8.188 9.912 2.791 609 HB2 LEU 75 HB2 LEU 75 5.363 9.760 1.762 610 HB3 LEU 75 HB1 LEU 75 6.805 9.908 0.801 611 HG LEU 75 HG LEU 75 5.882 7.524 2.360 612 HD11 LEU 75 HD11 LEU 75 5.024 8.057 0.035 613 HD12 LEU 75 HD12 LEU 75 5.753 6.468 0.269 614 HD13 LEU 75 HD13 LEU 75 6.667 7.748 -0.523 615 HD21 LEU 75 HD21 LEU 75 7.948 6.425 1.811 616 HD22 LEU 75 HD22 LEU 75 8.316 7.900 2.699 617 HD23 LEU 75 HD23 LEU 75 8.528 7.848 0.949 618 H ARG 76 HN ARG 76 4.963 11.296 3.390 619 HA ARG 76 HA ARG 76 5.919 13.895 2.516 620 HB2 ARG 76 HB2 ARG 76 3.150 13.020 3.292 621 HB3 ARG 76 HB1 ARG 76 3.580 14.573 2.578 622 HG2 ARG 76 HG2 ARG 76 4.423 13.380 0.592 623 HG3 ARG 76 HG1 ARG 76 3.888 11.872 1.328 624 HD2 ARG 76 HD2 ARG 76 1.618 12.838 1.441 625 HD3 ARG 76 HD1 ARG 76 2.188 14.175 0.447 626 HE ARG 76 HE ARG 76 2.901 11.947 -0.955 627 HH11 ARG 76 HH11 ARG 76 -0.119 13.188 0.298 628 HH12 ARG 76 HH12 ARG 76 -1.093 12.360 -0.875 629 HH21 ARG 76 HH21 ARG 76 1.637 10.835 -2.480 630 HH22 ARG 76 HH22 ARG 76 -0.089 11.000 -2.458 631 H LYS 77 HN LYS 77 6.266 12.285 5.140 632 HA LYS 77 HA LYS 77 6.475 14.619 6.842 633 HB2 LYS 77 HB2 LYS 77 4.215 13.639 7.346 634 HB3 LYS 77 HB1 LYS 77 5.001 12.108 7.707 635 HG2 LYS 77 HG2 LYS 77 6.239 13.214 9.536 636 HG3 LYS 77 HG1 LYS 77 5.341 14.696 9.203 637 HD2 LYS 77 HD2 LYS 77 3.248 13.571 9.711 638 HD3 LYS 77 HD1 LYS 77 4.104 12.051 9.967 639 HE2 LYS 77 HE2 LYS 77 5.344 13.099 11.826 640 HE3 LYS 77 HE1 LYS 77 4.411 14.576 11.590 641 HZ1 LYS 77 HZ1 LYS 77 3.501 13.231 13.374 642 HZ2 LYS 77 HZ2 LYS 77 3.293 11.925 12.323 643 HZ3 LYS 77 HZ3 LYS 77 2.398 13.342 12.098 644 H LYS 78 HN LYS 78 7.939 14.109 8.671 645 HA LYS 78 HA LYS 78 9.762 13.114 9.651 646 HB2 LYS 78 HB2 LYS 78 8.317 11.016 9.483 647 HB3 LYS 78 HB1 LYS 78 9.194 10.639 8.014 648 HG2 LYS 78 HG2 LYS 78 10.263 9.397 9.664 649 HG3 LYS 78 HG1 LYS 78 11.303 10.803 9.440 650 HD2 LYS 78 HD2 LYS 78 11.087 10.421 11.791 651 HD3 LYS 78 HD1 LYS 78 10.157 11.863 11.391 652 HE2 LYS 78 HE2 LYS 78 8.098 10.545 11.387 653 HE3 LYS 78 HE1 LYS 78 9.023 9.092 11.759 654 HZ1 LYS 78 HZ1 LYS 78 8.727 11.485 13.489 655 HZ2 LYS 78 HZ2 LYS 78 9.721 10.167 13.841 656 HZ3 LYS 78 HZ3 LYS 78 8.046 9.960 13.757 657 H ARG 79 HN ARG 79 11.860 13.497 9.132 658 HA ARG 79 HA ARG 79 12.504 13.415 6.274 659 HB2 ARG 79 HB2 ARG 79 14.453 14.893 6.859 660 HB3 ARG 79 HB1 ARG 79 12.866 15.615 7.029 661 HG2 ARG 79 HG2 ARG 79 14.204 14.408 9.402 662 HG3 ARG 79 HG1 ARG 79 14.684 16.007 8.834 663 HD2 ARG 79 HD2 ARG 79 11.906 15.153 9.639 664 HD3 ARG 79 HD1 ARG 79 12.992 16.178 10.573 665 HE ARG 79 HE ARG 79 12.258 17.110 7.911 666 HH11 ARG 79 HH11 ARG 79 11.792 17.309 11.369 667 HH12 ARG 79 HH12 ARG 79 10.953 18.822 11.303 668 HH21 ARG 79 HH21 ARG 79 11.146 19.108 7.815 669 HH22 ARG 79 HH22 ARG 79 10.583 19.846 9.280 670 H LYS 80 HN LYS 80 12.497 11.137 8.073 671 HA LYS 80 HA LYS 80 14.777 9.956 6.891 672 HB2 LYS 80 HB2 LYS 80 15.920 9.114 8.867 673 HB3 LYS 80 HB1 LYS 80 15.929 10.865 8.848 674 HG2 LYS 80 HG2 LYS 80 13.896 9.352 10.443 675 HG3 LYS 80 HG1 LYS 80 15.519 9.639 11.065 676 HD2 LYS 80 HD2 LYS 80 15.147 12.079 10.668 677 HD3 LYS 80 HD1 LYS 80 13.470 11.700 10.268 678 HE2 LYS 80 HE2 LYS 80 13.644 12.405 12.585 679 HE3 LYS 80 HE1 LYS 80 13.176 10.708 12.494 680 HZ1 LYS 80 HZ1 LYS 80 15.517 10.122 12.903 681 HZ2 LYS 80 HZ2 LYS 80 14.838 10.996 14.178 682 HZ3 LYS 80 HZ3 LYS 80 15.887 11.763 13.095 683 HA PRO 81 HA PRO 81 11.384 6.986 7.243 684 HB2 PRO 81 HB2 PRO 81 11.947 5.628 4.995 685 HB3 PRO 81 HB1 PRO 81 11.179 7.220 4.946 686 HG2 PRO 81 HG2 PRO 81 14.056 6.493 4.547 687 HG3 PRO 81 HG1 PRO 81 13.041 7.593 3.593 688 HD2 PRO 81 HD2 PRO 81 14.783 8.457 5.487 689 HD3 PRO 81 HD1 PRO 81 13.277 9.318 5.101 690 H GLN 82 HN GLN 82 14.530 6.727 7.954 691 HA GLN 82 HA GLN 82 14.354 3.825 8.403 692 HB2 GLN 82 HB2 GLN 82 16.827 5.490 7.878 693 HB3 GLN 82 HB1 GLN 82 16.843 3.794 8.336 694 HG2 GLN 82 HG2 GLN 82 15.509 4.843 5.854 695 HG3 GLN 82 HG1 GLN 82 17.161 4.237 5.901 696 HE21 GLN 82 HE21 GLN 82 16.705 2.587 4.458 697 HE22 GLN 82 HE22 GLN 82 15.775 1.199 4.902 698 H ALA 83 HN ALA 83 15.306 3.071 10.382 699 HA ALA 83 HA ALA 83 14.714 4.786 12.581 700 HB1 ALA 83 HB1 ALA 83 16.020 2.069 12.588 701 HB2 ALA 83 HB2 ALA 83 14.285 2.371 12.645 702 HB3 ALA 83 HB3 ALA 83 15.315 2.893 13.977 703 H1 VAL 201 HT1 VAL 201 -5.535 0.772 -14.832 704 H2 VAL 201 HT2 VAL 201 -5.944 0.196 -16.363 705 H3 VAL 201 HT3 VAL 201 -4.606 1.210 -16.174 706 HA VAL 201 HA VAL 201 -4.877 -1.511 -15.045 707 HB VAL 201 HB VAL 201 -3.040 -0.583 -17.259 708 HG11 VAL 201 HG11 VAL 201 -3.652 -3.334 -16.182 709 HG12 VAL 201 HG12 VAL 201 -2.158 -2.427 -15.940 710 HG13 VAL 201 HG13 VAL 201 -2.603 -2.978 -17.555 711 HG21 VAL 201 HG21 VAL 201 -4.443 -1.892 -18.782 712 HG22 VAL 201 HG22 VAL 201 -5.344 -0.564 -18.052 713 HG23 VAL 201 HG23 VAL 201 -5.571 -2.211 -17.466 714 H VAL 202 HN VAL 202 -4.190 -0.865 -12.997 715 HA VAL 202 HA VAL 202 -1.545 0.341 -12.764 716 HB VAL 202 HB VAL 202 -3.458 -0.580 -10.603 717 HG11 VAL 202 HG11 VAL 202 -2.004 0.697 -9.077 718 HG12 VAL 202 HG12 VAL 202 -0.884 0.987 -10.407 719 HG13 VAL 202 HG13 VAL 202 -1.157 -0.655 -9.826 720 HG21 VAL 202 HG21 VAL 202 -2.802 2.203 -11.569 721 HG22 VAL 202 HG22 VAL 202 -3.888 1.795 -10.241 722 HG23 VAL 202 HG23 VAL 202 -4.301 1.331 -11.891 723 HA PRO 203 HA PRO 203 0.294 -3.719 -13.111 724 HB2 PRO 203 HB2 PRO 203 2.557 -2.270 -11.842 725 HB3 PRO 203 HB1 PRO 203 2.532 -3.252 -13.308 726 HG2 PRO 203 HG2 PRO 203 2.651 -0.588 -13.429 727 HG3 PRO 203 HG1 PRO 203 1.717 -1.524 -14.610 728 HD2 PRO 203 HD2 PRO 203 0.771 0.106 -12.305 729 HD3 PRO 203 HD1 PRO 203 0.017 -0.165 -13.890 730 H LYS 204 HN LYS 204 0.283 -5.386 -11.751 731 HA LYS 204 HA LYS 204 -0.346 -5.147 -9.020 732 HB2 LYS 204 HB2 LYS 204 0.865 -7.492 -10.503 733 HB3 LYS 204 HB1 LYS 204 0.153 -7.568 -8.899 734 HG2 LYS 204 HG2 LYS 204 -2.014 -6.868 -9.881 735 HG3 LYS 204 HG1 LYS 204 -1.265 -6.949 -11.482 736 HD2 LYS 204 HD2 LYS 204 -0.862 -9.295 -11.248 737 HD3 LYS 204 HD1 LYS 204 -1.360 -9.266 -9.557 738 HE2 LYS 204 HE2 LYS 204 -3.100 -10.200 -11.016 739 HE3 LYS 204 HE1 LYS 204 -3.632 -8.729 -10.204 740 HZ1 LYS 204 HZ1 LYS 204 -2.656 -8.886 -13.001 741 HZ2 LYS 204 HZ2 LYS 204 -3.201 -7.490 -12.221 742 HZ3 LYS 204 HZ3 LYS 204 -4.275 -8.755 -12.535 743 H LYS 205 HN LYS 205 0.943 -4.469 -7.434 744 HA LYS 205 HA LYS 205 3.768 -4.252 -7.877 745 HB2 LYS 205 HB2 LYS 205 2.641 -2.449 -6.727 746 HB3 LYS 205 HB1 LYS 205 2.066 -3.550 -5.484 747 HG2 LYS 205 HG2 LYS 205 3.937 -2.223 -4.685 748 HG3 LYS 205 HG1 LYS 205 4.356 -3.936 -4.750 749 HD2 LYS 205 HD2 LYS 205 5.440 -3.511 -6.960 750 HD3 LYS 205 HD1 LYS 205 5.149 -1.790 -6.714 751 HE2 LYS 205 HE2 LYS 205 6.467 -1.889 -4.638 752 HE3 LYS 205 HE1 LYS 205 6.794 -3.593 -4.946 753 HZ1 LYS 205 HZ1 LYS 205 7.625 -1.313 -6.657 754 HZ2 LYS 205 HZ2 LYS 205 7.894 -2.944 -7.018 755 HZ3 LYS 205 HZ3 LYS 205 8.637 -2.246 -5.671 756 H LYS 206 HN LYS 206 4.799 -6.115 -7.876 757 HA LYS 206 HA LYS 206 4.326 -8.197 -5.961 758 HB2 LYS 206 HB2 LYS 206 5.113 -8.610 -8.280 759 HB3 LYS 206 HB1 LYS 206 6.620 -7.795 -7.896 760 HG2 LYS 206 HG2 LYS 206 7.204 -9.503 -6.313 761 HG3 LYS 206 HG1 LYS 206 5.633 -10.279 -6.518 762 HD2 LYS 206 HD2 LYS 206 7.713 -9.947 -8.678 763 HD3 LYS 206 HD1 LYS 206 7.410 -11.430 -7.773 764 HE2 LYS 206 HE2 LYS 206 5.434 -10.015 -9.563 765 HE3 LYS 206 HE1 LYS 206 6.331 -11.474 -9.968 766 HZ1 LYS 206 HZ1 LYS 206 4.321 -11.208 -7.786 767 HZ2 LYS 206 HZ2 LYS 206 5.214 -12.608 -8.134 768 HZ3 LYS 206 HZ3 LYS 206 4.104 -12.017 -9.260 769 H ILE 207 HN ILE 207 5.073 -8.203 -3.941 770 HA ILE 207 HA ILE 207 7.297 -6.382 -3.276 771 HB ILE 207 HB ILE 207 5.132 -7.476 -1.478 772 HG12 ILE 207 HG12 ILE 207 4.472 -5.738 -3.224 773 HG13 ILE 207 HG11 ILE 207 4.090 -5.373 -1.549 774 HG21 ILE 207 HG21 ILE 207 6.023 -5.699 0.101 775 HG22 ILE 207 HG22 ILE 207 7.443 -5.633 -0.946 776 HG23 ILE 207 HG23 ILE 207 7.023 -7.135 -0.125 777 HD11 ILE 207 HD11 ILE 207 5.871 -3.815 -1.401 778 HD12 ILE 207 HD12 ILE 207 4.982 -3.463 -2.880 779 HD13 ILE 207 HD13 ILE 207 6.521 -4.319 -2.958 780 H LYS 208 HN LYS 208 9.116 -7.552 -3.290 781 HA LYS 208 HA LYS 208 9.484 -9.403 -1.147 782 HB2 LYS 208 HB2 LYS 208 10.532 -11.096 -2.942 783 HB3 LYS 208 HB1 LYS 208 8.885 -11.225 -2.347 784 HG2 LYS 208 HG2 LYS 208 8.243 -9.774 -4.347 785 HG3 LYS 208 HG1 LYS 208 9.845 -10.159 -4.975 786 HD2 LYS 208 HD2 LYS 208 8.118 -11.674 -5.847 787 HD3 LYS 208 HD1 LYS 208 9.330 -12.530 -4.896 788 HE2 LYS 208 HE2 LYS 208 6.963 -13.230 -4.470 789 HE3 LYS 208 HE1 LYS 208 7.852 -12.726 -3.040 790 HZ1 LYS 208 HZ1 LYS 208 5.624 -11.815 -3.044 791 HZ2 LYS 208 HZ2 LYS 208 5.879 -11.069 -4.539 792 HZ3 LYS 208 HZ3 LYS 208 6.754 -10.563 -3.176 793 H LYS 209 HN LYS 209 10.618 -7.277 -1.015 794 HA LYS 209 HA LYS 209 12.594 -6.309 -0.563 795 HB2 LYS 209 HB2 LYS 209 13.819 -8.829 -1.678 796 HB3 LYS 209 HB1 LYS 209 14.690 -7.576 -0.806 797 HG2 LYS 209 HG2 LYS 209 13.195 -8.007 1.148 798 HG3 LYS 209 HG1 LYS 209 12.535 -9.381 0.263 799 HD2 LYS 209 HD2 LYS 209 15.410 -8.994 1.089 800 HD3 LYS 209 HD1 LYS 209 14.259 -10.120 1.805 801 HE2 LYS 209 HE2 LYS 209 14.097 -11.301 -0.338 802 HE3 LYS 209 HE1 LYS 209 15.267 -10.181 -1.036 803 HZ1 LYS 209 HZ1 LYS 209 16.362 -12.200 -0.385 804 HZ2 LYS 209 HZ2 LYS 209 15.760 -12.083 1.189 805 HZ3 LYS 209 HZ3 LYS 209 16.883 -10.948 0.627 806 H GLU 210 HN GLU 210 11.285 -5.980 -3.238 807 HA GLU 210 HA GLU 210 13.393 -5.377 -5.058 808 HB2 GLU 210 HB2 GLU 210 10.604 -4.230 -4.831 809 HB3 GLU 210 HB1 GLU 210 11.719 -3.831 -6.127 810 HG2 GLU 210 HG2 GLU 210 10.244 -5.454 -6.973 811 HG3 GLU 210 HG1 GLU 210 11.778 -6.271 -6.692 812 H GLN 211 HN GLN 211 11.758 -3.628 -2.511 813 HA GLN 211 HA GLN 211 13.144 -1.161 -3.045 814 HB2 GLN 211 HB2 GLN 211 11.198 -2.053 -0.937 815 HB3 GLN 211 HB1 GLN 211 12.050 -0.526 -0.790 816 HG2 GLN 211 HG2 GLN 211 9.993 0.016 -1.743 817 HG3 GLN 211 HG1 GLN 211 11.133 0.046 -3.082 818 HE21 GLN 211 HE21 GLN 211 8.463 -1.602 -1.625 819 HE22 GLN 211 HE22 GLN 211 8.071 -2.605 -2.976 820 H VAL 212 HN VAL 212 14.807 -3.434 -2.522 821 HA VAL 212 HA VAL 212 16.004 -2.898 0.081 822 HB VAL 212 HB VAL 212 15.810 -5.237 -0.851 823 HG11 VAL 212 HG11 VAL 212 17.461 -5.960 -2.509 824 HG12 VAL 212 HG12 VAL 212 17.983 -4.288 -2.712 825 HG13 VAL 212 HG13 VAL 212 16.348 -4.763 -3.172 826 HG21 VAL 212 HG21 VAL 212 18.593 -4.280 -0.209 827 HG22 VAL 212 HG22 VAL 212 18.029 -5.947 -0.116 828 HG23 VAL 212 HG23 VAL 212 17.352 -4.726 0.961 829 H GLU 213 HN GLU 213 16.107 -1.730 -3.029 830 HA GLU 213 HA GLU 213 18.501 -0.196 -2.514 831 HB2 GLU 213 HB2 GLU 213 19.341 -2.251 -3.608 832 HB3 GLU 213 HB1 GLU 213 18.267 -1.953 -4.966 833 HG2 GLU 213 HG2 GLU 213 19.466 -0.010 -5.600 834 HG3 GLU 213 HG1 GLU 213 20.404 -0.030 -4.106 Start of MODEL 7 1 H1 SER 1 HT1 SER 1 -25.280 4.153 9.054 2 H2 SER 1 HT2 SER 1 -24.550 5.639 8.695 3 H3 SER 1 HT3 SER 1 -23.637 4.385 9.378 4 HA SER 1 HA SER 1 -23.835 3.065 7.428 5 HB2 SER 1 HB2 SER 1 -25.446 5.354 6.285 6 HB3 SER 1 HB1 SER 1 -25.075 3.824 5.486 7 HG SER 1 HG SER 1 -26.517 2.802 6.712 8 H GLU 2 HN GLU 2 -22.443 5.587 8.596 9 HA GLU 2 HA GLU 2 -21.248 6.651 6.159 10 HB2 GLU 2 HB2 GLU 2 -21.362 7.615 9.005 11 HB3 GLU 2 HB1 GLU 2 -20.281 8.335 7.827 12 HG2 GLU 2 HG2 GLU 2 -22.328 9.620 8.029 13 HG3 GLU 2 HG1 GLU 2 -22.178 8.917 6.417 14 H GLU 3 HN GLU 3 -20.607 4.119 8.047 15 HA GLU 3 HA GLU 3 -17.859 4.626 8.689 16 HB2 GLU 3 HB2 GLU 3 -19.351 1.994 8.652 17 HB3 GLU 3 HB1 GLU 3 -17.773 2.272 9.375 18 HG2 GLU 3 HG2 GLU 3 -20.420 3.385 10.256 19 HG3 GLU 3 HG1 GLU 3 -19.376 2.260 11.122 20 H GLU 4 HN GLU 4 -19.527 2.618 6.257 21 HA GLU 4 HA GLU 4 -17.094 1.815 5.007 22 HB2 GLU 4 HB2 GLU 4 -19.170 0.500 4.790 23 HB3 GLU 4 HB1 GLU 4 -19.905 1.808 3.875 24 HG2 GLU 4 HG2 GLU 4 -18.038 1.540 2.209 25 HG3 GLU 4 HG1 GLU 4 -17.592 0.069 3.069 26 H ASP 5 HN ASP 5 -19.228 4.554 4.670 27 HA ASP 5 HA ASP 5 -17.951 5.329 2.162 28 HB2 ASP 5 HB2 ASP 5 -20.477 5.379 2.464 29 HB3 ASP 5 HB1 ASP 5 -20.227 6.756 3.524 30 H LYS 6 HN LYS 6 -17.162 5.567 5.231 31 HA LYS 6 HA LYS 6 -16.428 8.309 5.529 32 HB2 LYS 6 HB2 LYS 6 -16.269 5.922 7.067 33 HB3 LYS 6 HB1 LYS 6 -14.623 6.521 6.918 34 HG2 LYS 6 HG2 LYS 6 -16.983 8.063 7.984 35 HG3 LYS 6 HG1 LYS 6 -15.698 7.328 8.942 36 HD2 LYS 6 HD2 LYS 6 -14.072 8.787 7.717 37 HD3 LYS 6 HD1 LYS 6 -15.455 9.607 6.988 38 HE2 LYS 6 HE2 LYS 6 -14.795 9.427 9.924 39 HE3 LYS 6 HE1 LYS 6 -14.699 10.862 8.906 40 HZ1 LYS 6 HZ1 LYS 6 -17.082 10.789 8.618 41 HZ2 LYS 6 HZ2 LYS 6 -16.704 10.836 10.263 42 HZ3 LYS 6 HZ3 LYS 6 -17.191 9.385 9.551 43 H CYS 7 HN CYS 7 -15.052 5.485 4.083 44 HA CYS 7 HA CYS 7 -12.436 6.610 3.666 45 HB2 CYS 7 HB2 CYS 7 -13.706 4.068 2.623 46 HB3 CYS 7 HB1 CYS 7 -11.993 4.479 2.518 47 HG CYS 7 HG CYS 7 -12.316 4.787 5.579 48 H LYS 8 HN LYS 8 -11.613 7.397 1.762 49 HA LYS 8 HA LYS 8 -13.602 8.237 -0.204 50 HB2 LYS 8 HB2 LYS 8 -10.757 9.031 0.351 51 HB3 LYS 8 HB1 LYS 8 -11.499 9.410 -1.194 52 HG2 LYS 8 HG2 LYS 8 -11.626 11.292 0.302 53 HG3 LYS 8 HG1 LYS 8 -13.231 10.676 -0.084 54 HD2 LYS 8 HD2 LYS 8 -13.264 9.485 2.077 55 HD3 LYS 8 HD1 LYS 8 -11.669 10.140 2.445 56 HE2 LYS 8 HE2 LYS 8 -12.553 12.393 2.402 57 HE3 LYS 8 HE1 LYS 8 -14.140 11.784 1.931 58 HZ1 LYS 8 HZ1 LYS 8 -14.054 12.253 4.292 59 HZ2 LYS 8 HZ2 LYS 8 -12.748 11.195 4.484 60 HZ3 LYS 8 HZ3 LYS 8 -14.263 10.594 4.031 61 HA PRO 9 HA PRO 9 -12.667 5.091 -3.077 62 HB2 PRO 9 HB2 PRO 9 -13.646 6.311 -5.307 63 HB3 PRO 9 HB1 PRO 9 -14.670 5.563 -4.079 64 HG2 PRO 9 HG2 PRO 9 -14.012 8.441 -4.508 65 HG3 PRO 9 HG1 PRO 9 -15.546 7.700 -4.014 66 HD2 PRO 9 HD2 PRO 9 -13.827 8.921 -2.269 67 HD3 PRO 9 HD1 PRO 9 -14.920 7.610 -1.793 68 H MET 10 HN MET 10 -10.735 4.631 -3.970 69 HA MET 10 HA MET 10 -9.025 6.860 -4.736 70 HB2 MET 10 HB2 MET 10 -8.188 5.086 -3.179 71 HB3 MET 10 HB1 MET 10 -8.292 3.941 -4.515 72 HG2 MET 10 HG2 MET 10 -6.113 4.510 -4.715 73 HG3 MET 10 HG1 MET 10 -6.822 5.789 -5.706 74 HE1 MET 10 HE1 MET 10 -5.541 4.720 -2.340 75 HE2 MET 10 HE2 MET 10 -6.853 5.672 -1.656 76 HE3 MET 10 HE3 MET 10 -5.181 6.205 -1.465 77 H SER 11 HN SER 11 -8.607 7.352 -6.823 78 HA SER 11 HA SER 11 -9.792 5.687 -8.881 79 HB2 SER 11 HB2 SER 11 -9.225 7.660 -10.347 80 HB3 SER 11 HB1 SER 11 -10.311 8.021 -9.009 81 HG SER 11 HG SER 11 -8.196 9.328 -9.532 82 H TYR 12 HN TYR 12 -8.375 5.912 -11.099 83 HA TYR 12 HA TYR 12 -6.330 4.027 -10.746 84 HB2 TYR 12 HB2 TYR 12 -7.006 3.795 -12.884 85 HB3 TYR 12 HB1 TYR 12 -7.558 5.463 -12.989 86 HD1 TYR 12 HD1 TYR 12 -4.384 3.481 -13.019 87 HD2 TYR 12 HD2 TYR 12 -6.463 6.892 -14.448 88 HE1 TYR 12 HE1 TYR 12 -2.502 3.983 -14.502 89 HE2 TYR 12 HE2 TYR 12 -4.581 7.411 -15.942 90 HH TYR 12 HH TYR 12 -2.046 5.200 -16.549 91 H GLU 13 HN GLU 13 -6.111 7.479 -11.532 92 HA GLU 13 HA GLU 13 -3.348 7.770 -11.710 93 HB2 GLU 13 HB2 GLU 13 -5.540 9.614 -10.737 94 HB3 GLU 13 HB1 GLU 13 -3.888 10.162 -10.959 95 HG2 GLU 13 HG2 GLU 13 -5.390 8.826 -13.184 96 HG3 GLU 13 HG1 GLU 13 -5.601 10.551 -12.854 97 H GLU 14 HN GLU 14 -5.433 7.503 -8.977 98 HA GLU 14 HA GLU 14 -3.534 8.472 -7.059 99 HB2 GLU 14 HB2 GLU 14 -6.301 7.371 -6.959 100 HB3 GLU 14 HB1 GLU 14 -5.402 7.718 -5.487 101 HG2 GLU 14 HG2 GLU 14 -5.720 9.797 -7.607 102 HG3 GLU 14 HG1 GLU 14 -7.004 9.490 -6.481 103 H LYS 15 HN LYS 15 -5.130 5.349 -7.741 104 HA LYS 15 HA LYS 15 -3.695 3.751 -5.976 105 HB2 LYS 15 HB2 LYS 15 -4.799 3.094 -8.702 106 HB3 LYS 15 HB1 LYS 15 -4.088 1.890 -7.635 107 HG2 LYS 15 HG2 LYS 15 -5.819 1.911 -6.192 108 HG3 LYS 15 HG1 LYS 15 -6.267 3.569 -6.569 109 HD2 LYS 15 HD2 LYS 15 -7.451 2.992 -8.415 110 HD3 LYS 15 HD1 LYS 15 -6.484 1.549 -8.727 111 HE2 LYS 15 HE2 LYS 15 -7.504 0.519 -6.731 112 HE3 LYS 15 HE1 LYS 15 -8.564 1.915 -6.573 113 HZ1 LYS 15 HZ1 LYS 15 -9.372 1.395 -8.854 114 HZ2 LYS 15 HZ2 LYS 15 -9.735 0.205 -7.713 115 HZ3 LYS 15 HZ3 LYS 15 -8.471 -0.041 -8.813 116 H ARG 16 HN ARG 16 -2.824 4.938 -9.191 117 HA ARG 16 HA ARG 16 -0.400 3.536 -9.505 118 HB2 ARG 16 HB2 ARG 16 -1.391 4.776 -11.360 119 HB3 ARG 16 HB1 ARG 16 -1.120 6.289 -10.507 120 HG2 ARG 16 HG2 ARG 16 1.316 5.709 -10.503 121 HG3 ARG 16 HG1 ARG 16 0.926 4.424 -11.626 122 HD2 ARG 16 HD2 ARG 16 1.706 6.388 -12.804 123 HD3 ARG 16 HD1 ARG 16 0.023 6.062 -13.162 124 HE ARG 16 HE ARG 16 0.844 8.118 -11.222 125 HH11 ARG 16 HH11 ARG 16 -1.047 7.090 -13.978 126 HH12 ARG 16 HH12 ARG 16 -1.961 8.567 -14.072 127 HH21 ARG 16 HH21 ARG 16 -0.335 10.077 -11.353 128 HH22 ARG 16 HH22 ARG 16 -1.541 10.274 -12.596 129 H GLN 17 HN GLN 17 -0.954 6.837 -8.287 130 HA GLN 17 HA GLN 17 1.646 7.401 -7.492 131 HB2 GLN 17 HB2 GLN 17 -0.186 9.063 -7.576 132 HB3 GLN 17 HB1 GLN 17 -0.910 8.316 -6.158 133 HG2 GLN 17 HG2 GLN 17 0.265 10.197 -5.373 134 HG3 GLN 17 HG1 GLN 17 1.246 8.795 -4.959 135 HE21 GLN 17 HE21 GLN 17 0.964 10.254 -8.131 136 HE22 GLN 17 HE22 GLN 17 2.611 10.770 -8.241 137 H LEU 18 HN LEU 18 -0.948 5.798 -5.802 138 HA LEU 18 HA LEU 18 0.193 5.420 -3.288 139 HB2 LEU 18 HB2 LEU 18 -2.168 4.880 -4.366 140 HB3 LEU 18 HB1 LEU 18 -1.458 3.303 -4.563 141 HG LEU 18 HG LEU 18 -2.080 4.739 -2.008 142 HD11 LEU 18 HD11 LEU 18 -3.262 2.479 -1.720 143 HD12 LEU 18 HD12 LEU 18 -3.070 2.333 -3.459 144 HD13 LEU 18 HD13 LEU 18 -3.974 3.685 -2.780 145 HD21 LEU 18 HD21 LEU 18 -0.156 3.759 -1.287 146 HD22 LEU 18 HD22 LEU 18 -0.208 2.491 -2.506 147 HD23 LEU 18 HD23 LEU 18 -1.259 2.399 -1.095 148 H SER 19 HN SER 19 0.194 3.253 -6.104 149 HA SER 19 HA SER 19 1.742 1.227 -4.967 150 HB2 SER 19 HB2 SER 19 1.796 0.285 -7.094 151 HB3 SER 19 HB1 SER 19 0.370 1.317 -7.177 152 HG SER 19 HG SER 19 1.765 2.949 -8.123 153 H LEU 20 HN LEU 20 2.601 4.303 -6.212 154 HA LEU 20 HA LEU 20 5.404 3.655 -6.513 155 HB2 LEU 20 HB2 LEU 20 3.870 6.203 -6.882 156 HB3 LEU 20 HB1 LEU 20 5.578 6.037 -7.211 157 HG LEU 20 HG LEU 20 3.290 4.756 -8.649 158 HD11 LEU 20 HD11 LEU 20 4.022 7.042 -9.239 159 HD12 LEU 20 HD12 LEU 20 4.139 5.884 -10.555 160 HD13 LEU 20 HD13 LEU 20 5.589 6.382 -9.681 161 HD21 LEU 20 HD21 LEU 20 4.912 3.022 -8.324 162 HD22 LEU 20 HD22 LEU 20 6.214 4.082 -8.861 163 HD23 LEU 20 HD23 LEU 20 4.971 3.561 -10.001 164 H ASP 21 HN ASP 21 3.294 5.370 -4.270 165 HA ASP 21 HA ASP 21 5.462 6.338 -2.639 166 HB2 ASP 21 HB2 ASP 21 3.770 7.038 -1.059 167 HB3 ASP 21 HB1 ASP 21 3.380 7.555 -2.675 168 H ILE 22 HN ILE 22 3.485 3.455 -2.707 169 HA ILE 22 HA ILE 22 4.424 2.305 -0.314 170 HB ILE 22 HB ILE 22 3.091 1.376 -2.759 171 HG12 ILE 22 HG12 ILE 22 2.746 0.555 0.109 172 HG13 ILE 22 HG11 ILE 22 2.040 2.021 -0.566 173 HG21 ILE 22 HG21 ILE 22 4.527 -0.659 -1.084 174 HG22 ILE 22 HG22 ILE 22 4.971 -0.194 -2.719 175 HG23 ILE 22 HG23 ILE 22 3.423 -0.977 -2.414 176 HD11 ILE 22 HD11 ILE 22 1.485 -0.783 -1.517 177 HD12 ILE 22 HD12 ILE 22 0.737 0.697 -2.116 178 HD13 ILE 22 HD13 ILE 22 0.445 0.172 -0.460 179 H ASN 23 HN ASN 23 5.707 2.335 -3.597 180 HA ASN 23 HA ASN 23 7.914 0.643 -3.052 181 HB2 ASN 23 HB2 ASN 23 7.288 2.587 -5.242 182 HB3 ASN 23 HB1 ASN 23 8.881 1.846 -5.146 183 HD21 ASN 23 HD21 ASN 23 7.877 -0.664 -4.074 184 HD22 ASN 23 HD22 ASN 23 7.116 -1.474 -5.398 185 H LYS 24 HN LYS 24 7.300 3.925 -2.332 186 HA LYS 24 HA LYS 24 10.023 4.758 -2.041 187 HB2 LYS 24 HB2 LYS 24 7.365 5.849 -1.278 188 HB3 LYS 24 HB1 LYS 24 8.797 6.525 -0.522 189 HG2 LYS 24 HG2 LYS 24 9.675 7.140 -2.701 190 HG3 LYS 24 HG1 LYS 24 8.277 6.404 -3.488 191 HD2 LYS 24 HD2 LYS 24 6.789 8.000 -2.516 192 HD3 LYS 24 HD1 LYS 24 8.053 8.638 -1.469 193 HE2 LYS 24 HE2 LYS 24 7.637 10.152 -3.312 194 HE3 LYS 24 HE1 LYS 24 9.251 9.463 -3.462 195 HZ1 LYS 24 HZ1 LYS 24 6.839 8.585 -4.954 196 HZ2 LYS 24 HZ2 LYS 24 8.378 7.902 -5.095 197 HZ3 LYS 24 HZ3 LYS 24 8.116 9.499 -5.582 198 H LEU 25 HN LEU 25 7.780 2.988 -0.130 199 HA LEU 25 HA LEU 25 8.965 3.486 2.423 200 HB2 LEU 25 HB2 LEU 25 7.085 1.348 1.432 201 HB3 LEU 25 HB1 LEU 25 7.645 1.447 3.091 202 HG LEU 25 HG LEU 25 5.827 3.325 1.621 203 HD11 LEU 25 HD11 LEU 25 5.700 1.906 4.254 204 HD12 LEU 25 HD12 LEU 25 4.877 1.396 2.779 205 HD13 LEU 25 HD13 LEU 25 4.425 2.908 3.572 206 HD21 LEU 25 HD21 LEU 25 7.223 3.834 4.231 207 HD22 LEU 25 HD22 LEU 25 5.963 4.838 3.522 208 HD23 LEU 25 HD23 LEU 25 7.529 4.694 2.729 209 HA PRO 26 HA PRO 26 12.360 0.581 2.080 210 HB2 PRO 26 HB2 PRO 26 12.861 0.367 4.764 211 HB3 PRO 26 HB1 PRO 26 13.462 1.689 3.762 212 HG2 PRO 26 HG2 PRO 26 11.135 1.615 5.622 213 HG3 PRO 26 HG1 PRO 26 12.270 2.935 5.316 214 HD2 PRO 26 HD2 PRO 26 9.755 2.856 4.271 215 HD3 PRO 26 HD1 PRO 26 11.111 3.660 3.457 216 H GLY 27 HN GLY 27 12.747 -1.647 2.653 217 HA2 GLY 27 HA2 GLY 27 10.589 -3.294 2.386 218 HA3 GLY 27 HA1 GLY 27 12.106 -3.812 3.093 219 H GLU 28 HN GLU 28 12.133 -2.445 5.459 220 HA GLU 28 HA GLU 28 10.482 -4.044 7.067 221 HB2 GLU 28 HB2 GLU 28 11.189 -2.147 8.816 222 HB3 GLU 28 HB1 GLU 28 12.247 -3.456 8.329 223 HG2 GLU 28 HG2 GLU 28 12.252 -0.796 6.961 224 HG3 GLU 28 HG1 GLU 28 13.202 -1.119 8.400 225 H LYS 29 HN LYS 29 10.139 -0.629 6.117 226 HA LYS 29 HA LYS 29 7.825 -0.233 7.773 227 HB2 LYS 29 HB2 LYS 29 9.332 1.364 5.790 228 HB3 LYS 29 HB1 LYS 29 7.647 1.792 6.006 229 HG2 LYS 29 HG2 LYS 29 9.144 3.153 7.376 230 HG3 LYS 29 HG1 LYS 29 8.021 2.216 8.355 231 HD2 LYS 29 HD2 LYS 29 9.654 0.885 9.211 232 HD3 LYS 29 HD1 LYS 29 10.683 1.034 7.780 233 HE2 LYS 29 HE2 LYS 29 11.653 2.186 9.710 234 HE3 LYS 29 HE1 LYS 29 11.250 3.314 8.414 235 HZ1 LYS 29 HZ1 LYS 29 9.230 3.898 9.622 236 HZ2 LYS 29 HZ2 LYS 29 10.597 4.171 10.575 237 HZ3 LYS 29 HZ3 LYS 29 9.633 2.813 10.858 238 H LEU 30 HN LEU 30 8.431 -1.310 4.540 239 HA LEU 30 HA LEU 30 5.698 -0.901 3.735 240 HB2 LEU 30 HB2 LEU 30 6.710 -0.693 1.808 241 HB3 LEU 30 HB1 LEU 30 8.205 -1.356 2.430 242 HG LEU 30 HG LEU 30 5.973 -3.087 1.415 243 HD11 LEU 30 HD11 LEU 30 8.076 -1.598 -0.004 244 HD12 LEU 30 HD12 LEU 30 6.405 -1.863 -0.465 245 HD13 LEU 30 HD13 LEU 30 7.588 -3.163 -0.614 246 HD21 LEU 30 HD21 LEU 30 7.825 -4.055 2.853 247 HD22 LEU 30 HD22 LEU 30 8.925 -3.632 1.539 248 HD23 LEU 30 HD23 LEU 30 7.623 -4.784 1.261 249 H GLY 31 HN GLY 31 7.419 -3.355 5.350 250 HA2 GLY 31 HA2 GLY 31 5.717 -5.549 4.835 251 HA3 GLY 31 HA1 GLY 31 6.555 -5.256 6.349 252 H ARG 32 HN ARG 32 5.196 -2.551 6.521 253 HA ARG 32 HA ARG 32 2.897 -3.346 7.987 254 HB2 ARG 32 HB2 ARG 32 4.074 -1.261 8.494 255 HB3 ARG 32 HB1 ARG 32 3.593 -0.608 6.942 256 HG2 ARG 32 HG2 ARG 32 1.664 0.083 7.778 257 HG3 ARG 32 HG1 ARG 32 1.286 -1.535 8.376 258 HD2 ARG 32 HD2 ARG 32 3.057 0.462 9.765 259 HD3 ARG 32 HD1 ARG 32 1.364 0.158 10.174 260 HE ARG 32 HE ARG 32 2.005 -2.033 10.914 261 HH11 ARG 32 HH11 ARG 32 4.684 0.104 10.186 262 HH12 ARG 32 HH12 ARG 32 5.827 -0.795 11.127 263 HH21 ARG 32 HH21 ARG 32 3.512 -3.220 12.155 264 HH22 ARG 32 HH22 ARG 32 5.156 -2.674 12.257 265 H VAL 33 HN VAL 33 3.301 -1.944 4.728 266 HA VAL 33 HA VAL 33 0.537 -1.653 4.244 267 HB VAL 33 HB VAL 33 1.648 -2.237 1.742 268 HG11 VAL 33 HG11 VAL 33 1.106 0.318 3.211 269 HG12 VAL 33 HG12 VAL 33 0.054 -0.523 2.073 270 HG13 VAL 33 HG13 VAL 33 1.520 0.262 1.502 271 HG21 VAL 33 HG21 VAL 33 3.487 -0.356 3.176 272 HG22 VAL 33 HG22 VAL 33 3.658 -1.037 1.558 273 HG23 VAL 33 HG23 VAL 33 3.873 -2.065 2.976 274 H VAL 34 HN VAL 34 2.743 -4.277 3.355 275 HA VAL 34 HA VAL 34 0.922 -6.159 2.458 276 HB VAL 34 HB VAL 34 2.589 -7.658 2.625 277 HG11 VAL 34 HG11 VAL 34 3.885 -5.787 1.939 278 HG12 VAL 34 HG12 VAL 34 4.849 -6.788 3.025 279 HG13 VAL 34 HG13 VAL 34 4.127 -5.293 3.617 280 HG21 VAL 34 HG21 VAL 34 2.069 -8.188 4.950 281 HG22 VAL 34 HG22 VAL 34 3.152 -6.891 5.471 282 HG23 VAL 34 HG23 VAL 34 3.803 -8.288 4.615 283 H HIS 35 HN HIS 35 1.651 -5.263 5.826 284 HA HIS 35 HA HIS 35 0.028 -7.264 7.010 285 HB2 HIS 35 HB2 HIS 35 1.840 -6.187 8.250 286 HB3 HIS 35 HB1 HIS 35 1.016 -4.637 8.145 287 HD1 HIS 35 HD1 HIS 35 0.937 -7.909 9.966 288 HD2 HIS 35 HD2 HIS 35 -1.085 -4.276 9.957 289 HE1 HIS 35 HE1 HIS 35 -0.458 -7.904 12.055 290 HE2 HIS 35 HE2 HIS 35 -1.786 -5.769 11.948 291 H ILE 36 HN ILE 36 -0.521 -3.786 6.442 292 HA ILE 36 HA ILE 36 -3.139 -3.634 7.412 293 HB ILE 36 HB ILE 36 -1.903 -2.130 5.088 294 HG12 ILE 36 HG12 ILE 36 -2.267 -1.225 7.942 295 HG13 ILE 36 HG11 ILE 36 -0.791 -1.978 7.364 296 HG21 ILE 36 HG21 ILE 36 -3.729 -0.742 4.994 297 HG22 ILE 36 HG22 ILE 36 -4.134 -1.006 6.695 298 HG23 ILE 36 HG23 ILE 36 -4.521 -2.239 5.499 299 HD11 ILE 36 HD11 ILE 36 -0.676 -0.131 5.665 300 HD12 ILE 36 HD12 ILE 36 -0.435 0.348 7.343 301 HD13 ILE 36 HD13 ILE 36 -1.977 0.648 6.553 302 H ILE 37 HN ILE 37 -1.901 -4.366 4.216 303 HA ILE 37 HA ILE 37 -4.343 -4.725 2.910 304 HB ILE 37 HB ILE 37 -1.547 -5.600 2.404 305 HG12 ILE 37 HG12 ILE 37 -3.305 -3.884 0.698 306 HG13 ILE 37 HG11 ILE 37 -2.487 -3.232 2.110 307 HG21 ILE 37 HG21 ILE 37 -3.938 -6.742 1.248 308 HG22 ILE 37 HG22 ILE 37 -2.259 -7.289 1.149 309 HG23 ILE 37 HG23 ILE 37 -2.851 -6.057 0.036 310 HD11 ILE 37 HD11 ILE 37 -1.169 -2.763 0.213 311 HD12 ILE 37 HD12 ILE 37 -1.229 -4.452 -0.309 312 HD13 ILE 37 HD13 ILE 37 -0.347 -4.011 1.152 313 H GLN 38 HN GLN 38 -2.104 -7.315 4.010 314 HA GLN 38 HA GLN 38 -3.764 -9.472 3.587 315 HB2 GLN 38 HB2 GLN 38 -1.745 -9.068 5.803 316 HB3 GLN 38 HB1 GLN 38 -2.521 -10.608 5.465 317 HG2 GLN 38 HG2 GLN 38 -1.514 -10.612 3.233 318 HG3 GLN 38 HG1 GLN 38 -0.754 -9.068 3.596 319 HE21 GLN 38 HE21 GLN 38 -1.135 -11.663 5.911 320 HE22 GLN 38 HE22 GLN 38 0.544 -12.041 6.050 321 H SER 39 HN SER 39 -3.858 -7.218 6.290 322 HA SER 39 HA SER 39 -5.611 -8.894 7.854 323 HB2 SER 39 HB2 SER 39 -5.677 -6.954 9.406 324 HB3 SER 39 HB1 SER 39 -4.038 -7.439 8.999 325 HG SER 39 HG SER 39 -3.836 -5.700 7.669 326 H ARG 40 HN ARG 40 -5.940 -5.864 6.032 327 HA ARG 40 HA ARG 40 -8.762 -5.696 6.493 328 HB2 ARG 40 HB2 ARG 40 -6.935 -4.213 4.594 329 HB3 ARG 40 HB1 ARG 40 -8.645 -3.843 4.793 330 HG2 ARG 40 HG2 ARG 40 -8.253 -3.410 7.138 331 HG3 ARG 40 HG1 ARG 40 -6.544 -3.760 6.940 332 HD2 ARG 40 HD2 ARG 40 -6.557 -1.472 6.792 333 HD3 ARG 40 HD1 ARG 40 -6.720 -1.930 5.096 334 HE ARG 40 HE ARG 40 -9.209 -1.648 5.524 335 HH11 ARG 40 HH11 ARG 40 -6.741 0.246 7.134 336 HH12 ARG 40 HH12 ARG 40 -7.826 1.523 7.573 337 HH21 ARG 40 HH21 ARG 40 -10.649 0.005 6.157 338 HH22 ARG 40 HH22 ARG 40 -10.050 1.387 7.018 339 H GLU 41 HN GLU 41 -6.722 -7.193 4.203 340 HA GLU 41 HA GLU 41 -9.040 -8.070 2.612 341 HB2 GLU 41 HB2 GLU 41 -6.153 -8.244 1.784 342 HB3 GLU 41 HB1 GLU 41 -7.584 -8.381 0.773 343 HG2 GLU 41 HG2 GLU 41 -6.778 -5.860 2.176 344 HG3 GLU 41 HG1 GLU 41 -6.270 -6.283 0.539 345 HA PRO 42 HA PRO 42 -7.275 -11.558 5.105 346 HB2 PRO 42 HB2 PRO 42 -9.563 -12.721 5.887 347 HB3 PRO 42 HB1 PRO 42 -8.946 -11.271 6.666 348 HG2 PRO 42 HG2 PRO 42 -11.084 -11.511 4.596 349 HG3 PRO 42 HG1 PRO 42 -11.077 -10.546 6.085 350 HD2 PRO 42 HD2 PRO 42 -10.511 -9.517 3.629 351 HD3 PRO 42 HD1 PRO 42 -9.828 -8.865 5.134 352 H SER 43 HN SER 43 -9.117 -11.280 2.381 353 HA SER 43 HA SER 43 -9.301 -14.011 1.586 354 HB2 SER 43 HB2 SER 43 -9.558 -12.895 -0.734 355 HB3 SER 43 HB1 SER 43 -10.787 -12.560 0.487 356 HG SER 43 HG SER 43 -8.931 -10.877 -0.668 357 H LEU 44 HN LEU 44 -6.719 -11.755 1.745 358 HA LEU 44 HA LEU 44 -5.090 -13.594 0.130 359 HB2 LEU 44 HB2 LEU 44 -3.616 -11.712 -0.420 360 HB3 LEU 44 HB1 LEU 44 -5.236 -11.477 -1.001 361 HG LEU 44 HG LEU 44 -5.395 -10.103 1.289 362 HD11 LEU 44 HD11 LEU 44 -3.331 -8.782 1.485 363 HD12 LEU 44 HD12 LEU 44 -2.536 -9.900 0.379 364 HD13 LEU 44 HD13 LEU 44 -3.112 -10.471 1.945 365 HD21 LEU 44 HD21 LEU 44 -6.019 -9.286 -0.894 366 HD22 LEU 44 HD22 LEU 44 -4.326 -9.165 -1.368 367 HD23 LEU 44 HD23 LEU 44 -4.967 -8.110 -0.109 368 H LYS 45 HN LYS 45 -5.755 -13.612 3.016 369 HA LYS 45 HA LYS 45 -3.422 -12.860 4.471 370 HB2 LYS 45 HB2 LYS 45 -4.352 -14.085 6.323 371 HB3 LYS 45 HB1 LYS 45 -5.637 -13.182 5.538 372 HG2 LYS 45 HG2 LYS 45 -6.417 -15.204 4.438 373 HG3 LYS 45 HG1 LYS 45 -5.084 -16.115 5.159 374 HD2 LYS 45 HD2 LYS 45 -7.182 -14.668 6.755 375 HD3 LYS 45 HD1 LYS 45 -7.255 -16.385 6.343 376 HE2 LYS 45 HE2 LYS 45 -4.952 -16.569 7.380 377 HE3 LYS 45 HE1 LYS 45 -5.226 -14.957 8.039 378 HZ1 LYS 45 HZ1 LYS 45 -6.963 -17.313 8.538 379 HZ2 LYS 45 HZ2 LYS 45 -7.162 -15.772 9.204 380 HZ3 LYS 45 HZ3 LYS 45 -5.816 -16.703 9.620 381 H ASN 46 HN ASN 46 -4.201 -15.516 2.447 382 HA ASN 46 HA ASN 46 -2.339 -17.400 3.497 383 HB2 ASN 46 HB2 ASN 46 -4.293 -17.913 1.972 384 HB3 ASN 46 HB1 ASN 46 -3.350 -17.227 0.655 385 HD21 ASN 46 HD21 ASN 46 -3.222 -19.112 -0.490 386 HD22 ASN 46 HD22 ASN 46 -2.285 -20.475 0.036 387 H SER 47 HN SER 47 -2.029 -14.541 1.692 388 HA SER 47 HA SER 47 0.355 -15.195 0.259 389 HB2 SER 47 HB2 SER 47 -0.866 -12.521 0.979 390 HB3 SER 47 HB1 SER 47 0.489 -12.735 -0.133 391 HG SER 47 HG SER 47 -1.558 -14.370 -0.797 392 H ASN 48 HN ASN 48 2.461 -14.566 0.704 393 HA ASN 48 HA ASN 48 3.169 -14.677 3.497 394 HB2 ASN 48 HB2 ASN 48 4.937 -14.293 1.086 395 HB3 ASN 48 HB1 ASN 48 5.460 -14.795 2.686 396 HD21 ASN 48 HD21 ASN 48 5.176 -16.925 3.301 397 HD22 ASN 48 HD22 ASN 48 4.701 -18.157 2.183 398 HA PRO 49 HA PRO 49 3.366 -10.312 4.116 399 HB2 PRO 49 HB2 PRO 49 5.086 -10.263 6.237 400 HB3 PRO 49 HB1 PRO 49 3.381 -10.696 6.366 401 HG2 PRO 49 HG2 PRO 49 5.776 -12.467 6.225 402 HG3 PRO 49 HG1 PRO 49 4.323 -12.614 7.231 403 HD2 PRO 49 HD2 PRO 49 4.681 -14.080 4.991 404 HD3 PRO 49 HD1 PRO 49 3.077 -13.540 5.528 405 H ASP 50 HN ASP 50 6.258 -12.182 3.571 406 HA ASP 50 HA ASP 50 7.783 -9.744 2.981 407 HB2 ASP 50 HB2 ASP 50 8.646 -12.629 3.244 408 HB3 ASP 50 HB1 ASP 50 9.722 -11.330 2.750 409 H GLU 51 HN GLU 51 5.688 -11.616 1.403 410 HA GLU 51 HA GLU 51 7.014 -11.260 -1.167 411 HB2 GLU 51 HB2 GLU 51 6.297 -13.812 0.114 412 HB3 GLU 51 HB1 GLU 51 5.793 -13.645 -1.552 413 HG2 GLU 51 HG2 GLU 51 8.114 -13.116 -2.153 414 HG3 GLU 51 HG1 GLU 51 8.589 -13.374 -0.485 415 H ILE 52 HN ILE 52 4.978 -9.832 0.192 416 HA ILE 52 HA ILE 52 2.398 -10.770 -0.375 417 HB ILE 52 HB ILE 52 3.194 -9.012 1.362 418 HG12 ILE 52 HG12 ILE 52 0.920 -8.161 1.530 419 HG13 ILE 52 HG11 ILE 52 0.599 -8.598 -0.137 420 HG21 ILE 52 HG21 ILE 52 2.429 -7.245 -0.942 421 HG22 ILE 52 HG22 ILE 52 4.070 -7.446 -0.331 422 HG23 ILE 52 HG23 ILE 52 2.828 -6.716 0.686 423 HD11 ILE 52 HD11 ILE 52 1.221 -10.519 2.057 424 HD12 ILE 52 HD12 ILE 52 0.751 -10.921 0.408 425 HD13 ILE 52 HD13 ILE 52 -0.393 -10.125 1.484 426 H GLU 53 HN GLU 53 0.831 -9.923 -1.631 427 HA GLU 53 HA GLU 53 1.726 -8.725 -4.169 428 HB2 GLU 53 HB2 GLU 53 0.846 -11.030 -4.392 429 HB3 GLU 53 HB1 GLU 53 -0.617 -10.555 -3.551 430 HG2 GLU 53 HG2 GLU 53 -1.198 -10.660 -5.798 431 HG3 GLU 53 HG1 GLU 53 -1.014 -8.943 -5.478 432 H ILE 54 HN ILE 54 1.406 -6.521 -3.499 433 HA ILE 54 HA ILE 54 -1.088 -5.767 -2.331 434 HB ILE 54 HB ILE 54 0.951 -4.024 -3.709 435 HG12 ILE 54 HG12 ILE 54 0.675 -4.819 -0.813 436 HG13 ILE 54 HG11 ILE 54 2.052 -5.093 -1.872 437 HG21 ILE 54 HG21 ILE 54 -1.247 -3.335 -1.796 438 HG22 ILE 54 HG22 ILE 54 -1.245 -3.008 -3.528 439 HG23 ILE 54 HG23 ILE 54 -0.078 -2.206 -2.475 440 HD11 ILE 54 HD11 ILE 54 2.645 -3.287 -0.461 441 HD12 ILE 54 HD12 ILE 54 1.095 -2.497 -0.723 442 HD13 ILE 54 HD13 ILE 54 2.269 -2.589 -2.034 443 H ASP 55 HN ASP 55 -2.793 -6.265 -3.576 444 HA ASP 55 HA ASP 55 -2.708 -5.628 -6.433 445 HB2 ASP 55 HB2 ASP 55 -3.401 -7.927 -5.724 446 HB3 ASP 55 HB1 ASP 55 -4.784 -7.213 -4.893 447 H PHE 56 HN PHE 56 -3.093 -3.486 -6.540 448 HA PHE 56 HA PHE 56 -4.703 -2.077 -4.717 449 HB2 PHE 56 HB2 PHE 56 -3.623 -1.264 -7.398 450 HB3 PHE 56 HB1 PHE 56 -4.370 -0.157 -6.254 451 HD1 PHE 56 HD1 PHE 56 -3.303 0.033 -3.952 452 HD2 PHE 56 HD2 PHE 56 -1.336 -1.757 -7.255 453 HE1 PHE 56 HE1 PHE 56 -1.184 0.358 -2.819 454 HE2 PHE 56 HE2 PHE 56 0.825 -1.433 -6.122 455 HZ PHE 56 HZ PHE 56 0.892 -0.366 -3.895 456 H GLU 57 HN GLU 57 -5.653 -3.979 -7.300 457 HA GLU 57 HA GLU 57 -8.032 -2.457 -7.921 458 HB2 GLU 57 HB2 GLU 57 -6.978 -5.128 -8.834 459 HB3 GLU 57 HB1 GLU 57 -8.558 -4.525 -9.324 460 HG2 GLU 57 HG2 GLU 57 -5.946 -3.104 -9.805 461 HG3 GLU 57 HG1 GLU 57 -6.778 -4.117 -10.985 462 H THR 58 HN THR 58 -7.134 -5.373 -6.147 463 HA THR 58 HA THR 58 -9.889 -5.859 -5.382 464 HB THR 58 HB THR 58 -8.892 -7.728 -4.010 465 HG1 THR 58 HG1 THR 58 -6.526 -6.967 -5.418 466 HG21 THR 58 HG21 THR 58 -8.258 -7.679 -6.960 467 HG22 THR 58 HG22 THR 58 -9.800 -8.131 -6.234 468 HG23 THR 58 HG23 THR 58 -8.373 -9.128 -5.961 469 H LEU 59 HN LEU 59 -7.030 -4.365 -4.044 470 HA LEU 59 HA LEU 59 -7.705 -4.276 -1.345 471 HB2 LEU 59 HB2 LEU 59 -6.302 -2.203 -2.990 472 HB3 LEU 59 HB1 LEU 59 -6.378 -2.220 -1.247 473 HG LEU 59 HG LEU 59 -5.077 -4.295 -2.990 474 HD11 LEU 59 HD11 LEU 59 -3.912 -2.349 -1.021 475 HD12 LEU 59 HD12 LEU 59 -3.827 -2.207 -2.776 476 HD13 LEU 59 HD13 LEU 59 -3.033 -3.551 -1.959 477 HD21 LEU 59 HD21 LEU 59 -5.629 -4.196 -0.038 478 HD22 LEU 59 HD22 LEU 59 -4.295 -5.134 -0.717 479 HD23 LEU 59 HD23 LEU 59 -5.951 -5.492 -1.196 480 H LYS 60 HN LYS 60 -9.335 -3.406 -0.312 481 HA LYS 60 HA LYS 60 -11.361 -1.920 -1.614 482 HB2 LYS 60 HB2 LYS 60 -10.773 -2.397 1.305 483 HB3 LYS 60 HB1 LYS 60 -12.209 -1.554 0.739 484 HG2 LYS 60 HG2 LYS 60 -12.990 -3.517 -0.372 485 HG3 LYS 60 HG1 LYS 60 -11.470 -4.350 -0.058 486 HD2 LYS 60 HD2 LYS 60 -13.383 -3.401 2.065 487 HD3 LYS 60 HD1 LYS 60 -13.279 -5.058 1.464 488 HE2 LYS 60 HE2 LYS 60 -10.858 -5.040 2.146 489 HE3 LYS 60 HE1 LYS 60 -11.168 -3.499 2.941 490 HZ1 LYS 60 HZ1 LYS 60 -11.295 -5.444 4.431 491 HZ2 LYS 60 HZ2 LYS 60 -12.628 -6.002 3.555 492 HZ3 LYS 60 HZ3 LYS 60 -12.724 -4.538 4.392 493 HA PRO 61 HA PRO 61 -10.033 2.316 -1.558 494 HB2 PRO 61 HB2 PRO 61 -12.566 2.813 -0.060 495 HB3 PRO 61 HB1 PRO 61 -11.915 3.646 -1.476 496 HG2 PRO 61 HG2 PRO 61 -13.903 1.864 -1.678 497 HG3 PRO 61 HG1 PRO 61 -12.674 2.069 -2.933 498 HD2 PRO 61 HD2 PRO 61 -13.053 -0.148 -1.013 499 HD3 PRO 61 HD1 PRO 61 -12.242 -0.148 -2.590 500 H SER 62 HN SER 62 -11.539 1.025 1.354 501 HA SER 62 HA SER 62 -10.515 2.758 3.253 502 HB2 SER 62 HB2 SER 62 -10.966 -0.206 3.628 503 HB3 SER 62 HB1 SER 62 -11.062 1.061 4.853 504 HG SER 62 HG SER 62 -12.865 1.905 3.767 505 H THR 63 HN THR 63 -9.106 -0.330 2.079 506 HA THR 63 HA THR 63 -6.779 -0.160 3.683 507 HB THR 63 HB THR 63 -6.734 -1.560 1.029 508 HG1 THR 63 HG1 THR 63 -8.047 -3.188 1.805 509 HG21 THR 63 HG21 THR 63 -4.778 -2.181 2.011 510 HG22 THR 63 HG22 THR 63 -5.820 -3.313 2.886 511 HG23 THR 63 HG23 THR 63 -5.372 -1.780 3.627 512 H LEU 64 HN LEU 64 -7.456 0.723 0.307 513 HA LEU 64 HA LEU 64 -4.869 1.474 -0.407 514 HB2 LEU 64 HB2 LEU 64 -7.514 2.514 -1.392 515 HB3 LEU 64 HB1 LEU 64 -5.984 2.864 -2.154 516 HG LEU 64 HG LEU 64 -7.157 0.104 -1.846 517 HD11 LEU 64 HD11 LEU 64 -7.894 2.137 -3.604 518 HD12 LEU 64 HD12 LEU 64 -8.279 0.421 -3.735 519 HD13 LEU 64 HD13 LEU 64 -6.847 1.070 -4.536 520 HD21 LEU 64 HD21 LEU 64 -4.689 1.183 -3.171 521 HD22 LEU 64 HD22 LEU 64 -5.381 -0.391 -3.570 522 HD23 LEU 64 HD23 LEU 64 -4.806 -0.071 -1.934 523 H ARG 65 HN ARG 65 -7.486 3.497 0.948 524 HA ARG 65 HA ARG 65 -5.940 5.873 0.955 525 HB2 ARG 65 HB2 ARG 65 -8.375 5.068 2.526 526 HB3 ARG 65 HB1 ARG 65 -7.643 6.662 2.630 527 HG2 ARG 65 HG2 ARG 65 -8.726 5.425 0.109 528 HG3 ARG 65 HG1 ARG 65 -9.581 6.586 1.119 529 HD2 ARG 65 HD2 ARG 65 -7.846 8.249 0.697 530 HD3 ARG 65 HD1 ARG 65 -6.966 7.090 -0.297 531 HE ARG 65 HE ARG 65 -9.652 7.467 -1.194 532 HH11 ARG 65 HH11 ARG 65 -6.401 8.805 -1.354 533 HH12 ARG 65 HH12 ARG 65 -6.703 9.660 -2.837 534 HH21 ARG 65 HH21 ARG 65 -10.031 8.609 -3.145 535 HH22 ARG 65 HH22 ARG 65 -8.765 9.575 -3.830 536 H GLU 66 HN GLU 66 -6.218 3.185 3.167 537 HA GLU 66 HA GLU 66 -4.840 4.413 5.330 538 HB2 GLU 66 HB2 GLU 66 -6.200 2.455 5.732 539 HB3 GLU 66 HB1 GLU 66 -5.254 1.512 4.587 540 HG2 GLU 66 HG2 GLU 66 -4.633 0.900 6.810 541 HG3 GLU 66 HG1 GLU 66 -3.290 1.761 6.052 542 H LEU 67 HN LEU 67 -3.796 2.008 2.898 543 HA LEU 67 HA LEU 67 -1.093 1.909 3.338 544 HB2 LEU 67 HB2 LEU 67 -2.238 2.113 0.542 545 HB3 LEU 67 HB1 LEU 67 -0.872 1.151 1.099 546 HG LEU 67 HG LEU 67 -3.725 0.613 1.894 547 HD11 LEU 67 HD11 LEU 67 -2.222 -1.174 0.107 548 HD12 LEU 67 HD12 LEU 67 -2.849 0.313 -0.597 549 HD13 LEU 67 HD13 LEU 67 -3.948 -0.832 0.174 550 HD21 LEU 67 HD21 LEU 67 -1.405 -0.183 3.102 551 HD22 LEU 67 HD22 LEU 67 -1.743 -1.515 2.005 552 HD23 LEU 67 HD23 LEU 67 -2.950 -1.026 3.193 553 H GLU 68 HN GLU 68 -2.766 4.205 1.203 554 HA GLU 68 HA GLU 68 -0.644 5.830 0.466 555 HB2 GLU 68 HB2 GLU 68 -2.853 5.993 -0.542 556 HB3 GLU 68 HB1 GLU 68 -3.539 6.530 0.980 557 HG2 GLU 68 HG2 GLU 68 -1.713 8.419 0.657 558 HG3 GLU 68 HG1 GLU 68 -2.028 8.035 -1.037 559 H ARG 69 HN ARG 69 -2.978 6.501 3.090 560 HA ARG 69 HA ARG 69 -1.668 8.788 4.089 561 HB2 ARG 69 HB2 ARG 69 -3.826 7.005 4.925 562 HB3 ARG 69 HB1 ARG 69 -3.018 7.809 6.261 563 HG2 ARG 69 HG2 ARG 69 -3.877 9.462 3.950 564 HG3 ARG 69 HG1 ARG 69 -5.120 8.851 5.042 565 HD2 ARG 69 HD2 ARG 69 -4.372 11.062 5.732 566 HD3 ARG 69 HD1 ARG 69 -3.955 9.846 6.936 567 HE ARG 69 HE ARG 69 -1.962 10.766 4.979 568 HH11 ARG 69 HH11 ARG 69 -2.991 10.333 8.301 569 HH12 ARG 69 HH12 ARG 69 -1.461 10.798 8.968 570 HH21 ARG 69 HH21 ARG 69 0.057 11.353 5.867 571 HH22 ARG 69 HH22 ARG 69 0.263 11.386 7.592 572 H TYR 70 HN TYR 70 -1.088 5.438 4.580 573 HA TYR 70 HA TYR 70 0.390 5.721 7.006 574 HB2 TYR 70 HB2 TYR 70 -0.509 3.563 6.577 575 HB3 TYR 70 HB1 TYR 70 0.172 3.534 4.957 576 HD1 TYR 70 HD2 TYR 70 1.429 4.039 8.438 577 HD2 TYR 70 HD1 TYR 70 1.944 2.187 4.658 578 HE1 TYR 70 HE2 TYR 70 3.472 2.959 9.266 579 HE2 TYR 70 HE1 TYR 70 3.977 1.083 5.463 580 HH TYR 70 HH TYR 70 5.561 1.109 7.133 581 H VAL 71 HN VAL 71 1.264 5.279 3.579 582 HA VAL 71 HA VAL 71 4.041 5.365 4.023 583 HB VAL 71 HB VAL 71 4.350 5.673 1.696 584 HG11 VAL 71 HG11 VAL 71 2.578 4.151 0.674 585 HG12 VAL 71 HG12 VAL 71 1.959 4.001 2.320 586 HG13 VAL 71 HG13 VAL 71 3.609 3.503 1.946 587 HG21 VAL 71 HG21 VAL 71 2.721 6.429 0.168 588 HG22 VAL 71 HG22 VAL 71 2.873 7.617 1.458 589 HG23 VAL 71 HG23 VAL 71 1.491 6.519 1.423 590 H THR 72 HN THR 72 1.606 7.866 3.595 591 HA THR 72 HA THR 72 3.399 9.914 2.930 592 HB THR 72 HB THR 72 1.583 11.496 3.468 593 HG1 THR 72 HG1 THR 72 -0.450 9.911 3.793 594 HG21 THR 72 HG21 THR 72 1.041 9.047 1.854 595 HG22 THR 72 HG22 THR 72 1.641 10.608 1.286 596 HG23 THR 72 HG23 THR 72 -0.034 10.443 1.820 597 H SER 73 HN SER 73 2.336 8.609 5.964 598 HA SER 73 HA SER 73 3.306 10.638 7.660 599 HB2 SER 73 HB2 SER 73 3.026 9.082 9.427 600 HB3 SER 73 HB1 SER 73 1.796 8.649 8.235 601 HG SER 73 HG SER 73 3.030 6.933 7.578 602 H CYS 74 HN CYS 74 4.830 8.139 5.838 603 HA CYS 74 HA CYS 74 7.397 8.510 7.216 604 HB2 CYS 74 HB2 CYS 74 6.724 6.190 6.908 605 HB3 CYS 74 HB1 CYS 74 6.552 6.451 5.173 606 HG CYS 74 HG CYS 74 9.556 7.346 5.765 607 H LEU 75 HN LEU 75 5.781 9.213 4.242 608 HA LEU 75 HA LEU 75 8.287 9.779 2.858 609 HB2 LEU 75 HB2 LEU 75 5.461 9.745 1.821 610 HB3 LEU 75 HB1 LEU 75 6.902 9.827 0.852 611 HG LEU 75 HG LEU 75 5.892 7.504 2.443 612 HD11 LEU 75 HD11 LEU 75 5.054 8.013 0.112 613 HD12 LEU 75 HD12 LEU 75 5.754 6.414 0.362 614 HD13 LEU 75 HD13 LEU 75 6.690 7.670 -0.442 615 HD21 LEU 75 HD21 LEU 75 7.915 6.326 1.935 616 HD22 LEU 75 HD22 LEU 75 8.336 7.805 2.787 617 HD23 LEU 75 HD23 LEU 75 8.552 7.703 1.042 618 H ARG 76 HN ARG 76 5.171 11.376 3.520 619 HA ARG 76 HA ARG 76 6.160 13.813 2.324 620 HB2 ARG 76 HB2 ARG 76 3.497 13.128 3.526 621 HB3 ARG 76 HB1 ARG 76 3.887 14.683 2.794 622 HG2 ARG 76 HG2 ARG 76 4.460 13.460 0.701 623 HG3 ARG 76 HG1 ARG 76 3.846 11.997 1.473 624 HD2 ARG 76 HD2 ARG 76 1.694 13.054 1.761 625 HD3 ARG 76 HD1 ARG 76 2.279 14.508 0.961 626 HE ARG 76 HE ARG 76 2.769 12.700 -0.912 627 HH11 ARG 76 HH11 ARG 76 -0.088 13.167 1.052 628 HH12 ARG 76 HH12 ARG 76 -1.162 12.488 -0.126 629 HH21 ARG 76 HH21 ARG 76 1.364 11.795 -2.454 630 HH22 ARG 76 HH22 ARG 76 -0.337 11.705 -2.128 631 H LYS 77 HN LYS 77 6.380 12.401 5.280 632 HA LYS 77 HA LYS 77 6.367 14.956 6.712 633 HB2 LYS 77 HB2 LYS 77 6.209 12.121 7.715 634 HB3 LYS 77 HB1 LYS 77 6.468 13.496 8.784 635 HG2 LYS 77 HG2 LYS 77 4.143 13.235 6.914 636 HG3 LYS 77 HG1 LYS 77 4.092 12.741 8.611 637 HD2 LYS 77 HD2 LYS 77 4.670 15.526 7.591 638 HD3 LYS 77 HD1 LYS 77 3.126 14.973 8.235 639 HE2 LYS 77 HE2 LYS 77 4.266 14.449 10.374 640 HE3 LYS 77 HE1 LYS 77 5.743 15.151 9.717 641 HZ1 LYS 77 HZ1 LYS 77 3.172 16.589 10.086 642 HZ2 LYS 77 HZ2 LYS 77 4.603 17.260 9.480 643 HZ3 LYS 77 HZ3 LYS 77 4.531 16.731 11.083 644 H LYS 78 HN LYS 78 8.389 12.598 5.368 645 HA LYS 78 HA LYS 78 10.746 13.970 6.236 646 HB2 LYS 78 HB2 LYS 78 10.138 12.344 8.121 647 HB3 LYS 78 HB1 LYS 78 10.544 11.060 6.994 648 HG2 LYS 78 HG2 LYS 78 12.435 11.474 8.397 649 HG3 LYS 78 HG1 LYS 78 12.808 12.036 6.768 650 HD2 LYS 78 HD2 LYS 78 13.594 13.644 8.399 651 HD3 LYS 78 HD1 LYS 78 12.278 14.335 7.452 652 HE2 LYS 78 HE2 LYS 78 12.027 14.895 9.802 653 HE3 LYS 78 HE1 LYS 78 10.714 13.844 9.276 654 HZ1 LYS 78 HZ1 LYS 78 11.566 13.166 11.422 655 HZ2 LYS 78 HZ2 LYS 78 13.122 12.989 10.789 656 HZ3 LYS 78 HZ3 LYS 78 11.878 11.967 10.274 657 H ARG 79 HN ARG 79 11.027 14.237 4.003 658 HA ARG 79 HA ARG 79 10.888 12.169 2.106 659 HB2 ARG 79 HB2 ARG 79 12.287 13.685 0.672 660 HB3 ARG 79 HB1 ARG 79 10.818 14.398 1.311 661 HG2 ARG 79 HG2 ARG 79 12.365 16.089 1.575 662 HG3 ARG 79 HG1 ARG 79 12.350 15.336 3.167 663 HD2 ARG 79 HD2 ARG 79 14.357 14.073 2.591 664 HD3 ARG 79 HD1 ARG 79 14.367 14.808 0.990 665 HE ARG 79 HE ARG 79 14.532 16.988 2.380 666 HH11 ARG 79 HH11 ARG 79 16.037 13.928 3.173 667 HH12 ARG 79 HH12 ARG 79 17.386 14.655 3.985 668 HH21 ARG 79 HH21 ARG 79 16.310 17.943 3.453 669 HH22 ARG 79 HH22 ARG 79 17.538 16.936 4.149 670 H LYS 80 HN LYS 80 12.309 10.773 1.254 671 HA LYS 80 HA LYS 80 13.947 9.222 1.289 672 HB2 LYS 80 HB2 LYS 80 15.608 11.655 1.954 673 HB3 LYS 80 HB1 LYS 80 16.289 10.085 1.551 674 HG2 LYS 80 HG2 LYS 80 14.515 11.726 -0.248 675 HG3 LYS 80 HG1 LYS 80 16.273 11.612 -0.364 676 HD2 LYS 80 HD2 LYS 80 16.126 9.245 -0.836 677 HD3 LYS 80 HD1 LYS 80 14.379 9.272 -0.595 678 HE2 LYS 80 HE2 LYS 80 14.151 10.796 -2.500 679 HE3 LYS 80 HE1 LYS 80 15.895 10.741 -2.745 680 HZ1 LYS 80 HZ1 LYS 80 14.054 8.420 -2.922 681 HZ2 LYS 80 HZ2 LYS 80 15.724 8.374 -3.174 682 HZ3 LYS 80 HZ3 LYS 80 14.735 9.240 -4.236 683 HA PRO 81 HA PRO 81 13.903 8.814 5.897 684 HB2 PRO 81 HB2 PRO 81 12.097 6.854 6.123 685 HB3 PRO 81 HB1 PRO 81 11.596 8.538 5.915 686 HG2 PRO 81 HG2 PRO 81 11.713 6.333 3.901 687 HG3 PRO 81 HG1 PRO 81 10.484 7.591 4.116 688 HD2 PRO 81 HD2 PRO 81 12.511 7.674 2.241 689 HD3 PRO 81 HD1 PRO 81 11.645 9.095 2.855 690 H GLN 82 HN GLN 82 14.730 7.008 3.229 691 HA GLN 82 HA GLN 82 15.601 4.655 4.706 692 HB2 GLN 82 HB2 GLN 82 15.831 5.334 1.768 693 HB3 GLN 82 HB1 GLN 82 16.276 3.796 2.493 694 HG2 GLN 82 HG2 GLN 82 13.915 3.532 3.223 695 HG3 GLN 82 HG1 GLN 82 13.522 4.993 2.319 696 HE21 GLN 82 HE21 GLN 82 13.513 4.936 0.080 697 HE22 GLN 82 HE22 GLN 82 13.561 3.456 -0.811 698 H ALA 83 HN ALA 83 16.788 7.682 4.129 699 HA ALA 83 HA ALA 83 19.519 6.778 4.636 700 HB1 ALA 83 HB1 ALA 83 18.812 8.769 2.480 701 HB2 ALA 83 HB2 ALA 83 19.407 7.129 2.221 702 HB3 ALA 83 HB3 ALA 83 20.442 8.332 2.990 703 H1 VAL 201 HT1 VAL 201 -4.358 -1.527 -15.862 704 H2 VAL 201 HT2 VAL 201 -5.774 -0.822 -16.454 705 H3 VAL 201 HT3 VAL 201 -5.639 -1.187 -14.812 706 HA VAL 201 HA VAL 201 -4.071 0.821 -16.310 707 HB VAL 201 HB VAL 201 -5.160 2.455 -14.775 708 HG11 VAL 201 HG11 VAL 201 -7.283 2.539 -15.965 709 HG12 VAL 201 HG12 VAL 201 -7.059 0.877 -16.503 710 HG13 VAL 201 HG13 VAL 201 -5.963 2.139 -17.061 711 HG21 VAL 201 HG21 VAL 201 -6.915 0.109 -14.060 712 HG22 VAL 201 HG22 VAL 201 -7.238 1.787 -13.630 713 HG23 VAL 201 HG23 VAL 201 -5.820 0.967 -12.979 714 H VAL 202 HN VAL 202 -4.501 -0.966 -13.304 715 HA VAL 202 HA VAL 202 -1.858 0.002 -12.455 716 HB VAL 202 HB VAL 202 -4.269 -0.422 -10.675 717 HG11 VAL 202 HG11 VAL 202 -1.404 0.142 -9.911 718 HG12 VAL 202 HG12 VAL 202 -2.299 -1.342 -9.590 719 HG13 VAL 202 HG13 VAL 202 -2.777 0.164 -8.806 720 HG21 VAL 202 HG21 VAL 202 -2.553 2.026 -11.037 721 HG22 VAL 202 HG22 VAL 202 -4.059 1.895 -10.127 722 HG23 VAL 202 HG23 VAL 202 -4.076 1.758 -11.885 723 HA PRO 203 HA PRO 203 -1.316 -4.427 -12.510 724 HB2 PRO 203 HB2 PRO 203 1.350 -4.436 -12.283 725 HB3 PRO 203 HB1 PRO 203 0.557 -3.923 -13.776 726 HG2 PRO 203 HG2 PRO 203 1.725 -2.255 -11.584 727 HG3 PRO 203 HG1 PRO 203 1.847 -2.040 -13.340 728 HD2 PRO 203 HD2 PRO 203 0.087 -0.666 -11.744 729 HD3 PRO 203 HD1 PRO 203 -0.177 -0.981 -13.470 730 H LYS 204 HN LYS 204 -0.949 -6.011 -11.008 731 HA LYS 204 HA LYS 204 -1.066 -5.391 -8.266 732 HB2 LYS 204 HB2 LYS 204 -0.614 -7.851 -7.974 733 HB3 LYS 204 HB1 LYS 204 -1.980 -7.463 -9.008 734 HG2 LYS 204 HG2 LYS 204 -0.456 -7.786 -10.974 735 HG3 LYS 204 HG1 LYS 204 0.755 -8.393 -9.844 736 HD2 LYS 204 HD2 LYS 204 -0.397 -10.272 -10.780 737 HD3 LYS 204 HD1 LYS 204 -0.901 -10.102 -9.098 738 HE2 LYS 204 HE2 LYS 204 -2.939 -8.955 -9.833 739 HE3 LYS 204 HE1 LYS 204 -2.438 -9.145 -11.511 740 HZ1 LYS 204 HZ1 LYS 204 -4.007 -10.844 -10.927 741 HZ2 LYS 204 HZ2 LYS 204 -3.074 -11.327 -9.605 742 HZ3 LYS 204 HZ3 LYS 204 -2.496 -11.561 -11.177 743 H LYS 205 HN LYS 205 0.483 -5.225 -6.722 744 HA LYS 205 HA LYS 205 3.206 -4.946 -7.756 745 HB2 LYS 205 HB2 LYS 205 2.193 -2.955 -6.760 746 HB3 LYS 205 HB1 LYS 205 1.925 -3.822 -5.264 747 HG2 LYS 205 HG2 LYS 205 4.097 -3.655 -4.601 748 HG3 LYS 205 HG1 LYS 205 4.715 -3.659 -6.261 749 HD2 LYS 205 HD2 LYS 205 3.227 -1.370 -4.972 750 HD3 LYS 205 HD1 LYS 205 4.984 -1.485 -5.081 751 HE2 LYS 205 HE2 LYS 205 3.135 -1.502 -7.463 752 HE3 LYS 205 HE1 LYS 205 3.924 -0.060 -6.833 753 HZ1 LYS 205 HZ1 LYS 205 6.038 -0.933 -7.371 754 HZ2 LYS 205 HZ2 LYS 205 5.065 -1.162 -8.739 755 HZ3 LYS 205 HZ3 LYS 205 5.410 -2.466 -7.721 756 H LYS 206 HN LYS 206 3.865 -7.073 -7.664 757 HA LYS 206 HA LYS 206 3.864 -8.640 -5.295 758 HB2 LYS 206 HB2 LYS 206 5.688 -8.761 -7.709 759 HB3 LYS 206 HB1 LYS 206 5.592 -9.988 -6.455 760 HG2 LYS 206 HG2 LYS 206 3.240 -10.384 -7.059 761 HG3 LYS 206 HG1 LYS 206 3.403 -9.205 -8.365 762 HD2 LYS 206 HD2 LYS 206 5.116 -10.556 -9.413 763 HD3 LYS 206 HD1 LYS 206 5.073 -11.700 -8.071 764 HE2 LYS 206 HE2 LYS 206 2.813 -11.111 -9.979 765 HE3 LYS 206 HE1 LYS 206 3.835 -12.546 -9.992 766 HZ1 LYS 206 HZ1 LYS 206 1.830 -13.102 -8.897 767 HZ2 LYS 206 HZ2 LYS 206 1.888 -11.734 -7.903 768 HZ3 LYS 206 HZ3 LYS 206 3.012 -12.988 -7.692 769 H ILE 207 HN ILE 207 4.997 -8.235 -3.506 770 HA ILE 207 HA ILE 207 7.436 -6.602 -3.780 771 HB ILE 207 HB ILE 207 5.746 -6.897 -1.302 772 HG12 ILE 207 HG12 ILE 207 5.626 -4.900 -3.546 773 HG13 ILE 207 HG11 ILE 207 4.311 -5.773 -2.763 774 HG21 ILE 207 HG21 ILE 207 6.984 -4.947 -0.535 775 HG22 ILE 207 HG22 ILE 207 7.921 -4.949 -2.029 776 HG23 ILE 207 HG23 ILE 207 8.062 -6.294 -0.895 777 HD11 ILE 207 HD11 ILE 207 5.912 -3.541 -1.548 778 HD12 ILE 207 HD12 ILE 207 4.609 -4.431 -0.757 779 HD13 ILE 207 HD13 ILE 207 4.265 -3.436 -2.172 780 H LYS 208 HN LYS 208 9.310 -7.421 -3.125 781 HA LYS 208 HA LYS 208 9.291 -9.659 -1.204 782 HB2 LYS 208 HB2 LYS 208 11.592 -8.874 -3.007 783 HB3 LYS 208 HB1 LYS 208 11.447 -10.328 -2.036 784 HG2 LYS 208 HG2 LYS 208 9.808 -9.654 -4.467 785 HG3 LYS 208 HG1 LYS 208 11.147 -10.798 -4.398 786 HD2 LYS 208 HD2 LYS 208 9.827 -12.073 -2.679 787 HD3 LYS 208 HD1 LYS 208 8.464 -11.012 -3.045 788 HE2 LYS 208 HE2 LYS 208 8.762 -11.695 -5.466 789 HE3 LYS 208 HE1 LYS 208 9.868 -12.933 -4.877 790 HZ1 LYS 208 HZ1 LYS 208 7.586 -13.736 -5.227 791 HZ2 LYS 208 HZ2 LYS 208 7.042 -12.685 -4.023 792 HZ3 LYS 208 HZ3 LYS 208 8.115 -13.937 -3.632 793 H LYS 209 HN LYS 209 11.615 -9.494 0.060 794 HA LYS 209 HA LYS 209 11.676 -7.069 1.480 795 HB2 LYS 209 HB2 LYS 209 12.698 -9.124 2.360 796 HB3 LYS 209 HB1 LYS 209 13.910 -9.078 1.088 797 HG2 LYS 209 HG2 LYS 209 14.733 -8.278 3.278 798 HG3 LYS 209 HG1 LYS 209 14.873 -7.077 1.992 799 HD2 LYS 209 HD2 LYS 209 12.864 -5.961 2.790 800 HD3 LYS 209 HD1 LYS 209 12.656 -7.187 4.040 801 HE2 LYS 209 HE2 LYS 209 15.044 -5.363 3.801 802 HE3 LYS 209 HE1 LYS 209 13.671 -5.078 4.869 803 HZ1 LYS 209 HZ1 LYS 209 15.534 -6.118 6.021 804 HZ2 LYS 209 HZ2 LYS 209 15.461 -7.446 4.982 805 HZ3 LYS 209 HZ3 LYS 209 14.176 -7.121 6.029 806 H GLU 210 HN GLU 210 13.574 -8.242 -1.255 807 HA GLU 210 HA GLU 210 14.579 -5.560 -1.786 808 HB2 GLU 210 HB2 GLU 210 14.927 -8.158 -3.297 809 HB3 GLU 210 HB1 GLU 210 15.691 -6.635 -3.729 810 HG2 GLU 210 HG2 GLU 210 16.955 -6.638 -1.679 811 HG3 GLU 210 HG1 GLU 210 16.118 -8.091 -1.131 812 H GLN 211 HN GLN 211 12.351 -4.748 -1.992 813 HA GLN 211 HA GLN 211 10.520 -5.619 -3.911 814 HB2 GLN 211 HB2 GLN 211 9.492 -3.395 -3.710 815 HB3 GLN 211 HB1 GLN 211 9.893 -4.074 -2.139 816 HG2 GLN 211 HG2 GLN 211 11.775 -2.648 -1.908 817 HG3 GLN 211 HG1 GLN 211 11.651 -2.116 -3.584 818 HE21 GLN 211 HE21 GLN 211 11.640 -0.591 -1.094 819 HE22 GLN 211 HE22 GLN 211 10.172 0.320 -1.095 820 H VAL 212 HN VAL 212 13.348 -3.625 -4.235 821 HA VAL 212 HA VAL 212 12.678 -2.656 -6.852 822 HB VAL 212 HB VAL 212 15.004 -1.835 -6.938 823 HG11 VAL 212 HG11 VAL 212 13.273 -0.465 -5.903 824 HG12 VAL 212 HG12 VAL 212 14.828 -0.225 -5.108 825 HG13 VAL 212 HG13 VAL 212 13.592 -1.226 -4.345 826 HG21 VAL 212 HG21 VAL 212 16.459 -2.063 -4.971 827 HG22 VAL 212 HG22 VAL 212 16.113 -3.624 -5.717 828 HG23 VAL 212 HG23 VAL 212 15.280 -3.153 -4.237 829 H GLU 213 HN GLU 213 13.346 -3.419 -8.802 830 HA GLU 213 HA GLU 213 14.940 -5.876 -8.810 831 HB2 GLU 213 HB2 GLU 213 13.462 -6.679 -10.703 832 HB3 GLU 213 HB1 GLU 213 12.734 -6.682 -9.105 833 HG2 GLU 213 HG2 GLU 213 11.616 -4.550 -9.651 834 HG3 GLU 213 HG1 GLU 213 12.285 -4.653 -11.279 Start of MODEL 8 1 H1 SER 1 HT1 SER 1 -23.061 0.325 6.823 2 H2 SER 1 HT2 SER 1 -22.437 1.769 7.445 3 H3 SER 1 HT3 SER 1 -21.417 0.435 7.206 4 HA SER 1 HA SER 1 -21.688 0.567 4.851 5 HB2 SER 1 HB2 SER 1 -23.369 3.023 5.379 6 HB3 SER 1 HB1 SER 1 -23.038 2.277 3.814 7 HG SER 1 HG SER 1 -25.021 1.547 4.406 8 H GLU 2 HN GLU 2 -20.551 2.176 7.401 9 HA GLU 2 HA GLU 2 -19.579 4.575 6.229 10 HB2 GLU 2 HB2 GLU 2 -18.875 3.183 8.807 11 HB3 GLU 2 HB1 GLU 2 -18.287 4.764 8.331 12 HG2 GLU 2 HG2 GLU 2 -20.070 5.119 9.835 13 HG3 GLU 2 HG1 GLU 2 -20.666 5.528 8.231 14 H GLU 3 HN GLU 3 -18.354 1.337 6.537 15 HA GLU 3 HA GLU 3 -15.616 1.947 6.186 16 HB2 GLU 3 HB2 GLU 3 -17.143 -0.557 5.457 17 HB3 GLU 3 HB1 GLU 3 -15.392 -0.420 5.494 18 HG2 GLU 3 HG2 GLU 3 -17.269 -0.153 7.826 19 HG3 GLU 3 HG1 GLU 3 -16.157 -1.483 7.503 20 H GLU 4 HN GLU 4 -18.295 1.707 4.000 21 HA GLU 4 HA GLU 4 -16.512 1.877 1.696 22 HB2 GLU 4 HB2 GLU 4 -18.462 0.252 1.799 23 HB3 GLU 4 HB1 GLU 4 -19.518 1.650 1.663 24 HG2 GLU 4 HG2 GLU 4 -19.254 0.685 -0.498 25 HG3 GLU 4 HG1 GLU 4 -18.398 2.226 -0.462 26 H ASP 5 HN ASP 5 -18.713 3.797 3.599 27 HA ASP 5 HA ASP 5 -18.930 5.810 1.514 28 HB2 ASP 5 HB2 ASP 5 -20.967 5.238 2.709 29 HB3 ASP 5 HB1 ASP 5 -20.221 5.705 4.232 30 H LYS 6 HN LYS 6 -17.790 5.652 4.877 31 HA LYS 6 HA LYS 6 -16.836 8.301 4.967 32 HB2 LYS 6 HB2 LYS 6 -17.162 6.934 6.999 33 HB3 LYS 6 HB1 LYS 6 -15.837 5.891 6.510 34 HG2 LYS 6 HG2 LYS 6 -14.971 7.301 8.168 35 HG3 LYS 6 HG1 LYS 6 -14.340 7.921 6.645 36 HD2 LYS 6 HD2 LYS 6 -16.868 9.066 7.744 37 HD3 LYS 6 HD1 LYS 6 -15.336 9.532 8.474 38 HE2 LYS 6 HE2 LYS 6 -14.536 10.225 6.229 39 HE3 LYS 6 HE1 LYS 6 -16.134 9.865 5.584 40 HZ1 LYS 6 HZ1 LYS 6 -15.929 12.203 6.057 41 HZ2 LYS 6 HZ2 LYS 6 -15.507 11.886 7.664 42 HZ3 LYS 6 HZ3 LYS 6 -17.061 11.515 7.111 43 H CYS 7 HN CYS 7 -15.454 5.306 3.848 44 HA CYS 7 HA CYS 7 -12.901 6.514 3.243 45 HB2 CYS 7 HB2 CYS 7 -14.002 3.790 2.515 46 HB3 CYS 7 HB1 CYS 7 -12.325 4.309 2.340 47 HG CYS 7 HG CYS 7 -13.587 2.744 4.809 48 H LYS 8 HN LYS 8 -12.519 7.618 1.444 49 HA LYS 8 HA LYS 8 -14.565 7.659 -0.634 50 HB2 LYS 8 HB2 LYS 8 -12.202 9.405 0.007 51 HB3 LYS 8 HB1 LYS 8 -12.943 9.472 -1.581 52 HG2 LYS 8 HG2 LYS 8 -13.806 11.220 -0.178 53 HG3 LYS 8 HG1 LYS 8 -15.076 10.072 -0.581 54 HD2 LYS 8 HD2 LYS 8 -14.626 8.982 1.659 55 HD3 LYS 8 HD1 LYS 8 -13.594 10.365 2.026 56 HE2 LYS 8 HE2 LYS 8 -15.695 10.869 2.971 57 HE3 LYS 8 HE1 LYS 8 -15.587 11.820 1.490 58 HZ1 LYS 8 HZ1 LYS 8 -16.928 10.149 0.365 59 HZ2 LYS 8 HZ2 LYS 8 -17.750 10.793 1.694 60 HZ3 LYS 8 HZ3 LYS 8 -17.054 9.255 1.798 61 HA PRO 9 HA PRO 9 -12.708 4.784 -3.260 62 HB2 PRO 9 HB2 PRO 9 -13.619 5.728 -5.668 63 HB3 PRO 9 HB1 PRO 9 -14.596 4.799 -4.528 64 HG2 PRO 9 HG2 PRO 9 -14.505 7.746 -4.989 65 HG3 PRO 9 HG1 PRO 9 -15.901 6.704 -4.657 66 HD2 PRO 9 HD2 PRO 9 -14.763 8.271 -2.761 67 HD3 PRO 9 HD1 PRO 9 -15.512 6.712 -2.369 68 H MET 10 HN MET 10 -10.675 4.589 -3.891 69 HA MET 10 HA MET 10 -9.103 6.905 -4.600 70 HB2 MET 10 HB2 MET 10 -8.234 5.024 -3.181 71 HB3 MET 10 HB1 MET 10 -8.283 3.992 -4.606 72 HG2 MET 10 HG2 MET 10 -6.109 4.630 -4.665 73 HG3 MET 10 HG1 MET 10 -6.827 5.922 -5.630 74 HE1 MET 10 HE1 MET 10 -5.593 4.764 -2.265 75 HE2 MET 10 HE2 MET 10 -6.977 5.616 -1.591 76 HE3 MET 10 HE3 MET 10 -5.345 6.226 -1.315 77 H SER 11 HN SER 11 -8.634 7.571 -6.629 78 HA SER 11 HA SER 11 -9.880 6.170 -8.823 79 HB2 SER 11 HB2 SER 11 -9.054 8.132 -10.172 80 HB3 SER 11 HB1 SER 11 -10.100 8.555 -8.818 81 HG SER 11 HG SER 11 -8.234 9.098 -7.620 82 H TYR 12 HN TYR 12 -8.475 6.273 -11.012 83 HA TYR 12 HA TYR 12 -6.701 4.125 -10.741 84 HB2 TYR 12 HB2 TYR 12 -7.492 4.069 -12.856 85 HB3 TYR 12 HB1 TYR 12 -7.717 5.814 -12.931 86 HD1 TYR 12 HD1 TYR 12 -5.102 3.170 -13.191 87 HD2 TYR 12 HD2 TYR 12 -6.261 7.123 -14.219 88 HE1 TYR 12 HE1 TYR 12 -3.168 3.331 -14.691 89 HE2 TYR 12 HE2 TYR 12 -4.326 7.300 -15.724 90 HH TYR 12 HH TYR 12 -2.114 6.275 -15.994 91 H GLU 13 HN GLU 13 -5.986 7.550 -11.466 92 HA GLU 13 HA GLU 13 -3.190 7.207 -11.568 93 HB2 GLU 13 HB2 GLU 13 -5.040 9.532 -11.316 94 HB3 GLU 13 HB1 GLU 13 -3.335 9.786 -10.960 95 HG2 GLU 13 HG2 GLU 13 -4.319 8.531 -13.507 96 HG3 GLU 13 HG1 GLU 13 -4.029 10.272 -13.325 97 H GLU 14 HN GLU 14 -5.396 7.717 -8.939 98 HA GLU 14 HA GLU 14 -3.447 8.426 -7.010 99 HB2 GLU 14 HB2 GLU 14 -6.265 7.417 -6.875 100 HB3 GLU 14 HB1 GLU 14 -5.308 7.627 -5.421 101 HG2 GLU 14 HG2 GLU 14 -5.017 10.006 -6.000 102 HG3 GLU 14 HG1 GLU 14 -6.052 9.761 -7.407 103 H LYS 15 HN LYS 15 -5.085 5.397 -7.860 104 HA LYS 15 HA LYS 15 -3.744 3.746 -6.045 105 HB2 LYS 15 HB2 LYS 15 -4.896 3.120 -8.755 106 HB3 LYS 15 HB1 LYS 15 -4.219 1.893 -7.689 107 HG2 LYS 15 HG2 LYS 15 -5.919 2.013 -6.206 108 HG3 LYS 15 HG1 LYS 15 -6.311 3.677 -6.615 109 HD2 LYS 15 HD2 LYS 15 -7.557 3.098 -8.412 110 HD3 LYS 15 HD1 LYS 15 -6.641 1.624 -8.724 111 HE2 LYS 15 HE2 LYS 15 -7.632 0.681 -6.652 112 HE3 LYS 15 HE1 LYS 15 -8.676 2.094 -6.551 113 HZ1 LYS 15 HZ1 LYS 15 -9.605 1.506 -8.707 114 HZ2 LYS 15 HZ2 LYS 15 -9.801 0.237 -7.607 115 HZ3 LYS 15 HZ3 LYS 15 -8.596 0.144 -8.798 116 H ARG 16 HN ARG 16 -2.817 4.852 -9.283 117 HA ARG 16 HA ARG 16 -0.428 3.339 -9.460 118 HB2 ARG 16 HB2 ARG 16 -1.432 4.488 -11.418 119 HB3 ARG 16 HB1 ARG 16 -0.953 6.029 -10.718 120 HG2 ARG 16 HG2 ARG 16 1.386 5.263 -10.741 121 HG3 ARG 16 HG1 ARG 16 0.863 3.806 -11.557 122 HD2 ARG 16 HD2 ARG 16 1.792 5.453 -13.108 123 HD3 ARG 16 HD1 ARG 16 0.110 5.093 -13.429 124 HE ARG 16 HE ARG 16 -0.498 7.239 -12.694 125 HH11 ARG 16 HH11 ARG 16 2.973 6.715 -12.590 126 HH12 ARG 16 HH12 ARG 16 3.351 8.407 -12.560 127 HH21 ARG 16 HH21 ARG 16 0.004 9.459 -12.685 128 HH22 ARG 16 HH22 ARG 16 1.668 9.963 -12.596 129 H GLN 17 HN GLN 17 -0.993 6.700 -8.416 130 HA GLN 17 HA GLN 17 1.657 7.237 -7.701 131 HB2 GLN 17 HB2 GLN 17 -0.237 8.890 -7.981 132 HB3 GLN 17 HB1 GLN 17 -0.755 8.432 -6.362 133 HG2 GLN 17 HG2 GLN 17 0.582 10.450 -6.293 134 HG3 GLN 17 HG1 GLN 17 1.409 9.122 -5.483 135 HE21 GLN 17 HE21 GLN 17 1.382 11.189 -8.270 136 HE22 GLN 17 HE22 GLN 17 2.986 10.827 -8.802 137 H LEU 18 HN LEU 18 -0.970 5.752 -5.991 138 HA LEU 18 HA LEU 18 0.081 5.542 -3.408 139 HB2 LEU 18 HB2 LEU 18 -2.230 4.881 -4.565 140 HB3 LEU 18 HB1 LEU 18 -1.468 3.315 -4.599 141 HG LEU 18 HG LEU 18 -2.294 4.917 -2.221 142 HD11 LEU 18 HD11 LEU 18 -3.347 2.630 -1.770 143 HD12 LEU 18 HD12 LEU 18 -3.034 2.314 -3.470 144 HD13 LEU 18 HD13 LEU 18 -4.066 3.663 -2.997 145 HD21 LEU 18 HD21 LEU 18 -0.414 4.159 -1.260 146 HD22 LEU 18 HD22 LEU 18 -0.200 2.851 -2.418 147 HD23 LEU 18 HD23 LEU 18 -1.359 2.683 -1.101 148 H SER 19 HN SER 19 0.139 3.200 -6.063 149 HA SER 19 HA SER 19 1.768 1.299 -4.845 150 HB2 SER 19 HB2 SER 19 1.897 0.286 -6.964 151 HB3 SER 19 HB1 SER 19 0.371 1.165 -6.992 152 HG SER 19 HG SER 19 1.652 2.934 -7.983 153 H LEU 20 HN LEU 20 2.517 4.342 -6.189 154 HA LEU 20 HA LEU 20 5.329 3.782 -6.587 155 HB2 LEU 20 HB2 LEU 20 3.665 6.246 -6.951 156 HB3 LEU 20 HB1 LEU 20 5.373 6.179 -7.313 157 HG LEU 20 HG LEU 20 3.177 4.643 -8.660 158 HD11 LEU 20 HD11 LEU 20 3.511 7.022 -9.246 159 HD12 LEU 20 HD12 LEU 20 3.717 5.904 -10.588 160 HD13 LEU 20 HD13 LEU 20 5.129 6.612 -9.800 161 HD21 LEU 20 HD21 LEU 20 4.989 3.157 -8.488 162 HD22 LEU 20 HD22 LEU 20 6.156 4.405 -8.924 163 HD23 LEU 20 HD23 LEU 20 5.015 3.801 -10.129 164 H ASP 21 HN ASP 21 3.247 5.423 -4.274 165 HA ASP 21 HA ASP 21 5.431 6.436 -2.690 166 HB2 ASP 21 HB2 ASP 21 3.778 7.018 -1.040 167 HB3 ASP 21 HB1 ASP 21 3.288 7.551 -2.626 168 H ILE 22 HN ILE 22 3.392 3.555 -2.591 169 HA ILE 22 HA ILE 22 4.493 2.373 -0.312 170 HB ILE 22 HB ILE 22 3.097 1.434 -2.736 171 HG12 ILE 22 HG12 ILE 22 2.733 0.753 0.169 172 HG13 ILE 22 HG11 ILE 22 1.995 2.148 -0.614 173 HG21 ILE 22 HG21 ILE 22 4.561 -0.525 -0.998 174 HG22 ILE 22 HG22 ILE 22 4.907 -0.174 -2.686 175 HG23 ILE 22 HG23 ILE 22 3.379 -0.926 -2.236 176 HD11 ILE 22 HD11 ILE 22 1.553 -0.694 -1.498 177 HD12 ILE 22 HD12 ILE 22 0.677 0.752 -2.009 178 HD13 ILE 22 HD13 ILE 22 0.510 0.163 -0.357 179 H ASN 23 HN ASN 23 5.616 2.596 -3.605 180 HA ASN 23 HA ASN 23 7.760 0.769 -3.395 181 HB2 ASN 23 HB2 ASN 23 6.578 1.702 -5.465 182 HB3 ASN 23 HB1 ASN 23 7.552 3.138 -5.245 183 HD21 ASN 23 HD21 ASN 23 9.943 1.567 -4.407 184 HD22 ASN 23 HD22 ASN 23 10.528 0.837 -5.871 185 H LYS 24 HN LYS 24 7.260 3.965 -2.275 186 HA LYS 24 HA LYS 24 10.039 4.721 -2.143 187 HB2 LYS 24 HB2 LYS 24 7.450 5.925 -1.302 188 HB3 LYS 24 HB1 LYS 24 8.939 6.544 -0.608 189 HG2 LYS 24 HG2 LYS 24 9.753 7.174 -2.770 190 HG3 LYS 24 HG1 LYS 24 8.398 6.365 -3.565 191 HD2 LYS 24 HD2 LYS 24 6.844 7.948 -2.724 192 HD3 LYS 24 HD1 LYS 24 8.028 8.621 -1.605 193 HE2 LYS 24 HE2 LYS 24 8.189 8.779 -4.621 194 HE3 LYS 24 HE1 LYS 24 7.643 10.072 -3.551 195 HZ1 LYS 24 HZ1 LYS 24 9.931 10.411 -4.144 196 HZ2 LYS 24 HZ2 LYS 24 10.354 8.863 -3.614 197 HZ3 LYS 24 HZ3 LYS 24 9.845 10.027 -2.499 198 H LEU 25 HN LEU 25 7.866 2.924 -0.210 199 HA LEU 25 HA LEU 25 8.975 3.532 2.345 200 HB2 LEU 25 HB2 LEU 25 7.265 1.245 1.393 201 HB3 LEU 25 HB1 LEU 25 7.766 1.452 3.058 202 HG LEU 25 HG LEU 25 5.881 3.152 1.459 203 HD11 LEU 25 HD11 LEU 25 5.734 1.847 4.146 204 HD12 LEU 25 HD12 LEU 25 5.035 1.187 2.668 205 HD13 LEU 25 HD13 LEU 25 4.421 2.698 3.345 206 HD21 LEU 25 HD21 LEU 25 7.172 3.825 4.079 207 HD22 LEU 25 HD22 LEU 25 5.845 4.714 3.338 208 HD23 LEU 25 HD23 LEU 25 7.426 4.675 2.560 209 HA PRO 26 HA PRO 26 12.525 0.802 2.235 210 HB2 PRO 26 HB2 PRO 26 12.936 0.701 4.935 211 HB3 PRO 26 HB1 PRO 26 13.476 2.045 3.926 212 HG2 PRO 26 HG2 PRO 26 11.074 1.828 5.683 213 HG3 PRO 26 HG1 PRO 26 12.135 3.218 5.425 214 HD2 PRO 26 HD2 PRO 26 9.692 2.973 4.248 215 HD3 PRO 26 HD1 PRO 26 11.039 3.848 3.490 216 H GLY 27 HN GLY 27 13.007 -1.329 2.870 217 HA2 GLY 27 HA2 GLY 27 10.935 -3.108 2.544 218 HA3 GLY 27 HA1 GLY 27 12.518 -3.539 3.153 219 H GLU 28 HN GLU 28 12.162 -1.818 5.537 220 HA GLU 28 HA GLU 28 10.766 -3.716 7.156 221 HB2 GLU 28 HB2 GLU 28 11.255 -1.810 8.926 222 HB3 GLU 28 HB1 GLU 28 12.504 -2.916 8.383 223 HG2 GLU 28 HG2 GLU 28 12.077 -0.279 7.055 224 HG3 GLU 28 HG1 GLU 28 13.005 -0.413 8.538 225 H LYS 29 HN LYS 29 10.140 -0.387 6.121 226 HA LYS 29 HA LYS 29 7.802 -0.118 7.756 227 HB2 LYS 29 HB2 LYS 29 9.273 1.527 5.807 228 HB3 LYS 29 HB1 LYS 29 7.545 1.825 5.857 229 HG2 LYS 29 HG2 LYS 29 8.785 3.361 7.285 230 HG3 LYS 29 HG1 LYS 29 7.681 2.359 8.222 231 HD2 LYS 29 HD2 LYS 29 9.359 1.256 9.279 232 HD3 LYS 29 HD1 LYS 29 10.467 1.395 7.907 233 HE2 LYS 29 HE2 LYS 29 11.182 2.752 9.833 234 HE3 LYS 29 HE1 LYS 29 10.843 3.734 8.409 235 HZ1 LYS 29 HZ1 LYS 29 9.025 3.333 10.731 236 HZ2 LYS 29 HZ2 LYS 29 8.677 4.273 9.368 237 HZ3 LYS 29 HZ3 LYS 29 9.926 4.729 10.410 238 H LEU 30 HN LEU 30 8.491 -1.263 4.543 239 HA LEU 30 HA LEU 30 5.777 -0.957 3.670 240 HB2 LEU 30 HB2 LEU 30 6.594 -1.166 1.649 241 HB3 LEU 30 HB1 LEU 30 8.184 -1.220 2.363 242 HG LEU 30 HG LEU 30 6.537 -3.578 1.478 243 HD11 LEU 30 HD11 LEU 30 7.806 -1.942 -0.101 244 HD12 LEU 30 HD12 LEU 30 7.917 -3.682 -0.354 245 HD13 LEU 30 HD13 LEU 30 9.226 -2.822 0.457 246 HD21 LEU 30 HD21 LEU 30 9.146 -3.446 2.901 247 HD22 LEU 30 HD22 LEU 30 8.706 -4.818 1.901 248 HD23 LEU 30 HD23 LEU 30 7.735 -4.402 3.315 249 H GLY 31 HN GLY 31 7.423 -3.255 5.531 250 HA2 GLY 31 HA2 GLY 31 5.765 -5.511 5.096 251 HA3 GLY 31 HA1 GLY 31 6.581 -5.128 6.601 252 H ARG 32 HN ARG 32 5.208 -2.447 6.706 253 HA ARG 32 HA ARG 32 2.879 -3.226 8.130 254 HB2 ARG 32 HB2 ARG 32 3.941 -1.109 8.642 255 HB3 ARG 32 HB1 ARG 32 3.605 -0.514 7.025 256 HG2 ARG 32 HG2 ARG 32 1.725 0.348 7.844 257 HG3 ARG 32 HG1 ARG 32 1.134 -1.304 8.001 258 HD2 ARG 32 HD2 ARG 32 2.690 0.168 10.118 259 HD3 ARG 32 HD1 ARG 32 0.935 -0.006 10.096 260 HE ARG 32 HE ARG 32 2.807 -2.285 10.312 261 HH11 ARG 32 HH11 ARG 32 -0.203 -0.687 11.159 262 HH12 ARG 32 HH12 ARG 32 -0.688 -1.925 12.272 263 HH21 ARG 32 HH21 ARG 32 2.149 -3.922 11.765 264 HH22 ARG 32 HH22 ARG 32 0.641 -3.761 12.614 265 H VAL 33 HN VAL 33 3.282 -1.875 4.841 266 HA VAL 33 HA VAL 33 0.531 -1.685 4.281 267 HB VAL 33 HB VAL 33 1.673 -2.338 1.829 268 HG11 VAL 33 HG11 VAL 33 1.145 0.266 3.221 269 HG12 VAL 33 HG12 VAL 33 0.109 -0.592 2.079 270 HG13 VAL 33 HG13 VAL 33 1.596 0.159 1.522 271 HG21 VAL 33 HG21 VAL 33 3.525 -0.436 3.210 272 HG22 VAL 33 HG22 VAL 33 3.702 -1.184 1.622 273 HG23 VAL 33 HG23 VAL 33 3.892 -2.156 3.081 274 H VAL 34 HN VAL 34 2.794 -4.321 3.555 275 HA VAL 34 HA VAL 34 1.019 -6.249 2.671 276 HB VAL 34 HB VAL 34 2.666 -7.747 2.951 277 HG11 VAL 34 HG11 VAL 34 3.930 -5.872 2.215 278 HG12 VAL 34 HG12 VAL 34 4.904 -6.863 3.301 279 HG13 VAL 34 HG13 VAL 34 4.193 -5.356 3.879 280 HG21 VAL 34 HG21 VAL 34 2.111 -8.175 5.283 281 HG22 VAL 34 HG22 VAL 34 3.168 -6.843 5.770 282 HG23 VAL 34 HG23 VAL 34 3.853 -8.270 4.991 283 H HIS 35 HN HIS 35 1.610 -5.248 6.035 284 HA HIS 35 HA HIS 35 -0.084 -7.225 7.167 285 HB2 HIS 35 HB2 HIS 35 1.692 -6.143 8.469 286 HB3 HIS 35 HB1 HIS 35 0.863 -4.597 8.335 287 HD1 HIS 35 HD1 HIS 35 0.941 -7.726 10.296 288 HD2 HIS 35 HD2 HIS 35 -1.542 -4.417 9.885 289 HE1 HIS 35 HE1 HIS 35 -0.605 -7.792 12.275 290 HE2 HIS 35 HE2 HIS 35 -2.193 -5.869 11.927 291 H ILE 36 HN ILE 36 -0.551 -3.764 6.473 292 HA ILE 36 HA ILE 36 -3.198 -3.557 7.364 293 HB ILE 36 HB ILE 36 -1.906 -2.097 5.043 294 HG12 ILE 36 HG12 ILE 36 -2.280 -1.152 7.884 295 HG13 ILE 36 HG11 ILE 36 -0.815 -1.953 7.341 296 HG21 ILE 36 HG21 ILE 36 -3.726 -0.695 4.937 297 HG22 ILE 36 HG22 ILE 36 -4.127 -0.940 6.640 298 HG23 ILE 36 HG23 ILE 36 -4.529 -2.180 5.459 299 HD11 ILE 36 HD11 ILE 36 -0.638 -0.137 5.611 300 HD12 ILE 36 HD12 ILE 36 -0.391 0.356 7.281 301 HD13 ILE 36 HD13 ILE 36 -1.919 0.689 6.480 302 H ILE 37 HN ILE 37 -1.862 -4.336 4.229 303 HA ILE 37 HA ILE 37 -4.266 -4.719 2.856 304 HB ILE 37 HB ILE 37 -1.450 -5.578 2.441 305 HG12 ILE 37 HG12 ILE 37 -3.163 -3.903 0.649 306 HG13 ILE 37 HG11 ILE 37 -2.418 -3.218 2.085 307 HG21 ILE 37 HG21 ILE 37 -3.773 -6.795 1.271 308 HG22 ILE 37 HG22 ILE 37 -2.074 -7.263 1.148 309 HG23 ILE 37 HG23 ILE 37 -2.738 -6.060 0.045 310 HD11 ILE 37 HD11 ILE 37 -1.029 -2.742 0.243 311 HD12 ILE 37 HD12 ILE 37 -1.042 -4.435 -0.271 312 HD13 ILE 37 HD13 ILE 37 -0.225 -3.974 1.221 313 H GLN 38 HN GLN 38 -2.051 -7.293 4.069 314 HA GLN 38 HA GLN 38 -3.702 -9.457 3.624 315 HB2 GLN 38 HB2 GLN 38 -1.767 -9.015 5.911 316 HB3 GLN 38 HB1 GLN 38 -2.528 -10.560 5.565 317 HG2 GLN 38 HG2 GLN 38 -1.450 -10.588 3.375 318 HG3 GLN 38 HG1 GLN 38 -0.717 -9.034 3.734 319 HE21 GLN 38 HE21 GLN 38 -1.131 -11.608 6.069 320 HE22 GLN 38 HE22 GLN 38 0.550 -11.961 6.263 321 H SER 39 HN SER 39 -3.820 -7.216 6.369 322 HA SER 39 HA SER 39 -5.660 -8.832 7.860 323 HB2 SER 39 HB2 SER 39 -5.795 -6.898 9.381 324 HB3 SER 39 HB1 SER 39 -4.127 -7.296 8.996 325 HG SER 39 HG SER 39 -4.026 -5.567 7.620 326 H ARG 40 HN ARG 40 -5.953 -5.843 5.951 327 HA ARG 40 HA ARG 40 -8.802 -5.718 6.308 328 HB2 ARG 40 HB2 ARG 40 -6.942 -4.171 4.491 329 HB3 ARG 40 HB1 ARG 40 -8.659 -3.831 4.670 330 HG2 ARG 40 HG2 ARG 40 -8.329 -3.403 7.009 331 HG3 ARG 40 HG1 ARG 40 -6.620 -3.778 6.877 332 HD2 ARG 40 HD2 ARG 40 -6.547 -1.505 6.742 333 HD3 ARG 40 HD1 ARG 40 -6.739 -1.900 5.035 334 HE ARG 40 HE ARG 40 -9.206 -1.536 5.471 335 HH11 ARG 40 HH11 ARG 40 -6.712 0.128 7.291 336 HH12 ARG 40 HH12 ARG 40 -7.746 1.435 7.764 337 HH21 ARG 40 HH21 ARG 40 -10.592 0.170 6.152 338 HH22 ARG 40 HH22 ARG 40 -9.951 1.457 7.121 339 H GLU 41 HN GLU 41 -6.663 -7.253 4.168 340 HA GLU 41 HA GLU 41 -8.903 -8.122 2.461 341 HB2 GLU 41 HB2 GLU 41 -6.000 -8.330 1.710 342 HB3 GLU 41 HB1 GLU 41 -7.411 -8.394 0.661 343 HG2 GLU 41 HG2 GLU 41 -6.536 -5.930 2.130 344 HG3 GLU 41 HG1 GLU 41 -6.012 -6.345 0.499 345 HA PRO 42 HA PRO 42 -7.280 -11.637 5.038 346 HB2 PRO 42 HB2 PRO 42 -10.098 -12.492 5.062 347 HB3 PRO 42 HB1 PRO 42 -8.999 -12.229 6.418 348 HG2 PRO 42 HG2 PRO 42 -11.049 -10.561 5.896 349 HG3 PRO 42 HG1 PRO 42 -9.514 -9.989 6.574 350 HD2 PRO 42 HD2 PRO 42 -10.518 -9.835 3.759 351 HD3 PRO 42 HD1 PRO 42 -9.625 -8.625 4.704 352 H SER 43 HN SER 43 -8.991 -11.256 2.149 353 HA SER 43 HA SER 43 -9.158 -13.946 1.288 354 HB2 SER 43 HB2 SER 43 -9.229 -12.764 -1.016 355 HB3 SER 43 HB1 SER 43 -10.524 -12.424 0.131 356 HG SER 43 HG SER 43 -8.693 -10.739 -0.943 357 H LEU 44 HN LEU 44 -6.538 -11.762 1.658 358 HA LEU 44 HA LEU 44 -4.847 -13.629 0.146 359 HB2 LEU 44 HB2 LEU 44 -3.330 -11.761 -0.352 360 HB3 LEU 44 HB1 LEU 44 -4.917 -11.541 -1.030 361 HG LEU 44 HG LEU 44 -5.205 -10.140 1.233 362 HD11 LEU 44 HD11 LEU 44 -3.154 -8.779 1.462 363 HD12 LEU 44 HD12 LEU 44 -2.305 -9.958 0.464 364 HD13 LEU 44 HD13 LEU 44 -2.974 -10.440 2.024 365 HD21 LEU 44 HD21 LEU 44 -5.746 -9.355 -0.976 366 HD22 LEU 44 HD22 LEU 44 -4.038 -9.230 -1.394 367 HD23 LEU 44 HD23 LEU 44 -4.730 -8.160 -0.174 368 H LYS 45 HN LYS 45 -5.649 -13.494 3.061 369 HA LYS 45 HA LYS 45 -3.289 -12.856 4.523 370 HB2 LYS 45 HB2 LYS 45 -4.274 -13.969 6.396 371 HB3 LYS 45 HB1 LYS 45 -5.537 -13.072 5.574 372 HG2 LYS 45 HG2 LYS 45 -6.383 -15.105 4.574 373 HG3 LYS 45 HG1 LYS 45 -5.049 -16.026 5.280 374 HD2 LYS 45 HD2 LYS 45 -7.090 -14.511 6.889 375 HD3 LYS 45 HD1 LYS 45 -7.173 -16.239 6.532 376 HE2 LYS 45 HE2 LYS 45 -4.904 -16.462 7.535 377 HE3 LYS 45 HE1 LYS 45 -5.033 -14.787 8.065 378 HZ1 LYS 45 HZ1 LYS 45 -7.017 -15.385 9.327 379 HZ2 LYS 45 HZ2 LYS 45 -5.670 -16.270 9.836 380 HZ3 LYS 45 HZ3 LYS 45 -6.842 -17.002 8.860 381 H ASN 46 HN ASN 46 -4.206 -15.483 2.531 382 HA ASN 46 HA ASN 46 -2.475 -17.474 3.546 383 HB2 ASN 46 HB2 ASN 46 -2.747 -18.542 1.299 384 HB3 ASN 46 HB1 ASN 46 -4.293 -18.000 1.957 385 HD21 ASN 46 HD21 ASN 46 -5.407 -16.372 0.934 386 HD22 ASN 46 HD22 ASN 46 -4.940 -15.743 -0.615 387 H SER 47 HN SER 47 -1.939 -14.603 1.757 388 HA SER 47 HA SER 47 0.504 -15.407 0.501 389 HB2 SER 47 HB2 SER 47 -0.761 -12.696 0.926 390 HB3 SER 47 HB1 SER 47 0.707 -12.956 -0.021 391 HG SER 47 HG SER 47 -0.835 -14.632 -1.091 392 H ASN 48 HN ASN 48 2.559 -15.131 1.186 393 HA ASN 48 HA ASN 48 3.023 -14.765 3.983 394 HB2 ASN 48 HB2 ASN 48 4.998 -14.968 1.700 395 HB3 ASN 48 HB1 ASN 48 5.385 -15.114 3.405 396 HD21 ASN 48 HD21 ASN 48 4.844 -16.995 4.509 397 HD22 ASN 48 HD22 ASN 48 4.385 -18.446 3.682 398 HA PRO 49 HA PRO 49 3.374 -10.439 4.188 399 HB2 PRO 49 HB2 PRO 49 5.231 -10.209 6.200 400 HB3 PRO 49 HB1 PRO 49 3.525 -10.586 6.450 401 HG2 PRO 49 HG2 PRO 49 5.868 -12.431 6.345 402 HG3 PRO 49 HG1 PRO 49 4.479 -12.432 7.449 403 HD2 PRO 49 HD2 PRO 49 4.621 -14.132 5.381 404 HD3 PRO 49 HD1 PRO 49 3.077 -13.416 5.890 405 H ASP 50 HN ASP 50 6.384 -12.252 3.851 406 HA ASP 50 HA ASP 50 7.784 -9.841 2.976 407 HB2 ASP 50 HB2 ASP 50 8.770 -12.688 3.278 408 HB3 ASP 50 HB1 ASP 50 9.770 -11.326 2.800 409 H GLU 51 HN GLU 51 5.620 -11.654 1.565 410 HA GLU 51 HA GLU 51 6.877 -11.468 -1.074 411 HB2 GLU 51 HB2 GLU 51 5.487 -13.949 -0.019 412 HB3 GLU 51 HB1 GLU 51 6.009 -13.707 -1.672 413 HG2 GLU 51 HG2 GLU 51 8.067 -14.346 -1.232 414 HG3 GLU 51 HG1 GLU 51 8.168 -13.292 0.167 415 H ILE 52 HN ILE 52 4.881 -9.902 0.365 416 HA ILE 52 HA ILE 52 2.291 -10.755 -0.399 417 HB ILE 52 HB ILE 52 3.036 -9.132 1.538 418 HG12 ILE 52 HG12 ILE 52 0.707 -8.365 1.672 419 HG13 ILE 52 HG11 ILE 52 0.454 -8.831 -0.000 420 HG21 ILE 52 HG21 ILE 52 2.300 -7.258 -0.682 421 HG22 ILE 52 HG22 ILE 52 3.857 -7.349 0.135 422 HG23 ILE 52 HG23 ILE 52 2.430 -6.810 1.013 423 HD11 ILE 52 HD11 ILE 52 1.196 -10.684 2.203 424 HD12 ILE 52 HD12 ILE 52 0.778 -11.129 0.554 425 HD13 ILE 52 HD13 ILE 52 -0.439 -10.428 1.616 426 H GLU 53 HN GLU 53 0.874 -9.912 -1.796 427 HA GLU 53 HA GLU 53 2.029 -8.495 -4.106 428 HB2 GLU 53 HB2 GLU 53 -0.269 -10.465 -3.957 429 HB3 GLU 53 HB1 GLU 53 0.131 -9.536 -5.392 430 HG2 GLU 53 HG2 GLU 53 2.141 -11.330 -4.097 431 HG3 GLU 53 HG1 GLU 53 0.941 -11.962 -5.230 432 H ILE 54 HN ILE 54 1.527 -6.383 -3.566 433 HA ILE 54 HA ILE 54 -0.982 -5.708 -2.390 434 HB ILE 54 HB ILE 54 1.002 -3.897 -3.764 435 HG12 ILE 54 HG12 ILE 54 0.844 -4.789 -0.882 436 HG13 ILE 54 HG11 ILE 54 2.175 -5.030 -2.006 437 HG21 ILE 54 HG21 ILE 54 -1.159 -3.312 -1.780 438 HG22 ILE 54 HG22 ILE 54 -1.173 -2.896 -3.489 439 HG23 ILE 54 HG23 ILE 54 -0.004 -2.144 -2.405 440 HD11 ILE 54 HD11 ILE 54 2.711 -3.242 -0.446 441 HD12 ILE 54 HD12 ILE 54 1.237 -2.399 -0.900 442 HD13 ILE 54 HD13 ILE 54 2.530 -2.603 -2.078 443 H ASP 55 HN ASP 55 -2.694 -6.211 -3.636 444 HA ASP 55 HA ASP 55 -2.640 -5.539 -6.486 445 HB2 ASP 55 HB2 ASP 55 -3.292 -7.860 -5.807 446 HB3 ASP 55 HB1 ASP 55 -4.680 -7.181 -4.964 447 H PHE 56 HN PHE 56 -3.068 -3.426 -6.590 448 HA PHE 56 HA PHE 56 -4.635 -2.044 -4.715 449 HB2 PHE 56 HB2 PHE 56 -3.548 -1.224 -7.386 450 HB3 PHE 56 HB1 PHE 56 -4.329 -0.110 -6.269 451 HD1 PHE 56 HD1 PHE 56 -3.332 0.086 -3.952 452 HD2 PHE 56 HD2 PHE 56 -1.258 -1.696 -7.181 453 HE1 PHE 56 HE1 PHE 56 -1.250 0.436 -2.755 454 HE2 PHE 56 HE2 PHE 56 0.868 -1.343 -5.988 455 HZ PHE 56 HZ PHE 56 0.859 -0.258 -3.765 456 H GLU 57 HN GLU 57 -5.672 -3.907 -7.291 457 HA GLU 57 HA GLU 57 -8.046 -2.310 -7.804 458 HB2 GLU 57 HB2 GLU 57 -6.942 -4.844 -8.965 459 HB3 GLU 57 HB1 GLU 57 -8.600 -4.349 -9.288 460 HG2 GLU 57 HG2 GLU 57 -6.128 -2.744 -9.895 461 HG3 GLU 57 HG1 GLU 57 -7.085 -3.658 -11.059 462 H THR 58 HN THR 58 -7.097 -5.270 -6.163 463 HA THR 58 HA THR 58 -9.866 -5.786 -5.427 464 HB THR 58 HB THR 58 -8.885 -7.787 -4.237 465 HG1 THR 58 HG1 THR 58 -6.549 -7.009 -5.690 466 HG21 THR 58 HG21 THR 58 -8.412 -7.464 -7.200 467 HG22 THR 58 HG22 THR 58 -9.893 -8.024 -6.421 468 HG23 THR 58 HG23 THR 58 -8.431 -9.009 -6.351 469 H LEU 59 HN LEU 59 -6.995 -4.374 -4.094 470 HA LEU 59 HA LEU 59 -7.582 -4.406 -1.365 471 HB2 LEU 59 HB2 LEU 59 -6.301 -2.238 -2.998 472 HB3 LEU 59 HB1 LEU 59 -6.343 -2.280 -1.254 473 HG LEU 59 HG LEU 59 -4.985 -4.274 -3.045 474 HD11 LEU 59 HD11 LEU 59 -3.836 -2.337 -1.061 475 HD12 LEU 59 HD12 LEU 59 -3.856 -2.097 -2.807 476 HD13 LEU 59 HD13 LEU 59 -2.952 -3.439 -2.111 477 HD21 LEU 59 HD21 LEU 59 -5.487 -4.224 -0.084 478 HD22 LEU 59 HD22 LEU 59 -4.111 -5.084 -0.790 479 HD23 LEU 59 HD23 LEU 59 -5.751 -5.532 -1.248 480 H LYS 60 HN LYS 60 -9.195 -3.544 -0.226 481 HA LYS 60 HA LYS 60 -11.306 -2.128 -1.463 482 HB2 LYS 60 HB2 LYS 60 -10.611 -2.424 1.465 483 HB3 LYS 60 HB1 LYS 60 -12.121 -1.754 0.865 484 HG2 LYS 60 HG2 LYS 60 -12.612 -3.904 -0.227 485 HG3 LYS 60 HG1 LYS 60 -11.119 -4.559 0.441 486 HD2 LYS 60 HD2 LYS 60 -13.435 -3.496 2.051 487 HD3 LYS 60 HD1 LYS 60 -13.081 -5.199 1.768 488 HE2 LYS 60 HE2 LYS 60 -10.869 -4.844 2.865 489 HE3 LYS 60 HE1 LYS 60 -11.385 -3.208 3.264 490 HZ1 LYS 60 HZ1 LYS 60 -13.239 -4.159 4.515 491 HZ2 LYS 60 HZ2 LYS 60 -11.749 -4.678 5.121 492 HZ3 LYS 60 HZ3 LYS 60 -12.684 -5.718 4.171 493 HA PRO 61 HA PRO 61 -9.982 2.109 -1.689 494 HB2 PRO 61 HB2 PRO 61 -12.532 2.622 -0.223 495 HB3 PRO 61 HB1 PRO 61 -11.887 3.411 -1.665 496 HG2 PRO 61 HG2 PRO 61 -13.833 1.560 -1.795 497 HG3 PRO 61 HG1 PRO 61 -12.622 1.775 -3.066 498 HD2 PRO 61 HD2 PRO 61 -12.934 -0.423 -1.135 499 HD3 PRO 61 HD1 PRO 61 -12.053 -0.393 -2.675 500 H SER 62 HN SER 62 -11.471 0.963 1.299 501 HA SER 62 HA SER 62 -10.453 2.801 3.107 502 HB2 SER 62 HB2 SER 62 -10.758 -0.136 3.704 503 HB3 SER 62 HB1 SER 62 -11.018 1.233 4.785 504 HG SER 62 HG SER 62 -12.668 1.711 2.904 505 H THR 63 HN THR 63 -9.056 -0.362 2.162 506 HA THR 63 HA THR 63 -6.706 -0.165 3.680 507 HB THR 63 HB THR 63 -6.696 -1.539 1.009 508 HG1 THR 63 HG1 THR 63 -7.959 -3.214 1.854 509 HG21 THR 63 HG21 THR 63 -4.724 -2.179 1.962 510 HG22 THR 63 HG22 THR 63 -5.760 -3.317 2.835 511 HG23 THR 63 HG23 THR 63 -5.299 -1.796 3.590 512 H LEU 64 HN LEU 64 -7.398 0.696 0.311 513 HA LEU 64 HA LEU 64 -4.834 1.487 -0.431 514 HB2 LEU 64 HB2 LEU 64 -7.507 2.502 -1.378 515 HB3 LEU 64 HB1 LEU 64 -5.989 2.824 -2.180 516 HG LEU 64 HG LEU 64 -7.079 0.053 -1.743 517 HD11 LEU 64 HD11 LEU 64 -7.782 2.105 -3.670 518 HD12 LEU 64 HD12 LEU 64 -8.598 0.593 -3.279 519 HD13 LEU 64 HD13 LEU 64 -7.254 0.602 -4.422 520 HD21 LEU 64 HD21 LEU 64 -4.757 1.230 -3.224 521 HD22 LEU 64 HD22 LEU 64 -5.473 -0.303 -3.729 522 HD23 LEU 64 HD23 LEU 64 -4.797 -0.139 -2.108 523 H ARG 65 HN ARG 65 -7.476 3.443 0.943 524 HA ARG 65 HA ARG 65 -6.041 5.877 0.958 525 HB2 ARG 65 HB2 ARG 65 -8.359 4.925 2.628 526 HB3 ARG 65 HB1 ARG 65 -7.733 6.566 2.670 527 HG2 ARG 65 HG2 ARG 65 -8.829 5.218 0.213 528 HG3 ARG 65 HG1 ARG 65 -9.745 6.298 1.259 529 HD2 ARG 65 HD2 ARG 65 -8.158 8.101 0.781 530 HD3 ARG 65 HD1 ARG 65 -7.256 7.022 -0.277 531 HE ARG 65 HE ARG 65 -10.011 7.213 -1.022 532 HH11 ARG 65 HH11 ARG 65 -6.920 8.839 -1.264 533 HH12 ARG 65 HH12 ARG 65 -7.309 9.630 -2.762 534 HH21 ARG 65 HH21 ARG 65 -10.533 8.299 -2.975 535 HH22 ARG 65 HH22 ARG 65 -9.358 9.338 -3.715 536 H GLU 66 HN GLU 66 -6.208 3.175 3.183 537 HA GLU 66 HA GLU 66 -4.795 4.424 5.310 538 HB2 GLU 66 HB2 GLU 66 -6.148 2.470 5.740 539 HB3 GLU 66 HB1 GLU 66 -5.214 1.519 4.593 540 HG2 GLU 66 HG2 GLU 66 -4.573 0.917 6.807 541 HG3 GLU 66 HG1 GLU 66 -3.238 1.776 6.040 542 H LEU 67 HN LEU 67 -3.767 2.041 2.849 543 HA LEU 67 HA LEU 67 -1.063 1.929 3.276 544 HB2 LEU 67 HB2 LEU 67 -2.238 2.176 0.491 545 HB3 LEU 67 HB1 LEU 67 -0.846 1.228 1.005 546 HG LEU 67 HG LEU 67 -3.691 0.643 1.805 547 HD11 LEU 67 HD11 LEU 67 -2.177 -1.162 0.062 548 HD12 LEU 67 HD12 LEU 67 -2.737 0.339 -0.673 549 HD13 LEU 67 HD13 LEU 67 -3.893 -0.767 0.071 550 HD21 LEU 67 HD21 LEU 67 -1.358 -0.130 3.039 551 HD22 LEU 67 HD22 LEU 67 -1.710 -1.474 1.961 552 HD23 LEU 67 HD23 LEU 67 -2.910 -0.959 3.142 553 H GLU 68 HN GLU 68 -2.631 4.224 1.028 554 HA GLU 68 HA GLU 68 -0.555 5.945 0.443 555 HB2 GLU 68 HB2 GLU 68 -2.706 6.020 -0.613 556 HB3 GLU 68 HB1 GLU 68 -3.449 6.551 0.894 557 HG2 GLU 68 HG2 GLU 68 -3.099 8.320 -0.776 558 HG3 GLU 68 HG1 GLU 68 -2.339 8.653 0.776 559 H ARG 69 HN ARG 69 -2.986 6.577 2.998 560 HA ARG 69 HA ARG 69 -1.670 8.791 4.113 561 HB2 ARG 69 HB2 ARG 69 -3.754 6.895 5.049 562 HB3 ARG 69 HB1 ARG 69 -3.106 8.068 6.179 563 HG2 ARG 69 HG2 ARG 69 -3.974 9.100 3.556 564 HG3 ARG 69 HG1 ARG 69 -5.247 8.523 4.636 565 HD2 ARG 69 HD2 ARG 69 -4.859 10.904 4.938 566 HD3 ARG 69 HD1 ARG 69 -4.418 10.010 6.389 567 HE ARG 69 HE ARG 69 -2.074 10.207 5.068 568 HH11 ARG 69 HH11 ARG 69 -4.497 12.567 5.957 569 HH12 ARG 69 HH12 ARG 69 -3.349 13.855 6.139 570 HH21 ARG 69 HH21 ARG 69 -0.568 11.887 5.306 571 HH22 ARG 69 HH22 ARG 69 -1.115 13.475 5.756 572 H TYR 70 HN TYR 70 -1.165 5.400 4.586 573 HA TYR 70 HA TYR 70 0.284 5.663 7.027 574 HB2 TYR 70 HB2 TYR 70 -0.553 3.485 6.598 575 HB3 TYR 70 HB1 TYR 70 0.100 3.483 4.964 576 HD1 TYR 70 HD2 TYR 70 1.418 3.998 8.429 577 HD2 TYR 70 HD1 TYR 70 1.901 2.176 4.628 578 HE1 TYR 70 HE2 TYR 70 3.521 2.990 9.198 579 HE2 TYR 70 HE1 TYR 70 3.985 1.139 5.379 580 HH TYR 70 HH TYR 70 4.983 1.170 8.677 581 H VAL 71 HN VAL 71 1.233 5.225 3.614 582 HA VAL 71 HA VAL 71 3.999 5.334 4.106 583 HB VAL 71 HB VAL 71 4.353 5.680 1.795 584 HG11 VAL 71 HG11 VAL 71 2.536 4.210 0.712 585 HG12 VAL 71 HG12 VAL 71 1.982 3.979 2.373 586 HG13 VAL 71 HG13 VAL 71 3.620 3.516 1.912 587 HG21 VAL 71 HG21 VAL 71 2.767 6.488 0.252 588 HG22 VAL 71 HG22 VAL 71 2.889 7.635 1.581 589 HG23 VAL 71 HG23 VAL 71 1.506 6.543 1.478 590 H THR 72 HN THR 72 1.542 7.821 3.740 591 HA THR 72 HA THR 72 3.317 9.931 3.217 592 HB THR 72 HB THR 72 1.533 11.479 3.850 593 HG1 THR 72 HG1 THR 72 0.493 9.205 5.082 594 HG21 THR 72 HG21 THR 72 1.049 9.155 2.075 595 HG22 THR 72 HG22 THR 72 1.279 10.861 1.667 596 HG23 THR 72 HG23 THR 72 -0.264 10.310 2.325 597 H SER 73 HN SER 73 2.369 8.350 6.155 598 HA SER 73 HA SER 73 3.323 10.345 7.943 599 HB2 SER 73 HB2 SER 73 2.951 8.763 9.664 600 HB3 SER 73 HB1 SER 73 1.724 8.412 8.442 601 HG SER 73 HG SER 73 2.964 6.679 7.731 602 H CYS 74 HN CYS 74 4.784 8.026 5.942 603 HA CYS 74 HA CYS 74 7.401 8.329 7.220 604 HB2 CYS 74 HB2 CYS 74 6.964 6.068 6.625 605 HB3 CYS 74 HB1 CYS 74 6.392 6.531 5.026 606 HG CYS 74 HG CYS 74 9.502 7.535 5.439 607 H LEU 75 HN LEU 75 5.968 8.617 4.010 608 HA LEU 75 HA LEU 75 8.282 9.708 2.815 609 HB2 LEU 75 HB2 LEU 75 5.431 9.771 1.840 610 HB3 LEU 75 HB1 LEU 75 6.864 9.911 0.847 611 HG LEU 75 HG LEU 75 5.853 7.487 2.292 612 HD11 LEU 75 HD11 LEU 75 5.009 8.132 0.009 613 HD12 LEU 75 HD12 LEU 75 5.714 6.524 0.151 614 HD13 LEU 75 HD13 LEU 75 6.641 7.831 -0.578 615 HD21 LEU 75 HD21 LEU 75 7.871 6.342 1.801 616 HD22 LEU 75 HD22 LEU 75 8.327 7.828 2.615 617 HD23 LEU 75 HD23 LEU 75 8.494 7.697 0.866 618 H ARG 76 HN ARG 76 5.347 11.177 4.091 619 HA ARG 76 HA ARG 76 6.263 13.771 3.132 620 HB2 ARG 76 HB2 ARG 76 3.600 12.933 4.242 621 HB3 ARG 76 HB1 ARG 76 3.995 14.559 3.692 622 HG2 ARG 76 HG2 ARG 76 4.523 13.592 1.458 623 HG3 ARG 76 HG1 ARG 76 3.933 12.046 2.063 624 HD2 ARG 76 HD2 ARG 76 2.181 13.098 0.831 625 HD3 ARG 76 HD1 ARG 76 1.786 13.092 2.544 626 HE ARG 76 HE ARG 76 2.846 15.506 2.314 627 HH11 ARG 76 HH11 ARG 76 0.549 13.862 0.243 628 HH12 ARG 76 HH12 ARG 76 -0.228 15.323 -0.270 629 HH21 ARG 76 HH21 ARG 76 1.812 17.439 1.638 630 HH22 ARG 76 HH22 ARG 76 0.492 17.353 0.518 631 H LYS 77 HN LYS 77 7.062 12.064 5.631 632 HA LYS 77 HA LYS 77 6.995 14.332 7.498 633 HB2 LYS 77 HB2 LYS 77 5.232 12.803 8.222 634 HB3 LYS 77 HB1 LYS 77 6.343 11.447 8.179 635 HG2 LYS 77 HG2 LYS 77 7.618 12.392 10.012 636 HG3 LYS 77 HG1 LYS 77 6.557 13.803 10.033 637 HD2 LYS 77 HD2 LYS 77 4.676 12.449 10.664 638 HD3 LYS 77 HD1 LYS 77 5.613 10.970 10.456 639 HE2 LYS 77 HE2 LYS 77 5.383 11.559 12.816 640 HE3 LYS 77 HE1 LYS 77 7.067 11.613 12.299 641 HZ1 LYS 77 HZ1 LYS 77 6.900 14.011 12.126 642 HZ2 LYS 77 HZ2 LYS 77 6.491 13.505 13.684 643 HZ3 LYS 77 HZ3 LYS 77 5.278 13.965 12.599 644 H LYS 78 HN LYS 78 8.731 11.616 6.180 645 HA LYS 78 HA LYS 78 11.237 12.560 7.087 646 HB2 LYS 78 HB2 LYS 78 10.227 11.510 9.179 647 HB3 LYS 78 HB1 LYS 78 10.364 9.966 8.358 648 HG2 LYS 78 HG2 LYS 78 12.245 10.195 9.794 649 HG3 LYS 78 HG1 LYS 78 12.812 10.384 8.135 650 HD2 LYS 78 HD2 LYS 78 12.873 12.789 8.389 651 HD3 LYS 78 HD1 LYS 78 12.186 12.663 10.007 652 HE2 LYS 78 HE2 LYS 78 14.599 13.025 10.093 653 HE3 LYS 78 HE1 LYS 78 14.160 11.458 10.768 654 HZ1 LYS 78 HZ1 LYS 78 14.842 10.403 8.727 655 HZ2 LYS 78 HZ2 LYS 78 16.113 11.340 9.328 656 HZ3 LYS 78 HZ3 LYS 78 15.197 11.898 8.023 657 H ARG 79 HN ARG 79 11.493 12.312 4.791 658 HA ARG 79 HA ARG 79 11.012 9.847 3.467 659 HB2 ARG 79 HB2 ARG 79 12.361 10.854 1.602 660 HB3 ARG 79 HB1 ARG 79 10.978 11.795 2.127 661 HG2 ARG 79 HG2 ARG 79 12.562 13.426 1.885 662 HG3 ARG 79 HG1 ARG 79 12.737 13.041 3.594 663 HD2 ARG 79 HD2 ARG 79 14.642 11.599 3.079 664 HD3 ARG 79 HD1 ARG 79 14.459 11.963 1.364 665 HE ARG 79 HE ARG 79 14.726 14.371 2.786 666 HH11 ARG 79 HH11 ARG 79 16.643 11.578 1.888 667 HH12 ARG 79 HH12 ARG 79 18.138 12.451 1.877 668 HH21 ARG 79 HH21 ARG 79 16.700 15.519 2.769 669 HH22 ARG 79 HH22 ARG 79 18.171 14.688 2.376 670 H LYS 80 HN LYS 80 12.269 8.175 2.943 671 HA LYS 80 HA LYS 80 13.835 6.576 3.258 672 HB2 LYS 80 HB2 LYS 80 15.670 8.972 3.118 673 HB3 LYS 80 HB1 LYS 80 16.211 7.301 3.037 674 HG2 LYS 80 HG2 LYS 80 14.324 8.605 1.086 675 HG3 LYS 80 HG1 LYS 80 16.050 8.356 0.825 676 HD2 LYS 80 HD2 LYS 80 15.741 5.943 0.979 677 HD3 LYS 80 HD1 LYS 80 14.021 6.171 1.297 678 HE2 LYS 80 HE2 LYS 80 13.743 7.198 -0.899 679 HE3 LYS 80 HE1 LYS 80 15.466 7.006 -1.214 680 HZ1 LYS 80 HZ1 LYS 80 15.205 4.626 -1.126 681 HZ2 LYS 80 HZ2 LYS 80 14.122 5.265 -2.255 682 HZ3 LYS 80 HZ3 LYS 80 13.568 4.776 -0.734 683 HA PRO 81 HA PRO 81 14.490 7.302 7.751 684 HB2 PRO 81 HB2 PRO 81 12.329 6.179 8.800 685 HB3 PRO 81 HB1 PRO 81 12.224 7.780 8.057 686 HG2 PRO 81 HG2 PRO 81 11.322 5.146 7.012 687 HG3 PRO 81 HG1 PRO 81 10.617 6.752 6.771 688 HD2 PRO 81 HD2 PRO 81 12.351 5.354 5.006 689 HD3 PRO 81 HD1 PRO 81 11.796 7.032 4.853 690 H GLN 82 HN GLN 82 15.555 5.246 6.017 691 HA GLN 82 HA GLN 82 15.152 2.773 7.508 692 HB2 GLN 82 HB2 GLN 82 15.307 2.684 5.047 693 HB3 GLN 82 HB1 GLN 82 16.926 3.357 5.129 694 HG2 GLN 82 HG2 GLN 82 17.764 1.408 6.207 695 HG3 GLN 82 HG1 GLN 82 16.139 0.751 6.400 696 HE21 GLN 82 HE21 GLN 82 15.095 -0.142 4.646 697 HE22 GLN 82 HE22 GLN 82 15.919 -0.528 3.171 698 H ALA 83 HN ALA 83 17.891 4.801 6.517 699 HA ALA 83 HA ALA 83 19.898 5.263 7.477 700 HB1 ALA 83 HB1 ALA 83 18.204 5.227 9.971 701 HB2 ALA 83 HB2 ALA 83 18.399 6.590 8.869 702 HB3 ALA 83 HB3 ALA 83 19.778 6.004 9.801 703 H1 VAL 201 HT1 VAL 201 -5.195 0.755 -16.001 704 H2 VAL 201 HT2 VAL 201 -5.344 -0.301 -17.314 705 H3 VAL 201 HT3 VAL 201 -3.855 0.417 -16.972 706 HA VAL 201 HA VAL 201 -5.267 -1.482 -15.200 707 HB VAL 201 HB VAL 201 -4.408 -2.520 -17.300 708 HG11 VAL 201 HG11 VAL 201 -1.985 -2.708 -17.640 709 HG12 VAL 201 HG12 VAL 201 -1.721 -1.592 -16.300 710 HG13 VAL 201 HG13 VAL 201 -2.547 -1.040 -17.757 711 HG21 VAL 201 HG21 VAL 201 -2.990 -3.300 -14.758 712 HG22 VAL 201 HG22 VAL 201 -3.081 -4.302 -16.205 713 HG23 VAL 201 HG23 VAL 201 -4.552 -3.888 -15.327 714 H VAL 202 HN VAL 202 -4.188 -1.924 -13.261 715 HA VAL 202 HA VAL 202 -1.962 -0.109 -12.636 716 HB VAL 202 HB VAL 202 -3.925 -1.470 -10.777 717 HG11 VAL 202 HG11 VAL 202 -1.542 0.264 -10.122 718 HG12 VAL 202 HG12 VAL 202 -1.738 -1.445 -9.732 719 HG13 VAL 202 HG13 VAL 202 -2.777 -0.241 -8.969 720 HG21 VAL 202 HG21 VAL 202 -3.421 1.461 -11.273 721 HG22 VAL 202 HG22 VAL 202 -4.675 0.756 -10.249 722 HG23 VAL 202 HG23 VAL 202 -4.738 0.537 -11.999 723 HA PRO 203 HA PRO 203 0.543 -3.816 -12.834 724 HB2 PRO 203 HB2 PRO 203 2.813 -2.610 -11.850 725 HB3 PRO 203 HB1 PRO 203 2.320 -2.571 -13.545 726 HG2 PRO 203 HG2 PRO 203 1.964 -0.504 -11.421 727 HG3 PRO 203 HG1 PRO 203 2.381 -0.295 -13.131 728 HD2 PRO 203 HD2 PRO 203 -0.102 0.164 -12.198 729 HD3 PRO 203 HD1 PRO 203 0.186 -0.499 -13.820 730 H LYS 204 HN LYS 204 0.710 -5.375 -11.376 731 HA LYS 204 HA LYS 204 -0.111 -4.894 -8.688 732 HB2 LYS 204 HB2 LYS 204 1.046 -7.430 -9.860 733 HB3 LYS 204 HB1 LYS 204 0.068 -7.289 -8.404 734 HG2 LYS 204 HG2 LYS 204 -0.828 -6.801 -11.240 735 HG3 LYS 204 HG1 LYS 204 -1.288 -8.145 -10.191 736 HD2 LYS 204 HD2 LYS 204 -2.430 -6.628 -8.685 737 HD3 LYS 204 HD1 LYS 204 -1.893 -5.241 -9.631 738 HE2 LYS 204 HE2 LYS 204 -3.670 -7.447 -10.665 739 HE3 LYS 204 HE1 LYS 204 -4.245 -5.891 -10.068 740 HZ1 LYS 204 HZ1 LYS 204 -2.968 -4.800 -11.821 741 HZ2 LYS 204 HZ2 LYS 204 -4.088 -5.893 -12.467 742 HZ3 LYS 204 HZ3 LYS 204 -2.453 -6.305 -12.397 743 H LYS 205 HN LYS 205 1.111 -4.423 -6.981 744 HA LYS 205 HA LYS 205 3.945 -4.102 -7.453 745 HB2 LYS 205 HB2 LYS 205 2.643 -2.287 -6.419 746 HB3 LYS 205 HB1 LYS 205 2.277 -3.331 -5.055 747 HG2 LYS 205 HG2 LYS 205 4.058 -1.789 -4.498 748 HG3 LYS 205 HG1 LYS 205 4.659 -3.449 -4.507 749 HD2 LYS 205 HD2 LYS 205 5.509 -3.077 -6.806 750 HD3 LYS 205 HD1 LYS 205 5.003 -1.393 -6.686 751 HE2 LYS 205 HE2 LYS 205 6.502 -1.070 -4.793 752 HE3 LYS 205 HE1 LYS 205 6.995 -2.763 -4.887 753 HZ1 LYS 205 HZ1 LYS 205 7.725 -2.265 -7.228 754 HZ2 LYS 205 HZ2 LYS 205 8.647 -1.529 -6.010 755 HZ3 LYS 205 HZ3 LYS 205 7.511 -0.619 -6.873 756 H LYS 206 HN LYS 206 5.256 -5.727 -7.104 757 HA LYS 206 HA LYS 206 4.683 -7.765 -5.158 758 HB2 LYS 206 HB2 LYS 206 7.036 -7.313 -6.990 759 HB3 LYS 206 HB1 LYS 206 6.936 -8.657 -5.861 760 HG2 LYS 206 HG2 LYS 206 4.819 -9.343 -6.975 761 HG3 LYS 206 HG1 LYS 206 5.113 -8.091 -8.183 762 HD2 LYS 206 HD2 LYS 206 7.131 -9.156 -8.894 763 HD3 LYS 206 HD1 LYS 206 7.060 -10.301 -7.550 764 HE2 LYS 206 HE2 LYS 206 5.039 -10.096 -9.779 765 HE3 LYS 206 HE1 LYS 206 6.323 -11.301 -9.676 766 HZ1 LYS 206 HZ1 LYS 206 5.344 -12.206 -7.715 767 HZ2 LYS 206 HZ2 LYS 206 4.127 -12.088 -8.882 768 HZ3 LYS 206 HZ3 LYS 206 4.200 -10.960 -7.620 769 H ILE 207 HN ILE 207 6.060 -8.318 -3.429 770 HA ILE 207 HA ILE 207 7.598 -6.107 -2.263 771 HB ILE 207 HB ILE 207 5.328 -7.565 -0.906 772 HG12 ILE 207 HG12 ILE 207 4.760 -5.778 -2.651 773 HG13 ILE 207 HG11 ILE 207 4.035 -5.604 -1.057 774 HG21 ILE 207 HG21 ILE 207 6.890 -5.248 0.191 775 HG22 ILE 207 HG22 ILE 207 7.296 -6.929 0.535 776 HG23 ILE 207 HG23 ILE 207 5.733 -6.279 1.033 777 HD11 ILE 207 HD11 ILE 207 6.432 -4.108 -2.087 778 HD12 ILE 207 HD12 ILE 207 5.706 -3.916 -0.493 779 HD13 ILE 207 HD13 ILE 207 4.796 -3.473 -1.937 780 H LYS 208 HN LYS 208 9.424 -6.885 -1.337 781 HA LYS 208 HA LYS 208 9.490 -9.662 -0.412 782 HB2 LYS 208 HB2 LYS 208 11.642 -8.499 -2.192 783 HB3 LYS 208 HB1 LYS 208 11.512 -10.155 -1.621 784 HG2 LYS 208 HG2 LYS 208 9.382 -10.343 -2.928 785 HG3 LYS 208 HG1 LYS 208 9.752 -8.767 -3.625 786 HD2 LYS 208 HD2 LYS 208 10.501 -10.426 -5.163 787 HD3 LYS 208 HD1 LYS 208 11.933 -9.730 -4.402 788 HE2 LYS 208 HE2 LYS 208 12.150 -11.620 -2.945 789 HE3 LYS 208 HE1 LYS 208 10.612 -12.281 -3.493 790 HZ1 LYS 208 HZ1 LYS 208 11.566 -12.581 -5.687 791 HZ2 LYS 208 HZ2 LYS 208 12.484 -13.398 -4.525 792 HZ3 LYS 208 HZ3 LYS 208 13.039 -11.936 -5.164 793 H LYS 209 HN LYS 209 12.290 -9.697 0.129 794 HA LYS 209 HA LYS 209 12.518 -8.280 2.539 795 HB2 LYS 209 HB2 LYS 209 14.648 -9.393 0.705 796 HB3 LYS 209 HB1 LYS 209 15.006 -8.683 2.270 797 HG2 LYS 209 HG2 LYS 209 13.722 -10.387 3.387 798 HG3 LYS 209 HG1 LYS 209 13.219 -11.069 1.838 799 HD2 LYS 209 HD2 LYS 209 15.019 -12.395 2.749 800 HD3 LYS 209 HD1 LYS 209 15.602 -11.529 1.327 801 HE2 LYS 209 HE2 LYS 209 16.621 -9.841 2.776 802 HE3 LYS 209 HE1 LYS 209 16.036 -10.701 4.196 803 HZ1 LYS 209 HZ1 LYS 209 17.378 -12.625 3.454 804 HZ2 LYS 209 HZ2 LYS 209 18.307 -11.268 3.840 805 HZ3 LYS 209 HZ3 LYS 209 18.029 -11.666 2.223 806 H GLU 210 HN GLU 210 13.695 -7.569 -0.697 807 HA GLU 210 HA GLU 210 14.140 -4.771 0.101 808 HB2 GLU 210 HB2 GLU 210 15.306 -6.311 -2.231 809 HB3 GLU 210 HB1 GLU 210 15.644 -4.631 -1.840 810 HG2 GLU 210 HG2 GLU 210 16.686 -5.294 0.240 811 HG3 GLU 210 HG1 GLU 210 16.290 -6.981 -0.077 812 H GLN 211 HN GLN 211 13.197 -3.162 -1.140 813 HA GLN 211 HA GLN 211 10.765 -3.811 -2.424 814 HB2 GLN 211 HB2 GLN 211 10.787 -1.377 -3.110 815 HB3 GLN 211 HB1 GLN 211 10.889 -1.688 -1.383 816 HG2 GLN 211 HG2 GLN 211 13.141 -1.092 -1.287 817 HG3 GLN 211 HG1 GLN 211 13.347 -1.243 -3.032 818 HE21 GLN 211 HE21 GLN 211 12.027 0.717 -0.464 819 HE22 GLN 211 HE22 GLN 211 11.865 2.164 -1.394 820 H VAL 212 HN VAL 212 10.306 -4.266 -4.464 821 HA VAL 212 HA VAL 212 12.422 -4.359 -6.430 822 HB VAL 212 HB VAL 212 10.672 -5.318 -7.925 823 HG11 VAL 212 HG11 VAL 212 12.071 -6.772 -6.553 824 HG12 VAL 212 HG12 VAL 212 10.446 -7.436 -6.716 825 HG13 VAL 212 HG13 VAL 212 10.924 -6.632 -5.221 826 HG21 VAL 212 HG21 VAL 212 8.922 -5.075 -5.480 827 HG22 VAL 212 HG22 VAL 212 8.508 -5.940 -6.959 828 HG23 VAL 212 HG23 VAL 212 8.724 -4.191 -6.994 829 H GLU 213 HN GLU 213 11.762 -3.594 -8.720 830 HA GLU 213 HA GLU 213 11.648 -1.809 -10.094 831 HB2 GLU 213 HB2 GLU 213 9.406 -1.058 -8.228 832 HB3 GLU 213 HB1 GLU 213 9.869 -0.043 -9.582 833 HG2 GLU 213 HG2 GLU 213 8.085 -1.289 -10.383 834 HG3 GLU 213 HG1 GLU 213 9.504 -2.103 -11.034 Start of MODEL 9 1 H1 SER 1 HT1 SER 1 -22.963 3.243 9.872 2 H2 SER 1 HT2 SER 1 -24.593 2.784 9.788 3 H3 SER 1 HT3 SER 1 -24.143 4.360 9.392 4 HA SER 1 HA SER 1 -23.362 1.931 7.921 5 HB2 SER 1 HB2 SER 1 -25.247 4.135 7.076 6 HB3 SER 1 HB1 SER 1 -24.931 2.616 6.233 7 HG SER 1 HG SER 1 -26.786 2.269 7.344 8 H GLU 2 HN GLU 2 -22.238 4.774 8.954 9 HA GLU 2 HA GLU 2 -21.099 5.607 6.397 10 HB2 GLU 2 HB2 GLU 2 -21.281 6.894 9.101 11 HB3 GLU 2 HB1 GLU 2 -20.208 7.513 7.861 12 HG2 GLU 2 HG2 GLU 2 -22.199 7.702 6.357 13 HG3 GLU 2 HG1 GLU 2 -23.199 7.296 7.751 14 H GLU 3 HN GLU 3 -20.357 3.578 8.910 15 HA GLU 3 HA GLU 3 -17.691 4.172 9.514 16 HB2 GLU 3 HB2 GLU 3 -18.868 1.387 9.426 17 HB3 GLU 3 HB1 GLU 3 -17.518 1.933 10.404 18 HG2 GLU 3 HG2 GLU 3 -19.264 1.801 11.915 19 HG3 GLU 3 HG1 GLU 3 -19.219 3.514 11.503 20 H GLU 4 HN GLU 4 -19.039 1.968 7.074 21 HA GLU 4 HA GLU 4 -16.450 1.257 6.065 22 HB2 GLU 4 HB2 GLU 4 -19.252 0.710 5.097 23 HB3 GLU 4 HB1 GLU 4 -17.827 0.173 4.219 24 HG2 GLU 4 HG2 GLU 4 -18.487 -0.565 7.059 25 HG3 GLU 4 HG1 GLU 4 -18.799 -1.572 5.646 26 H ASP 5 HN ASP 5 -18.875 3.643 5.244 27 HA ASP 5 HA ASP 5 -17.575 4.140 2.672 28 HB2 ASP 5 HB2 ASP 5 -20.087 3.901 2.862 29 HB3 ASP 5 HB1 ASP 5 -20.087 5.430 3.732 30 H LYS 6 HN LYS 6 -16.998 5.028 5.678 31 HA LYS 6 HA LYS 6 -16.728 7.858 5.486 32 HB2 LYS 6 HB2 LYS 6 -16.792 6.482 7.624 33 HB3 LYS 6 HB1 LYS 6 -15.150 5.978 7.263 34 HG2 LYS 6 HG2 LYS 6 -15.079 7.736 8.872 35 HG3 LYS 6 HG1 LYS 6 -14.449 8.353 7.345 36 HD2 LYS 6 HD2 LYS 6 -16.506 9.504 6.896 37 HD3 LYS 6 HD1 LYS 6 -17.290 8.743 8.281 38 HE2 LYS 6 HE2 LYS 6 -15.735 9.894 9.785 39 HE3 LYS 6 HE1 LYS 6 -14.963 10.657 8.397 40 HZ1 LYS 6 HZ1 LYS 6 -16.999 11.808 7.903 41 HZ2 LYS 6 HZ2 LYS 6 -16.570 12.113 9.507 42 HZ3 LYS 6 HZ3 LYS 6 -17.810 11.019 9.158 43 H CYS 7 HN CYS 7 -15.003 5.176 4.312 44 HA CYS 7 HA CYS 7 -12.493 6.529 3.924 45 HB2 CYS 7 HB2 CYS 7 -13.504 3.893 2.842 46 HB3 CYS 7 HB1 CYS 7 -11.837 4.466 2.762 47 HG CYS 7 HG CYS 7 -12.599 2.423 4.809 48 H LYS 8 HN LYS 8 -11.635 7.184 1.937 49 HA LYS 8 HA LYS 8 -13.710 8.023 0.043 50 HB2 LYS 8 HB2 LYS 8 -10.932 8.999 0.643 51 HB3 LYS 8 HB1 LYS 8 -11.696 9.388 -0.888 52 HG2 LYS 8 HG2 LYS 8 -12.001 11.197 0.639 53 HG3 LYS 8 HG1 LYS 8 -13.549 10.431 0.298 54 HD2 LYS 8 HD2 LYS 8 -13.318 9.171 2.436 55 HD3 LYS 8 HD1 LYS 8 -11.852 10.094 2.771 56 HE2 LYS 8 HE2 LYS 8 -14.642 11.185 2.436 57 HE3 LYS 8 HE1 LYS 8 -13.725 11.080 3.937 58 HZ1 LYS 8 HZ1 LYS 8 -12.120 12.640 3.020 59 HZ2 LYS 8 HZ2 LYS 8 -13.672 13.311 3.023 60 HZ3 LYS 8 HZ3 LYS 8 -13.003 12.738 1.580 61 HA PRO 9 HA PRO 9 -12.584 5.082 -2.981 62 HB2 PRO 9 HB2 PRO 9 -13.495 6.419 -5.187 63 HB3 PRO 9 HB1 PRO 9 -14.547 5.560 -4.058 64 HG2 PRO 9 HG2 PRO 9 -13.967 8.477 -4.273 65 HG3 PRO 9 HG1 PRO 9 -15.494 7.659 -3.895 66 HD2 PRO 9 HD2 PRO 9 -13.905 8.821 -2.004 67 HD3 PRO 9 HD1 PRO 9 -14.955 7.437 -1.658 68 H MET 10 HN MET 10 -10.646 4.700 -3.885 69 HA MET 10 HA MET 10 -8.924 6.977 -4.487 70 HB2 MET 10 HB2 MET 10 -8.086 5.120 -3.044 71 HB3 MET 10 HB1 MET 10 -8.222 4.036 -4.425 72 HG2 MET 10 HG2 MET 10 -6.020 4.575 -4.561 73 HG3 MET 10 HG1 MET 10 -6.711 5.843 -5.577 74 HE1 MET 10 HE1 MET 10 -5.930 4.832 -2.082 75 HE2 MET 10 HE2 MET 10 -5.312 6.266 -1.268 76 HE3 MET 10 HE3 MET 10 -4.284 5.379 -2.391 77 H SER 11 HN SER 11 -8.640 7.654 -6.538 78 HA SER 11 HA SER 11 -9.834 6.167 -8.695 79 HB2 SER 11 HB2 SER 11 -9.021 8.108 -10.093 80 HB3 SER 11 HB1 SER 11 -10.102 8.534 -8.768 81 HG SER 11 HG SER 11 -8.242 9.114 -7.540 82 H TYR 12 HN TYR 12 -8.383 6.286 -10.903 83 HA TYR 12 HA TYR 12 -6.593 4.150 -10.446 84 HB2 TYR 12 HB2 TYR 12 -6.750 3.743 -12.641 85 HB3 TYR 12 HB1 TYR 12 -8.066 4.905 -12.560 86 HD1 TYR 12 HD1 TYR 12 -4.466 4.592 -13.320 87 HD2 TYR 12 HD2 TYR 12 -8.029 6.811 -13.926 88 HE1 TYR 12 HE1 TYR 12 -3.355 5.857 -15.122 89 HE2 TYR 12 HE2 TYR 12 -6.931 8.103 -15.706 90 HH TYR 12 HH TYR 12 -4.564 8.713 -16.355 91 H GLU 13 HN GLU 13 -5.940 7.456 -11.626 92 HA GLU 13 HA GLU 13 -3.170 7.444 -11.569 93 HB2 GLU 13 HB2 GLU 13 -3.426 9.946 -11.062 94 HB3 GLU 13 HB1 GLU 13 -4.396 9.408 -12.441 95 HG2 GLU 13 HG2 GLU 13 -6.350 9.326 -11.120 96 HG3 GLU 13 HG1 GLU 13 -5.450 9.679 -9.644 97 H GLU 14 HN GLU 14 -5.406 7.630 -8.908 98 HA GLU 14 HA GLU 14 -3.465 8.437 -6.992 99 HB2 GLU 14 HB2 GLU 14 -6.279 7.455 -6.892 100 HB3 GLU 14 HB1 GLU 14 -5.352 7.644 -5.409 101 HG2 GLU 14 HG2 GLU 14 -4.965 10.017 -6.038 102 HG3 GLU 14 HG1 GLU 14 -6.027 9.778 -7.423 103 H LYS 15 HN LYS 15 -5.075 5.358 -7.767 104 HA LYS 15 HA LYS 15 -3.648 3.752 -5.971 105 HB2 LYS 15 HB2 LYS 15 -4.794 3.078 -8.677 106 HB3 LYS 15 HB1 LYS 15 -4.086 1.881 -7.601 107 HG2 LYS 15 HG2 LYS 15 -5.795 1.957 -6.117 108 HG3 LYS 15 HG1 LYS 15 -6.234 3.610 -6.551 109 HD2 LYS 15 HD2 LYS 15 -7.427 2.982 -8.375 110 HD3 LYS 15 HD1 LYS 15 -6.482 1.518 -8.634 111 HE2 LYS 15 HE2 LYS 15 -7.511 0.570 -6.607 112 HE3 LYS 15 HE1 LYS 15 -8.550 1.988 -6.492 113 HZ1 LYS 15 HZ1 LYS 15 -9.673 0.140 -7.569 114 HZ2 LYS 15 HZ2 LYS 15 -8.472 0.063 -8.763 115 HZ3 LYS 15 HZ3 LYS 15 -9.479 1.423 -8.654 116 H ARG 16 HN ARG 16 -2.865 4.881 -9.224 117 HA ARG 16 HA ARG 16 -0.401 3.590 -9.580 118 HB2 ARG 16 HB2 ARG 16 -1.523 4.915 -11.352 119 HB3 ARG 16 HB1 ARG 16 -1.158 6.378 -10.458 120 HG2 ARG 16 HG2 ARG 16 1.267 5.710 -10.637 121 HG3 ARG 16 HG1 ARG 16 0.745 4.530 -11.820 122 HD2 ARG 16 HD2 ARG 16 1.508 6.549 -12.912 123 HD3 ARG 16 HD1 ARG 16 -0.212 6.317 -13.150 124 HE ARG 16 HE ARG 16 0.682 8.104 -11.013 125 HH11 ARG 16 HH11 ARG 16 -0.863 7.662 -14.123 126 HH12 ARG 16 HH12 ARG 16 -1.542 9.256 -14.159 127 HH21 ARG 16 HH21 ARG 16 -0.196 10.212 -11.058 128 HH22 ARG 16 HH22 ARG 16 -1.155 10.717 -12.415 129 H GLN 17 HN GLN 17 -1.023 6.867 -8.362 130 HA GLN 17 HA GLN 17 1.533 7.518 -7.549 131 HB2 GLN 17 HB2 GLN 17 -0.480 9.026 -7.642 132 HB3 GLN 17 HB1 GLN 17 -1.024 8.303 -6.138 133 HG2 GLN 17 HG2 GLN 17 1.638 9.648 -6.388 134 HG3 GLN 17 HG1 GLN 17 0.174 10.541 -5.998 135 HE21 GLN 17 HE21 GLN 17 -0.923 8.351 -4.422 136 HE22 GLN 17 HE22 GLN 17 0.009 8.256 -2.970 137 H LEU 18 HN LEU 18 -0.996 5.821 -5.844 138 HA LEU 18 HA LEU 18 0.171 5.506 -3.339 139 HB2 LEU 18 HB2 LEU 18 -2.188 4.921 -4.336 140 HB3 LEU 18 HB1 LEU 18 -1.461 3.362 -4.614 141 HG LEU 18 HG LEU 18 -2.071 4.687 -1.998 142 HD11 LEU 18 HD11 LEU 18 -3.216 2.466 -1.713 143 HD12 LEU 18 HD12 LEU 18 -2.910 2.189 -3.419 144 HD13 LEU 18 HD13 LEU 18 -3.908 3.548 -2.910 145 HD21 LEU 18 HD21 LEU 18 -0.091 3.773 -1.331 146 HD22 LEU 18 HD22 LEU 18 -0.107 2.540 -2.586 147 HD23 LEU 18 HD23 LEU 18 -1.133 2.363 -1.164 148 H SER 19 HN SER 19 0.188 3.298 -6.128 149 HA SER 19 HA SER 19 1.792 1.317 -4.975 150 HB2 SER 19 HB2 SER 19 1.856 0.361 -7.116 151 HB3 SER 19 HB1 SER 19 0.365 1.301 -7.132 152 HG SER 19 HG SER 19 1.687 3.029 -8.096 153 H LEU 20 HN LEU 20 2.540 4.384 -6.287 154 HA LEU 20 HA LEU 20 5.360 3.886 -6.634 155 HB2 LEU 20 HB2 LEU 20 3.719 6.395 -6.809 156 HB3 LEU 20 HB1 LEU 20 5.416 6.300 -7.219 157 HG LEU 20 HG LEU 20 3.130 4.963 -8.623 158 HD11 LEU 20 HD11 LEU 20 3.592 7.358 -9.044 159 HD12 LEU 20 HD12 LEU 20 3.712 6.330 -10.468 160 HD13 LEU 20 HD13 LEU 20 5.174 6.898 -9.659 161 HD21 LEU 20 HD21 LEU 20 4.954 3.402 -8.529 162 HD22 LEU 20 HD22 LEU 20 6.084 4.635 -9.088 163 HD23 LEU 20 HD23 LEU 20 4.812 4.050 -10.161 164 H ASP 21 HN ASP 21 3.222 5.380 -4.265 165 HA ASP 21 HA ASP 21 5.404 6.384 -2.676 166 HB2 ASP 21 HB2 ASP 21 3.763 7.083 -1.072 167 HB3 ASP 21 HB1 ASP 21 3.303 7.582 -2.676 168 H ILE 22 HN ILE 22 3.359 3.525 -2.621 169 HA ILE 22 HA ILE 22 4.468 2.349 -0.329 170 HB ILE 22 HB ILE 22 3.033 1.412 -2.724 171 HG12 ILE 22 HG12 ILE 22 2.768 0.674 0.174 172 HG13 ILE 22 HG11 ILE 22 2.008 2.090 -0.549 173 HG21 ILE 22 HG21 ILE 22 4.547 -0.567 -1.053 174 HG22 ILE 22 HG22 ILE 22 4.880 -0.168 -2.732 175 HG23 ILE 22 HG23 ILE 22 3.361 -0.944 -2.295 176 HD11 ILE 22 HD11 ILE 22 1.523 -0.737 -1.452 177 HD12 ILE 22 HD12 ILE 22 0.660 0.713 -1.956 178 HD13 ILE 22 HD13 ILE 22 0.508 0.130 -0.300 179 H ASN 23 HN ASN 23 5.542 2.516 -3.654 180 HA ASN 23 HA ASN 23 7.724 0.754 -3.461 181 HB2 ASN 23 HB2 ASN 23 6.844 1.442 -5.615 182 HB3 ASN 23 HB1 ASN 23 7.231 3.122 -5.278 183 HD21 ASN 23 HD21 ASN 23 9.330 3.836 -5.508 184 HD22 ASN 23 HD22 ASN 23 10.562 2.892 -6.264 185 H LYS 24 HN LYS 24 7.239 3.965 -2.342 186 HA LYS 24 HA LYS 24 10.022 4.681 -2.165 187 HB2 LYS 24 HB2 LYS 24 7.439 5.924 -1.358 188 HB3 LYS 24 HB1 LYS 24 8.942 6.572 -0.724 189 HG2 LYS 24 HG2 LYS 24 9.705 7.126 -2.918 190 HG3 LYS 24 HG1 LYS 24 8.370 6.242 -3.663 191 HD2 LYS 24 HD2 LYS 24 6.774 7.820 -2.857 192 HD3 LYS 24 HD1 LYS 24 7.976 8.614 -1.843 193 HE2 LYS 24 HE2 LYS 24 7.971 8.559 -4.875 194 HE3 LYS 24 HE1 LYS 24 7.490 9.915 -3.851 195 HZ1 LYS 24 HZ1 LYS 24 9.725 10.213 -4.650 196 HZ2 LYS 24 HZ2 LYS 24 10.203 8.717 -4.028 197 HZ3 LYS 24 HZ3 LYS 24 9.765 9.966 -2.979 198 H LEU 25 HN LEU 25 7.825 2.909 -0.250 199 HA LEU 25 HA LEU 25 8.966 3.512 2.308 200 HB2 LEU 25 HB2 LEU 25 7.140 1.306 1.373 201 HB3 LEU 25 HB1 LEU 25 7.688 1.464 3.030 202 HG LEU 25 HG LEU 25 5.840 3.264 1.502 203 HD11 LEU 25 HD11 LEU 25 5.728 1.921 4.174 204 HD12 LEU 25 HD12 LEU 25 4.923 1.345 2.713 205 HD13 LEU 25 HD13 LEU 25 4.434 2.873 3.455 206 HD21 LEU 25 HD21 LEU 25 7.229 3.864 4.087 207 HD22 LEU 25 HD22 LEU 25 5.927 4.816 3.381 208 HD23 LEU 25 HD23 LEU 25 7.488 4.711 2.567 209 HA PRO 26 HA PRO 26 12.369 0.593 2.159 210 HB2 PRO 26 HB2 PRO 26 12.962 0.608 4.805 211 HB3 PRO 26 HB1 PRO 26 13.435 1.918 3.719 212 HG2 PRO 26 HG2 PRO 26 11.147 1.767 5.635 213 HG3 PRO 26 HG1 PRO 26 12.211 3.137 5.284 214 HD2 PRO 26 HD2 PRO 26 9.694 2.884 4.254 215 HD3 PRO 26 HD1 PRO 26 11.000 3.754 3.424 216 H GLY 27 HN GLY 27 12.892 -1.508 3.143 217 HA2 GLY 27 HA2 GLY 27 10.833 -3.289 2.866 218 HA3 GLY 27 HA1 GLY 27 12.317 -3.653 3.716 219 H GLU 28 HN GLU 28 12.158 -2.223 6.000 220 HA GLU 28 HA GLU 28 10.409 -3.759 7.564 221 HB2 GLU 28 HB2 GLU 28 10.922 -1.738 9.245 222 HB3 GLU 28 HB1 GLU 28 12.049 -3.046 8.930 223 HG2 GLU 28 HG2 GLU 28 12.109 -0.523 7.343 224 HG3 GLU 28 HG1 GLU 28 12.891 -0.637 8.913 225 H LYS 29 HN LYS 29 10.073 -0.458 6.338 226 HA LYS 29 HA LYS 29 7.686 0.033 7.838 227 HB2 LYS 29 HB2 LYS 29 9.303 1.492 5.848 228 HB3 LYS 29 HB1 LYS 29 7.598 1.900 5.876 229 HG2 LYS 29 HG2 LYS 29 8.899 3.416 7.254 230 HG3 LYS 29 HG1 LYS 29 7.764 2.489 8.231 231 HD2 LYS 29 HD2 LYS 29 9.404 1.386 9.332 232 HD3 LYS 29 HD1 LYS 29 10.485 1.368 7.934 233 HE2 LYS 29 HE2 LYS 29 11.295 2.787 9.801 234 HE3 LYS 29 HE1 LYS 29 11.073 3.668 8.293 235 HZ1 LYS 29 HZ1 LYS 29 9.232 3.657 10.624 236 HZ2 LYS 29 HZ2 LYS 29 8.918 4.440 9.160 237 HZ3 LYS 29 HZ3 LYS 29 10.212 4.942 10.124 238 H LEU 30 HN LEU 30 8.461 -1.315 4.740 239 HA LEU 30 HA LEU 30 5.777 -0.989 3.754 240 HB2 LEU 30 HB2 LEU 30 6.820 -1.002 1.842 241 HB3 LEU 30 HB1 LEU 30 8.325 -1.446 2.599 242 HG LEU 30 HG LEU 30 6.279 -3.380 1.501 243 HD11 LEU 30 HD11 LEU 30 7.868 -1.730 0.102 244 HD12 LEU 30 HD12 LEU 30 7.427 -3.344 -0.448 245 HD13 LEU 30 HD13 LEU 30 8.976 -3.078 0.347 246 HD21 LEU 30 HD21 LEU 30 7.668 -4.291 3.361 247 HD22 LEU 30 HD22 LEU 30 9.106 -3.896 2.423 248 HD23 LEU 30 HD23 LEU 30 7.957 -5.082 1.813 249 H GLY 31 HN GLY 31 7.399 -3.297 5.653 250 HA2 GLY 31 HA2 GLY 31 5.732 -5.540 5.105 251 HA3 GLY 31 HA1 GLY 31 6.587 -5.247 6.608 252 H ARG 32 HN ARG 32 5.139 -2.504 6.616 253 HA ARG 32 HA ARG 32 2.841 -3.351 8.101 254 HB2 ARG 32 HB2 ARG 32 3.963 -1.280 8.712 255 HB3 ARG 32 HB1 ARG 32 3.590 -0.591 7.142 256 HG2 ARG 32 HG2 ARG 32 1.662 0.154 7.932 257 HG3 ARG 32 HG1 ARG 32 1.170 -1.501 8.295 258 HD2 ARG 32 HD2 ARG 32 2.835 0.236 10.105 259 HD3 ARG 32 HD1 ARG 32 1.095 -0.019 10.271 260 HE ARG 32 HE ARG 32 2.797 -2.388 10.290 261 HH11 ARG 32 HH11 ARG 32 0.978 -0.029 12.135 262 HH12 ARG 32 HH12 ARG 32 0.888 -1.027 13.553 263 HH21 ARG 32 HH21 ARG 32 2.656 -3.705 12.152 264 HH22 ARG 32 HH22 ARG 32 1.831 -3.113 13.561 265 H VAL 33 HN VAL 33 3.319 -1.930 4.858 266 HA VAL 33 HA VAL 33 0.574 -1.650 4.297 267 HB VAL 33 HB VAL 33 1.687 -2.285 1.828 268 HG11 VAL 33 HG11 VAL 33 1.216 0.292 3.287 269 HG12 VAL 33 HG12 VAL 33 0.187 -0.496 2.091 270 HG13 VAL 33 HG13 VAL 33 1.704 0.240 1.598 271 HG21 VAL 33 HG21 VAL 33 3.612 -0.453 3.195 272 HG22 VAL 33 HG22 VAL 33 3.760 -1.238 1.620 273 HG23 VAL 33 HG23 VAL 33 3.915 -2.188 3.099 274 H VAL 34 HN VAL 34 2.789 -4.301 3.516 275 HA VAL 34 HA VAL 34 1.000 -6.199 2.615 276 HB VAL 34 HB VAL 34 2.640 -7.722 2.909 277 HG11 VAL 34 HG11 VAL 34 3.932 -5.859 2.170 278 HG12 VAL 34 HG12 VAL 34 4.883 -6.845 3.276 279 HG13 VAL 34 HG13 VAL 34 4.177 -5.328 3.832 280 HG21 VAL 34 HG21 VAL 34 2.080 -8.143 5.231 281 HG22 VAL 34 HG22 VAL 34 3.107 -6.789 5.724 282 HG23 VAL 34 HG23 VAL 34 3.829 -8.210 4.969 283 H HIS 35 HN HIS 35 1.578 -5.190 5.961 284 HA HIS 35 HA HIS 35 -0.037 -7.227 7.122 285 HB2 HIS 35 HB2 HIS 35 1.794 -6.141 8.351 286 HB3 HIS 35 HB1 HIS 35 0.931 -4.609 8.292 287 HD1 HIS 35 HD1 HIS 35 0.830 -7.986 9.944 288 HD2 HIS 35 HD2 HIS 35 -1.036 -4.282 10.198 289 HE1 HIS 35 HE1 HIS 35 -0.516 -8.052 12.067 290 HE2 HIS 35 HE2 HIS 35 -1.778 -5.874 12.099 291 H ILE 36 HN ILE 36 -0.553 -3.774 6.472 292 HA ILE 36 HA ILE 36 -3.193 -3.589 7.410 293 HB ILE 36 HB ILE 36 -1.895 -2.108 5.104 294 HG12 ILE 36 HG12 ILE 36 -2.315 -1.169 7.940 295 HG13 ILE 36 HG11 ILE 36 -0.840 -1.967 7.421 296 HG21 ILE 36 HG21 ILE 36 -3.716 -0.709 4.976 297 HG22 ILE 36 HG22 ILE 36 -4.153 -0.975 6.668 298 HG23 ILE 36 HG23 ILE 36 -4.520 -2.205 5.464 299 HD11 ILE 36 HD11 ILE 36 -0.644 -0.148 5.690 300 HD12 ILE 36 HD12 ILE 36 -0.407 0.335 7.365 301 HD13 ILE 36 HD13 ILE 36 -1.929 0.678 6.555 302 H ILE 37 HN ILE 37 -1.878 -4.321 4.245 303 HA ILE 37 HA ILE 37 -4.271 -4.705 2.872 304 HB ILE 37 HB ILE 37 -1.461 -5.588 2.462 305 HG12 ILE 37 HG12 ILE 37 -3.174 -3.901 0.679 306 HG13 ILE 37 HG11 ILE 37 -2.379 -3.226 2.089 307 HG21 ILE 37 HG21 ILE 37 -3.794 -6.783 1.281 308 HG22 ILE 37 HG22 ILE 37 -2.100 -7.276 1.179 309 HG23 ILE 37 HG23 ILE 37 -2.736 -6.069 0.065 310 HD11 ILE 37 HD11 ILE 37 -1.018 -2.791 0.222 311 HD12 ILE 37 HD12 ILE 37 -1.090 -4.483 -0.291 312 HD13 ILE 37 HD13 ILE 37 -0.224 -4.043 1.181 313 H GLN 38 HN GLN 38 -2.083 -7.295 4.075 314 HA GLN 38 HA GLN 38 -3.721 -9.464 3.659 315 HB2 GLN 38 HB2 GLN 38 -1.797 -8.942 5.934 316 HB3 GLN 38 HB1 GLN 38 -2.581 -10.495 5.684 317 HG2 GLN 38 HG2 GLN 38 -1.513 -10.688 3.507 318 HG3 GLN 38 HG1 GLN 38 -0.782 -9.106 3.734 319 HE21 GLN 38 HE21 GLN 38 -1.167 -11.481 6.270 320 HE22 GLN 38 HE22 GLN 38 0.516 -11.821 6.470 321 H SER 39 HN SER 39 -3.870 -7.204 6.394 322 HA SER 39 HA SER 39 -5.726 -8.814 7.872 323 HB2 SER 39 HB2 SER 39 -5.839 -6.881 9.401 324 HB3 SER 39 HB1 SER 39 -4.180 -7.319 9.021 325 HG SER 39 HG SER 39 -3.953 -5.559 7.795 326 H ARG 40 HN ARG 40 -5.980 -5.850 5.932 327 HA ARG 40 HA ARG 40 -8.830 -5.688 6.305 328 HB2 ARG 40 HB2 ARG 40 -6.956 -4.143 4.499 329 HB3 ARG 40 HB1 ARG 40 -8.669 -3.788 4.685 330 HG2 ARG 40 HG2 ARG 40 -8.338 -3.387 7.020 331 HG3 ARG 40 HG1 ARG 40 -6.636 -3.793 6.898 332 HD2 ARG 40 HD2 ARG 40 -6.492 -1.531 6.785 333 HD3 ARG 40 HD1 ARG 40 -6.741 -1.873 5.072 334 HE ARG 40 HE ARG 40 -9.224 -1.525 5.723 335 HH11 ARG 40 HH11 ARG 40 -6.506 0.268 7.002 336 HH12 ARG 40 HH12 ARG 40 -7.466 1.632 7.473 337 HH21 ARG 40 HH21 ARG 40 -10.492 0.249 6.401 338 HH22 ARG 40 HH22 ARG 40 -9.723 1.621 7.136 339 H GLU 41 HN GLU 41 -6.723 -7.265 4.166 340 HA GLU 41 HA GLU 41 -8.966 -8.047 2.414 341 HB2 GLU 41 HB2 GLU 41 -6.045 -8.275 1.715 342 HB3 GLU 41 HB1 GLU 41 -7.433 -8.349 0.638 343 HG2 GLU 41 HG2 GLU 41 -6.622 -5.877 2.124 344 HG3 GLU 41 HG1 GLU 41 -6.039 -6.290 0.512 345 HA PRO 42 HA PRO 42 -7.406 -11.657 4.879 346 HB2 PRO 42 HB2 PRO 42 -9.994 -12.761 5.108 347 HB3 PRO 42 HB1 PRO 42 -9.077 -11.947 6.367 348 HG2 PRO 42 HG2 PRO 42 -11.390 -11.019 4.920 349 HG3 PRO 42 HG1 PRO 42 -10.558 -10.251 6.276 350 HD2 PRO 42 HD2 PRO 42 -10.522 -9.493 3.513 351 HD3 PRO 42 HD1 PRO 42 -9.691 -8.727 4.871 352 H SER 43 HN SER 43 -8.929 -11.204 1.931 353 HA SER 43 HA SER 43 -9.128 -13.939 1.118 354 HB2 SER 43 HB2 SER 43 -8.963 -11.413 -0.543 355 HB3 SER 43 HB1 SER 43 -9.416 -13.008 -1.143 356 HG SER 43 HG SER 43 -10.903 -11.164 0.223 357 H LEU 44 HN LEU 44 -6.532 -11.763 1.556 358 HA LEU 44 HA LEU 44 -4.796 -13.582 0.038 359 HB2 LEU 44 HB2 LEU 44 -3.274 -11.682 -0.348 360 HB3 LEU 44 HB1 LEU 44 -4.839 -11.461 -1.073 361 HG LEU 44 HG LEU 44 -5.205 -10.150 1.244 362 HD11 LEU 44 HD11 LEU 44 -3.187 -8.749 1.518 363 HD12 LEU 44 HD12 LEU 44 -2.306 -9.890 0.506 364 HD13 LEU 44 HD13 LEU 44 -2.983 -10.415 2.049 365 HD21 LEU 44 HD21 LEU 44 -5.752 -9.306 -0.941 366 HD22 LEU 44 HD22 LEU 44 -4.044 -9.132 -1.342 367 HD23 LEU 44 HD23 LEU 44 -4.764 -8.116 -0.095 368 H LYS 45 HN LYS 45 -5.681 -13.666 2.834 369 HA LYS 45 HA LYS 45 -3.536 -12.935 4.544 370 HB2 LYS 45 HB2 LYS 45 -4.642 -14.283 6.228 371 HB3 LYS 45 HB1 LYS 45 -5.821 -13.308 5.366 372 HG2 LYS 45 HG2 LYS 45 -6.470 -15.251 4.038 373 HG3 LYS 45 HG1 LYS 45 -5.266 -16.226 4.891 374 HD2 LYS 45 HD2 LYS 45 -7.552 -14.813 6.241 375 HD3 LYS 45 HD1 LYS 45 -7.567 -16.515 5.764 376 HE2 LYS 45 HE2 LYS 45 -5.464 -16.784 7.097 377 HE3 LYS 45 HE1 LYS 45 -5.740 -15.164 7.730 378 HZ1 LYS 45 HZ1 LYS 45 -7.862 -15.890 8.615 379 HZ2 LYS 45 HZ2 LYS 45 -6.610 -16.849 9.227 380 HZ3 LYS 45 HZ3 LYS 45 -7.615 -17.449 8.006 381 H ASN 46 HN ASN 46 -4.028 -15.615 2.415 382 HA ASN 46 HA ASN 46 -2.208 -17.401 3.740 383 HB2 ASN 46 HB2 ASN 46 -4.041 -18.187 2.248 384 HB3 ASN 46 HB1 ASN 46 -3.213 -17.455 0.884 385 HD21 ASN 46 HD21 ASN 46 -1.594 -19.135 3.514 386 HD22 ASN 46 HD22 ASN 46 -1.047 -20.474 2.555 387 H SER 47 HN SER 47 -1.902 -14.671 1.781 388 HA SER 47 HA SER 47 0.645 -15.281 0.622 389 HB2 SER 47 HB2 SER 47 -0.756 -12.632 1.043 390 HB3 SER 47 HB1 SER 47 0.697 -12.861 0.068 391 HG SER 47 HG SER 47 -1.610 -14.398 -0.450 392 H ASN 48 HN ASN 48 2.643 -14.849 1.409 393 HA ASN 48 HA ASN 48 2.869 -14.410 4.250 394 HB2 ASN 48 HB2 ASN 48 4.939 -14.898 2.102 395 HB3 ASN 48 HB1 ASN 48 5.313 -14.757 3.812 396 HD21 ASN 48 HD21 ASN 48 4.767 -16.418 5.205 397 HD22 ASN 48 HD22 ASN 48 4.248 -17.972 4.646 398 HA PRO 49 HA PRO 49 3.497 -10.101 4.310 399 HB2 PRO 49 HB2 PRO 49 5.385 -9.892 6.293 400 HB3 PRO 49 HB1 PRO 49 3.667 -10.171 6.581 401 HG2 PRO 49 HG2 PRO 49 5.913 -12.137 6.516 402 HG3 PRO 49 HG1 PRO 49 4.548 -12.022 7.643 403 HD2 PRO 49 HD2 PRO 49 4.559 -13.809 5.649 404 HD3 PRO 49 HD1 PRO 49 3.065 -12.990 6.147 405 H ASP 50 HN ASP 50 6.215 -12.176 3.783 406 HA ASP 50 HA ASP 50 7.837 -9.925 2.841 407 HB2 ASP 50 HB2 ASP 50 8.522 -12.786 3.504 408 HB3 ASP 50 HB1 ASP 50 9.641 -11.720 2.659 409 H GLU 51 HN GLU 51 5.532 -11.768 1.596 410 HA GLU 51 HA GLU 51 6.755 -11.766 -1.071 411 HB2 GLU 51 HB2 GLU 51 5.138 -14.090 0.007 412 HB3 GLU 51 HB1 GLU 51 5.882 -13.977 -1.581 413 HG2 GLU 51 HG2 GLU 51 8.102 -13.941 -0.488 414 HG3 GLU 51 HG1 GLU 51 7.306 -14.169 1.063 415 H ILE 52 HN ILE 52 4.864 -10.049 0.349 416 HA ILE 52 HA ILE 52 2.223 -10.766 -0.391 417 HB ILE 52 HB ILE 52 3.095 -9.142 1.513 418 HG12 ILE 52 HG12 ILE 52 0.811 -8.253 1.671 419 HG13 ILE 52 HG11 ILE 52 0.499 -8.749 0.019 420 HG21 ILE 52 HG21 ILE 52 2.375 -7.282 -0.725 421 HG22 ILE 52 HG22 ILE 52 3.970 -7.451 0.005 422 HG23 ILE 52 HG23 ILE 52 2.628 -6.811 0.951 423 HD11 ILE 52 HD11 ILE 52 1.164 -10.580 2.275 424 HD12 ILE 52 HD12 ILE 52 0.722 -11.052 0.640 425 HD13 ILE 52 HD13 ILE 52 -0.456 -10.256 1.677 426 H GLU 53 HN GLU 53 0.886 -9.925 -1.848 427 HA GLU 53 HA GLU 53 2.139 -8.533 -4.127 428 HB2 GLU 53 HB2 GLU 53 1.445 -10.866 -4.623 429 HB3 GLU 53 HB1 GLU 53 -0.180 -10.497 -4.077 430 HG2 GLU 53 HG2 GLU 53 -0.210 -10.533 -6.430 431 HG3 GLU 53 HG1 GLU 53 -0.336 -8.844 -5.953 432 H ILE 54 HN ILE 54 1.621 -6.429 -3.460 433 HA ILE 54 HA ILE 54 -0.933 -5.748 -2.418 434 HB ILE 54 HB ILE 54 1.106 -3.943 -3.730 435 HG12 ILE 54 HG12 ILE 54 0.836 -4.803 -0.845 436 HG13 ILE 54 HG11 ILE 54 2.206 -5.072 -1.916 437 HG21 ILE 54 HG21 ILE 54 -1.109 -3.345 -1.799 438 HG22 ILE 54 HG22 ILE 54 -1.104 -2.962 -3.519 439 HG23 ILE 54 HG23 ILE 54 0.048 -2.179 -2.436 440 HD11 ILE 54 HD11 ILE 54 2.715 -3.257 -0.394 441 HD12 ILE 54 HD12 ILE 54 1.244 -2.428 -0.869 442 HD13 ILE 54 HD13 ILE 54 2.551 -2.633 -2.029 443 H ASP 55 HN ASP 55 -2.611 -6.215 -3.737 444 HA ASP 55 HA ASP 55 -2.461 -5.417 -6.553 445 HB2 ASP 55 HB2 ASP 55 -3.094 -7.783 -6.046 446 HB3 ASP 55 HB1 ASP 55 -4.517 -7.179 -5.203 447 H PHE 56 HN PHE 56 -2.990 -3.351 -6.669 448 HA PHE 56 HA PHE 56 -4.591 -2.051 -4.749 449 HB2 PHE 56 HB2 PHE 56 -3.544 -1.116 -7.406 450 HB3 PHE 56 HB1 PHE 56 -4.294 -0.065 -6.211 451 HD1 PHE 56 HD1 PHE 56 -3.226 0.078 -3.938 452 HD2 PHE 56 HD2 PHE 56 -1.254 -1.652 -7.263 453 HE1 PHE 56 HE1 PHE 56 -1.111 0.364 -2.785 454 HE2 PHE 56 HE2 PHE 56 0.905 -1.369 -6.112 455 HZ PHE 56 HZ PHE 56 0.965 -0.351 -3.861 456 H GLU 57 HN GLU 57 -5.510 -3.849 -7.423 457 HA GLU 57 HA GLU 57 -7.928 -2.348 -7.964 458 HB2 GLU 57 HB2 GLU 57 -6.753 -4.885 -9.067 459 HB3 GLU 57 HB1 GLU 57 -8.381 -4.363 -9.487 460 HG2 GLU 57 HG2 GLU 57 -5.869 -2.763 -9.925 461 HG3 GLU 57 HG1 GLU 57 -6.715 -3.706 -11.151 462 H THR 58 HN THR 58 -6.905 -5.106 -6.119 463 HA THR 58 HA THR 58 -9.679 -5.786 -5.517 464 HB THR 58 HB THR 58 -8.605 -7.701 -4.226 465 HG1 THR 58 HG1 THR 58 -6.326 -6.908 -5.757 466 HG21 THR 58 HG21 THR 58 -8.170 -7.443 -7.205 467 HG22 THR 58 HG22 THR 58 -9.617 -8.052 -6.396 468 HG23 THR 58 HG23 THR 58 -8.109 -8.962 -6.309 469 H LEU 59 HN LEU 59 -6.864 -4.311 -4.105 470 HA LEU 59 HA LEU 59 -7.513 -4.335 -1.412 471 HB2 LEU 59 HB2 LEU 59 -6.185 -2.177 -3.002 472 HB3 LEU 59 HB1 LEU 59 -6.257 -2.230 -1.258 473 HG LEU 59 HG LEU 59 -4.915 -4.247 -3.036 474 HD11 LEU 59 HD11 LEU 59 -3.754 -2.332 -1.038 475 HD12 LEU 59 HD12 LEU 59 -3.751 -2.090 -2.785 476 HD13 LEU 59 HD13 LEU 59 -2.880 -3.449 -2.080 477 HD21 LEU 59 HD21 LEU 59 -5.448 -4.184 -0.078 478 HD22 LEU 59 HD22 LEU 59 -4.085 -5.075 -0.771 479 HD23 LEU 59 HD23 LEU 59 -5.731 -5.486 -1.243 480 H LYS 60 HN LYS 60 -9.136 -3.494 -0.286 481 HA LYS 60 HA LYS 60 -11.250 -2.043 -1.463 482 HB2 LYS 60 HB2 LYS 60 -10.471 -2.311 1.447 483 HB3 LYS 60 HB1 LYS 60 -12.010 -1.682 0.879 484 HG2 LYS 60 HG2 LYS 60 -12.622 -3.806 0.007 485 HG3 LYS 60 HG1 LYS 60 -11.010 -4.445 0.282 486 HD2 LYS 60 HD2 LYS 60 -11.428 -3.904 2.734 487 HD3 LYS 60 HD1 LYS 60 -13.120 -3.748 2.278 488 HE2 LYS 60 HE2 LYS 60 -13.248 -6.000 1.597 489 HE3 LYS 60 HE1 LYS 60 -11.495 -6.186 1.620 490 HZ1 LYS 60 HZ1 LYS 60 -11.491 -6.044 3.984 491 HZ2 LYS 60 HZ2 LYS 60 -12.629 -7.209 3.537 492 HZ3 LYS 60 HZ3 LYS 60 -13.144 -5.678 4.031 493 HA PRO 61 HA PRO 61 -9.934 2.233 -1.555 494 HB2 PRO 61 HB2 PRO 61 -12.514 2.662 -0.107 495 HB3 PRO 61 HB1 PRO 61 -11.846 3.528 -1.498 496 HG2 PRO 61 HG2 PRO 61 -13.767 1.716 -1.813 497 HG3 PRO 61 HG1 PRO 61 -12.458 1.906 -2.988 498 HD2 PRO 61 HD2 PRO 61 -12.917 -0.265 -1.013 499 HD3 PRO 61 HD1 PRO 61 -12.069 -0.314 -2.573 500 H SER 62 HN SER 62 -11.422 0.938 1.368 501 HA SER 62 HA SER 62 -10.420 2.720 3.245 502 HB2 SER 62 HB2 SER 62 -10.894 -0.245 3.624 503 HB3 SER 62 HB1 SER 62 -10.895 0.998 4.878 504 HG SER 62 HG SER 62 -12.959 0.176 3.544 505 H THR 63 HN THR 63 -9.015 -0.373 2.114 506 HA THR 63 HA THR 63 -6.673 -0.209 3.680 507 HB THR 63 HB THR 63 -6.661 -1.569 1.006 508 HG1 THR 63 HG1 THR 63 -7.953 -3.224 1.809 509 HG21 THR 63 HG21 THR 63 -4.685 -2.171 1.986 510 HG22 THR 63 HG22 THR 63 -5.722 -3.364 2.779 511 HG23 THR 63 HG23 THR 63 -5.307 -1.873 3.614 512 H LEU 64 HN LEU 64 -7.355 0.682 0.305 513 HA LEU 64 HA LEU 64 -4.787 1.476 -0.417 514 HB2 LEU 64 HB2 LEU 64 -7.443 2.529 -1.352 515 HB3 LEU 64 HB1 LEU 64 -5.919 2.861 -2.140 516 HG LEU 64 HG LEU 64 -7.095 0.106 -1.802 517 HD11 LEU 64 HD11 LEU 64 -7.819 2.182 -3.574 518 HD12 LEU 64 HD12 LEU 64 -8.375 0.510 -3.560 519 HD13 LEU 64 HD13 LEU 64 -6.953 0.960 -4.503 520 HD21 LEU 64 HD21 LEU 64 -4.659 1.205 -3.166 521 HD22 LEU 64 HD22 LEU 64 -5.388 -0.327 -3.654 522 HD23 LEU 64 HD23 LEU 64 -4.778 -0.127 -2.012 523 H ARG 65 HN ARG 65 -7.428 3.475 0.922 524 HA ARG 65 HA ARG 65 -5.902 5.855 0.984 525 HB2 ARG 65 HB2 ARG 65 -8.342 5.001 2.517 526 HB3 ARG 65 HB1 ARG 65 -7.626 6.601 2.658 527 HG2 ARG 65 HG2 ARG 65 -8.703 5.388 0.121 528 HG3 ARG 65 HG1 ARG 65 -9.534 6.568 1.131 529 HD2 ARG 65 HD2 ARG 65 -7.736 8.177 0.736 530 HD3 ARG 65 HD1 ARG 65 -6.911 7.001 -0.285 531 HE ARG 65 HE ARG 65 -9.571 7.475 -1.179 532 HH11 ARG 65 HH11 ARG 65 -6.326 8.803 -1.193 533 HH12 ARG 65 HH12 ARG 65 -6.565 9.688 -2.671 534 HH21 ARG 65 HH21 ARG 65 -9.878 8.655 -3.134 535 HH22 ARG 65 HH22 ARG 65 -8.567 9.601 -3.769 536 H GLU 66 HN GLU 66 -6.127 3.130 3.140 537 HA GLU 66 HA GLU 66 -4.772 4.390 5.311 538 HB2 GLU 66 HB2 GLU 66 -6.116 2.427 5.736 539 HB3 GLU 66 HB1 GLU 66 -5.166 1.481 4.596 540 HG2 GLU 66 HG2 GLU 66 -4.513 0.886 6.801 541 HG3 GLU 66 HG1 GLU 66 -3.198 1.791 6.055 542 H LEU 67 HN LEU 67 -3.728 1.995 2.872 543 HA LEU 67 HA LEU 67 -1.016 1.926 3.307 544 HB2 LEU 67 HB2 LEU 67 -2.163 2.096 0.511 545 HB3 LEU 67 HB1 LEU 67 -0.793 1.149 1.080 546 HG LEU 67 HG LEU 67 -3.637 0.598 1.888 547 HD11 LEU 67 HD11 LEU 67 -2.142 -1.180 0.085 548 HD12 LEU 67 HD12 LEU 67 -2.791 0.304 -0.610 549 HD13 LEU 67 HD13 LEU 67 -3.870 -0.852 0.175 550 HD21 LEU 67 HD21 LEU 67 -1.328 -0.174 3.102 551 HD22 LEU 67 HD22 LEU 67 -1.611 -1.501 1.984 552 HD23 LEU 67 HD23 LEU 67 -2.848 -1.062 3.162 553 H GLU 68 HN GLU 68 -2.759 4.208 1.192 554 HA GLU 68 HA GLU 68 -0.617 5.822 0.425 555 HB2 GLU 68 HB2 GLU 68 -2.829 5.910 -0.618 556 HB3 GLU 68 HB1 GLU 68 -3.523 6.560 0.856 557 HG2 GLU 68 HG2 GLU 68 -1.971 8.523 0.566 558 HG3 GLU 68 HG1 GLU 68 -1.627 7.892 -1.048 559 H ARG 69 HN ARG 69 -3.008 6.534 2.997 560 HA ARG 69 HA ARG 69 -1.718 8.806 4.026 561 HB2 ARG 69 HB2 ARG 69 -3.743 6.885 5.003 562 HB3 ARG 69 HB1 ARG 69 -3.031 7.970 6.180 563 HG2 ARG 69 HG2 ARG 69 -4.028 9.164 3.668 564 HG3 ARG 69 HG1 ARG 69 -5.235 8.560 4.806 565 HD2 ARG 69 HD2 ARG 69 -4.753 10.925 5.186 566 HD3 ARG 69 HD1 ARG 69 -4.272 9.941 6.567 567 HE ARG 69 HE ARG 69 -2.131 10.397 4.719 568 HH11 ARG 69 HH11 ARG 69 -3.904 11.817 7.379 569 HH12 ARG 69 HH12 ARG 69 -2.568 12.788 7.909 570 HH21 ARG 69 HH21 ARG 69 -0.372 11.641 5.432 571 HH22 ARG 69 HH22 ARG 69 -0.557 12.677 6.814 572 H TYR 70 HN TYR 70 -1.156 5.434 4.557 573 HA TYR 70 HA TYR 70 0.323 5.728 6.967 574 HB2 TYR 70 HB2 TYR 70 -0.574 3.576 6.551 575 HB3 TYR 70 HB1 TYR 70 0.109 3.530 4.930 576 HD1 TYR 70 HD2 TYR 70 1.300 3.967 8.446 577 HD2 TYR 70 HD1 TYR 70 1.925 2.257 4.615 578 HE1 TYR 70 HE2 TYR 70 3.335 2.874 9.283 579 HE2 TYR 70 HE1 TYR 70 3.946 1.146 5.425 580 HH TYR 70 HH TYR 70 5.516 1.191 7.136 581 H VAL 71 HN VAL 71 1.252 5.262 3.554 582 HA VAL 71 HA VAL 71 4.020 5.386 4.030 583 HB VAL 71 HB VAL 71 4.354 5.736 1.710 584 HG11 VAL 71 HG11 VAL 71 2.606 4.205 0.650 585 HG12 VAL 71 HG12 VAL 71 1.998 4.006 2.294 586 HG13 VAL 71 HG13 VAL 71 3.656 3.550 1.901 587 HG21 VAL 71 HG21 VAL 71 2.730 6.498 0.183 588 HG22 VAL 71 HG22 VAL 71 2.841 7.657 1.503 589 HG23 VAL 71 HG23 VAL 71 1.483 6.531 1.423 590 H THR 72 HN THR 72 1.554 7.860 3.632 591 HA THR 72 HA THR 72 3.327 9.950 3.035 592 HB THR 72 HB THR 72 1.535 11.514 3.593 593 HG1 THR 72 HG1 THR 72 0.486 9.264 4.885 594 HG21 THR 72 HG21 THR 72 1.032 9.091 1.950 595 HG22 THR 72 HG22 THR 72 1.348 10.752 1.430 596 HG23 THR 72 HG23 THR 72 -0.231 10.316 2.091 597 H SER 73 HN SER 73 2.425 8.448 6.017 598 HA SER 73 HA SER 73 3.373 10.484 7.753 599 HB2 SER 73 HB2 SER 73 3.120 8.898 9.488 600 HB3 SER 73 HB1 SER 73 1.874 8.481 8.306 601 HG SER 73 HG SER 73 3.075 6.760 7.633 602 H CYS 74 HN CYS 74 4.836 8.067 5.808 603 HA CYS 74 HA CYS 74 7.451 8.400 7.095 604 HB2 CYS 74 HB2 CYS 74 6.818 6.099 6.727 605 HB3 CYS 74 HB1 CYS 74 6.487 6.425 5.027 606 HG CYS 74 HG CYS 74 9.489 7.341 5.261 607 H LEU 75 HN LEU 75 5.713 9.213 4.203 608 HA LEU 75 HA LEU 75 8.174 9.925 2.799 609 HB2 LEU 75 HB2 LEU 75 5.352 9.770 1.763 610 HB3 LEU 75 HB1 LEU 75 6.793 9.955 0.803 611 HG LEU 75 HG LEU 75 5.891 7.527 2.308 612 HD11 LEU 75 HD11 LEU 75 5.052 8.107 -0.020 613 HD12 LEU 75 HD12 LEU 75 5.779 6.514 0.199 614 HD13 LEU 75 HD13 LEU 75 6.701 7.806 -0.564 615 HD21 LEU 75 HD21 LEU 75 7.965 6.453 1.738 616 HD22 LEU 75 HD22 LEU 75 8.316 7.900 2.677 617 HD23 LEU 75 HD23 LEU 75 8.547 7.906 0.929 618 H ARG 76 HN ARG 76 5.252 11.382 4.098 619 HA ARG 76 HA ARG 76 6.054 13.934 2.907 620 HB2 ARG 76 HB2 ARG 76 3.394 13.068 3.991 621 HB3 ARG 76 HB1 ARG 76 3.755 14.695 3.418 622 HG2 ARG 76 HG2 ARG 76 4.421 13.629 1.227 623 HG3 ARG 76 HG1 ARG 76 3.704 12.147 1.857 624 HD2 ARG 76 HD2 ARG 76 2.069 13.259 0.519 625 HD3 ARG 76 HD1 ARG 76 1.611 13.372 2.215 626 HE ARG 76 HE ARG 76 2.960 15.668 1.826 627 HH11 ARG 76 HH11 ARG 76 0.307 14.163 0.107 628 HH12 ARG 76 HH12 ARG 76 -0.334 15.669 -0.468 629 HH21 ARG 76 HH21 ARG 76 2.120 17.640 1.091 630 HH22 ARG 76 HH22 ARG 76 0.692 17.656 0.105 631 H LYS 77 HN LYS 77 5.516 12.280 5.895 632 HA LYS 77 HA LYS 77 5.960 14.708 7.461 633 HB2 LYS 77 HB2 LYS 77 4.194 12.978 8.072 634 HB3 LYS 77 HB1 LYS 77 5.515 11.887 8.462 635 HG2 LYS 77 HG2 LYS 77 6.315 13.543 10.130 636 HG3 LYS 77 HG1 LYS 77 4.869 14.501 9.804 637 HD2 LYS 77 HD2 LYS 77 3.464 12.633 10.498 638 HD3 LYS 77 HD1 LYS 77 4.899 11.650 10.791 639 HE2 LYS 77 HE2 LYS 77 5.630 13.307 12.481 640 HE3 LYS 77 HE1 LYS 77 4.120 14.180 12.234 641 HZ1 LYS 77 HZ1 LYS 77 4.042 12.702 14.163 642 HZ2 LYS 77 HZ2 LYS 77 4.322 11.368 13.163 643 HZ3 LYS 77 HZ3 LYS 77 2.902 12.266 12.996 644 H LYS 78 HN LYS 78 7.848 12.886 5.742 645 HA LYS 78 HA LYS 78 10.188 13.364 7.335 646 HB2 LYS 78 HB2 LYS 78 9.236 11.108 8.092 647 HB3 LYS 78 HB1 LYS 78 9.673 10.510 6.500 648 HG2 LYS 78 HG2 LYS 78 11.437 9.896 7.920 649 HG3 LYS 78 HG1 LYS 78 12.028 11.287 7.009 650 HD2 LYS 78 HD2 LYS 78 12.655 11.540 9.324 651 HD3 LYS 78 HD1 LYS 78 11.426 12.742 8.928 652 HE2 LYS 78 HE2 LYS 78 9.711 11.321 9.944 653 HE3 LYS 78 HE1 LYS 78 10.935 10.114 10.328 654 HZ1 LYS 78 HZ1 LYS 78 10.824 12.884 11.391 655 HZ2 LYS 78 HZ2 LYS 78 12.026 11.752 11.744 656 HZ3 LYS 78 HZ3 LYS 78 10.436 11.474 12.241 657 H ARG 79 HN ARG 79 12.113 13.226 6.017 658 HA ARG 79 HA ARG 79 11.479 13.705 3.237 659 HB2 ARG 79 HB2 ARG 79 13.934 14.287 3.082 660 HB3 ARG 79 HB1 ARG 79 12.950 15.289 4.127 661 HG2 ARG 79 HG2 ARG 79 14.898 14.981 5.340 662 HG3 ARG 79 HG1 ARG 79 13.793 13.800 6.034 663 HD2 ARG 79 HD2 ARG 79 16.047 12.890 5.683 664 HD3 ARG 79 HD1 ARG 79 14.823 12.029 4.754 665 HE ARG 79 HE ARG 79 15.600 13.499 2.835 666 HH11 ARG 79 HH11 ARG 79 17.728 12.549 5.452 667 HH12 ARG 79 HH12 ARG 79 19.153 12.577 4.467 668 HH21 ARG 79 HH21 ARG 79 17.474 13.527 1.539 669 HH22 ARG 79 HH22 ARG 79 19.011 13.130 2.236 670 H LYS 80 HN LYS 80 11.102 11.042 4.013 671 HA LYS 80 HA LYS 80 11.378 8.948 3.222 672 HB2 LYS 80 HB2 LYS 80 11.619 9.974 0.998 673 HB3 LYS 80 HB1 LYS 80 13.348 10.146 1.273 674 HG2 LYS 80 HG2 LYS 80 13.509 7.683 1.497 675 HG3 LYS 80 HG1 LYS 80 11.801 7.571 1.077 676 HD2 LYS 80 HD2 LYS 80 12.277 8.654 -1.077 677 HD3 LYS 80 HD1 LYS 80 13.990 8.717 -0.654 678 HE2 LYS 80 HE2 LYS 80 12.320 6.225 -0.983 679 HE3 LYS 80 HE1 LYS 80 13.529 6.823 -2.117 680 HZ1 LYS 80 HZ1 LYS 80 15.218 6.509 -0.405 681 HZ2 LYS 80 HZ2 LYS 80 14.427 5.059 -0.755 682 HZ3 LYS 80 HZ3 LYS 80 14.052 5.904 0.659 683 HA PRO 81 HA PRO 81 14.709 7.606 5.913 684 HB2 PRO 81 HB2 PRO 81 13.832 5.015 4.705 685 HB3 PRO 81 HB1 PRO 81 14.071 5.410 6.409 686 HG2 PRO 81 HG2 PRO 81 11.627 5.216 5.363 687 HG3 PRO 81 HG1 PRO 81 12.006 6.439 6.590 688 HD2 PRO 81 HD2 PRO 81 11.591 6.743 3.660 689 HD3 PRO 81 HD1 PRO 81 11.221 7.867 4.982 690 H GLN 82 HN GLN 82 16.800 7.504 5.400 691 HA GLN 82 HA GLN 82 17.516 6.654 2.669 692 HB2 GLN 82 HB2 GLN 82 19.006 8.534 4.509 693 HB3 GLN 82 HB1 GLN 82 19.475 8.108 2.871 694 HG2 GLN 82 HG2 GLN 82 16.951 9.555 3.634 695 HG3 GLN 82 HG1 GLN 82 18.413 10.312 3.010 696 HE21 GLN 82 HE21 GLN 82 15.685 10.249 1.951 697 HE22 GLN 82 HE22 GLN 82 15.830 9.622 0.343 698 H ALA 83 HN ALA 83 17.596 5.676 5.817 699 HA ALA 83 HA ALA 83 20.211 4.409 5.720 700 HB1 ALA 83 HB1 ALA 83 19.432 5.377 7.830 701 HB2 ALA 83 HB2 ALA 83 19.707 3.643 7.979 702 HB3 ALA 83 HB3 ALA 83 18.063 4.268 7.836 703 H1 VAL 201 HT1 VAL 201 -4.468 1.940 -16.245 704 H2 VAL 201 HT2 VAL 201 -4.521 0.998 -17.646 705 H3 VAL 201 HT3 VAL 201 -3.053 1.644 -17.114 706 HA VAL 201 HA VAL 201 -4.663 -0.355 -15.652 707 HB VAL 201 HB VAL 201 -3.635 -1.260 -17.720 708 HG11 VAL 201 HG11 VAL 201 -1.200 -1.434 -17.905 709 HG12 VAL 201 HG12 VAL 201 -1.025 -0.438 -16.459 710 HG13 VAL 201 HG13 VAL 201 -1.742 0.244 -17.919 711 HG21 VAL 201 HG21 VAL 201 -2.442 -3.138 -16.674 712 HG22 VAL 201 HG22 VAL 201 -3.935 -2.737 -15.828 713 HG23 VAL 201 HG23 VAL 201 -2.382 -2.237 -15.159 714 H VAL 202 HN VAL 202 -3.775 -1.006 -13.668 715 HA VAL 202 HA VAL 202 -1.625 0.737 -12.662 716 HB VAL 202 HB VAL 202 -3.728 -0.734 -11.058 717 HG11 VAL 202 HG11 VAL 202 -1.614 -0.460 -9.850 718 HG12 VAL 202 HG12 VAL 202 -2.886 0.545 -9.155 719 HG13 VAL 202 HG13 VAL 202 -1.651 1.273 -10.181 720 HG21 VAL 202 HG21 VAL 202 -3.473 2.217 -11.613 721 HG22 VAL 202 HG22 VAL 202 -4.714 1.436 -10.634 722 HG23 VAL 202 HG23 VAL 202 -4.644 1.139 -12.371 723 HA PRO 203 HA PRO 203 0.683 -3.203 -12.794 724 HB2 PRO 203 HB2 PRO 203 2.779 -1.267 -11.978 725 HB3 PRO 203 HB1 PRO 203 2.816 -2.495 -13.246 726 HG2 PRO 203 HG2 PRO 203 2.587 0.100 -13.840 727 HG3 PRO 203 HG1 PRO 203 1.735 -1.142 -14.776 728 HD2 PRO 203 HD2 PRO 203 0.677 0.734 -12.708 729 HD3 PRO 203 HD1 PRO 203 -0.090 0.136 -14.197 730 H LYS 204 HN LYS 204 0.632 -4.473 -11.076 731 HA LYS 204 HA LYS 204 0.237 -3.386 -8.450 732 HB2 LYS 204 HB2 LYS 204 0.067 -5.766 -7.770 733 HB3 LYS 204 HB1 LYS 204 -1.012 -5.344 -9.091 734 HG2 LYS 204 HG2 LYS 204 0.625 -6.329 -10.679 735 HG3 LYS 204 HG1 LYS 204 1.585 -6.851 -9.292 736 HD2 LYS 204 HD2 LYS 204 -0.308 -8.168 -8.475 737 HD3 LYS 204 HD1 LYS 204 -1.270 -7.644 -9.860 738 HE2 LYS 204 HE2 LYS 204 -0.362 -9.876 -10.211 739 HE3 LYS 204 HE1 LYS 204 0.300 -8.730 -11.372 740 HZ1 LYS 204 HZ1 LYS 204 1.666 -9.707 -8.917 741 HZ2 LYS 204 HZ2 LYS 204 2.295 -8.582 -10.008 742 HZ3 LYS 204 HZ3 LYS 204 2.019 -10.170 -10.508 743 H LYS 205 HN LYS 205 1.524 -3.971 -6.588 744 HA LYS 205 HA LYS 205 4.352 -3.814 -7.277 745 HB2 LYS 205 HB2 LYS 205 2.794 -3.146 -4.800 746 HB3 LYS 205 HB1 LYS 205 4.538 -3.335 -4.741 747 HG2 LYS 205 HG2 LYS 205 3.090 -1.402 -6.536 748 HG3 LYS 205 HG1 LYS 205 3.803 -0.990 -4.977 749 HD2 LYS 205 HD2 LYS 205 5.315 -2.091 -7.351 750 HD3 LYS 205 HD1 LYS 205 5.266 -0.394 -6.872 751 HE2 LYS 205 HE2 LYS 205 6.296 -0.975 -4.725 752 HE3 LYS 205 HE1 LYS 205 6.344 -2.669 -5.204 753 HZ1 LYS 205 HZ1 LYS 205 7.857 -2.125 -6.982 754 HZ2 LYS 205 HZ2 LYS 205 8.477 -1.521 -5.524 755 HZ3 LYS 205 HZ3 LYS 205 7.746 -0.473 -6.629 756 H LYS 206 HN LYS 206 5.397 -5.630 -7.417 757 HA LYS 206 HA LYS 206 4.643 -7.978 -5.911 758 HB2 LYS 206 HB2 LYS 206 7.061 -7.545 -7.684 759 HB3 LYS 206 HB1 LYS 206 6.476 -9.086 -7.083 760 HG2 LYS 206 HG2 LYS 206 5.753 -9.054 -9.279 761 HG3 LYS 206 HG1 LYS 206 4.324 -8.541 -8.381 762 HD2 LYS 206 HD2 LYS 206 4.748 -6.234 -8.932 763 HD3 LYS 206 HD1 LYS 206 6.282 -6.655 -9.691 764 HE2 LYS 206 HE2 LYS 206 3.547 -7.517 -10.616 765 HE3 LYS 206 HE1 LYS 206 4.538 -6.262 -11.354 766 HZ1 LYS 206 HZ1 LYS 206 4.698 -8.358 -12.550 767 HZ2 LYS 206 HZ2 LYS 206 5.268 -9.135 -11.162 768 HZ3 LYS 206 HZ3 LYS 206 6.197 -7.927 -11.895 769 H ILE 207 HN ILE 207 5.094 -7.796 -3.797 770 HA ILE 207 HA ILE 207 7.516 -6.389 -2.981 771 HB ILE 207 HB ILE 207 5.332 -7.476 -1.219 772 HG12 ILE 207 HG12 ILE 207 4.539 -5.894 -3.045 773 HG13 ILE 207 HG11 ILE 207 4.173 -5.412 -1.393 774 HG21 ILE 207 HG21 ILE 207 6.121 -5.587 0.266 775 HG22 ILE 207 HG22 ILE 207 7.504 -5.434 -0.820 776 HG23 ILE 207 HG23 ILE 207 7.243 -6.934 0.069 777 HD11 ILE 207 HD11 ILE 207 5.968 -3.805 -1.439 778 HD12 ILE 207 HD12 ILE 207 4.901 -3.550 -2.814 779 HD13 ILE 207 HD13 ILE 207 6.456 -4.352 -3.041 780 H LYS 208 HN LYS 208 8.522 -8.414 -4.050 781 HA LYS 208 HA LYS 208 8.989 -10.405 -1.931 782 HB2 LYS 208 HB2 LYS 208 7.811 -11.275 -3.974 783 HB3 LYS 208 HB1 LYS 208 9.240 -10.861 -4.910 784 HG2 LYS 208 HG2 LYS 208 10.559 -12.465 -3.782 785 HG3 LYS 208 HG1 LYS 208 9.309 -12.736 -2.562 786 HD2 LYS 208 HD2 LYS 208 7.823 -13.511 -4.466 787 HD3 LYS 208 HD1 LYS 208 9.274 -13.512 -5.469 788 HE2 LYS 208 HE2 LYS 208 8.875 -15.089 -2.931 789 HE3 LYS 208 HE1 LYS 208 8.797 -15.734 -4.567 790 HZ1 LYS 208 HZ1 LYS 208 11.192 -14.504 -3.321 791 HZ2 LYS 208 HZ2 LYS 208 11.115 -15.165 -4.873 792 HZ3 LYS 208 HZ3 LYS 208 10.933 -16.161 -3.521 793 H LYS 209 HN LYS 209 10.491 -8.598 -1.334 794 HA LYS 209 HA LYS 209 12.588 -7.832 -1.016 795 HB2 LYS 209 HB2 LYS 209 13.342 -10.312 -2.566 796 HB3 LYS 209 HB1 LYS 209 14.491 -9.275 -1.727 797 HG2 LYS 209 HG2 LYS 209 13.267 -9.714 0.382 798 HG3 LYS 209 HG1 LYS 209 12.249 -10.857 -0.493 799 HD2 LYS 209 HD2 LYS 209 14.165 -12.231 -1.005 800 HD3 LYS 209 HD1 LYS 209 15.248 -11.048 -0.268 801 HE2 LYS 209 HE2 LYS 209 13.118 -12.657 1.137 802 HE3 LYS 209 HE1 LYS 209 14.861 -12.891 1.261 803 HZ1 LYS 209 HZ1 LYS 209 14.082 -11.675 3.158 804 HZ2 LYS 209 HZ2 LYS 209 13.322 -10.525 2.183 805 HZ3 LYS 209 HZ3 LYS 209 15.009 -10.631 2.203 806 H GLU 210 HN GLU 210 11.013 -7.205 -3.473 807 HA GLU 210 HA GLU 210 13.192 -5.776 -4.817 808 HB2 GLU 210 HB2 GLU 210 11.846 -5.937 -6.941 809 HB3 GLU 210 HB1 GLU 210 12.529 -7.459 -6.392 810 HG2 GLU 210 HG2 GLU 210 10.337 -8.039 -5.409 811 HG3 GLU 210 HG1 GLU 210 9.675 -6.553 -6.086 812 H GLN 211 HN GLN 211 12.292 -4.532 -2.845 813 HA GLN 211 HA GLN 211 9.707 -3.435 -2.874 814 HB2 GLN 211 HB2 GLN 211 10.614 -1.860 -1.152 815 HB3 GLN 211 HB1 GLN 211 10.901 -3.559 -0.808 816 HG2 GLN 211 HG2 GLN 211 13.199 -3.304 -1.682 817 HG3 GLN 211 HG1 GLN 211 12.893 -1.583 -1.895 818 HE21 GLN 211 HE21 GLN 211 13.429 -4.140 0.390 819 HE22 GLN 211 HE22 GLN 211 13.721 -3.127 1.758 820 H VAL 212 HN VAL 212 12.794 -2.132 -4.038 821 HA VAL 212 HA VAL 212 11.511 0.384 -4.743 822 HB VAL 212 HB VAL 212 13.819 0.220 -3.687 823 HG11 VAL 212 HG11 VAL 212 14.608 -0.578 -6.481 824 HG12 VAL 212 HG12 VAL 212 14.726 -1.577 -5.034 825 HG13 VAL 212 HG13 VAL 212 15.717 -0.128 -5.186 826 HG21 VAL 212 HG21 VAL 212 14.723 2.095 -4.997 827 HG22 VAL 212 HG22 VAL 212 13.009 2.291 -4.632 828 HG23 VAL 212 HG23 VAL 212 13.514 1.786 -6.244 829 H GLU 213 HN GLU 213 11.368 -2.451 -6.131 830 HA GLU 213 HA GLU 213 12.087 -1.694 -8.843 831 HB2 GLU 213 HB2 GLU 213 12.550 -3.986 -8.049 832 HB3 GLU 213 HB1 GLU 213 10.833 -4.235 -7.781 833 HG2 GLU 213 HG2 GLU 213 11.593 -5.282 -9.845 834 HG3 GLU 213 HG1 GLU 213 10.401 -4.021 -10.154 Start of MODEL 10 1 H1 SER 1 HT1 SER 1 -20.963 -3.066 7.999 2 H2 SER 1 HT2 SER 1 -20.952 -1.428 8.404 3 H3 SER 1 HT3 SER 1 -19.496 -2.266 8.229 4 HA SER 1 HA SER 1 -19.887 -2.577 5.905 5 HB2 SER 1 HB2 SER 1 -22.378 -2.660 6.102 6 HB3 SER 1 HB1 SER 1 -22.372 -0.913 6.340 7 HG SER 1 HG SER 1 -21.023 -1.836 4.093 8 H GLU 2 HN GLU 2 -19.510 -0.214 8.171 9 HA GLU 2 HA GLU 2 -19.349 2.081 6.520 10 HB2 GLU 2 HB2 GLU 2 -18.223 1.498 9.246 11 HB3 GLU 2 HB1 GLU 2 -18.162 3.067 8.463 12 HG2 GLU 2 HG2 GLU 2 -20.631 3.056 8.342 13 HG3 GLU 2 HG1 GLU 2 -20.626 1.551 9.260 14 H GLU 3 HN GLU 3 -17.183 -0.524 7.107 15 HA GLU 3 HA GLU 3 -14.716 0.767 6.723 16 HB2 GLU 3 HB2 GLU 3 -13.812 -1.458 6.222 17 HB3 GLU 3 HB1 GLU 3 -14.995 -1.654 7.521 18 HG2 GLU 3 HG2 GLU 3 -16.639 -2.434 5.935 19 HG3 GLU 3 HG1 GLU 3 -15.513 -2.185 4.601 20 H GLU 4 HN GLU 4 -17.143 -0.266 4.398 21 HA GLU 4 HA GLU 4 -15.324 0.404 2.207 22 HB2 GLU 4 HB2 GLU 4 -16.507 -1.682 1.932 23 HB3 GLU 4 HB1 GLU 4 -18.053 -0.895 2.213 24 HG2 GLU 4 HG2 GLU 4 -17.761 0.396 0.153 25 HG3 GLU 4 HG1 GLU 4 -16.230 -0.426 -0.135 26 H ASP 5 HN ASP 5 -18.184 1.582 3.835 27 HA ASP 5 HA ASP 5 -18.870 3.341 1.641 28 HB2 ASP 5 HB2 ASP 5 -20.716 2.302 2.718 29 HB3 ASP 5 HB1 ASP 5 -20.160 2.821 4.304 30 H LYS 6 HN LYS 6 -17.624 3.635 4.924 31 HA LYS 6 HA LYS 6 -17.769 6.480 4.978 32 HB2 LYS 6 HB2 LYS 6 -17.689 4.987 7.003 33 HB3 LYS 6 HB1 LYS 6 -15.993 4.693 6.652 34 HG2 LYS 6 HG2 LYS 6 -15.509 7.061 6.941 35 HG3 LYS 6 HG1 LYS 6 -17.216 7.372 7.263 36 HD2 LYS 6 HD2 LYS 6 -17.107 5.914 9.226 37 HD3 LYS 6 HD1 LYS 6 -15.398 5.613 8.904 38 HE2 LYS 6 HE2 LYS 6 -16.639 8.294 9.518 39 HE3 LYS 6 HE1 LYS 6 -15.695 7.313 10.638 40 HZ1 LYS 6 HZ1 LYS 6 -13.790 7.538 9.167 41 HZ2 LYS 6 HZ2 LYS 6 -14.354 9.056 9.652 42 HZ3 LYS 6 HZ3 LYS 6 -14.695 8.487 8.099 43 H CYS 7 HN CYS 7 -15.580 4.206 3.678 44 HA CYS 7 HA CYS 7 -13.339 6.020 3.497 45 HB2 CYS 7 HB2 CYS 7 -13.796 3.274 2.324 46 HB3 CYS 7 HB1 CYS 7 -12.265 4.147 2.286 47 HG CYS 7 HG CYS 7 -13.491 2.214 4.642 48 H LYS 8 HN LYS 8 -12.604 7.010 1.648 49 HA LYS 8 HA LYS 8 -14.616 7.349 -0.449 50 HB2 LYS 8 HB2 LYS 8 -12.196 8.922 0.388 51 HB3 LYS 8 HB1 LYS 8 -12.890 9.143 -1.209 52 HG2 LYS 8 HG2 LYS 8 -13.707 10.819 0.313 53 HG3 LYS 8 HG1 LYS 8 -15.010 9.769 -0.233 54 HD2 LYS 8 HD2 LYS 8 -14.835 8.512 1.898 55 HD3 LYS 8 HD1 LYS 8 -13.587 9.641 2.427 56 HE2 LYS 8 HE2 LYS 8 -15.144 11.470 2.359 57 HE3 LYS 8 HE1 LYS 8 -16.388 10.436 1.658 58 HZ1 LYS 8 HZ1 LYS 8 -15.221 10.186 4.378 59 HZ2 LYS 8 HZ2 LYS 8 -16.349 9.119 3.706 60 HZ3 LYS 8 HZ3 LYS 8 -16.777 10.728 3.997 61 HA PRO 9 HA PRO 9 -12.780 4.593 -3.226 62 HB2 PRO 9 HB2 PRO 9 -13.668 5.721 -5.564 63 HB3 PRO 9 HB1 PRO 9 -14.653 4.711 -4.503 64 HG2 PRO 9 HG2 PRO 9 -14.561 7.679 -4.748 65 HG3 PRO 9 HG1 PRO 9 -15.954 6.618 -4.484 66 HD2 PRO 9 HD2 PRO 9 -14.802 8.055 -2.492 67 HD3 PRO 9 HD1 PRO 9 -15.567 6.482 -2.204 68 H MET 10 HN MET 10 -10.761 4.411 -3.916 69 HA MET 10 HA MET 10 -9.202 6.778 -4.537 70 HB2 MET 10 HB2 MET 10 -8.321 4.908 -3.114 71 HB3 MET 10 HB1 MET 10 -8.320 3.888 -4.549 72 HG2 MET 10 HG2 MET 10 -6.148 4.595 -4.507 73 HG3 MET 10 HG1 MET 10 -6.880 5.812 -5.558 74 HE1 MET 10 HE1 MET 10 -6.112 4.832 -2.031 75 HE2 MET 10 HE2 MET 10 -5.536 6.297 -1.236 76 HE3 MET 10 HE3 MET 10 -4.521 5.485 -2.427 77 H SER 11 HN SER 11 -8.676 7.441 -6.542 78 HA SER 11 HA SER 11 -9.867 6.030 -8.766 79 HB2 SER 11 HB2 SER 11 -9.084 8.045 -10.068 80 HB3 SER 11 HB1 SER 11 -10.175 8.404 -8.732 81 HG SER 11 HG SER 11 -8.378 9.013 -7.486 82 H TYR 12 HN TYR 12 -8.427 6.152 -10.927 83 HA TYR 12 HA TYR 12 -6.513 4.133 -10.581 84 HB2 TYR 12 HB2 TYR 12 -7.266 3.967 -12.702 85 HB3 TYR 12 HB1 TYR 12 -7.597 5.689 -12.834 86 HD1 TYR 12 HD1 TYR 12 -4.816 3.213 -12.950 87 HD2 TYR 12 HD2 TYR 12 -6.197 7.048 -14.127 88 HE1 TYR 12 HE1 TYR 12 -2.855 3.458 -14.406 89 HE2 TYR 12 HE2 TYR 12 -4.241 7.311 -15.585 90 HH TYR 12 HH TYR 12 -2.218 4.753 -16.433 91 H GLU 13 HN GLU 13 -6.104 7.575 -11.281 92 HA GLU 13 HA GLU 13 -3.306 7.595 -11.508 93 HB2 GLU 13 HB2 GLU 13 -5.295 9.716 -10.673 94 HB3 GLU 13 HB1 GLU 13 -3.597 10.062 -10.972 95 HG2 GLU 13 HG2 GLU 13 -5.166 8.664 -13.084 96 HG3 GLU 13 HG1 GLU 13 -5.409 10.404 -12.854 97 H GLU 14 HN GLU 14 -5.435 7.693 -8.760 98 HA GLU 14 HA GLU 14 -3.448 8.480 -6.877 99 HB2 GLU 14 HB2 GLU 14 -6.235 7.390 -6.642 100 HB3 GLU 14 HB1 GLU 14 -5.239 7.692 -5.228 101 HG2 GLU 14 HG2 GLU 14 -5.051 10.058 -5.929 102 HG3 GLU 14 HG1 GLU 14 -6.139 9.715 -7.271 103 H LYS 15 HN LYS 15 -5.110 5.427 -7.628 104 HA LYS 15 HA LYS 15 -3.723 3.743 -5.912 105 HB2 LYS 15 HB2 LYS 15 -4.854 3.220 -8.651 106 HB3 LYS 15 HB1 LYS 15 -4.116 1.955 -7.676 107 HG2 LYS 15 HG2 LYS 15 -5.803 1.909 -6.168 108 HG3 LYS 15 HG1 LYS 15 -6.297 3.569 -6.490 109 HD2 LYS 15 HD2 LYS 15 -7.468 3.011 -8.361 110 HD3 LYS 15 HD1 LYS 15 -6.485 1.586 -8.690 111 HE2 LYS 15 HE2 LYS 15 -7.483 0.531 -6.690 112 HE3 LYS 15 HE1 LYS 15 -8.585 1.901 -6.555 113 HZ1 LYS 15 HZ1 LYS 15 -8.387 0.051 -8.884 114 HZ2 LYS 15 HZ2 LYS 15 -9.439 1.377 -8.761 115 HZ3 LYS 15 HZ3 LYS 15 -9.621 0.057 -7.721 116 H ARG 16 HN ARG 16 -2.805 4.904 -9.135 117 HA ARG 16 HA ARG 16 -0.415 3.419 -9.361 118 HB2 ARG 16 HB2 ARG 16 -1.440 4.573 -11.281 119 HB3 ARG 16 HB1 ARG 16 -1.018 6.118 -10.556 120 HG2 ARG 16 HG2 ARG 16 1.359 5.374 -10.585 121 HG3 ARG 16 HG1 ARG 16 0.848 4.006 -11.552 122 HD2 ARG 16 HD2 ARG 16 1.702 5.755 -12.969 123 HD3 ARG 16 HD1 ARG 16 -0.018 5.555 -13.217 124 HE ARG 16 HE ARG 16 1.122 7.717 -11.581 125 HH11 ARG 16 HH11 ARG 16 -1.154 6.557 -13.967 126 HH12 ARG 16 HH12 ARG 16 -1.989 8.077 -14.103 127 HH21 ARG 16 HH21 ARG 16 0.040 9.720 -11.759 128 HH22 ARG 16 HH22 ARG 16 -1.307 9.880 -12.851 129 H GLN 17 HN GLN 17 -0.971 6.765 -8.260 130 HA GLN 17 HA GLN 17 1.639 7.385 -7.531 131 HB2 GLN 17 HB2 GLN 17 -0.236 9.010 -7.582 132 HB3 GLN 17 HB1 GLN 17 -0.895 8.264 -6.136 133 HG2 GLN 17 HG2 GLN 17 0.242 10.160 -5.376 134 HG3 GLN 17 HG1 GLN 17 1.312 8.807 -5.026 135 HE21 GLN 17 HE21 GLN 17 0.803 10.280 -8.165 136 HE22 GLN 17 HE22 GLN 17 2.413 10.883 -8.346 137 H LEU 18 HN LEU 18 -0.897 5.753 -5.805 138 HA LEU 18 HA LEU 18 0.274 5.403 -3.303 139 HB2 LEU 18 HB2 LEU 18 -2.099 4.888 -4.314 140 HB3 LEU 18 HB1 LEU 18 -1.415 3.304 -4.572 141 HG LEU 18 HG LEU 18 -1.945 4.686 -1.965 142 HD11 LEU 18 HD11 LEU 18 -3.151 2.440 -1.690 143 HD12 LEU 18 HD12 LEU 18 -3.011 2.327 -3.438 144 HD13 LEU 18 HD13 LEU 18 -3.877 3.676 -2.704 145 HD21 LEU 18 HD21 LEU 18 -0.019 3.662 -1.318 146 HD22 LEU 18 HD22 LEU 18 -0.124 2.424 -2.565 147 HD23 LEU 18 HD23 LEU 18 -1.139 2.316 -1.128 148 H SER 19 HN SER 19 0.276 3.221 -6.120 149 HA SER 19 HA SER 19 1.862 1.233 -4.934 150 HB2 SER 19 HB2 SER 19 1.921 0.240 -7.055 151 HB3 SER 19 HB1 SER 19 0.430 1.179 -7.078 152 HG SER 19 HG SER 19 1.751 2.897 -8.075 153 H LEU 20 HN LEU 20 2.623 4.297 -6.220 154 HA LEU 20 HA LEU 20 5.445 3.739 -6.577 155 HB2 LEU 20 HB2 LEU 20 3.809 6.227 -6.919 156 HB3 LEU 20 HB1 LEU 20 5.526 6.147 -7.241 157 HG LEU 20 HG LEU 20 3.310 4.773 -8.706 158 HD11 LEU 20 HD11 LEU 20 3.877 7.075 -9.295 159 HD12 LEU 20 HD12 LEU 20 4.167 5.944 -10.608 160 HD13 LEU 20 HD13 LEU 20 5.519 6.568 -9.660 161 HD21 LEU 20 HD21 LEU 20 4.971 3.106 -8.430 162 HD22 LEU 20 HD22 LEU 20 6.261 4.233 -8.848 163 HD23 LEU 20 HD23 LEU 20 5.099 3.724 -10.075 164 H ASP 21 HN ASP 21 3.301 5.304 -4.282 165 HA ASP 21 HA ASP 21 5.482 6.323 -2.688 166 HB2 ASP 21 HB2 ASP 21 3.806 7.061 -1.108 167 HB3 ASP 21 HB1 ASP 21 3.426 7.572 -2.727 168 H ILE 22 HN ILE 22 3.392 3.492 -2.608 169 HA ILE 22 HA ILE 22 4.483 2.332 -0.296 170 HB ILE 22 HB ILE 22 3.059 1.376 -2.694 171 HG12 ILE 22 HG12 ILE 22 2.787 0.638 0.204 172 HG13 ILE 22 HG11 ILE 22 2.023 2.049 -0.521 173 HG21 ILE 22 HG21 ILE 22 4.582 -0.585 -1.007 174 HG22 ILE 22 HG22 ILE 22 4.924 -0.189 -2.686 175 HG23 ILE 22 HG23 ILE 22 3.409 -0.976 -2.257 176 HD11 ILE 22 HD11 ILE 22 1.553 -0.789 -1.398 177 HD12 ILE 22 HD12 ILE 22 0.712 0.653 -1.960 178 HD13 ILE 22 HD13 ILE 22 0.516 0.112 -0.294 179 H ASN 23 HN ASN 23 5.549 2.478 -3.617 180 HA ASN 23 HA ASN 23 7.747 0.737 -3.416 181 HB2 ASN 23 HB2 ASN 23 6.732 1.455 -5.545 182 HB3 ASN 23 HB1 ASN 23 7.284 3.096 -5.253 183 HD21 ASN 23 HD21 ASN 23 9.434 3.610 -5.576 184 HD22 ASN 23 HD22 ASN 23 10.532 2.545 -6.378 185 H LYS 24 HN LYS 24 7.205 3.948 -2.343 186 HA LYS 24 HA LYS 24 9.969 4.735 -2.184 187 HB2 LYS 24 HB2 LYS 24 7.363 5.911 -1.331 188 HB3 LYS 24 HB1 LYS 24 8.869 6.613 -0.765 189 HG2 LYS 24 HG2 LYS 24 9.538 7.091 -3.028 190 HG3 LYS 24 HG1 LYS 24 8.129 6.239 -3.664 191 HD2 LYS 24 HD2 LYS 24 6.642 7.872 -2.715 192 HD3 LYS 24 HD1 LYS 24 7.965 8.668 -1.873 193 HE2 LYS 24 HE2 LYS 24 7.326 9.930 -3.848 194 HE3 LYS 24 HE1 LYS 24 8.950 9.276 -4.053 195 HZ1 LYS 24 HZ1 LYS 24 6.454 8.167 -5.221 196 HZ2 LYS 24 HZ2 LYS 24 7.989 7.472 -5.378 197 HZ3 LYS 24 HZ3 LYS 24 7.674 8.990 -6.057 198 H LEU 25 HN LEU 25 7.804 2.940 -0.233 199 HA LEU 25 HA LEU 25 8.907 3.612 2.315 200 HB2 LEU 25 HB2 LEU 25 7.184 1.324 1.392 201 HB3 LEU 25 HB1 LEU 25 7.724 1.506 3.050 202 HG LEU 25 HG LEU 25 5.805 3.227 1.516 203 HD11 LEU 25 HD11 LEU 25 5.745 1.887 4.192 204 HD12 LEU 25 HD12 LEU 25 4.964 1.277 2.733 205 HD13 LEU 25 HD13 LEU 25 4.415 2.785 3.471 206 HD21 LEU 25 HD21 LEU 25 7.168 3.891 4.100 207 HD22 LEU 25 HD22 LEU 25 5.834 4.789 3.386 208 HD23 LEU 25 HD23 LEU 25 7.398 4.740 2.576 209 HA PRO 26 HA PRO 26 12.439 0.863 2.266 210 HB2 PRO 26 HB2 PRO 26 12.895 0.862 4.955 211 HB3 PRO 26 HB1 PRO 26 13.407 2.175 3.891 212 HG2 PRO 26 HG2 PRO 26 11.040 2.005 5.701 213 HG3 PRO 26 HG1 PRO 26 12.089 3.390 5.374 214 HD2 PRO 26 HD2 PRO 26 9.623 3.081 4.250 215 HD3 PRO 26 HD1 PRO 26 10.947 3.957 3.453 216 H GLY 27 HN GLY 27 12.926 -1.286 3.040 217 HA2 GLY 27 HA2 GLY 27 10.865 -3.054 2.746 218 HA3 GLY 27 HA1 GLY 27 12.371 -3.457 3.541 219 H GLU 28 HN GLU 28 12.216 -2.009 5.849 220 HA GLU 28 HA GLU 28 10.600 -3.643 7.453 221 HB2 GLU 28 HB2 GLU 28 11.106 -1.730 9.184 222 HB3 GLU 28 HB1 GLU 28 12.356 -2.843 8.659 223 HG2 GLU 28 HG2 GLU 28 11.941 -0.205 7.326 224 HG3 GLU 28 HG1 GLU 28 12.885 -0.359 8.795 225 H LYS 29 HN LYS 29 10.080 -0.333 6.306 226 HA LYS 29 HA LYS 29 7.709 0.040 7.867 227 HB2 LYS 29 HB2 LYS 29 9.246 1.586 5.889 228 HB3 LYS 29 HB1 LYS 29 7.523 1.911 5.891 229 HG2 LYS 29 HG2 LYS 29 8.777 3.479 7.286 230 HG3 LYS 29 HG1 LYS 29 7.613 2.548 8.223 231 HD2 LYS 29 HD2 LYS 29 9.211 1.488 9.410 232 HD3 LYS 29 HD1 LYS 29 10.344 1.438 8.053 233 HE2 LYS 29 HE2 LYS 29 11.131 2.894 9.868 234 HE3 LYS 29 HE1 LYS 29 10.863 3.785 8.372 235 HZ1 LYS 29 HZ1 LYS 29 8.772 4.582 9.254 236 HZ2 LYS 29 HZ2 LYS 29 10.017 4.952 10.337 237 HZ3 LYS 29 HZ3 LYS 29 8.973 3.665 10.662 238 H LEU 30 HN LEU 30 8.462 -1.272 4.752 239 HA LEU 30 HA LEU 30 5.764 -0.982 3.792 240 HB2 LEU 30 HB2 LEU 30 6.776 -1.007 1.862 241 HB3 LEU 30 HB1 LEU 30 8.299 -1.402 2.604 242 HG LEU 30 HG LEU 30 6.292 -3.399 1.550 243 HD11 LEU 30 HD11 LEU 30 7.741 -1.747 0.089 244 HD12 LEU 30 HD12 LEU 30 7.503 -3.429 -0.383 245 HD13 LEU 30 HD13 LEU 30 8.996 -2.939 0.414 246 HD21 LEU 30 HD21 LEU 30 7.710 -4.263 3.411 247 HD22 LEU 30 HD22 LEU 30 9.136 -3.836 2.469 248 HD23 LEU 30 HD23 LEU 30 8.017 -5.056 1.867 249 H GLY 31 HN GLY 31 7.410 -3.249 5.707 250 HA2 GLY 31 HA2 GLY 31 5.773 -5.519 5.183 251 HA3 GLY 31 HA1 GLY 31 6.615 -5.195 6.687 252 H ARG 32 HN ARG 32 5.152 -2.480 6.720 253 HA ARG 32 HA ARG 32 2.830 -3.348 8.146 254 HB2 ARG 32 HB2 ARG 32 3.803 -1.290 8.850 255 HB3 ARG 32 HB1 ARG 32 3.678 -0.606 7.242 256 HG2 ARG 32 HG2 ARG 32 1.689 0.224 7.748 257 HG3 ARG 32 HG1 ARG 32 1.084 -1.400 8.069 258 HD2 ARG 32 HD2 ARG 32 2.594 0.256 10.078 259 HD3 ARG 32 HD1 ARG 32 0.834 0.207 9.970 260 HE ARG 32 HE ARG 32 2.241 -2.329 10.304 261 HH11 ARG 32 HH11 ARG 32 0.346 0.238 11.748 262 HH12 ARG 32 HH12 ARG 32 -0.106 -0.708 13.130 263 HH21 ARG 32 HH21 ARG 32 1.638 -3.574 12.118 264 HH22 ARG 32 HH22 ARG 32 0.623 -2.876 13.339 265 H VAL 33 HN VAL 33 3.311 -1.944 4.891 266 HA VAL 33 HA VAL 33 0.561 -1.694 4.312 267 HB VAL 33 HB VAL 33 1.702 -2.366 1.862 268 HG11 VAL 33 HG11 VAL 33 1.203 0.253 3.241 269 HG12 VAL 33 HG12 VAL 33 0.156 -0.602 2.104 270 HG13 VAL 33 HG13 VAL 33 1.651 0.131 1.543 271 HG21 VAL 33 HG21 VAL 33 3.584 -0.479 3.220 272 HG22 VAL 33 HG22 VAL 33 3.754 -1.268 1.649 273 HG23 VAL 33 HG23 VAL 33 3.920 -2.209 3.133 274 H VAL 34 HN VAL 34 2.806 -4.340 3.593 275 HA VAL 34 HA VAL 34 1.047 -6.268 2.684 276 HB VAL 34 HB VAL 34 2.687 -7.779 3.037 277 HG11 VAL 34 HG11 VAL 34 3.968 -5.922 2.272 278 HG12 VAL 34 HG12 VAL 34 4.920 -6.888 3.398 279 HG13 VAL 34 HG13 VAL 34 4.205 -5.365 3.927 280 HG21 VAL 34 HG21 VAL 34 2.095 -8.138 5.375 281 HG22 VAL 34 HG22 VAL 34 3.149 -6.794 5.835 282 HG23 VAL 34 HG23 VAL 34 3.839 -8.246 5.108 283 H HIS 35 HN HIS 35 1.548 -5.216 6.042 284 HA HIS 35 HA HIS 35 -0.113 -7.237 7.163 285 HB2 HIS 35 HB2 HIS 35 1.656 -6.148 8.472 286 HB3 HIS 35 HB1 HIS 35 0.807 -4.610 8.352 287 HD1 HIS 35 HD1 HIS 35 0.498 -8.013 9.956 288 HD2 HIS 35 HD2 HIS 35 -1.194 -4.222 10.204 289 HE1 HIS 35 HE1 HIS 35 -0.948 -8.051 12.014 290 HE2 HIS 35 HE2 HIS 35 -1.952 -5.745 12.158 291 H ILE 36 HN ILE 36 -0.607 -3.778 6.473 292 HA ILE 36 HA ILE 36 -3.263 -3.602 7.354 293 HB ILE 36 HB ILE 36 -1.974 -2.120 5.046 294 HG12 ILE 36 HG12 ILE 36 -2.385 -1.180 7.884 295 HG13 ILE 36 HG11 ILE 36 -0.905 -1.961 7.358 296 HG21 ILE 36 HG21 ILE 36 -3.804 -0.678 5.013 297 HG22 ILE 36 HG22 ILE 36 -4.280 -1.112 6.659 298 HG23 ILE 36 HG23 ILE 36 -4.567 -2.238 5.339 299 HD11 ILE 36 HD11 ILE 36 -0.700 -0.154 5.647 300 HD12 ILE 36 HD12 ILE 36 -0.541 0.372 7.318 301 HD13 ILE 36 HD13 ILE 36 -2.041 0.653 6.441 302 H ILE 37 HN ILE 37 -1.877 -4.417 4.248 303 HA ILE 37 HA ILE 37 -4.264 -4.800 2.837 304 HB ILE 37 HB ILE 37 -1.447 -5.703 2.458 305 HG12 ILE 37 HG12 ILE 37 -3.123 -3.977 0.673 306 HG13 ILE 37 HG11 ILE 37 -2.345 -3.327 2.105 307 HG21 ILE 37 HG21 ILE 37 -3.775 -6.894 1.292 308 HG22 ILE 37 HG22 ILE 37 -2.077 -7.349 1.118 309 HG23 ILE 37 HG23 ILE 37 -2.777 -6.133 0.053 310 HD11 ILE 37 HD11 ILE 37 -0.948 -2.865 0.287 311 HD12 ILE 37 HD12 ILE 37 -1.038 -4.538 -0.285 312 HD13 ILE 37 HD13 ILE 37 -0.185 -4.163 1.212 313 H GLN 38 HN GLN 38 -2.069 -7.331 4.132 314 HA GLN 38 HA GLN 38 -3.705 -9.518 3.722 315 HB2 GLN 38 HB2 GLN 38 -1.772 -8.987 5.991 316 HB3 GLN 38 HB1 GLN 38 -2.530 -10.548 5.712 317 HG2 GLN 38 HG2 GLN 38 -1.465 -10.653 3.509 318 HG3 GLN 38 HG1 GLN 38 -0.711 -9.093 3.820 319 HE21 GLN 38 HE21 GLN 38 -1.153 -11.541 6.277 320 HE22 GLN 38 HE22 GLN 38 0.522 -11.925 6.464 321 H SER 39 HN SER 39 -3.929 -7.143 6.334 322 HA SER 39 HA SER 39 -5.766 -8.751 7.872 323 HB2 SER 39 HB2 SER 39 -5.920 -6.736 9.328 324 HB3 SER 39 HB1 SER 39 -4.266 -7.270 9.053 325 HG SER 39 HG SER 39 -3.898 -5.579 7.754 326 H ARG 40 HN ARG 40 -5.999 -5.789 5.916 327 HA ARG 40 HA ARG 40 -8.845 -5.629 6.204 328 HB2 ARG 40 HB2 ARG 40 -6.785 -4.123 4.657 329 HB3 ARG 40 HB1 ARG 40 -8.446 -4.057 4.083 330 HG2 ARG 40 HG2 ARG 40 -9.146 -3.201 6.210 331 HG3 ARG 40 HG1 ARG 40 -7.512 -3.356 6.844 332 HD2 ARG 40 HD2 ARG 40 -6.699 -1.712 5.424 333 HD3 ARG 40 HD1 ARG 40 -8.137 -1.745 4.411 334 HE ARG 40 HE ARG 40 -9.347 -0.600 6.113 335 HH11 ARG 40 HH11 ARG 40 -5.966 -0.922 6.930 336 HH12 ARG 40 HH12 ARG 40 -5.931 0.524 7.892 337 HH21 ARG 40 HH21 ARG 40 -9.319 1.264 7.402 338 HH22 ARG 40 HH22 ARG 40 -7.844 1.758 8.175 339 H GLU 41 HN GLU 41 -6.664 -7.160 4.032 340 HA GLU 41 HA GLU 41 -8.901 -8.160 2.400 341 HB2 GLU 41 HB2 GLU 41 -5.984 -8.408 1.706 342 HB3 GLU 41 HB1 GLU 41 -7.379 -8.513 0.639 343 HG2 GLU 41 HG2 GLU 41 -6.493 -5.995 2.012 344 HG3 GLU 41 HG1 GLU 41 -5.996 -6.471 0.388 345 HA PRO 42 HA PRO 42 -7.233 -11.455 5.247 346 HB2 PRO 42 HB2 PRO 42 -9.564 -12.662 5.874 347 HB3 PRO 42 HB1 PRO 42 -9.009 -11.200 6.677 348 HG2 PRO 42 HG2 PRO 42 -11.008 -11.487 4.483 349 HG3 PRO 42 HG1 PRO 42 -11.084 -10.476 5.938 350 HD2 PRO 42 HD2 PRO 42 -10.394 -9.515 3.498 351 HD3 PRO 42 HD1 PRO 42 -9.764 -8.833 5.011 352 H SER 43 HN SER 43 -9.086 -11.502 2.435 353 HA SER 43 HA SER 43 -9.102 -14.263 1.851 354 HB2 SER 43 HB2 SER 43 -9.300 -13.406 -0.560 355 HB3 SER 43 HB1 SER 43 -10.554 -12.900 0.575 356 HG SER 43 HG SER 43 -8.652 -11.406 -0.734 357 H LEU 44 HN LEU 44 -6.583 -11.867 1.758 358 HA LEU 44 HA LEU 44 -4.880 -13.810 0.358 359 HB2 LEU 44 HB2 LEU 44 -3.379 -11.950 -0.208 360 HB3 LEU 44 HB1 LEU 44 -4.972 -11.748 -0.868 361 HG LEU 44 HG LEU 44 -5.219 -10.272 1.360 362 HD11 LEU 44 HD11 LEU 44 -3.123 -8.895 1.439 363 HD12 LEU 44 HD12 LEU 44 -2.323 -10.199 0.562 364 HD13 LEU 44 HD13 LEU 44 -3.004 -10.500 2.160 365 HD21 LEU 44 HD21 LEU 44 -5.798 -9.551 -0.858 366 HD22 LEU 44 HD22 LEU 44 -4.098 -9.465 -1.318 367 HD23 LEU 44 HD23 LEU 44 -4.746 -8.343 -0.122 368 H LYS 45 HN LYS 45 -5.638 -13.612 3.261 369 HA LYS 45 HA LYS 45 -3.267 -12.910 4.675 370 HB2 LYS 45 HB2 LYS 45 -4.277 -13.782 6.607 371 HB3 LYS 45 HB1 LYS 45 -5.584 -13.082 5.672 372 HG2 LYS 45 HG2 LYS 45 -6.226 -15.307 4.902 373 HG3 LYS 45 HG1 LYS 45 -4.898 -16.005 5.834 374 HD2 LYS 45 HD2 LYS 45 -7.097 -14.368 7.078 375 HD3 LYS 45 HD1 LYS 45 -7.161 -16.124 6.926 376 HE2 LYS 45 HE2 LYS 45 -6.287 -15.906 9.037 377 HE3 LYS 45 HE1 LYS 45 -4.822 -16.016 8.063 378 HZ1 LYS 45 HZ1 LYS 45 -4.762 -14.235 9.750 379 HZ2 LYS 45 HZ2 LYS 45 -6.038 -13.459 8.961 380 HZ3 LYS 45 HZ3 LYS 45 -4.553 -13.651 8.181 381 H ASN 46 HN ASN 46 -4.069 -15.582 2.723 382 HA ASN 46 HA ASN 46 -2.333 -17.499 3.922 383 HB2 ASN 46 HB2 ASN 46 -4.077 -18.245 2.424 384 HB3 ASN 46 HB1 ASN 46 -3.436 -17.261 1.116 385 HD21 ASN 46 HD21 ASN 46 -2.949 -20.108 3.062 386 HD22 ASN 46 HD22 ASN 46 -1.814 -20.878 1.996 387 H SER 47 HN SER 47 -1.888 -14.769 1.879 388 HA SER 47 HA SER 47 0.629 -15.493 0.766 389 HB2 SER 47 HB2 SER 47 -0.693 -12.799 1.133 390 HB3 SER 47 HB1 SER 47 0.782 -13.056 0.197 391 HG SER 47 HG SER 47 -1.601 -14.502 -0.317 392 H ASN 48 HN ASN 48 2.649 -15.247 1.552 393 HA ASN 48 HA ASN 48 3.032 -14.845 4.334 394 HB2 ASN 48 HB2 ASN 48 5.078 -14.898 2.109 395 HB3 ASN 48 HB1 ASN 48 5.435 -15.032 3.823 396 HD21 ASN 48 HD21 ASN 48 4.979 -16.948 4.903 397 HD22 ASN 48 HD22 ASN 48 4.604 -18.415 4.064 398 HA PRO 49 HA PRO 49 3.255 -10.473 4.596 399 HB2 PRO 49 HB2 PRO 49 4.914 -10.280 6.769 400 HB3 PRO 49 HB1 PRO 49 3.191 -10.651 6.860 401 HG2 PRO 49 HG2 PRO 49 5.530 -12.497 6.966 402 HG3 PRO 49 HG1 PRO 49 4.037 -12.512 7.922 403 HD2 PRO 49 HD2 PRO 49 4.410 -14.184 5.853 404 HD3 PRO 49 HD1 PRO 49 2.814 -13.505 6.231 405 H ASP 50 HN ASP 50 6.098 -12.379 4.183 406 HA ASP 50 HA ASP 50 7.697 -9.996 3.576 407 HB2 ASP 50 HB2 ASP 50 8.479 -12.896 3.911 408 HB3 ASP 50 HB1 ASP 50 9.600 -11.631 3.423 409 H GLU 51 HN GLU 51 5.541 -11.716 1.985 410 HA GLU 51 HA GLU 51 6.975 -11.562 -0.561 411 HB2 GLU 51 HB2 GLU 51 5.413 -14.005 0.300 412 HB3 GLU 51 HB1 GLU 51 6.236 -13.781 -1.235 413 HG2 GLU 51 HG2 GLU 51 8.390 -13.671 -0.017 414 HG3 GLU 51 HG1 GLU 51 7.519 -14.019 1.475 415 H ILE 52 HN ILE 52 4.906 -9.930 0.639 416 HA ILE 52 HA ILE 52 2.367 -10.787 -0.306 417 HB ILE 52 HB ILE 52 3.019 -9.133 1.653 418 HG12 ILE 52 HG12 ILE 52 0.680 -8.360 1.633 419 HG13 ILE 52 HG11 ILE 52 0.521 -8.891 -0.029 420 HG21 ILE 52 HG21 ILE 52 2.388 -7.308 -0.644 421 HG22 ILE 52 HG22 ILE 52 3.922 -7.393 0.220 422 HG23 ILE 52 HG23 ILE 52 2.471 -6.820 1.045 423 HD11 ILE 52 HD11 ILE 52 1.140 -10.658 2.286 424 HD12 ILE 52 HD12 ILE 52 0.818 -11.169 0.635 425 HD13 ILE 52 HD13 ILE 52 -0.459 -10.430 1.598 426 H GLU 53 HN GLU 53 1.117 -10.040 -1.899 427 HA GLU 53 HA GLU 53 2.408 -8.440 -4.002 428 HB2 GLU 53 HB2 GLU 53 0.807 -10.876 -4.090 429 HB3 GLU 53 HB1 GLU 53 0.126 -9.612 -5.100 430 HG2 GLU 53 HG2 GLU 53 1.523 -10.877 -6.494 431 HG3 GLU 53 HG1 GLU 53 2.405 -9.393 -6.155 432 H ILE 54 HN ILE 54 1.775 -6.394 -3.414 433 HA ILE 54 HA ILE 54 -0.831 -5.804 -2.418 434 HB ILE 54 HB ILE 54 1.196 -3.930 -3.650 435 HG12 ILE 54 HG12 ILE 54 0.873 -4.823 -0.782 436 HG13 ILE 54 HG11 ILE 54 2.266 -5.077 -1.824 437 HG21 ILE 54 HG21 ILE 54 -1.087 -3.416 -1.780 438 HG22 ILE 54 HG22 ILE 54 -1.032 -2.999 -3.489 439 HG23 ILE 54 HG23 ILE 54 0.063 -2.214 -2.351 440 HD11 ILE 54 HD11 ILE 54 2.777 -3.279 -0.323 441 HD12 ILE 54 HD12 ILE 54 1.271 -2.473 -0.722 442 HD13 ILE 54 HD13 ILE 54 2.545 -2.608 -1.930 443 H ASP 55 HN ASP 55 -2.470 -6.294 -3.828 444 HA ASP 55 HA ASP 55 -2.249 -5.356 -6.605 445 HB2 ASP 55 HB2 ASP 55 -2.860 -7.746 -6.290 446 HB3 ASP 55 HB1 ASP 55 -4.290 -7.241 -5.390 447 H PHE 56 HN PHE 56 -2.915 -3.323 -6.757 448 HA PHE 56 HA PHE 56 -4.550 -2.152 -4.756 449 HB2 PHE 56 HB2 PHE 56 -3.531 -1.010 -7.342 450 HB3 PHE 56 HB1 PHE 56 -4.280 -0.080 -6.045 451 HD1 PHE 56 HD1 PHE 56 -3.178 0.079 -3.879 452 HD2 PHE 56 HD2 PHE 56 -1.238 -1.688 -7.197 453 HE1 PHE 56 HE1 PHE 56 -1.057 0.331 -2.723 454 HE2 PHE 56 HE2 PHE 56 0.928 -1.436 -6.050 455 HZ PHE 56 HZ PHE 56 1.006 -0.415 -3.801 456 H GLU 57 HN GLU 57 -5.413 -3.871 -7.482 457 HA GLU 57 HA GLU 57 -7.847 -2.383 -7.995 458 HB2 GLU 57 HB2 GLU 57 -6.661 -4.902 -9.127 459 HB3 GLU 57 HB1 GLU 57 -8.298 -4.395 -9.527 460 HG2 GLU 57 HG2 GLU 57 -5.829 -2.728 -9.965 461 HG3 GLU 57 HG1 GLU 57 -6.606 -3.723 -11.195 462 H THR 58 HN THR 58 -6.812 -5.306 -6.359 463 HA THR 58 HA THR 58 -9.548 -5.992 -5.668 464 HB THR 58 HB THR 58 -8.424 -7.903 -4.423 465 HG1 THR 58 HG1 THR 58 -6.154 -7.027 -5.925 466 HG21 THR 58 HG21 THR 58 -7.951 -7.587 -7.387 467 HG22 THR 58 HG22 THR 58 -9.416 -8.208 -6.620 468 HG23 THR 58 HG23 THR 58 -7.909 -9.119 -6.512 469 H LEU 59 HN LEU 59 -6.803 -4.411 -4.236 470 HA LEU 59 HA LEU 59 -7.469 -4.511 -1.525 471 HB2 LEU 59 HB2 LEU 59 -6.226 -2.266 -3.081 472 HB3 LEU 59 HB1 LEU 59 -6.276 -2.376 -1.338 473 HG LEU 59 HG LEU 59 -4.855 -4.258 -3.205 474 HD11 LEU 59 HD11 LEU 59 -3.753 -2.435 -1.095 475 HD12 LEU 59 HD12 LEU 59 -3.815 -2.037 -2.810 476 HD13 LEU 59 HD13 LEU 59 -2.856 -3.406 -2.257 477 HD21 LEU 59 HD21 LEU 59 -5.350 -4.352 -0.245 478 HD22 LEU 59 HD22 LEU 59 -3.988 -5.180 -1.008 479 HD23 LEU 59 HD23 LEU 59 -5.638 -5.604 -1.460 480 H LYS 60 HN LYS 60 -9.057 -3.631 -0.352 481 HA LYS 60 HA LYS 60 -11.226 -2.276 -1.584 482 HB2 LYS 60 HB2 LYS 60 -10.486 -2.581 1.332 483 HB3 LYS 60 HB1 LYS 60 -12.006 -1.902 0.768 484 HG2 LYS 60 HG2 LYS 60 -12.541 -4.036 -0.313 485 HG3 LYS 60 HG1 LYS 60 -11.020 -4.701 0.281 486 HD2 LYS 60 HD2 LYS 60 -13.314 -3.705 1.967 487 HD3 LYS 60 HD1 LYS 60 -12.852 -5.389 1.716 488 HE2 LYS 60 HE2 LYS 60 -10.602 -4.779 2.698 489 HE3 LYS 60 HE1 LYS 60 -11.324 -3.242 3.171 490 HZ1 LYS 60 HZ1 LYS 60 -12.063 -5.955 4.088 491 HZ2 LYS 60 HZ2 LYS 60 -13.058 -4.610 4.353 492 HZ3 LYS 60 HZ3 LYS 60 -11.500 -4.661 5.020 493 HA PRO 61 HA PRO 61 -10.035 2.020 -1.595 494 HB2 PRO 61 HB2 PRO 61 -12.590 2.483 -0.132 495 HB3 PRO 61 HB1 PRO 61 -11.976 3.259 -1.593 496 HG2 PRO 61 HG2 PRO 61 -13.917 1.401 -1.665 497 HG3 PRO 61 HG1 PRO 61 -12.732 1.606 -2.962 498 HD2 PRO 61 HD2 PRO 61 -12.969 -0.551 -0.955 499 HD3 PRO 61 HD1 PRO 61 -12.204 -0.578 -2.555 500 H SER 62 HN SER 62 -11.424 0.594 1.297 501 HA SER 62 HA SER 62 -10.582 2.342 3.268 502 HB2 SER 62 HB2 SER 62 -10.335 -0.541 3.868 503 HB3 SER 62 HB1 SER 62 -11.303 0.698 4.668 504 HG SER 62 HG SER 62 -12.952 0.218 3.433 505 H THR 63 HN THR 63 -8.938 -0.536 2.002 506 HA THR 63 HA THR 63 -6.612 -0.265 3.563 507 HB THR 63 HB THR 63 -6.513 -1.607 0.895 508 HG1 THR 63 HG1 THR 63 -7.819 -3.296 1.639 509 HG21 THR 63 HG21 THR 63 -4.636 -2.343 1.903 510 HG22 THR 63 HG22 THR 63 -5.716 -3.379 2.841 511 HG23 THR 63 HG23 THR 63 -5.203 -1.825 3.492 512 H LEU 64 HN LEU 64 -7.356 0.638 0.205 513 HA LEU 64 HA LEU 64 -4.807 1.524 -0.501 514 HB2 LEU 64 HB2 LEU 64 -7.500 2.457 -1.457 515 HB3 LEU 64 HB1 LEU 64 -5.988 2.877 -2.227 516 HG LEU 64 HG LEU 64 -7.092 0.083 -1.955 517 HD11 LEU 64 HD11 LEU 64 -8.012 1.987 -3.599 518 HD12 LEU 64 HD12 LEU 64 -7.960 0.278 -4.023 519 HD13 LEU 64 HD13 LEU 64 -6.685 1.363 -4.571 520 HD21 LEU 64 HD21 LEU 64 -4.618 1.204 -3.242 521 HD22 LEU 64 HD22 LEU 64 -5.263 -0.400 -3.600 522 HD23 LEU 64 HD23 LEU 64 -4.718 -0.015 -1.967 523 H ARG 65 HN ARG 65 -7.533 3.382 0.861 524 HA ARG 65 HA ARG 65 -6.155 5.848 0.887 525 HB2 ARG 65 HB2 ARG 65 -8.490 4.860 2.512 526 HB3 ARG 65 HB1 ARG 65 -7.882 6.507 2.589 527 HG2 ARG 65 HG2 ARG 65 -8.941 5.169 0.106 528 HG3 ARG 65 HG1 ARG 65 -9.853 6.270 1.136 529 HD2 ARG 65 HD2 ARG 65 -8.265 8.059 0.648 530 HD3 ARG 65 HD1 ARG 65 -7.327 6.961 -0.360 531 HE ARG 65 HE ARG 65 -10.030 7.082 -1.228 532 HH11 ARG 65 HH11 ARG 65 -7.041 8.918 -1.290 533 HH12 ARG 65 HH12 ARG 65 -7.401 9.696 -2.799 534 HH21 ARG 65 HH21 ARG 65 -10.497 8.148 -3.222 535 HH22 ARG 65 HH22 ARG 65 -9.349 9.274 -3.872 536 H GLU 66 HN GLU 66 -6.211 3.123 3.066 537 HA GLU 66 HA GLU 66 -4.838 4.411 5.215 538 HB2 GLU 66 HB2 GLU 66 -6.110 2.442 5.698 539 HB3 GLU 66 HB1 GLU 66 -5.260 1.517 4.468 540 HG2 GLU 66 HG2 GLU 66 -4.339 0.763 6.440 541 HG3 GLU 66 HG1 GLU 66 -3.162 1.947 5.878 542 H LEU 67 HN LEU 67 -3.753 1.978 2.818 543 HA LEU 67 HA LEU 67 -1.061 1.897 3.272 544 HB2 LEU 67 HB2 LEU 67 -2.179 2.053 0.463 545 HB3 LEU 67 HB1 LEU 67 -0.803 1.123 1.041 546 HG LEU 67 HG LEU 67 -3.662 0.552 1.788 547 HD11 LEU 67 HD11 LEU 67 -2.056 -1.261 0.107 548 HD12 LEU 67 HD12 LEU 67 -2.705 0.189 -0.659 549 HD13 LEU 67 HD13 LEU 67 -3.794 -0.963 0.117 550 HD21 LEU 67 HD21 LEU 67 -1.324 -0.186 3.062 551 HD22 LEU 67 HD22 LEU 67 -1.716 -1.570 2.051 552 HD23 LEU 67 HD23 LEU 67 -2.893 -0.970 3.217 553 H GLU 68 HN GLU 68 -2.707 4.240 1.116 554 HA GLU 68 HA GLU 68 -0.465 5.767 0.429 555 HB2 GLU 68 HB2 GLU 68 -2.642 5.982 -0.699 556 HB3 GLU 68 HB1 GLU 68 -3.329 6.683 0.758 557 HG2 GLU 68 HG2 GLU 68 -1.504 8.461 0.515 558 HG3 GLU 68 HG1 GLU 68 -1.355 7.872 -1.139 559 H ARG 69 HN ARG 69 -2.938 6.590 2.872 560 HA ARG 69 HA ARG 69 -1.654 8.823 3.962 561 HB2 ARG 69 HB2 ARG 69 -3.701 6.889 4.912 562 HB3 ARG 69 HB1 ARG 69 -3.079 8.072 6.044 563 HG2 ARG 69 HG2 ARG 69 -4.004 9.062 3.419 564 HG3 ARG 69 HG1 ARG 69 -5.237 8.488 4.543 565 HD2 ARG 69 HD2 ARG 69 -5.018 10.800 4.935 566 HD3 ARG 69 HD1 ARG 69 -4.178 9.996 6.257 567 HE ARG 69 HE ARG 69 -2.452 10.682 4.072 568 HH11 ARG 69 HH11 ARG 69 -3.962 11.852 7.003 569 HH12 ARG 69 HH12 ARG 69 -2.800 13.118 7.247 570 HH21 ARG 69 HH21 ARG 69 -0.939 12.364 4.374 571 HH22 ARG 69 HH22 ARG 69 -1.092 13.427 5.735 572 H TYR 70 HN TYR 70 -1.111 5.456 4.446 573 HA TYR 70 HA TYR 70 0.321 5.714 6.898 574 HB2 TYR 70 HB2 TYR 70 -0.597 3.577 6.465 575 HB3 TYR 70 HB1 TYR 70 0.108 3.525 4.852 576 HD1 TYR 70 HD2 TYR 70 1.262 3.985 8.371 577 HD2 TYR 70 HD1 TYR 70 1.911 2.209 4.574 578 HE1 TYR 70 HE2 TYR 70 3.276 2.891 9.247 579 HE2 TYR 70 HE1 TYR 70 3.915 1.093 5.426 580 HH TYR 70 HH TYR 70 5.447 1.108 7.153 581 H VAL 71 HN VAL 71 1.286 5.236 3.492 582 HA VAL 71 HA VAL 71 4.050 5.353 4.000 583 HB VAL 71 HB VAL 71 4.414 5.678 1.684 584 HG11 VAL 71 HG11 VAL 71 2.731 4.147 0.593 585 HG12 VAL 71 HG12 VAL 71 1.990 4.004 2.188 586 HG13 VAL 71 HG13 VAL 71 3.661 3.498 1.936 587 HG21 VAL 71 HG21 VAL 71 2.793 6.421 0.125 588 HG22 VAL 71 HG22 VAL 71 2.963 7.615 1.406 589 HG23 VAL 71 HG23 VAL 71 1.564 6.538 1.377 590 H THR 72 HN THR 72 1.593 7.828 3.572 591 HA THR 72 HA THR 72 3.365 9.917 2.982 592 HB THR 72 HB THR 72 1.548 11.470 3.575 593 HG1 THR 72 HG1 THR 72 0.517 10.434 5.268 594 HG21 THR 72 HG21 THR 72 1.076 9.083 1.864 595 HG22 THR 72 HG22 THR 72 1.454 10.739 1.378 596 HG23 THR 72 HG23 THR 72 -0.156 10.340 1.983 597 H SER 73 HN SER 73 2.382 8.439 5.962 598 HA SER 73 HA SER 73 3.354 10.452 7.698 599 HB2 SER 73 HB2 SER 73 3.041 8.897 9.438 600 HB3 SER 73 HB1 SER 73 1.829 8.455 8.227 601 HG SER 73 HG SER 73 3.103 6.747 7.588 602 H CYS 74 HN CYS 74 4.855 8.029 5.768 603 HA CYS 74 HA CYS 74 7.446 8.368 7.099 604 HB2 CYS 74 HB2 CYS 74 6.886 6.070 6.688 605 HB3 CYS 74 HB1 CYS 74 6.529 6.412 4.996 606 HG CYS 74 HG CYS 74 9.474 7.387 5.058 607 H LEU 75 HN LEU 75 5.751 9.213 4.196 608 HA LEU 75 HA LEU 75 8.220 9.944 2.820 609 HB2 LEU 75 HB2 LEU 75 5.405 9.791 1.759 610 HB3 LEU 75 HB1 LEU 75 6.853 9.972 0.811 611 HG LEU 75 HG LEU 75 5.945 7.548 2.322 612 HD11 LEU 75 HD11 LEU 75 5.083 8.089 0.002 613 HD12 LEU 75 HD12 LEU 75 5.849 6.515 0.213 614 HD13 LEU 75 HD13 LEU 75 6.733 7.830 -0.558 615 HD21 LEU 75 HD21 LEU 75 8.019 6.474 1.738 616 HD22 LEU 75 HD22 LEU 75 8.367 7.916 2.684 617 HD23 LEU 75 HD23 LEU 75 8.597 7.931 0.935 618 H ARG 76 HN ARG 76 5.182 11.367 3.936 619 HA ARG 76 HA ARG 76 6.030 13.941 2.830 620 HB2 ARG 76 HB2 ARG 76 3.325 13.047 3.772 621 HB3 ARG 76 HB1 ARG 76 3.697 14.649 3.142 622 HG2 ARG 76 HG2 ARG 76 4.424 13.579 1.028 623 HG3 ARG 76 HG1 ARG 76 3.880 12.038 1.691 624 HD2 ARG 76 HD2 ARG 76 1.652 12.972 1.966 625 HD3 ARG 76 HD1 ARG 76 2.180 14.461 1.195 626 HE ARG 76 HE ARG 76 2.812 12.474 -0.583 627 HH11 ARG 76 HH11 ARG 76 -0.124 13.583 0.970 628 HH12 ARG 76 HH12 ARG 76 -1.151 13.062 -0.327 629 HH21 ARG 76 HH21 ARG 76 1.454 11.788 -2.280 630 HH22 ARG 76 HH22 ARG 76 -0.259 12.041 -2.167 631 H LYS 77 HN LYS 77 5.056 12.322 5.752 632 HA LYS 77 HA LYS 77 5.298 14.691 7.425 633 HB2 LYS 77 HB2 LYS 77 3.739 12.500 7.557 634 HB3 LYS 77 HB1 LYS 77 5.060 11.975 8.583 635 HG2 LYS 77 HG2 LYS 77 4.746 14.002 9.953 636 HG3 LYS 77 HG1 LYS 77 3.342 14.411 8.965 637 HD2 LYS 77 HD2 LYS 77 2.355 12.205 9.559 638 HD3 LYS 77 HD1 LYS 77 3.705 11.947 10.665 639 HE2 LYS 77 HE2 LYS 77 3.055 13.943 11.917 640 HE3 LYS 77 HE1 LYS 77 1.710 14.202 10.807 641 HZ1 LYS 77 HZ1 LYS 77 0.836 12.014 11.492 642 HZ2 LYS 77 HZ2 LYS 77 0.919 13.114 12.773 643 HZ3 LYS 77 HZ3 LYS 77 2.078 11.894 12.632 644 H LYS 78 HN LYS 78 7.536 13.362 5.906 645 HA LYS 78 HA LYS 78 9.639 13.472 7.798 646 HB2 LYS 78 HB2 LYS 78 8.452 11.283 8.325 647 HB3 LYS 78 HB1 LYS 78 8.967 10.714 6.747 648 HG2 LYS 78 HG2 LYS 78 10.477 9.830 8.319 649 HG3 LYS 78 HG1 LYS 78 11.330 11.140 7.503 650 HD2 LYS 78 HD2 LYS 78 11.083 12.587 9.353 651 HD3 LYS 78 HD1 LYS 78 9.877 11.538 10.106 652 HE2 LYS 78 HE2 LYS 78 11.558 9.841 10.495 653 HE3 LYS 78 HE1 LYS 78 12.766 10.809 9.661 654 HZ1 LYS 78 HZ1 LYS 78 11.378 11.574 12.167 655 HZ2 LYS 78 HZ2 LYS 78 12.550 12.494 11.372 656 HZ3 LYS 78 HZ3 LYS 78 12.966 11.006 12.056 657 H ARG 79 HN ARG 79 11.733 12.554 6.556 658 HA ARG 79 HA ARG 79 11.285 13.050 3.699 659 HB2 ARG 79 HB2 ARG 79 13.450 14.214 3.548 660 HB3 ARG 79 HB1 ARG 79 12.302 15.046 4.575 661 HG2 ARG 79 HG2 ARG 79 14.473 13.279 5.668 662 HG3 ARG 79 HG1 ARG 79 14.698 14.998 5.352 663 HD2 ARG 79 HD2 ARG 79 12.771 13.723 7.279 664 HD3 ARG 79 HD1 ARG 79 14.164 14.729 7.662 665 HE ARG 79 HE ARG 79 12.519 16.283 6.083 666 HH11 ARG 79 HH11 ARG 79 12.325 14.662 9.180 667 HH12 ARG 79 HH12 ARG 79 11.140 15.754 9.824 668 HH21 ARG 79 HH21 ARG 79 10.967 17.732 6.931 669 HH22 ARG 79 HH22 ARG 79 10.358 17.496 8.539 670 H LYS 80 HN LYS 80 11.147 10.573 4.401 671 HA LYS 80 HA LYS 80 11.869 8.502 3.844 672 HB2 LYS 80 HB2 LYS 80 12.377 9.614 1.688 673 HB3 LYS 80 HB1 LYS 80 13.997 9.961 2.269 674 HG2 LYS 80 HG2 LYS 80 14.185 8.068 0.882 675 HG3 LYS 80 HG1 LYS 80 14.313 7.476 2.538 676 HD2 LYS 80 HD2 LYS 80 12.885 5.974 1.372 677 HD3 LYS 80 HD1 LYS 80 11.858 6.943 2.429 678 HE2 LYS 80 HE2 LYS 80 10.801 6.745 0.277 679 HE3 LYS 80 HE1 LYS 80 11.333 8.409 0.501 680 HZ1 LYS 80 HZ1 LYS 80 13.297 7.888 -0.852 681 HZ2 LYS 80 HZ2 LYS 80 11.860 7.666 -1.710 682 HZ3 LYS 80 HZ3 LYS 80 12.702 6.328 -1.114 683 HA PRO 81 HA PRO 81 15.139 8.308 7.087 684 HB2 PRO 81 HB2 PRO 81 13.479 5.965 7.843 685 HB3 PRO 81 HB1 PRO 81 14.042 7.289 8.869 686 HG2 PRO 81 HG2 PRO 81 11.479 7.106 8.178 687 HG3 PRO 81 HG1 PRO 81 12.288 8.682 8.249 688 HD2 PRO 81 HD2 PRO 81 11.672 6.983 5.847 689 HD3 PRO 81 HD1 PRO 81 11.438 8.732 6.075 690 H GLN 82 HN GLN 82 16.682 7.650 5.599 691 HA GLN 82 HA GLN 82 16.470 5.060 4.306 692 HB2 GLN 82 HB2 GLN 82 18.749 7.044 4.218 693 HB3 GLN 82 HB1 GLN 82 18.470 5.707 3.111 694 HG2 GLN 82 HG2 GLN 82 16.456 6.779 2.288 695 HG3 GLN 82 HG1 GLN 82 16.675 8.102 3.433 696 HE21 GLN 82 HE21 GLN 82 16.819 9.664 1.857 697 HE22 GLN 82 HE22 GLN 82 18.182 9.807 0.804 698 H ALA 83 HN ALA 83 17.787 3.300 4.685 699 HA ALA 83 HA ALA 83 19.017 3.174 7.294 700 HB1 ALA 83 HB1 ALA 83 19.313 0.815 6.840 701 HB2 ALA 83 HB2 ALA 83 18.884 1.056 5.147 702 HB3 ALA 83 HB3 ALA 83 17.674 1.299 6.405 703 H1 VAL 201 HT1 VAL 201 -6.810 -0.479 -15.593 704 H2 VAL 201 HT2 VAL 201 -5.237 0.099 -15.819 705 H3 VAL 201 HT3 VAL 201 -6.160 0.649 -14.516 706 HA VAL 201 HA VAL 201 -6.153 -1.503 -13.509 707 HB VAL 201 HB VAL 201 -4.671 -3.281 -14.436 708 HG11 VAL 201 HG11 VAL 201 -6.970 -2.464 -16.206 709 HG12 VAL 201 HG12 VAL 201 -7.083 -3.411 -14.723 710 HG13 VAL 201 HG13 VAL 201 -6.249 -4.070 -16.129 711 HG21 VAL 201 HG21 VAL 201 -3.282 -1.911 -15.881 712 HG22 VAL 201 HG22 VAL 201 -4.676 -1.537 -16.895 713 HG23 VAL 201 HG23 VAL 201 -4.064 -3.188 -16.811 714 H VAL 202 HN VAL 202 -4.382 -2.273 -12.195 715 HA VAL 202 HA VAL 202 -1.972 -0.588 -12.330 716 HB VAL 202 HB VAL 202 -3.420 -1.385 -9.801 717 HG11 VAL 202 HG11 VAL 202 -1.803 0.079 -8.676 718 HG12 VAL 202 HG12 VAL 202 -0.992 0.358 -10.216 719 HG13 VAL 202 HG13 VAL 202 -1.005 -1.256 -9.506 720 HG21 VAL 202 HG21 VAL 202 -3.180 1.332 -11.089 721 HG22 VAL 202 HG22 VAL 202 -3.933 0.989 -9.532 722 HG23 VAL 202 HG23 VAL 202 -4.642 0.351 -11.013 723 HA PRO 203 HA PRO 203 -0.078 -4.678 -12.395 724 HB2 PRO 203 HB2 PRO 203 2.314 -3.011 -11.821 725 HB3 PRO 203 HB1 PRO 203 2.063 -4.216 -13.087 726 HG2 PRO 203 HG2 PRO 203 2.065 -1.614 -13.661 727 HG3 PRO 203 HG1 PRO 203 0.943 -2.726 -14.466 728 HD2 PRO 203 HD2 PRO 203 0.426 -0.777 -12.261 729 HD3 PRO 203 HD1 PRO 203 -0.598 -1.218 -13.644 730 H LYS 204 HN LYS 204 0.086 -6.026 -10.730 731 HA LYS 204 HA LYS 204 -0.185 -5.231 -8.071 732 HB2 LYS 204 HB2 LYS 204 0.481 -7.595 -7.524 733 HB3 LYS 204 HB1 LYS 204 -0.850 -7.440 -8.663 734 HG2 LYS 204 HG2 LYS 204 0.689 -7.878 -10.510 735 HG3 LYS 204 HG1 LYS 204 2.019 -8.034 -9.362 736 HD2 LYS 204 HD2 LYS 204 0.979 -9.958 -8.350 737 HD3 LYS 204 HD1 LYS 204 -0.460 -9.752 -9.350 738 HE2 LYS 204 HE2 LYS 204 2.317 -10.393 -10.344 739 HE3 LYS 204 HE1 LYS 204 0.974 -11.530 -10.219 740 HZ1 LYS 204 HZ1 LYS 204 1.235 -10.699 -12.475 741 HZ2 LYS 204 HZ2 LYS 204 1.025 -9.110 -11.940 742 HZ3 LYS 204 HZ3 LYS 204 -0.251 -10.214 -11.829 743 H LYS 205 HN LYS 205 1.175 -4.703 -6.504 744 HA LYS 205 HA LYS 205 3.930 -4.222 -7.165 745 HB2 LYS 205 HB2 LYS 205 2.053 -3.248 -5.260 746 HB3 LYS 205 HB1 LYS 205 3.433 -3.882 -4.373 747 HG2 LYS 205 HG2 LYS 205 3.650 -1.905 -6.631 748 HG3 LYS 205 HG1 LYS 205 3.566 -1.457 -4.927 749 HD2 LYS 205 HD2 LYS 205 5.612 -2.650 -4.467 750 HD3 LYS 205 HD1 LYS 205 5.666 -3.267 -6.118 751 HE2 LYS 205 HE2 LYS 205 5.739 -0.338 -5.422 752 HE3 LYS 205 HE1 LYS 205 7.185 -1.323 -5.648 753 HZ1 LYS 205 HZ1 LYS 205 6.540 -1.757 -7.900 754 HZ2 LYS 205 HZ2 LYS 205 6.527 -0.085 -7.656 755 HZ3 LYS 205 HZ3 LYS 205 5.074 -0.942 -7.702 756 H LYS 206 HN LYS 206 5.058 -6.044 -7.382 757 HA LYS 206 HA LYS 206 4.787 -8.325 -5.688 758 HB2 LYS 206 HB2 LYS 206 6.952 -7.553 -7.651 759 HB3 LYS 206 HB1 LYS 206 6.809 -9.129 -6.888 760 HG2 LYS 206 HG2 LYS 206 4.767 -9.585 -8.019 761 HG3 LYS 206 HG1 LYS 206 4.654 -7.924 -8.605 762 HD2 LYS 206 HD2 LYS 206 6.882 -9.817 -9.337 763 HD3 LYS 206 HD1 LYS 206 5.429 -9.591 -10.310 764 HE2 LYS 206 HE2 LYS 206 5.960 -7.232 -10.583 765 HE3 LYS 206 HE1 LYS 206 7.380 -7.417 -9.559 766 HZ1 LYS 206 HZ1 LYS 206 6.961 -8.788 -12.159 767 HZ2 LYS 206 HZ2 LYS 206 8.337 -8.902 -11.186 768 HZ3 LYS 206 HZ3 LYS 206 7.938 -7.432 -11.915 769 H ILE 207 HN ILE 207 5.273 -8.099 -3.606 770 HA ILE 207 HA ILE 207 7.592 -6.466 -2.838 771 HB ILE 207 HB ILE 207 5.360 -7.487 -1.086 772 HG12 ILE 207 HG12 ILE 207 4.624 -5.948 -2.960 773 HG13 ILE 207 HG11 ILE 207 4.245 -5.407 -1.331 774 HG21 ILE 207 HG21 ILE 207 6.125 -5.589 0.383 775 HG22 ILE 207 HG22 ILE 207 7.541 -5.464 -0.663 776 HG23 ILE 207 HG23 ILE 207 7.241 -6.949 0.241 777 HD11 ILE 207 HD11 ILE 207 6.032 -3.815 -1.400 778 HD12 ILE 207 HD12 ILE 207 5.032 -3.619 -2.833 779 HD13 ILE 207 HD13 ILE 207 6.586 -4.443 -2.950 780 H LYS 208 HN LYS 208 9.272 -7.902 -3.033 781 HA LYS 208 HA LYS 208 9.169 -10.244 -1.244 782 HB2 LYS 208 HB2 LYS 208 10.812 -9.999 -3.778 783 HB3 LYS 208 HB1 LYS 208 10.659 -11.422 -2.757 784 HG2 LYS 208 HG2 LYS 208 8.375 -10.168 -4.261 785 HG3 LYS 208 HG1 LYS 208 9.339 -11.521 -4.856 786 HD2 LYS 208 HD2 LYS 208 8.440 -12.995 -3.366 787 HD3 LYS 208 HD1 LYS 208 8.153 -11.753 -2.147 788 HE2 LYS 208 HE2 LYS 208 6.052 -12.589 -3.052 789 HE3 LYS 208 HE1 LYS 208 6.285 -10.890 -3.448 790 HZ1 LYS 208 HZ1 LYS 208 7.132 -11.680 -5.651 791 HZ2 LYS 208 HZ2 LYS 208 5.485 -11.929 -5.373 792 HZ3 LYS 208 HZ3 LYS 208 6.574 -13.224 -5.247 793 H LYS 209 HN LYS 209 11.835 -8.827 -3.033 794 HA LYS 209 HA LYS 209 12.921 -7.589 -0.633 795 HB2 LYS 209 HB2 LYS 209 14.349 -9.685 -2.275 796 HB3 LYS 209 HB1 LYS 209 15.212 -8.528 -1.277 797 HG2 LYS 209 HG2 LYS 209 13.205 -10.551 -0.303 798 HG3 LYS 209 HG1 LYS 209 14.958 -10.662 -0.144 799 HD2 LYS 209 HD2 LYS 209 13.227 -8.505 1.066 800 HD3 LYS 209 HD1 LYS 209 13.874 -9.895 1.930 801 HE2 LYS 209 HE2 LYS 209 15.537 -7.787 0.555 802 HE3 LYS 209 HE1 LYS 209 15.188 -7.825 2.280 803 HZ1 LYS 209 HZ1 LYS 209 16.661 -9.912 0.765 804 HZ2 LYS 209 HZ2 LYS 209 16.315 -9.958 2.419 805 HZ3 LYS 209 HZ3 LYS 209 17.347 -8.771 1.806 806 H GLU 210 HN GLU 210 14.163 -5.788 -1.093 807 HA GLU 210 HA GLU 210 14.653 -3.898 -2.244 808 HB2 GLU 210 HB2 GLU 210 15.244 -5.925 -4.409 809 HB3 GLU 210 HB1 GLU 210 15.566 -4.208 -4.588 810 HG2 GLU 210 HG2 GLU 210 17.600 -5.276 -3.992 811 HG3 GLU 210 HG1 GLU 210 17.057 -4.343 -2.603 812 H GLN 211 HN GLN 211 12.682 -2.922 -2.231 813 HA GLN 211 HA GLN 211 10.500 -3.776 -3.836 814 HB2 GLN 211 HB2 GLN 211 9.321 -1.824 -3.000 815 HB3 GLN 211 HB1 GLN 211 10.174 -2.621 -1.688 816 HG2 GLN 211 HG2 GLN 211 11.224 -0.198 -3.132 817 HG3 GLN 211 HG1 GLN 211 10.256 -0.123 -1.662 818 HE21 GLN 211 HE21 GLN 211 11.153 -0.793 0.283 819 HE22 GLN 211 HE22 GLN 211 12.860 -1.013 0.483 820 H VAL 212 HN VAL 212 13.084 -1.512 -4.315 821 HA VAL 212 HA VAL 212 11.790 -0.313 -6.617 822 HB VAL 212 HB VAL 212 13.822 1.053 -6.832 823 HG11 VAL 212 HG11 VAL 212 12.027 1.828 -5.389 824 HG12 VAL 212 HG12 VAL 212 13.592 2.303 -4.732 825 HG13 VAL 212 HG13 VAL 212 12.717 0.944 -4.028 826 HG21 VAL 212 HG21 VAL 212 15.472 -0.568 -6.065 827 HG22 VAL 212 HG22 VAL 212 14.806 -0.492 -4.434 828 HG23 VAL 212 HG23 VAL 212 15.588 0.926 -5.133 829 H GLU 213 HN GLU 213 12.541 -0.490 -8.744 830 HA GLU 213 HA GLU 213 14.184 -2.874 -9.244 831 HB2 GLU 213 HB2 GLU 213 12.189 -1.510 -11.055 832 HB3 GLU 213 HB1 GLU 213 13.130 -2.934 -11.472 833 HG2 GLU 213 HG2 GLU 213 12.030 -4.146 -9.618 834 HG3 GLU 213 HG1 GLU 213 11.025 -2.725 -9.334 Start of MODEL 11 1 H1 SER 1 HT1 SER 1 -20.889 0.915 10.158 2 H2 SER 1 HT2 SER 1 -22.371 0.136 9.937 3 H3 SER 1 HT3 SER 1 -22.277 1.814 9.820 4 HA SER 1 HA SER 1 -20.968 -0.108 7.998 5 HB2 SER 1 HB2 SER 1 -23.296 1.749 7.498 6 HB3 SER 1 HB1 SER 1 -22.636 0.556 6.377 7 HG SER 1 HG SER 1 -24.604 0.001 7.707 8 H GLU 2 HN GLU 2 -20.469 2.670 9.546 9 HA GLU 2 HA GLU 2 -20.011 4.438 7.349 10 HB2 GLU 2 HB2 GLU 2 -19.565 4.602 10.298 11 HB3 GLU 2 HB1 GLU 2 -18.866 5.791 9.220 12 HG2 GLU 2 HG2 GLU 2 -21.115 6.290 8.351 13 HG3 GLU 2 HG1 GLU 2 -21.783 5.164 9.531 14 H GLU 3 HN GLU 3 -18.081 2.057 8.968 15 HA GLU 3 HA GLU 3 -15.552 3.237 8.652 16 HB2 GLU 3 HB2 GLU 3 -16.319 0.317 8.673 17 HB3 GLU 3 HB1 GLU 3 -14.664 0.905 8.741 18 HG2 GLU 3 HG2 GLU 3 -16.833 1.343 10.774 19 HG3 GLU 3 HG1 GLU 3 -15.386 0.353 10.950 20 H GLU 4 HN GLU 4 -17.597 1.535 6.405 21 HA GLU 4 HA GLU 4 -15.516 1.429 4.387 22 HB2 GLU 4 HB2 GLU 4 -17.040 -0.451 4.570 23 HB3 GLU 4 HB1 GLU 4 -18.424 0.597 4.320 24 HG2 GLU 4 HG2 GLU 4 -17.547 1.119 2.059 25 HG3 GLU 4 HG1 GLU 4 -16.277 -0.074 2.330 26 H ASP 5 HN ASP 5 -18.327 3.384 5.179 27 HA ASP 5 HA ASP 5 -18.317 4.604 2.538 28 HB2 ASP 5 HB2 ASP 5 -20.197 4.786 4.872 29 HB3 ASP 5 HB1 ASP 5 -20.302 5.907 3.521 30 H LYS 6 HN LYS 6 -17.095 5.231 5.661 31 HA LYS 6 HA LYS 6 -16.866 8.057 5.473 32 HB2 LYS 6 HB2 LYS 6 -16.559 6.546 7.549 33 HB3 LYS 6 HB1 LYS 6 -14.949 6.231 6.934 34 HG2 LYS 6 HG2 LYS 6 -14.842 7.926 8.624 35 HG3 LYS 6 HG1 LYS 6 -14.448 8.647 7.064 36 HD2 LYS 6 HD2 LYS 6 -15.925 10.120 8.292 37 HD3 LYS 6 HD1 LYS 6 -16.785 9.457 6.901 38 HE2 LYS 6 HE2 LYS 6 -17.770 7.737 8.408 39 HE3 LYS 6 HE1 LYS 6 -17.009 8.553 9.770 40 HZ1 LYS 6 HZ1 LYS 6 -19.357 9.153 9.431 41 HZ2 LYS 6 HZ2 LYS 6 -18.953 9.827 7.928 42 HZ3 LYS 6 HZ3 LYS 6 -18.318 10.490 9.348 43 H CYS 7 HN CYS 7 -15.183 5.366 4.200 44 HA CYS 7 HA CYS 7 -12.735 6.718 3.567 45 HB2 CYS 7 HB2 CYS 7 -13.841 4.012 2.781 46 HB3 CYS 7 HB1 CYS 7 -12.202 4.567 2.424 47 HG CYS 7 HG CYS 7 -13.528 3.505 5.344 48 H LYS 8 HN LYS 8 -12.091 7.533 1.646 49 HA LYS 8 HA LYS 8 -14.171 7.968 -0.369 50 HB2 LYS 8 HB2 LYS 8 -11.521 9.276 0.209 51 HB3 LYS 8 HB1 LYS 8 -12.291 9.475 -1.354 52 HG2 LYS 8 HG2 LYS 8 -12.782 11.349 0.065 53 HG3 LYS 8 HG1 LYS 8 -14.245 10.437 -0.294 54 HD2 LYS 8 HD2 LYS 8 -14.038 9.327 1.914 55 HD3 LYS 8 HD1 LYS 8 -12.634 10.337 2.258 56 HE2 LYS 8 HE2 LYS 8 -13.992 12.334 2.112 57 HE3 LYS 8 HE1 LYS 8 -15.397 11.374 1.653 58 HZ1 LYS 8 HZ1 LYS 8 -13.966 11.201 4.246 59 HZ2 LYS 8 HZ2 LYS 8 -15.317 10.286 3.805 60 HZ3 LYS 8 HZ3 LYS 8 -15.454 11.962 3.990 61 HA PRO 9 HA PRO 9 -12.687 4.908 -3.086 62 HB2 PRO 9 HB2 PRO 9 -13.562 5.997 -5.440 63 HB3 PRO 9 HB1 PRO 9 -14.608 5.151 -4.299 64 HG2 PRO 9 HG2 PRO 9 -14.223 8.080 -4.712 65 HG3 PRO 9 HG1 PRO 9 -15.710 7.181 -4.357 66 HD2 PRO 9 HD2 PRO 9 -14.340 8.591 -2.472 67 HD3 PRO 9 HD1 PRO 9 -15.279 7.139 -2.080 68 H MET 10 HN MET 10 -10.762 4.534 -4.057 69 HA MET 10 HA MET 10 -9.069 6.849 -4.575 70 HB2 MET 10 HB2 MET 10 -8.264 4.945 -3.157 71 HB3 MET 10 HB1 MET 10 -8.303 3.928 -4.594 72 HG2 MET 10 HG2 MET 10 -6.104 4.548 -4.555 73 HG3 MET 10 HG1 MET 10 -6.790 5.797 -5.596 74 HE1 MET 10 HE1 MET 10 -5.687 4.777 -2.148 75 HE2 MET 10 HE2 MET 10 -7.057 5.698 -1.531 76 HE3 MET 10 HE3 MET 10 -5.411 6.277 -1.269 77 H SER 11 HN SER 11 -8.721 7.575 -6.552 78 HA SER 11 HA SER 11 -9.863 6.220 -8.809 79 HB2 SER 11 HB2 SER 11 -8.425 8.837 -8.466 80 HB3 SER 11 HB1 SER 11 -9.049 8.288 -10.024 81 HG SER 11 HG SER 11 -10.335 9.427 -7.935 82 H TYR 12 HN TYR 12 -8.424 6.328 -10.968 83 HA TYR 12 HA TYR 12 -6.570 4.252 -10.612 84 HB2 TYR 12 HB2 TYR 12 -7.281 4.022 -12.727 85 HB3 TYR 12 HB1 TYR 12 -7.726 5.720 -12.859 86 HD1 TYR 12 HD1 TYR 12 -4.705 3.515 -12.922 87 HD2 TYR 12 HD2 TYR 12 -6.562 7.050 -14.363 88 HE1 TYR 12 HE1 TYR 12 -2.827 3.857 -14.459 89 HE2 TYR 12 HE2 TYR 12 -4.684 7.408 -15.906 90 HH TYR 12 HH TYR 12 -2.406 5.030 -16.610 91 H GLU 13 HN GLU 13 -5.908 7.589 -11.728 92 HA GLU 13 HA GLU 13 -3.194 7.693 -11.638 93 HB2 GLU 13 HB2 GLU 13 -5.219 9.726 -10.682 94 HB3 GLU 13 HB1 GLU 13 -3.515 10.104 -10.902 95 HG2 GLU 13 HG2 GLU 13 -5.092 8.931 -13.152 96 HG3 GLU 13 HG1 GLU 13 -5.219 10.659 -12.786 97 H GLU 14 HN GLU 14 -5.396 7.717 -8.909 98 HA GLU 14 HA GLU 14 -3.461 8.465 -6.968 99 HB2 GLU 14 HB2 GLU 14 -6.238 7.333 -6.825 100 HB3 GLU 14 HB1 GLU 14 -5.288 7.641 -5.382 101 HG2 GLU 14 HG2 GLU 14 -5.153 10.009 -5.994 102 HG3 GLU 14 HG1 GLU 14 -6.118 9.685 -7.434 103 H LYS 15 HN LYS 15 -5.078 5.401 -7.782 104 HA LYS 15 HA LYS 15 -3.698 3.754 -6.010 105 HB2 LYS 15 HB2 LYS 15 -4.810 3.145 -8.736 106 HB3 LYS 15 HB1 LYS 15 -4.098 1.919 -7.694 107 HG2 LYS 15 HG2 LYS 15 -5.820 1.950 -6.218 108 HG3 LYS 15 HG1 LYS 15 -6.280 3.603 -6.621 109 HD2 LYS 15 HD2 LYS 15 -7.488 2.988 -8.416 110 HD3 LYS 15 HD1 LYS 15 -6.451 1.614 -8.793 111 HE2 LYS 15 HE2 LYS 15 -7.394 0.472 -6.799 112 HE3 LYS 15 HE1 LYS 15 -8.548 1.789 -6.634 113 HZ1 LYS 15 HZ1 LYS 15 -9.540 -0.036 -7.824 114 HZ2 LYS 15 HZ2 LYS 15 -8.277 -0.059 -8.955 115 HZ3 LYS 15 HZ3 LYS 15 -9.336 1.260 -8.890 116 H ARG 16 HN ARG 16 -2.787 4.885 -9.238 117 HA ARG 16 HA ARG 16 -0.393 3.408 -9.476 118 HB2 ARG 16 HB2 ARG 16 -1.384 4.590 -11.391 119 HB3 ARG 16 HB1 ARG 16 -1.015 6.127 -10.623 120 HG2 ARG 16 HG2 ARG 16 1.390 5.392 -10.613 121 HG3 ARG 16 HG1 ARG 16 0.898 4.094 -11.682 122 HD2 ARG 16 HD2 ARG 16 1.767 5.927 -12.972 123 HD3 ARG 16 HD1 ARG 16 0.043 5.766 -13.241 124 HE ARG 16 HE ARG 16 1.178 7.777 -11.418 125 HH11 ARG 16 HH11 ARG 16 -1.003 6.859 -13.992 126 HH12 ARG 16 HH12 ARG 16 -1.786 8.409 -14.070 127 HH21 ARG 16 HH21 ARG 16 0.177 9.833 -11.525 128 HH22 ARG 16 HH22 ARG 16 -1.114 10.103 -12.661 129 H GLN 17 HN GLN 17 -0.990 6.719 -8.343 130 HA GLN 17 HA GLN 17 1.638 7.331 -7.637 131 HB2 GLN 17 HB2 GLN 17 -0.344 8.907 -7.810 132 HB3 GLN 17 HB1 GLN 17 -0.818 8.346 -6.212 133 HG2 GLN 17 HG2 GLN 17 0.372 10.385 -5.948 134 HG3 GLN 17 HG1 GLN 17 1.409 9.079 -5.376 135 HE21 GLN 17 HE21 GLN 17 0.909 11.474 -7.831 136 HE22 GLN 17 HE22 GLN 17 2.478 11.356 -8.549 137 H LEU 18 HN LEU 18 -0.940 5.766 -5.904 138 HA LEU 18 HA LEU 18 0.202 5.476 -3.369 139 HB2 LEU 18 HB2 LEU 18 -2.162 4.912 -4.426 140 HB3 LEU 18 HB1 LEU 18 -1.455 3.324 -4.572 141 HG LEU 18 HG LEU 18 -1.962 4.851 -2.037 142 HD11 LEU 18 HD11 LEU 18 -3.231 2.536 -1.776 143 HD12 LEU 18 HD12 LEU 18 -3.293 2.687 -3.528 144 HD13 LEU 18 HD13 LEU 18 -3.970 3.954 -2.507 145 HD21 LEU 18 HD21 LEU 18 -0.114 3.722 -1.354 146 HD22 LEU 18 HD22 LEU 18 -0.292 2.463 -2.573 147 HD23 LEU 18 HD23 LEU 18 -1.311 2.449 -1.135 148 H SER 19 HN SER 19 0.228 3.245 -6.144 149 HA SER 19 HA SER 19 1.788 1.265 -4.922 150 HB2 SER 19 HB2 SER 19 1.899 0.268 -7.043 151 HB3 SER 19 HB1 SER 19 0.395 1.186 -7.075 152 HG SER 19 HG SER 19 1.758 2.929 -8.038 153 H LEU 20 HN LEU 20 2.599 4.309 -6.221 154 HA LEU 20 HA LEU 20 5.416 3.711 -6.533 155 HB2 LEU 20 HB2 LEU 20 3.845 6.238 -6.900 156 HB3 LEU 20 HB1 LEU 20 5.550 6.079 -7.252 157 HG LEU 20 HG LEU 20 3.260 4.745 -8.644 158 HD11 LEU 20 HD11 LEU 20 3.864 7.065 -9.220 159 HD12 LEU 20 HD12 LEU 20 4.017 5.932 -10.559 160 HD13 LEU 20 HD13 LEU 20 5.456 6.494 -9.703 161 HD21 LEU 20 HD21 LEU 20 4.953 3.082 -8.386 162 HD22 LEU 20 HD22 LEU 20 6.204 4.203 -8.919 163 HD23 LEU 20 HD23 LEU 20 4.968 3.652 -10.053 164 H ASP 21 HN ASP 21 3.259 5.365 -4.296 165 HA ASP 21 HA ASP 21 5.421 6.396 -2.696 166 HB2 ASP 21 HB2 ASP 21 3.731 7.116 -1.121 167 HB3 ASP 21 HB1 ASP 21 3.349 7.620 -2.744 168 H ILE 22 HN ILE 22 3.356 3.548 -2.615 169 HA ILE 22 HA ILE 22 4.392 2.425 -0.263 170 HB ILE 22 HB ILE 22 3.021 1.427 -2.677 171 HG12 ILE 22 HG12 ILE 22 2.664 0.806 0.242 172 HG13 ILE 22 HG11 ILE 22 1.896 2.159 -0.583 173 HG21 ILE 22 HG21 ILE 22 4.466 -0.494 -0.884 174 HG22 ILE 22 HG22 ILE 22 4.873 -0.153 -2.560 175 HG23 ILE 22 HG23 ILE 22 3.335 -0.916 -2.163 176 HD11 ILE 22 HD11 ILE 22 1.520 -0.717 -1.383 177 HD12 ILE 22 HD12 ILE 22 0.614 0.691 -1.940 178 HD13 ILE 22 HD13 ILE 22 0.456 0.147 -0.271 179 H ASN 23 HN ASN 23 5.549 2.453 -3.580 180 HA ASN 23 HA ASN 23 7.726 0.684 -3.170 181 HB2 ASN 23 HB2 ASN 23 6.767 1.140 -5.389 182 HB3 ASN 23 HB1 ASN 23 7.311 2.808 -5.278 183 HD21 ASN 23 HD21 ASN 23 9.416 3.299 -5.750 184 HD22 ASN 23 HD22 ASN 23 10.565 2.136 -6.316 185 H LYS 24 HN LYS 24 7.179 3.914 -2.297 186 HA LYS 24 HA LYS 24 9.943 4.716 -2.180 187 HB2 LYS 24 HB2 LYS 24 7.332 5.911 -1.408 188 HB3 LYS 24 HB1 LYS 24 8.796 6.565 -0.693 189 HG2 LYS 24 HG2 LYS 24 9.662 7.122 -2.872 190 HG3 LYS 24 HG1 LYS 24 8.289 6.333 -3.654 191 HD2 LYS 24 HD2 LYS 24 6.771 7.962 -2.844 192 HD3 LYS 24 HD1 LYS 24 7.959 8.618 -1.721 193 HE2 LYS 24 HE2 LYS 24 8.166 8.740 -4.731 194 HE3 LYS 24 HE1 LYS 24 7.605 10.051 -3.693 195 HZ1 LYS 24 HZ1 LYS 24 9.944 10.288 -4.303 196 HZ2 LYS 24 HZ2 LYS 24 10.299 8.812 -3.571 197 HZ3 LYS 24 HZ3 LYS 24 9.758 10.108 -2.634 198 H LEU 25 HN LEU 25 7.810 2.927 -0.212 199 HA LEU 25 HA LEU 25 8.972 3.578 2.320 200 HB2 LEU 25 HB2 LEU 25 7.214 1.299 1.435 201 HB3 LEU 25 HB1 LEU 25 7.750 1.529 3.089 202 HG LEU 25 HG LEU 25 5.872 3.243 1.493 203 HD11 LEU 25 HD11 LEU 25 5.732 1.942 4.183 204 HD12 LEU 25 HD12 LEU 25 4.984 1.315 2.712 205 HD13 LEU 25 HD13 LEU 25 4.431 2.841 3.408 206 HD21 LEU 25 HD21 LEU 25 7.195 3.913 4.099 207 HD22 LEU 25 HD22 LEU 25 5.888 4.824 3.350 208 HD23 LEU 25 HD23 LEU 25 7.466 4.739 2.570 209 HA PRO 26 HA PRO 26 12.502 0.829 2.157 210 HB2 PRO 26 HB2 PRO 26 13.010 0.779 4.839 211 HB3 PRO 26 HB1 PRO 26 13.503 2.108 3.786 212 HG2 PRO 26 HG2 PRO 26 11.165 1.906 5.634 213 HG3 PRO 26 HG1 PRO 26 12.211 3.297 5.310 214 HD2 PRO 26 HD2 PRO 26 9.727 3.017 4.230 215 HD3 PRO 26 HD1 PRO 26 11.041 3.890 3.414 216 H GLY 27 HN GLY 27 13.099 -1.307 3.050 217 HA2 GLY 27 HA2 GLY 27 11.059 -3.109 2.664 218 HA3 GLY 27 HA1 GLY 27 12.561 -3.500 3.469 219 H GLU 28 HN GLU 28 12.273 -1.992 5.816 220 HA GLU 28 HA GLU 28 10.628 -3.732 7.318 221 HB2 GLU 28 HB2 GLU 28 11.040 -1.854 9.121 222 HB3 GLU 28 HB1 GLU 28 12.297 -2.983 8.654 223 HG2 GLU 28 HG2 GLU 28 12.023 -0.335 7.320 224 HG3 GLU 28 HG1 GLU 28 12.840 -0.494 8.867 225 H LYS 29 HN LYS 29 10.120 -0.411 6.189 226 HA LYS 29 HA LYS 29 7.739 -0.064 7.739 227 HB2 LYS 29 HB2 LYS 29 9.295 1.513 5.804 228 HB3 LYS 29 HB1 LYS 29 7.569 1.828 5.775 229 HG2 LYS 29 HG2 LYS 29 8.730 3.397 7.209 230 HG3 LYS 29 HG1 LYS 29 7.626 2.401 8.152 231 HD2 LYS 29 HD2 LYS 29 9.284 1.431 9.314 232 HD3 LYS 29 HD1 LYS 29 10.389 1.402 7.931 233 HE2 LYS 29 HE2 LYS 29 11.169 2.908 9.710 234 HE3 LYS 29 HE1 LYS 29 10.833 3.773 8.213 235 HZ1 LYS 29 HZ1 LYS 29 8.684 4.426 9.156 236 HZ2 LYS 29 HZ2 LYS 29 9.972 4.977 10.100 237 HZ3 LYS 29 HZ3 LYS 29 9.070 3.640 10.602 238 H LEU 30 HN LEU 30 8.503 -1.300 4.569 239 HA LEU 30 HA LEU 30 5.808 -1.000 3.637 240 HB2 LEU 30 HB2 LEU 30 6.704 -1.215 1.666 241 HB3 LEU 30 HB1 LEU 30 8.269 -1.472 2.393 242 HG LEU 30 HG LEU 30 6.329 -3.650 1.587 243 HD11 LEU 30 HD11 LEU 30 7.805 -2.073 -0.032 244 HD12 LEU 30 HD12 LEU 30 7.357 -3.735 -0.406 245 HD13 LEU 30 HD13 LEU 30 8.942 -3.380 0.284 246 HD21 LEU 30 HD21 LEU 30 7.809 -4.288 3.467 247 HD22 LEU 30 HD22 LEU 30 9.204 -3.871 2.473 248 HD23 LEU 30 HD23 LEU 30 8.143 -5.194 1.991 249 H GLY 31 HN GLY 31 7.369 -3.232 5.629 250 HA2 GLY 31 HA2 GLY 31 5.724 -5.505 5.166 251 HA3 GLY 31 HA1 GLY 31 6.530 -5.121 6.676 252 H ARG 32 HN ARG 32 5.171 -2.428 6.717 253 HA ARG 32 HA ARG 32 2.857 -3.175 8.171 254 HB2 ARG 32 HB2 ARG 32 3.988 -1.057 8.618 255 HB3 ARG 32 HB1 ARG 32 3.549 -0.474 7.023 256 HG2 ARG 32 HG2 ARG 32 1.606 0.250 7.790 257 HG3 ARG 32 HG1 ARG 32 1.203 -1.362 8.389 258 HD2 ARG 32 HD2 ARG 32 2.882 0.672 9.838 259 HD3 ARG 32 HD1 ARG 32 1.181 0.319 10.175 260 HE ARG 32 HE ARG 32 2.221 -2.078 10.510 261 HH11 ARG 32 HH11 ARG 32 3.450 1.019 11.603 262 HH12 ARG 32 HH12 ARG 32 4.285 0.343 12.965 263 HH21 ARG 32 HH21 ARG 32 3.319 -2.965 12.297 264 HH22 ARG 32 HH22 ARG 32 4.202 -1.919 13.365 265 H VAL 33 HN VAL 33 3.265 -1.871 4.874 266 HA VAL 33 HA VAL 33 0.504 -1.690 4.330 267 HB VAL 33 HB VAL 33 1.599 -2.274 1.862 268 HG11 VAL 33 HG11 VAL 33 1.117 0.263 3.380 269 HG12 VAL 33 HG12 VAL 33 0.124 -0.479 2.125 270 HG13 VAL 33 HG13 VAL 33 1.652 0.282 1.705 271 HG21 VAL 33 HG21 VAL 33 3.553 -0.457 3.210 272 HG22 VAL 33 HG22 VAL 33 3.672 -1.232 1.631 273 HG23 VAL 33 HG23 VAL 33 3.851 -2.191 3.101 274 H VAL 34 HN VAL 34 2.801 -4.292 3.541 275 HA VAL 34 HA VAL 34 1.040 -6.216 2.664 276 HB VAL 34 HB VAL 34 2.696 -7.712 2.927 277 HG11 VAL 34 HG11 VAL 34 4.033 -5.888 2.208 278 HG12 VAL 34 HG12 VAL 34 4.948 -6.825 3.391 279 HG13 VAL 34 HG13 VAL 34 4.196 -5.304 3.866 280 HG21 VAL 34 HG21 VAL 34 2.119 -8.185 5.238 281 HG22 VAL 34 HG22 VAL 34 3.153 -6.849 5.765 282 HG23 VAL 34 HG23 VAL 34 3.867 -8.256 4.977 283 H HIS 35 HN HIS 35 1.649 -5.256 6.048 284 HA HIS 35 HA HIS 35 -0.044 -7.191 7.228 285 HB2 HIS 35 HB2 HIS 35 1.637 -6.063 8.561 286 HB3 HIS 35 HB1 HIS 35 0.891 -4.501 8.250 287 HD1 HIS 35 HD1 HIS 35 0.703 -7.450 10.479 288 HD2 HIS 35 HD2 HIS 35 -1.517 -4.025 9.698 289 HE1 HIS 35 HE1 HIS 35 -0.931 -7.258 12.377 290 HE2 HIS 35 HE2 HIS 35 -2.391 -5.298 11.776 291 H ILE 36 HN ILE 36 -0.575 -3.735 6.564 292 HA ILE 36 HA ILE 36 -3.223 -3.537 7.377 293 HB ILE 36 HB ILE 36 -1.880 -2.132 5.052 294 HG12 ILE 36 HG12 ILE 36 -2.331 -1.118 7.856 295 HG13 ILE 36 HG11 ILE 36 -0.854 -1.935 7.373 296 HG21 ILE 36 HG21 ILE 36 -3.686 -0.725 4.856 297 HG22 ILE 36 HG22 ILE 36 -4.145 -0.925 6.547 298 HG23 ILE 36 HG23 ILE 36 -4.513 -2.193 5.381 299 HD11 ILE 36 HD11 ILE 36 -0.663 -0.137 5.592 300 HD12 ILE 36 HD12 ILE 36 -0.373 0.339 7.257 301 HD13 ILE 36 HD13 ILE 36 -1.904 0.716 6.487 302 H ILE 37 HN ILE 37 -1.885 -4.345 4.243 303 HA ILE 37 HA ILE 37 -4.290 -4.741 2.877 304 HB ILE 37 HB ILE 37 -1.472 -5.579 2.452 305 HG12 ILE 37 HG12 ILE 37 -3.188 -3.893 0.680 306 HG13 ILE 37 HG11 ILE 37 -2.457 -3.221 2.130 307 HG21 ILE 37 HG21 ILE 37 -3.785 -6.799 1.277 308 HG22 ILE 37 HG22 ILE 37 -2.083 -7.241 1.123 309 HG23 ILE 37 HG23 ILE 37 -2.777 -6.026 0.053 310 HD11 ILE 37 HD11 ILE 37 -1.070 -2.727 0.290 311 HD12 ILE 37 HD12 ILE 37 -1.047 -4.423 -0.209 312 HD13 ILE 37 HD13 ILE 37 -0.258 -3.933 1.288 313 H GLN 38 HN GLN 38 -2.055 -7.315 4.058 314 HA GLN 38 HA GLN 38 -3.668 -9.502 3.588 315 HB2 GLN 38 HB2 GLN 38 -1.772 -9.016 5.903 316 HB3 GLN 38 HB1 GLN 38 -2.515 -10.573 5.570 317 HG2 GLN 38 HG2 GLN 38 -1.419 -10.589 3.374 318 HG3 GLN 38 HG1 GLN 38 -0.666 -9.055 3.770 319 HE21 GLN 38 HE21 GLN 38 -1.184 -11.646 6.063 320 HE22 GLN 38 HE22 GLN 38 0.483 -12.039 6.284 321 H SER 39 HN SER 39 -3.840 -7.271 6.340 322 HA SER 39 HA SER 39 -5.661 -8.897 7.840 323 HB2 SER 39 HB2 SER 39 -5.791 -6.974 9.360 324 HB3 SER 39 HB1 SER 39 -4.122 -7.324 8.930 325 HG SER 39 HG SER 39 -4.115 -5.594 7.543 326 H ARG 40 HN ARG 40 -5.976 -6.025 5.793 327 HA ARG 40 HA ARG 40 -8.831 -5.885 6.185 328 HB2 ARG 40 HB2 ARG 40 -6.988 -4.356 4.333 329 HB3 ARG 40 HB1 ARG 40 -8.697 -4.005 4.551 330 HG2 ARG 40 HG2 ARG 40 -8.326 -3.520 6.864 331 HG3 ARG 40 HG1 ARG 40 -6.632 -3.973 6.735 332 HD2 ARG 40 HD2 ARG 40 -6.522 -1.680 6.595 333 HD3 ARG 40 HD1 ARG 40 -6.597 -2.135 4.893 334 HE ARG 40 HE ARG 40 -8.977 -1.586 4.960 335 HH11 ARG 40 HH11 ARG 40 -6.863 -0.224 7.407 336 HH12 ARG 40 HH12 ARG 40 -8.035 0.944 7.938 337 HH21 ARG 40 HH21 ARG 40 -10.501 -0.032 5.662 338 HH22 ARG 40 HH22 ARG 40 -10.086 1.060 6.945 339 H GLU 41 HN GLU 41 -6.660 -7.385 4.033 340 HA GLU 41 HA GLU 41 -8.860 -8.241 2.262 341 HB2 GLU 41 HB2 GLU 41 -5.934 -8.361 1.585 342 HB3 GLU 41 HB1 GLU 41 -7.311 -8.435 0.497 343 HG2 GLU 41 HG2 GLU 41 -6.542 -5.991 2.053 344 HG3 GLU 41 HG1 GLU 41 -5.980 -6.345 0.420 345 HA PRO 42 HA PRO 42 -7.210 -11.843 4.668 346 HB2 PRO 42 HB2 PRO 42 -9.726 -13.083 4.799 347 HB3 PRO 42 HB1 PRO 42 -8.922 -12.208 6.092 348 HG2 PRO 42 HG2 PRO 42 -11.220 -11.438 4.514 349 HG3 PRO 42 HG1 PRO 42 -10.535 -10.639 5.933 350 HD2 PRO 42 HD2 PRO 42 -10.381 -9.819 3.195 351 HD3 PRO 42 HD1 PRO 42 -9.674 -9.034 4.616 352 H SER 43 HN SER 43 -8.759 -11.399 1.716 353 HA SER 43 HA SER 43 -8.828 -14.098 0.813 354 HB2 SER 43 HB2 SER 43 -8.737 -11.520 -0.768 355 HB3 SER 43 HB1 SER 43 -9.176 -13.105 -1.404 356 HG SER 43 HG SER 43 -11.089 -12.933 -0.539 357 H LEU 44 HN LEU 44 -6.309 -11.870 1.352 358 HA LEU 44 HA LEU 44 -4.517 -13.572 -0.236 359 HB2 LEU 44 HB2 LEU 44 -3.042 -11.614 -0.512 360 HB3 LEU 44 HB1 LEU 44 -4.601 -11.408 -1.252 361 HG LEU 44 HG LEU 44 -5.073 -10.190 1.073 362 HD11 LEU 44 HD11 LEU 44 -3.092 -8.814 1.565 363 HD12 LEU 44 HD12 LEU 44 -2.141 -9.849 0.507 364 HD13 LEU 44 HD13 LEU 44 -2.875 -10.513 1.967 365 HD21 LEU 44 HD21 LEU 44 -5.498 -9.252 -1.100 366 HD22 LEU 44 HD22 LEU 44 -3.773 -9.055 -1.398 367 HD23 LEU 44 HD23 LEU 44 -4.567 -8.094 -0.151 368 H LYS 45 HN LYS 45 -5.406 -13.782 2.596 369 HA LYS 45 HA LYS 45 -3.149 -13.073 4.212 370 HB2 LYS 45 HB2 LYS 45 -4.224 -14.272 5.995 371 HB3 LYS 45 HB1 LYS 45 -5.434 -13.330 5.141 372 HG2 LYS 45 HG2 LYS 45 -6.221 -15.321 4.000 373 HG3 LYS 45 HG1 LYS 45 -4.942 -16.270 4.769 374 HD2 LYS 45 HD2 LYS 45 -6.795 -14.734 6.505 375 HD3 LYS 45 HD1 LYS 45 -7.361 -16.239 5.771 376 HE2 LYS 45 HE2 LYS 45 -5.796 -17.521 6.864 377 HE3 LYS 45 HE1 LYS 45 -4.702 -16.165 7.096 378 HZ1 LYS 45 HZ1 LYS 45 -6.206 -15.285 8.773 379 HZ2 LYS 45 HZ2 LYS 45 -5.755 -16.868 9.169 380 HZ3 LYS 45 HZ3 LYS 45 -7.283 -16.566 8.514 381 H ASN 46 HN ASN 46 -3.903 -15.678 2.104 382 HA ASN 46 HA ASN 46 -2.138 -17.636 3.142 383 HB2 ASN 46 HB2 ASN 46 -3.877 -18.103 1.423 384 HB3 ASN 46 HB1 ASN 46 -2.953 -17.161 0.260 385 HD21 ASN 46 HD21 ASN 46 -2.689 -18.889 -1.126 386 HD22 ASN 46 HD22 ASN 46 -1.628 -20.216 -0.769 387 H SER 47 HN SER 47 -1.730 -14.782 1.210 388 HA SER 47 HA SER 47 0.929 -15.265 0.361 389 HB2 SER 47 HB2 SER 47 -0.627 -12.695 0.693 390 HB3 SER 47 HB1 SER 47 0.969 -12.791 -0.061 391 HG SER 47 HG SER 47 0.070 -14.191 -1.621 392 H ASN 48 HN ASN 48 2.833 -14.895 1.357 393 HA ASN 48 HA ASN 48 2.791 -14.562 4.216 394 HB2 ASN 48 HB2 ASN 48 5.307 -14.592 2.572 395 HB3 ASN 48 HB1 ASN 48 5.031 -15.262 4.172 396 HD21 ASN 48 HD21 ASN 48 4.119 -17.314 4.364 397 HD22 ASN 48 HD22 ASN 48 3.964 -18.382 3.012 398 HA PRO 49 HA PRO 49 3.549 -10.195 4.433 399 HB2 PRO 49 HB2 PRO 49 5.317 -10.218 6.569 400 HB3 PRO 49 HB1 PRO 49 3.559 -10.192 6.701 401 HG2 PRO 49 HG2 PRO 49 5.447 -12.473 6.948 402 HG3 PRO 49 HG1 PRO 49 3.938 -12.156 7.819 403 HD2 PRO 49 HD2 PRO 49 4.094 -13.970 5.835 404 HD3 PRO 49 HD1 PRO 49 2.630 -13.010 6.125 405 H ASP 50 HN ASP 50 6.054 -12.492 3.970 406 HA ASP 50 HA ASP 50 7.913 -10.373 3.142 407 HB2 ASP 50 HB2 ASP 50 8.401 -13.304 3.717 408 HB3 ASP 50 HB1 ASP 50 9.624 -12.210 3.077 409 H GLU 51 HN GLU 51 5.498 -11.987 1.798 410 HA GLU 51 HA GLU 51 6.794 -12.038 -0.808 411 HB2 GLU 51 HB2 GLU 51 5.571 -14.320 0.606 412 HB3 GLU 51 HB1 GLU 51 5.127 -14.133 -1.075 413 HG2 GLU 51 HG2 GLU 51 7.521 -14.122 -1.673 414 HG3 GLU 51 HG1 GLU 51 7.913 -14.403 0.019 415 H ILE 52 HN ILE 52 4.961 -10.143 0.469 416 HA ILE 52 HA ILE 52 2.316 -10.758 -0.352 417 HB ILE 52 HB ILE 52 3.193 -9.133 1.547 418 HG12 ILE 52 HG12 ILE 52 0.931 -8.215 1.650 419 HG13 ILE 52 HG11 ILE 52 0.651 -8.674 -0.018 420 HG21 ILE 52 HG21 ILE 52 2.533 -7.271 -0.712 421 HG22 ILE 52 HG22 ILE 52 4.144 -7.515 -0.035 422 HG23 ILE 52 HG23 ILE 52 2.864 -6.811 0.954 423 HD11 ILE 52 HD11 ILE 52 1.218 -10.574 2.204 424 HD12 ILE 52 HD12 ILE 52 0.749 -10.986 0.559 425 HD13 ILE 52 HD13 ILE 52 -0.388 -10.166 1.623 426 H GLU 53 HN GLU 53 1.054 -9.901 -1.852 427 HA GLU 53 HA GLU 53 2.339 -8.408 -4.051 428 HB2 GLU 53 HB2 GLU 53 1.756 -10.800 -4.608 429 HB3 GLU 53 HB1 GLU 53 0.089 -10.467 -4.182 430 HG2 GLU 53 HG2 GLU 53 0.353 -8.649 -6.112 431 HG3 GLU 53 HG1 GLU 53 1.616 -9.774 -6.640 432 H ILE 54 HN ILE 54 1.670 -6.374 -3.055 433 HA ILE 54 HA ILE 54 -0.922 -5.785 -2.272 434 HB ILE 54 HB ILE 54 1.055 -3.950 -3.604 435 HG12 ILE 54 HG12 ILE 54 0.801 -4.788 -0.719 436 HG13 ILE 54 HG11 ILE 54 2.174 -5.020 -1.789 437 HG21 ILE 54 HG21 ILE 54 -1.162 -3.323 -1.692 438 HG22 ILE 54 HG22 ILE 54 -1.197 -3.042 -3.428 439 HG23 ILE 54 HG23 ILE 54 -0.046 -2.170 -2.415 440 HD11 ILE 54 HD11 ILE 54 2.720 -3.224 -0.341 441 HD12 ILE 54 HD12 ILE 54 1.172 -2.442 -0.641 442 HD13 ILE 54 HD13 ILE 54 2.375 -2.534 -1.925 443 H ASP 55 HN ASP 55 -2.618 -6.268 -3.554 444 HA ASP 55 HA ASP 55 -2.491 -5.612 -6.411 445 HB2 ASP 55 HB2 ASP 55 -3.170 -7.928 -5.770 446 HB3 ASP 55 HB1 ASP 55 -4.561 -7.251 -4.922 447 H PHE 56 HN PHE 56 -2.950 -3.488 -6.550 448 HA PHE 56 HA PHE 56 -4.576 -2.125 -4.694 449 HB2 PHE 56 HB2 PHE 56 -3.497 -1.254 -7.359 450 HB3 PHE 56 HB1 PHE 56 -4.272 -0.178 -6.202 451 HD1 PHE 56 HD1 PHE 56 -3.233 0.074 -3.941 452 HD2 PHE 56 HD2 PHE 56 -1.207 -1.793 -7.158 453 HE1 PHE 56 HE1 PHE 56 -1.143 0.406 -2.763 454 HE2 PHE 56 HE2 PHE 56 0.932 -1.450 -5.986 455 HZ PHE 56 HZ PHE 56 0.955 -0.341 -3.780 456 H GLU 57 HN GLU 57 -5.401 -3.919 -7.423 457 HA GLU 57 HA GLU 57 -7.812 -2.476 -8.033 458 HB2 GLU 57 HB2 GLU 57 -6.628 -5.064 -8.960 459 HB3 GLU 57 HB1 GLU 57 -8.290 -4.647 -9.361 460 HG2 GLU 57 HG2 GLU 57 -5.827 -3.056 -10.041 461 HG3 GLU 57 HG1 GLU 57 -6.811 -4.010 -11.154 462 H THR 58 HN THR 58 -6.973 -5.392 -6.219 463 HA THR 58 HA THR 58 -9.765 -5.827 -5.555 464 HB THR 58 HB THR 58 -8.871 -7.747 -4.191 465 HG1 THR 58 HG1 THR 58 -6.430 -7.080 -5.519 466 HG21 THR 58 HG21 THR 58 -8.163 -7.628 -7.122 467 HG22 THR 58 HG22 THR 58 -9.713 -8.113 -6.432 468 HG23 THR 58 HG23 THR 58 -8.282 -9.110 -6.171 469 H LEU 59 HN LEU 59 -6.949 -4.363 -4.131 470 HA LEU 59 HA LEU 59 -7.548 -4.406 -1.432 471 HB2 LEU 59 HB2 LEU 59 -6.314 -2.195 -3.033 472 HB3 LEU 59 HB1 LEU 59 -6.347 -2.259 -1.289 473 HG LEU 59 HG LEU 59 -4.957 -4.194 -3.121 474 HD11 LEU 59 HD11 LEU 59 -3.837 -2.311 -1.069 475 HD12 LEU 59 HD12 LEU 59 -3.870 -2.000 -2.803 476 HD13 LEU 59 HD13 LEU 59 -2.942 -3.354 -2.169 477 HD21 LEU 59 HD21 LEU 59 -5.442 -4.234 -0.158 478 HD22 LEU 59 HD22 LEU 59 -4.080 -5.074 -0.907 479 HD23 LEU 59 HD23 LEU 59 -5.727 -5.507 -1.354 480 H LYS 60 HN LYS 60 -9.119 -3.579 -0.226 481 HA LYS 60 HA LYS 60 -11.323 -2.166 -1.245 482 HB2 LYS 60 HB2 LYS 60 -10.262 -2.283 1.587 483 HB3 LYS 60 HB1 LYS 60 -11.853 -1.691 1.140 484 HG2 LYS 60 HG2 LYS 60 -12.500 -3.880 0.406 485 HG3 LYS 60 HG1 LYS 60 -10.871 -4.486 0.656 486 HD2 LYS 60 HD2 LYS 60 -11.104 -3.934 3.050 487 HD3 LYS 60 HD1 LYS 60 -12.781 -3.499 2.753 488 HE2 LYS 60 HE2 LYS 60 -13.300 -5.735 2.071 489 HE3 LYS 60 HE1 LYS 60 -11.601 -6.201 2.135 490 HZ1 LYS 60 HZ1 LYS 60 -12.827 -6.960 4.080 491 HZ2 LYS 60 HZ2 LYS 60 -13.240 -5.367 4.467 492 HZ3 LYS 60 HZ3 LYS 60 -11.623 -5.857 4.514 493 HA PRO 61 HA PRO 61 -9.960 2.081 -1.722 494 HB2 PRO 61 HB2 PRO 61 -12.550 2.548 -0.307 495 HB3 PRO 61 HB1 PRO 61 -11.890 3.342 -1.739 496 HG2 PRO 61 HG2 PRO 61 -13.780 1.473 -1.940 497 HG3 PRO 61 HG1 PRO 61 -12.494 1.647 -3.140 498 HD2 PRO 61 HD2 PRO 61 -12.883 -0.466 -1.102 499 HD3 PRO 61 HD1 PRO 61 -11.989 -0.525 -2.635 500 H SER 62 HN SER 62 -11.344 0.868 1.285 501 HA SER 62 HA SER 62 -10.341 2.918 2.960 502 HB2 SER 62 HB2 SER 62 -10.952 1.408 4.798 503 HB3 SER 62 HB1 SER 62 -12.231 1.355 3.578 504 HG SER 62 HG SER 62 -11.912 -0.708 3.625 505 H THR 63 HN THR 63 -9.082 -0.330 2.123 506 HA THR 63 HA THR 63 -6.743 -0.188 3.674 507 HB THR 63 HB THR 63 -6.722 -1.538 0.984 508 HG1 THR 63 HG1 THR 63 -7.977 -3.223 1.804 509 HG21 THR 63 HG21 THR 63 -4.750 -2.189 1.926 510 HG22 THR 63 HG22 THR 63 -5.774 -3.317 2.819 511 HG23 THR 63 HG23 THR 63 -5.306 -1.787 3.552 512 H LEU 64 HN LEU 64 -7.384 0.671 0.294 513 HA LEU 64 HA LEU 64 -4.820 1.479 -0.405 514 HB2 LEU 64 HB2 LEU 64 -7.485 2.465 -1.401 515 HB3 LEU 64 HB1 LEU 64 -5.957 2.821 -2.170 516 HG LEU 64 HG LEU 64 -7.017 0.030 -1.774 517 HD11 LEU 64 HD11 LEU 64 -7.758 2.059 -3.676 518 HD12 LEU 64 HD12 LEU 64 -8.448 0.461 -3.414 519 HD13 LEU 64 HD13 LEU 64 -7.055 0.659 -4.477 520 HD21 LEU 64 HD21 LEU 64 -4.673 1.226 -3.216 521 HD22 LEU 64 HD22 LEU 64 -5.338 -0.347 -3.665 522 HD23 LEU 64 HD23 LEU 64 -4.702 -0.090 -2.039 523 H ARG 65 HN ARG 65 -7.467 3.407 1.006 524 HA ARG 65 HA ARG 65 -6.029 5.839 1.008 525 HB2 ARG 65 HB2 ARG 65 -8.368 4.895 2.647 526 HB3 ARG 65 HB1 ARG 65 -7.682 6.508 2.799 527 HG2 ARG 65 HG2 ARG 65 -8.802 5.355 0.254 528 HG3 ARG 65 HG1 ARG 65 -9.673 6.421 1.353 529 HD2 ARG 65 HD2 ARG 65 -8.102 8.196 0.963 530 HD3 ARG 65 HD1 ARG 65 -7.091 7.140 -0.016 531 HE ARG 65 HE ARG 65 -9.751 7.330 -1.035 532 HH11 ARG 65 HH11 ARG 65 -6.684 9.014 -0.869 533 HH12 ARG 65 HH12 ARG 65 -6.882 9.783 -2.411 534 HH21 ARG 65 HH21 ARG 65 -10.008 8.375 -3.077 535 HH22 ARG 65 HH22 ARG 65 -8.747 9.420 -3.658 536 H GLU 66 HN GLU 66 -6.193 3.162 3.296 537 HA GLU 66 HA GLU 66 -4.723 4.521 5.316 538 HB2 GLU 66 HB2 GLU 66 -6.125 2.673 5.949 539 HB3 GLU 66 HB1 GLU 66 -5.236 1.584 4.888 540 HG2 GLU 66 HG2 GLU 66 -3.425 1.486 6.263 541 HG3 GLU 66 HG1 GLU 66 -3.761 3.046 7.009 542 H LEU 67 HN LEU 67 -3.799 2.071 2.882 543 HA LEU 67 HA LEU 67 -1.069 1.951 3.318 544 HB2 LEU 67 HB2 LEU 67 -2.222 2.126 0.525 545 HB3 LEU 67 HB1 LEU 67 -0.853 1.177 1.097 546 HG LEU 67 HG LEU 67 -3.698 0.622 1.905 547 HD11 LEU 67 HD11 LEU 67 -2.208 -1.157 0.102 548 HD12 LEU 67 HD12 LEU 67 -2.841 0.330 -0.598 549 HD13 LEU 67 HD13 LEU 67 -3.935 -0.815 0.181 550 HD21 LEU 67 HD21 LEU 67 -1.409 -0.138 3.131 551 HD22 LEU 67 HD22 LEU 67 -1.635 -1.453 1.983 552 HD23 LEU 67 HD23 LEU 67 -2.904 -1.070 3.143 553 H GLU 68 HN GLU 68 -2.779 4.248 1.180 554 HA GLU 68 HA GLU 68 -0.590 5.813 0.448 555 HB2 GLU 68 HB2 GLU 68 -2.784 5.953 -0.632 556 HB3 GLU 68 HB1 GLU 68 -3.469 6.664 0.820 557 HG2 GLU 68 HG2 GLU 68 -1.798 8.530 0.522 558 HG3 GLU 68 HG1 GLU 68 -1.484 7.860 -1.080 559 H ARG 69 HN ARG 69 -2.984 6.526 3.013 560 HA ARG 69 HA ARG 69 -1.657 8.810 4.000 561 HB2 ARG 69 HB2 ARG 69 -3.755 6.977 5.020 562 HB3 ARG 69 HB1 ARG 69 -3.083 8.183 6.103 563 HG2 ARG 69 HG2 ARG 69 -3.914 9.160 3.458 564 HG3 ARG 69 HG1 ARG 69 -5.218 8.598 4.508 565 HD2 ARG 69 HD2 ARG 69 -4.785 11.000 4.761 566 HD3 ARG 69 HD1 ARG 69 -4.489 10.111 6.253 567 HE ARG 69 HE ARG 69 -2.182 10.610 4.554 568 HH11 ARG 69 HH11 ARG 69 -4.081 11.584 7.320 569 HH12 ARG 69 HH12 ARG 69 -2.791 12.475 8.059 570 HH21 ARG 69 HH21 ARG 69 -0.467 11.769 5.520 571 HH22 ARG 69 HH22 ARG 69 -0.727 12.582 7.030 572 H TYR 70 HN TYR 70 -1.159 5.439 4.555 573 HA TYR 70 HA TYR 70 0.323 5.729 6.966 574 HB2 TYR 70 HB2 TYR 70 -0.503 3.555 6.581 575 HB3 TYR 70 HB1 TYR 70 0.108 3.538 4.932 576 HD1 TYR 70 HD2 TYR 70 1.538 4.124 8.338 577 HD2 TYR 70 HD1 TYR 70 1.871 2.182 4.583 578 HE1 TYR 70 HE2 TYR 70 3.649 3.110 9.069 579 HE2 TYR 70 HE1 TYR 70 3.967 1.138 5.295 580 HH TYR 70 HH TYR 70 5.060 1.209 8.550 581 H VAL 71 HN VAL 71 1.241 5.259 3.544 582 HA VAL 71 HA VAL 71 4.008 5.387 3.995 583 HB VAL 71 HB VAL 71 4.332 5.750 1.677 584 HG11 VAL 71 HG11 VAL 71 2.602 4.241 0.595 585 HG12 VAL 71 HG12 VAL 71 1.936 4.056 2.220 586 HG13 VAL 71 HG13 VAL 71 3.597 3.568 1.882 587 HG21 VAL 71 HG21 VAL 71 2.700 6.522 0.153 588 HG22 VAL 71 HG22 VAL 71 2.859 7.689 1.462 589 HG23 VAL 71 HG23 VAL 71 1.473 6.595 1.411 590 H THR 72 HN THR 72 1.554 7.876 3.646 591 HA THR 72 HA THR 72 3.331 9.976 3.092 592 HB THR 72 HB THR 72 1.540 11.527 3.736 593 HG1 THR 72 HG1 THR 72 0.497 9.221 4.921 594 HG21 THR 72 HG21 THR 72 1.044 9.190 1.980 595 HG22 THR 72 HG22 THR 72 1.334 10.878 1.544 596 HG23 THR 72 HG23 THR 72 -0.234 10.389 2.193 597 H SER 73 HN SER 73 2.380 8.438 6.059 598 HA SER 73 HA SER 73 3.298 10.435 7.844 599 HB2 SER 73 HB2 SER 73 3.037 8.816 9.551 600 HB3 SER 73 HB1 SER 73 1.805 8.423 8.347 601 HG SER 73 HG SER 73 3.063 6.734 7.622 602 H CYS 74 HN CYS 74 4.828 8.103 5.859 603 HA CYS 74 HA CYS 74 7.439 8.540 7.112 604 HB2 CYS 74 HB2 CYS 74 7.003 6.230 6.580 605 HB3 CYS 74 HB1 CYS 74 6.565 6.651 4.926 606 HG CYS 74 HG CYS 74 9.614 7.717 5.554 607 H LEU 75 HN LEU 75 5.913 8.767 3.931 608 HA LEU 75 HA LEU 75 8.227 9.817 2.674 609 HB2 LEU 75 HB2 LEU 75 5.377 9.849 1.707 610 HB3 LEU 75 HB1 LEU 75 6.814 9.958 0.713 611 HG LEU 75 HG LEU 75 5.787 7.577 2.216 612 HD11 LEU 75 HD11 LEU 75 4.962 8.184 -0.086 613 HD12 LEU 75 HD12 LEU 75 5.651 6.571 0.095 614 HD13 LEU 75 HD13 LEU 75 6.594 7.854 -0.658 615 HD21 LEU 75 HD21 LEU 75 7.805 6.413 1.750 616 HD22 LEU 75 HD22 LEU 75 8.260 7.911 2.543 617 HD23 LEU 75 HD23 LEU 75 8.437 7.752 0.798 618 H ARG 76 HN ARG 76 5.368 11.291 4.066 619 HA ARG 76 HA ARG 76 6.168 13.867 2.957 620 HB2 ARG 76 HB2 ARG 76 3.611 12.963 4.241 621 HB3 ARG 76 HB1 ARG 76 3.931 14.629 3.762 622 HG2 ARG 76 HG2 ARG 76 4.337 13.779 1.445 623 HG3 ARG 76 HG1 ARG 76 3.772 12.206 2.010 624 HD2 ARG 76 HD2 ARG 76 1.955 13.355 0.959 625 HD3 ARG 76 HD1 ARG 76 1.674 13.232 2.690 626 HE ARG 76 HE ARG 76 2.807 15.659 2.470 627 HH11 ARG 76 HH11 ARG 76 0.160 14.140 0.760 628 HH12 ARG 76 HH12 ARG 76 -0.680 15.630 0.475 629 HH21 ARG 76 HH21 ARG 76 1.709 17.630 2.083 630 HH22 ARG 76 HH22 ARG 76 0.199 17.612 1.223 631 H LYS 77 HN LYS 77 7.025 12.195 5.550 632 HA LYS 77 HA LYS 77 7.177 14.598 7.218 633 HB2 LYS 77 HB2 LYS 77 6.266 11.870 8.084 634 HB3 LYS 77 HB1 LYS 77 6.934 13.023 9.234 635 HG2 LYS 77 HG2 LYS 77 4.629 13.639 7.422 636 HG3 LYS 77 HG1 LYS 77 4.435 12.992 9.054 637 HD2 LYS 77 HD2 LYS 77 5.541 14.934 9.982 638 HD3 LYS 77 HD1 LYS 77 5.881 15.548 8.363 639 HE2 LYS 77 HE2 LYS 77 3.431 15.646 7.957 640 HE3 LYS 77 HE1 LYS 77 3.179 15.196 9.642 641 HZ1 LYS 77 HZ1 LYS 77 4.632 17.613 8.714 642 HZ2 LYS 77 HZ2 LYS 77 4.330 17.194 10.324 643 HZ3 LYS 77 HZ3 LYS 77 3.046 17.594 9.301 644 H LYS 78 HN LYS 78 8.707 11.680 6.095 645 HA LYS 78 HA LYS 78 11.284 12.509 6.975 646 HB2 LYS 78 HB2 LYS 78 10.116 11.597 9.072 647 HB3 LYS 78 HB1 LYS 78 10.243 10.021 8.314 648 HG2 LYS 78 HG2 LYS 78 12.060 10.236 9.817 649 HG3 LYS 78 HG1 LYS 78 12.713 10.382 8.186 650 HD2 LYS 78 HD2 LYS 78 12.928 12.736 8.386 651 HD3 LYS 78 HD1 LYS 78 11.983 12.762 9.875 652 HE2 LYS 78 HE2 LYS 78 14.354 13.021 10.355 653 HE3 LYS 78 HE1 LYS 78 13.745 11.505 11.014 654 HZ1 LYS 78 HZ1 LYS 78 15.887 11.228 9.934 655 HZ2 LYS 78 HZ2 LYS 78 15.250 11.790 8.473 656 HZ3 LYS 78 HZ3 LYS 78 14.691 10.338 9.137 657 H ARG 79 HN ARG 79 11.047 12.102 4.537 658 HA ARG 79 HA ARG 79 10.738 9.399 3.663 659 HB2 ARG 79 HB2 ARG 79 11.210 10.179 1.435 660 HB3 ARG 79 HB1 ARG 79 10.118 11.303 2.221 661 HG2 ARG 79 HG2 ARG 79 13.074 11.792 2.109 662 HG3 ARG 79 HG1 ARG 79 11.999 12.258 0.792 663 HD2 ARG 79 HD2 ARG 79 11.883 13.202 3.652 664 HD3 ARG 79 HD1 ARG 79 12.353 14.145 2.242 665 HE ARG 79 HE ARG 79 9.694 13.054 2.071 666 HH11 ARG 79 HH11 ARG 79 11.620 15.732 3.247 667 HH12 ARG 79 HH12 ARG 79 10.304 16.860 3.200 668 HH21 ARG 79 HH21 ARG 79 7.958 14.526 2.029 669 HH22 ARG 79 HH22 ARG 79 8.217 16.173 2.513 670 H LYS 80 HN LYS 80 12.250 8.070 2.668 671 HA LYS 80 HA LYS 80 14.120 6.803 2.773 672 HB2 LYS 80 HB2 LYS 80 15.561 9.457 2.701 673 HB3 LYS 80 HB1 LYS 80 16.241 7.892 2.285 674 HG2 LYS 80 HG2 LYS 80 14.081 9.379 0.807 675 HG3 LYS 80 HG1 LYS 80 15.738 9.103 0.275 676 HD2 LYS 80 HD2 LYS 80 13.659 6.963 0.736 677 HD3 LYS 80 HD1 LYS 80 14.150 7.594 -0.834 678 HE2 LYS 80 HE2 LYS 80 16.424 6.779 -0.449 679 HE3 LYS 80 HE1 LYS 80 15.938 6.160 1.128 680 HZ1 LYS 80 HZ1 LYS 80 15.861 4.335 -0.316 681 HZ2 LYS 80 HZ2 LYS 80 15.094 5.215 -1.543 682 HZ3 LYS 80 HZ3 LYS 80 14.245 4.809 -0.142 683 HA PRO 81 HA PRO 81 14.894 7.762 7.241 684 HB2 PRO 81 HB2 PRO 81 13.002 6.317 8.453 685 HB3 PRO 81 HB1 PRO 81 12.635 7.891 7.740 686 HG2 PRO 81 HG2 PRO 81 11.955 5.176 6.773 687 HG3 PRO 81 HG1 PRO 81 11.106 6.709 6.520 688 HD2 PRO 81 HD2 PRO 81 12.902 5.396 4.730 689 HD3 PRO 81 HD1 PRO 81 12.128 6.979 4.524 690 H GLN 82 HN GLN 82 16.698 6.298 6.193 691 HA GLN 82 HA GLN 82 16.620 3.559 7.139 692 HB2 GLN 82 HB2 GLN 82 18.839 5.209 5.914 693 HB3 GLN 82 HB1 GLN 82 19.002 3.517 6.363 694 HG2 GLN 82 HG2 GLN 82 17.244 2.919 4.783 695 HG3 GLN 82 HG1 GLN 82 17.062 4.616 4.341 696 HE21 GLN 82 HE21 GLN 82 17.550 4.150 2.194 697 HE22 GLN 82 HE22 GLN 82 19.167 3.824 1.678 698 H ALA 83 HN ALA 83 17.329 6.600 8.387 699 HA ALA 83 HA ALA 83 18.657 5.392 10.717 700 HB1 ALA 83 HB1 ALA 83 19.676 7.570 11.152 701 HB2 ALA 83 HB2 ALA 83 18.889 8.233 9.720 702 HB3 ALA 83 HB3 ALA 83 20.117 6.978 9.551 703 H1 VAL 201 HT1 VAL 201 -3.611 0.237 -16.833 704 H2 VAL 201 HT2 VAL 201 -4.296 1.469 -15.904 705 H3 VAL 201 HT3 VAL 201 -5.284 0.476 -16.844 706 HA VAL 201 HA VAL 201 -5.415 -0.122 -14.514 707 HB VAL 201 HB VAL 201 -3.947 -2.209 -16.145 708 HG11 VAL 201 HG11 VAL 201 -5.193 -3.827 -14.791 709 HG12 VAL 201 HG12 VAL 201 -5.890 -2.504 -13.855 710 HG13 VAL 201 HG13 VAL 201 -4.154 -2.809 -13.792 711 HG21 VAL 201 HG21 VAL 201 -6.895 -1.576 -16.033 712 HG22 VAL 201 HG22 VAL 201 -6.172 -2.949 -16.870 713 HG23 VAL 201 HG23 VAL 201 -5.820 -1.306 -17.405 714 H VAL 202 HN VAL 202 -4.402 -0.238 -12.588 715 HA VAL 202 HA VAL 202 -1.584 0.315 -12.470 716 HB VAL 202 HB VAL 202 -3.574 -0.234 -10.262 717 HG11 VAL 202 HG11 VAL 202 -1.886 0.695 -8.746 718 HG12 VAL 202 HG12 VAL 202 -0.746 0.808 -10.086 719 HG13 VAL 202 HG13 VAL 202 -1.304 -0.772 -9.536 720 HG21 VAL 202 HG21 VAL 202 -2.379 2.354 -11.245 721 HG22 VAL 202 HG22 VAL 202 -3.514 2.174 -9.908 722 HG23 VAL 202 HG23 VAL 202 -4.024 1.800 -11.555 723 HA PRO 203 HA PRO 203 -0.494 -4.008 -12.597 724 HB2 PRO 203 HB2 PRO 203 2.183 -3.621 -12.217 725 HB3 PRO 203 HB1 PRO 203 1.376 -3.418 -13.774 726 HG2 PRO 203 HG2 PRO 203 2.198 -1.352 -11.782 727 HG3 PRO 203 HG1 PRO 203 2.295 -1.306 -13.551 728 HD2 PRO 203 HD2 PRO 203 0.357 -0.034 -12.156 729 HD3 PRO 203 HD1 PRO 203 0.088 -0.699 -13.780 730 H LYS 204 HN LYS 204 -0.618 -5.418 -11.024 731 HA LYS 204 HA LYS 204 -0.653 -4.853 -8.323 732 HB2 LYS 204 HB2 LYS 204 -0.532 -7.276 -7.944 733 HB3 LYS 204 HB1 LYS 204 -1.656 -6.868 -9.226 734 HG2 LYS 204 HG2 LYS 204 1.147 -7.839 -9.734 735 HG3 LYS 204 HG1 LYS 204 -0.256 -8.902 -9.626 736 HD2 LYS 204 HD2 LYS 204 -1.297 -7.499 -11.457 737 HD3 LYS 204 HD1 LYS 204 0.284 -6.745 -11.656 738 HE2 LYS 204 HE2 LYS 204 0.143 -8.469 -13.271 739 HE3 LYS 204 HE1 LYS 204 1.220 -9.051 -12.004 740 HZ1 LYS 204 HZ1 LYS 204 -0.346 -10.754 -12.691 741 HZ2 LYS 204 HZ2 LYS 204 -1.649 -9.754 -12.285 742 HZ3 LYS 204 HZ3 LYS 204 -0.611 -10.321 -11.079 743 H LYS 205 HN LYS 205 0.787 -4.783 -6.710 744 HA LYS 205 HA LYS 205 3.553 -4.471 -7.565 745 HB2 LYS 205 HB2 LYS 205 2.406 -2.671 -6.314 746 HB3 LYS 205 HB1 LYS 205 2.225 -3.756 -4.952 747 HG2 LYS 205 HG2 LYS 205 4.054 -2.276 -4.535 748 HG3 LYS 205 HG1 LYS 205 4.685 -3.905 -4.788 749 HD2 LYS 205 HD2 LYS 205 5.373 -3.366 -7.011 750 HD3 LYS 205 HD1 LYS 205 4.541 -1.812 -6.949 751 HE2 LYS 205 HE2 LYS 205 6.059 -1.064 -5.192 752 HE3 LYS 205 HE1 LYS 205 6.884 -2.624 -5.235 753 HZ1 LYS 205 HZ1 LYS 205 6.717 -0.725 -7.512 754 HZ2 LYS 205 HZ2 LYS 205 7.552 -2.195 -7.502 755 HZ3 LYS 205 HZ3 LYS 205 8.067 -0.924 -6.509 756 H LYS 206 HN LYS 206 4.523 -6.416 -7.613 757 HA LYS 206 HA LYS 206 4.225 -8.328 -5.469 758 HB2 LYS 206 HB2 LYS 206 4.561 -9.012 -7.847 759 HB3 LYS 206 HB1 LYS 206 6.174 -8.318 -7.785 760 HG2 LYS 206 HG2 LYS 206 6.657 -9.911 -5.890 761 HG3 LYS 206 HG1 LYS 206 5.128 -10.698 -6.279 762 HD2 LYS 206 HD2 LYS 206 7.469 -10.344 -8.158 763 HD3 LYS 206 HD1 LYS 206 7.015 -11.837 -7.337 764 HE2 LYS 206 HE2 LYS 206 5.273 -10.350 -9.299 765 HE3 LYS 206 HE1 LYS 206 6.265 -11.751 -9.696 766 HZ1 LYS 206 HZ1 LYS 206 3.963 -12.366 -9.292 767 HZ2 LYS 206 HZ2 LYS 206 4.035 -11.720 -7.732 768 HZ3 LYS 206 HZ3 LYS 206 4.979 -13.063 -8.134 769 H ILE 207 HN ILE 207 5.158 -7.798 -3.571 770 HA ILE 207 HA ILE 207 7.947 -6.863 -3.668 771 HB ILE 207 HB ILE 207 7.283 -5.862 -1.301 772 HG12 ILE 207 HG12 ILE 207 4.725 -5.471 -2.842 773 HG13 ILE 207 HG11 ILE 207 4.911 -6.696 -1.589 774 HG21 ILE 207 HG21 ILE 207 6.851 -3.690 -2.462 775 HG22 ILE 207 HG22 ILE 207 6.797 -4.578 -3.986 776 HG23 ILE 207 HG23 ILE 207 8.280 -4.552 -3.034 777 HD11 ILE 207 HD11 ILE 207 5.258 -3.730 -1.213 778 HD12 ILE 207 HD12 ILE 207 5.422 -4.964 0.039 779 HD13 ILE 207 HD13 ILE 207 3.859 -4.688 -0.724 780 H LYS 208 HN LYS 208 8.286 -9.239 -3.602 781 HA LYS 208 HA LYS 208 8.060 -10.277 -0.884 782 HB2 LYS 208 HB2 LYS 208 8.830 -12.432 -1.835 783 HB3 LYS 208 HB1 LYS 208 7.347 -11.842 -2.562 784 HG2 LYS 208 HG2 LYS 208 8.534 -11.151 -4.535 785 HG3 LYS 208 HG1 LYS 208 10.076 -11.594 -3.800 786 HD2 LYS 208 HD2 LYS 208 9.302 -13.322 -5.353 787 HD3 LYS 208 HD1 LYS 208 9.366 -13.930 -3.699 788 HE2 LYS 208 HE2 LYS 208 6.931 -13.517 -3.501 789 HE3 LYS 208 HE1 LYS 208 6.904 -13.022 -5.191 790 HZ1 LYS 208 HZ1 LYS 208 7.638 -15.232 -5.816 791 HZ2 LYS 208 HZ2 LYS 208 6.211 -15.319 -4.915 792 HZ3 LYS 208 HZ3 LYS 208 7.691 -15.708 -4.191 793 H LYS 209 HN LYS 209 10.538 -9.725 -3.388 794 HA LYS 209 HA LYS 209 12.414 -9.238 -1.178 795 HB2 LYS 209 HB2 LYS 209 13.098 -10.669 -3.752 796 HB3 LYS 209 HB1 LYS 209 14.234 -10.242 -2.481 797 HG2 LYS 209 HG2 LYS 209 12.946 -11.687 -0.923 798 HG3 LYS 209 HG1 LYS 209 11.952 -12.194 -2.291 799 HD2 LYS 209 HD2 LYS 209 14.017 -12.985 -3.423 800 HD3 LYS 209 HD1 LYS 209 14.921 -12.592 -1.958 801 HE2 LYS 209 HE2 LYS 209 12.659 -14.573 -2.186 802 HE3 LYS 209 HE1 LYS 209 14.369 -14.960 -2.014 803 HZ1 LYS 209 HZ1 LYS 209 14.321 -13.809 0.148 804 HZ2 LYS 209 HZ2 LYS 209 13.297 -15.150 0.100 805 HZ3 LYS 209 HZ3 LYS 209 12.652 -13.593 -0.017 806 H GLU 210 HN GLU 210 11.000 -8.198 -4.075 807 HA GLU 210 HA GLU 210 13.112 -6.445 -4.920 808 HB2 GLU 210 HB2 GLU 210 10.215 -6.647 -5.737 809 HB3 GLU 210 HB1 GLU 210 11.374 -5.556 -6.480 810 HG2 GLU 210 HG2 GLU 210 12.687 -7.399 -7.272 811 HG3 GLU 210 HG1 GLU 210 11.671 -8.546 -6.401 812 H GLN 211 HN GLN 211 12.953 -5.777 -2.430 813 HA GLN 211 HA GLN 211 11.242 -3.404 -2.216 814 HB2 GLN 211 HB2 GLN 211 11.801 -3.445 0.179 815 HB3 GLN 211 HB1 GLN 211 11.098 -4.968 -0.345 816 HG2 GLN 211 HG2 GLN 211 13.398 -5.901 -0.503 817 HG3 GLN 211 HG1 GLN 211 14.000 -4.401 0.200 818 HE21 GLN 211 HE21 GLN 211 10.981 -5.916 1.109 819 HE22 GLN 211 HE22 GLN 211 11.465 -6.371 2.702 820 H VAL 212 HN VAL 212 12.409 -1.542 -0.982 821 HA VAL 212 HA VAL 212 14.983 -1.152 -2.358 822 HB VAL 212 HB VAL 212 13.170 0.125 -3.408 823 HG11 VAL 212 HG11 VAL 212 12.872 1.445 -0.717 824 HG12 VAL 212 HG12 VAL 212 11.695 0.401 -1.514 825 HG13 VAL 212 HG13 VAL 212 12.090 1.975 -2.206 826 HG21 VAL 212 HG21 VAL 212 14.211 2.347 -3.343 827 HG22 VAL 212 HG22 VAL 212 15.408 1.058 -3.475 828 HG23 VAL 212 HG23 VAL 212 15.142 1.858 -1.926 829 H GLU 213 HN GLU 213 16.583 0.009 -1.316 830 HA GLU 213 HA GLU 213 16.649 -0.032 1.518 831 HB2 GLU 213 HB2 GLU 213 18.440 1.268 -0.537 832 HB3 GLU 213 HB1 GLU 213 18.767 1.324 1.189 833 HG2 GLU 213 HG2 GLU 213 18.497 -1.212 -0.406 834 HG3 GLU 213 HG1 GLU 213 20.029 -0.425 -0.028 Start of MODEL 12 1 H1 SER 1 HT1 SER 1 -21.778 1.577 8.003 2 H2 SER 1 HT2 SER 1 -20.884 0.344 7.264 3 H3 SER 1 HT3 SER 1 -22.573 0.237 7.349 4 HA SER 1 HA SER 1 -21.901 0.849 5.154 5 HB2 SER 1 HB2 SER 1 -24.017 1.769 6.061 6 HB3 SER 1 HB1 SER 1 -23.133 3.178 6.641 7 HG SER 1 HG SER 1 -22.800 2.600 3.953 8 H GLU 2 HN GLU 2 -20.168 2.346 7.627 9 HA GLU 2 HA GLU 2 -19.012 4.455 6.133 10 HB2 GLU 2 HB2 GLU 2 -18.193 3.033 8.646 11 HB3 GLU 2 HB1 GLU 2 -17.269 4.351 7.954 12 HG2 GLU 2 HG2 GLU 2 -19.317 5.774 8.125 13 HG3 GLU 2 HG1 GLU 2 -20.075 4.454 9.011 14 H GLU 3 HN GLU 3 -18.495 1.071 6.169 15 HA GLU 3 HA GLU 3 -15.787 0.861 5.602 16 HB2 GLU 3 HB2 GLU 3 -18.008 -0.833 4.437 17 HB3 GLU 3 HB1 GLU 3 -16.314 -1.285 4.545 18 HG2 GLU 3 HG2 GLU 3 -17.074 -2.377 6.370 19 HG3 GLU 3 HG1 GLU 3 -16.749 -0.817 7.120 20 H GLU 4 HN GLU 4 -18.495 1.327 3.341 21 HA GLU 4 HA GLU 4 -16.581 1.800 1.176 22 HB2 GLU 4 HB2 GLU 4 -19.593 1.538 1.105 23 HB3 GLU 4 HB1 GLU 4 -18.555 1.724 -0.301 24 HG2 GLU 4 HG2 GLU 4 -18.428 -0.583 1.627 25 HG3 GLU 4 HG1 GLU 4 -19.295 -0.598 0.093 26 H ASP 5 HN ASP 5 -18.771 3.503 3.266 27 HA ASP 5 HA ASP 5 -18.954 5.783 1.478 28 HB2 ASP 5 HB2 ASP 5 -20.959 5.118 2.690 29 HB3 ASP 5 HB1 ASP 5 -20.133 5.373 4.223 30 H LYS 6 HN LYS 6 -17.717 5.173 4.754 31 HA LYS 6 HA LYS 6 -16.800 7.828 5.149 32 HB2 LYS 6 HB2 LYS 6 -17.298 6.063 6.923 33 HB3 LYS 6 HB1 LYS 6 -15.749 5.348 6.518 34 HG2 LYS 6 HG2 LYS 6 -15.534 6.696 8.489 35 HG3 LYS 6 HG1 LYS 6 -14.638 7.455 7.172 36 HD2 LYS 6 HD2 LYS 6 -16.289 9.115 6.878 37 HD3 LYS 6 HD1 LYS 6 -17.469 8.221 7.836 38 HE2 LYS 6 HE2 LYS 6 -14.952 9.528 8.858 39 HE3 LYS 6 HE1 LYS 6 -16.601 10.104 9.098 40 HZ1 LYS 6 HZ1 LYS 6 -17.034 7.924 10.237 41 HZ2 LYS 6 HZ2 LYS 6 -15.984 8.973 11.052 42 HZ3 LYS 6 HZ3 LYS 6 -15.362 7.652 10.205 43 H CYS 7 HN CYS 7 -15.424 4.922 3.813 44 HA CYS 7 HA CYS 7 -12.805 6.124 3.497 45 HB2 CYS 7 HB2 CYS 7 -13.830 3.482 2.441 46 HB3 CYS 7 HB1 CYS 7 -12.144 3.987 2.574 47 HG CYS 7 HG CYS 7 -14.285 3.201 5.126 48 H LYS 8 HN LYS 8 -12.586 7.576 1.929 49 HA LYS 8 HA LYS 8 -14.439 7.733 -0.243 50 HB2 LYS 8 HB2 LYS 8 -12.177 9.364 0.763 51 HB3 LYS 8 HB1 LYS 8 -12.576 9.530 -0.942 52 HG2 LYS 8 HG2 LYS 8 -13.687 11.158 0.625 53 HG3 LYS 8 HG1 LYS 8 -14.744 10.284 -0.481 54 HD2 LYS 8 HD2 LYS 8 -15.302 8.710 1.329 55 HD3 LYS 8 HD1 LYS 8 -14.277 9.629 2.426 56 HE2 LYS 8 HE2 LYS 8 -15.700 11.575 2.170 57 HE3 LYS 8 HE1 LYS 8 -16.686 10.726 0.979 58 HZ1 LYS 8 HZ1 LYS 8 -17.752 10.697 3.130 59 HZ2 LYS 8 HZ2 LYS 8 -16.391 10.001 3.843 60 HZ3 LYS 8 HZ3 LYS 8 -17.290 9.123 2.711 61 HA PRO 9 HA PRO 9 -12.715 5.000 -3.040 62 HB2 PRO 9 HB2 PRO 9 -13.555 6.134 -5.389 63 HB3 PRO 9 HB1 PRO 9 -14.589 5.198 -4.306 64 HG2 PRO 9 HG2 PRO 9 -14.338 8.153 -4.612 65 HG3 PRO 9 HG1 PRO 9 -15.785 7.172 -4.317 66 HD2 PRO 9 HD2 PRO 9 -14.532 8.585 -2.363 67 HD3 PRO 9 HD1 PRO 9 -15.400 7.074 -2.037 68 H MET 10 HN MET 10 -10.691 4.730 -3.655 69 HA MET 10 HA MET 10 -9.031 6.995 -4.337 70 HB2 MET 10 HB2 MET 10 -8.206 5.091 -2.931 71 HB3 MET 10 HB1 MET 10 -8.311 4.061 -4.355 72 HG2 MET 10 HG2 MET 10 -6.110 4.625 -4.423 73 HG3 MET 10 HG1 MET 10 -6.800 5.913 -5.413 74 HE1 MET 10 HE1 MET 10 -5.593 4.799 -2.031 75 HE2 MET 10 HE2 MET 10 -6.919 5.739 -1.358 76 HE3 MET 10 HE3 MET 10 -5.253 6.275 -1.132 77 H SER 11 HN SER 11 -8.697 7.692 -6.342 78 HA SER 11 HA SER 11 -9.978 6.329 -8.519 79 HB2 SER 11 HB2 SER 11 -9.148 8.310 -9.852 80 HB3 SER 11 HB1 SER 11 -10.172 8.710 -8.473 81 HG SER 11 HG SER 11 -8.297 9.236 -7.295 82 H TYR 12 HN TYR 12 -8.667 6.361 -10.734 83 HA TYR 12 HA TYR 12 -6.821 4.280 -10.553 84 HB2 TYR 12 HB2 TYR 12 -7.635 4.244 -12.657 85 HB3 TYR 12 HB1 TYR 12 -7.947 5.975 -12.674 86 HD1 TYR 12 HD1 TYR 12 -5.137 3.517 -12.998 87 HD2 TYR 12 HD2 TYR 12 -6.663 7.343 -14.047 88 HE1 TYR 12 HE1 TYR 12 -3.266 3.822 -14.554 89 HE2 TYR 12 HE2 TYR 12 -4.789 7.665 -15.608 90 HH TYR 12 HH TYR 12 -2.612 6.869 -16.070 91 H GLU 13 HN GLU 13 -6.268 7.734 -11.143 92 HA GLU 13 HA GLU 13 -3.492 7.594 -11.494 93 HB2 GLU 13 HB2 GLU 13 -5.167 9.853 -10.351 94 HB3 GLU 13 HB1 GLU 13 -3.547 10.042 -11.003 95 HG2 GLU 13 HG2 GLU 13 -4.701 10.672 -12.852 96 HG3 GLU 13 HG1 GLU 13 -4.780 8.920 -13.122 97 H GLU 14 HN GLU 14 -5.485 7.864 -8.650 98 HA GLU 14 HA GLU 14 -3.409 8.540 -6.852 99 HB2 GLU 14 HB2 GLU 14 -6.201 7.508 -6.546 100 HB3 GLU 14 HB1 GLU 14 -5.164 7.766 -5.157 101 HG2 GLU 14 HG2 GLU 14 -4.928 10.142 -5.876 102 HG3 GLU 14 HG1 GLU 14 -6.118 9.823 -7.135 103 H LYS 15 HN LYS 15 -5.121 5.527 -7.613 104 HA LYS 15 HA LYS 15 -3.727 3.814 -5.921 105 HB2 LYS 15 HB2 LYS 15 -4.886 3.292 -8.649 106 HB3 LYS 15 HB1 LYS 15 -4.188 2.029 -7.643 107 HG2 LYS 15 HG2 LYS 15 -5.882 2.073 -6.132 108 HG3 LYS 15 HG1 LYS 15 -6.329 3.733 -6.517 109 HD2 LYS 15 HD2 LYS 15 -7.537 3.144 -8.334 110 HD3 LYS 15 HD1 LYS 15 -6.558 1.719 -8.672 111 HE2 LYS 15 HE2 LYS 15 -7.543 0.647 -6.682 112 HE3 LYS 15 HE1 LYS 15 -8.615 2.031 -6.491 113 HZ1 LYS 15 HZ1 LYS 15 -9.522 1.561 -8.692 114 HZ2 LYS 15 HZ2 LYS 15 -9.721 0.240 -7.661 115 HZ3 LYS 15 HZ3 LYS 15 -8.509 0.209 -8.844 116 H ARG 16 HN ARG 16 -2.861 5.038 -9.117 117 HA ARG 16 HA ARG 16 -0.467 3.583 -9.451 118 HB2 ARG 16 HB2 ARG 16 -1.470 4.795 -11.311 119 HB3 ARG 16 HB1 ARG 16 -1.186 6.318 -10.484 120 HG2 ARG 16 HG2 ARG 16 1.242 5.783 -10.522 121 HG3 ARG 16 HG1 ARG 16 0.858 4.425 -11.555 122 HD2 ARG 16 HD2 ARG 16 1.608 6.457 -12.770 123 HD3 ARG 16 HD1 ARG 16 0.037 5.848 -13.245 124 HE ARG 16 HE ARG 16 -0.107 7.908 -11.251 125 HH11 ARG 16 HH11 ARG 16 0.129 7.262 -14.684 126 HH12 ARG 16 HH12 ARG 16 -0.588 8.771 -15.149 127 HH21 ARG 16 HH21 ARG 16 -1.040 9.904 -11.860 128 HH22 ARG 16 HH22 ARG 16 -1.238 10.282 -13.542 129 H GLN 17 HN GLN 17 -0.995 6.872 -8.230 130 HA GLN 17 HA GLN 17 1.644 7.409 -7.529 131 HB2 GLN 17 HB2 GLN 17 -0.310 9.011 -7.644 132 HB3 GLN 17 HB1 GLN 17 -0.766 8.433 -6.050 133 HG2 GLN 17 HG2 GLN 17 0.481 10.468 -5.830 134 HG3 GLN 17 HG1 GLN 17 1.446 9.125 -5.213 135 HE21 GLN 17 HE21 GLN 17 1.066 11.431 -7.784 136 HE22 GLN 17 HE22 GLN 17 2.649 11.241 -8.456 137 H LEU 18 HN LEU 18 -0.941 5.867 -5.783 138 HA LEU 18 HA LEU 18 0.224 5.479 -3.279 139 HB2 LEU 18 HB2 LEU 18 -2.149 4.954 -4.322 140 HB3 LEU 18 HB1 LEU 18 -1.447 3.374 -4.552 141 HG LEU 18 HG LEU 18 -1.935 4.782 -1.945 142 HD11 LEU 18 HD11 LEU 18 -3.216 2.516 -1.716 143 HD12 LEU 18 HD12 LEU 18 -3.208 2.586 -3.473 144 HD13 LEU 18 HD13 LEU 18 -3.938 3.891 -2.540 145 HD21 LEU 18 HD21 LEU 18 -0.056 3.645 -1.339 146 HD22 LEU 18 HD22 LEU 18 -0.256 2.425 -2.593 147 HD23 LEU 18 HD23 LEU 18 -1.248 2.363 -1.138 148 H SER 19 HN SER 19 0.225 3.343 -6.128 149 HA SER 19 HA SER 19 1.791 1.321 -4.974 150 HB2 SER 19 HB2 SER 19 1.849 0.373 -7.120 151 HB3 SER 19 HB1 SER 19 0.362 1.317 -7.119 152 HG SER 19 HG SER 19 1.687 3.051 -8.082 153 H LEU 20 HN LEU 20 2.584 4.398 -6.215 154 HA LEU 20 HA LEU 20 5.395 3.819 -6.595 155 HB2 LEU 20 HB2 LEU 20 3.810 6.354 -6.848 156 HB3 LEU 20 HB1 LEU 20 5.504 6.214 -7.248 157 HG LEU 20 HG LEU 20 3.197 4.878 -8.621 158 HD11 LEU 20 HD11 LEU 20 3.697 7.254 -9.106 159 HD12 LEU 20 HD12 LEU 20 3.808 6.187 -10.501 160 HD13 LEU 20 HD13 LEU 20 5.275 6.755 -9.701 161 HD21 LEU 20 HD21 LEU 20 4.938 3.273 -8.519 162 HD22 LEU 20 HD22 LEU 20 6.149 4.463 -8.996 163 HD23 LEU 20 HD23 LEU 20 4.915 3.946 -10.148 164 H ASP 21 HN ASP 21 3.289 5.440 -4.277 165 HA ASP 21 HA ASP 21 5.466 6.408 -2.665 166 HB2 ASP 21 HB2 ASP 21 3.794 7.087 -1.059 167 HB3 ASP 21 HB1 ASP 21 3.382 7.618 -2.663 168 H ILE 22 HN ILE 22 3.385 3.560 -2.601 169 HA ILE 22 HA ILE 22 4.480 2.363 -0.313 170 HB ILE 22 HB ILE 22 3.071 1.436 -2.733 171 HG12 ILE 22 HG12 ILE 22 2.740 0.729 0.168 172 HG13 ILE 22 HG11 ILE 22 1.997 2.133 -0.589 173 HG21 ILE 22 HG21 ILE 22 4.546 -0.528 -1.009 174 HG22 ILE 22 HG22 ILE 22 4.905 -0.159 -2.690 175 HG23 ILE 22 HG23 ILE 22 3.377 -0.923 -2.261 176 HD11 ILE 22 HD11 ILE 22 1.523 -0.711 -1.452 177 HD12 ILE 22 HD12 ILE 22 0.683 0.733 -2.013 178 HD13 ILE 22 HD13 ILE 22 0.484 0.191 -0.348 179 H ASN 23 HN ASN 23 5.572 2.547 -3.635 180 HA ASN 23 HA ASN 23 7.729 0.742 -3.406 181 HB2 ASN 23 HB2 ASN 23 6.701 1.454 -5.542 182 HB3 ASN 23 HB1 ASN 23 7.343 3.069 -5.297 183 HD21 ASN 23 HD21 ASN 23 9.523 3.440 -5.612 184 HD22 ASN 23 HD22 ASN 23 10.552 2.300 -6.406 185 H LYS 24 HN LYS 24 7.258 3.923 -2.276 186 HA LYS 24 HA LYS 24 10.042 4.679 -2.175 187 HB2 LYS 24 HB2 LYS 24 7.460 5.891 -1.327 188 HB3 LYS 24 HB1 LYS 24 8.951 6.514 -0.640 189 HG2 LYS 24 HG2 LYS 24 9.751 7.144 -2.811 190 HG3 LYS 24 HG1 LYS 24 8.392 6.334 -3.597 191 HD2 LYS 24 HD2 LYS 24 6.838 7.907 -2.717 192 HD3 LYS 24 HD1 LYS 24 8.043 8.590 -1.629 193 HE2 LYS 24 HE2 LYS 24 8.181 8.724 -4.645 194 HE3 LYS 24 HE1 LYS 24 7.563 10.007 -3.603 195 HZ1 LYS 24 HZ1 LYS 24 9.867 10.383 -4.231 196 HZ2 LYS 24 HZ2 LYS 24 10.325 8.916 -3.533 197 HZ3 LYS 24 HZ3 LYS 24 9.731 10.164 -2.560 198 H LEU 25 HN LEU 25 7.861 2.910 -0.221 199 HA LEU 25 HA LEU 25 9.043 3.522 2.312 200 HB2 LEU 25 HB2 LEU 25 7.167 1.345 1.424 201 HB3 LEU 25 HB1 LEU 25 7.751 1.492 3.069 202 HG LEU 25 HG LEU 25 5.904 3.323 1.578 203 HD11 LEU 25 HD11 LEU 25 5.835 1.979 4.252 204 HD12 LEU 25 HD12 LEU 25 4.969 1.438 2.813 205 HD13 LEU 25 HD13 LEU 25 4.548 2.973 3.581 206 HD21 LEU 25 HD21 LEU 25 7.353 3.914 4.134 207 HD22 LEU 25 HD22 LEU 25 6.064 4.889 3.437 208 HD23 LEU 25 HD23 LEU 25 7.609 4.741 2.602 209 HA PRO 26 HA PRO 26 12.433 0.601 2.205 210 HB2 PRO 26 HB2 PRO 26 12.870 0.556 4.911 211 HB3 PRO 26 HB1 PRO 26 13.505 1.805 3.836 212 HG2 PRO 26 HG2 PRO 26 11.142 1.879 5.650 213 HG3 PRO 26 HG1 PRO 26 12.293 3.165 5.263 214 HD2 PRO 26 HD2 PRO 26 9.792 3.013 4.186 215 HD3 PRO 26 HD1 PRO 26 11.165 3.765 3.350 216 H GLY 27 HN GLY 27 12.821 -1.549 2.942 217 HA2 GLY 27 HA2 GLY 27 10.708 -3.222 2.565 218 HA3 GLY 27 HA1 GLY 27 12.188 -3.707 3.363 219 H GLU 28 HN GLU 28 12.019 -2.367 5.773 220 HA GLU 28 HA GLU 28 10.253 -4.148 7.105 221 HB2 GLU 28 HB2 GLU 28 11.202 -3.303 9.133 222 HB3 GLU 28 HB1 GLU 28 12.442 -3.451 7.920 223 HG2 GLU 28 HG2 GLU 28 13.084 -1.494 8.641 224 HG3 GLU 28 HG1 GLU 28 11.840 -0.920 7.551 225 H LYS 29 HN LYS 29 10.137 -0.749 6.372 226 HA LYS 29 HA LYS 29 7.755 -0.181 7.870 227 HB2 LYS 29 HB2 LYS 29 9.417 1.233 5.895 228 HB3 LYS 29 HB1 LYS 29 7.722 1.665 5.854 229 HG2 LYS 29 HG2 LYS 29 9.002 3.193 7.235 230 HG3 LYS 29 HG1 LYS 29 7.816 2.317 8.196 231 HD2 LYS 29 HD2 LYS 29 9.370 1.261 9.404 232 HD3 LYS 29 HD1 LYS 29 10.476 1.083 8.032 233 HE2 LYS 29 HE2 LYS 29 11.432 2.540 9.717 234 HE3 LYS 29 HE1 LYS 29 11.081 3.460 8.255 235 HZ1 LYS 29 HZ1 LYS 29 10.382 4.702 10.161 236 HZ2 LYS 29 HZ2 LYS 29 9.492 3.400 10.762 237 HZ3 LYS 29 HZ3 LYS 29 8.993 4.181 9.349 238 H LEU 30 HN LEU 30 8.452 -1.463 4.724 239 HA LEU 30 HA LEU 30 5.761 -1.062 3.792 240 HB2 LEU 30 HB2 LEU 30 6.866 -1.022 1.900 241 HB3 LEU 30 HB1 LEU 30 8.302 -1.699 2.629 242 HG LEU 30 HG LEU 30 6.043 -3.377 1.587 243 HD11 LEU 30 HD11 LEU 30 8.468 -2.328 0.277 244 HD12 LEU 30 HD12 LEU 30 6.807 -2.185 -0.269 245 HD13 LEU 30 HD13 LEU 30 7.632 -3.745 -0.320 246 HD21 LEU 30 HD21 LEU 30 8.862 -3.983 2.334 247 HD22 LEU 30 HD22 LEU 30 7.814 -5.108 1.487 248 HD23 LEU 30 HD23 LEU 30 7.418 -4.589 3.127 249 H GLY 31 HN GLY 31 7.348 -3.396 5.671 250 HA2 GLY 31 HA2 GLY 31 5.658 -5.618 5.170 251 HA3 GLY 31 HA1 GLY 31 6.479 -5.286 6.685 252 H ARG 32 HN ARG 32 5.109 -2.546 6.668 253 HA ARG 32 HA ARG 32 2.769 -3.322 8.106 254 HB2 ARG 32 HB2 ARG 32 3.948 -1.259 8.679 255 HB3 ARG 32 HB1 ARG 32 3.549 -0.585 7.108 256 HG2 ARG 32 HG2 ARG 32 1.672 0.217 7.966 257 HG3 ARG 32 HG1 ARG 32 1.130 -1.437 8.251 258 HD2 ARG 32 HD2 ARG 32 2.844 0.140 10.159 259 HD3 ARG 32 HD1 ARG 32 1.092 -0.011 10.284 260 HE ARG 32 HE ARG 32 2.826 -2.392 10.347 261 HH11 ARG 32 HH11 ARG 32 0.411 -0.339 11.838 262 HH12 ARG 32 HH12 ARG 32 0.085 -1.447 13.131 263 HH21 ARG 32 HH21 ARG 32 2.398 -3.857 12.053 264 HH22 ARG 32 HH22 ARG 32 1.206 -3.449 13.249 265 H VAL 33 HN VAL 33 3.307 -1.986 4.832 266 HA VAL 33 HA VAL 33 0.555 -1.679 4.272 267 HB VAL 33 HB VAL 33 1.643 -2.338 1.807 268 HG11 VAL 33 HG11 VAL 33 1.208 0.253 3.257 269 HG12 VAL 33 HG12 VAL 33 0.171 -0.527 2.062 270 HG13 VAL 33 HG13 VAL 33 1.696 0.193 1.568 271 HG21 VAL 33 HG21 VAL 33 3.607 -0.515 3.128 272 HG22 VAL 33 HG22 VAL 33 3.731 -1.338 1.568 273 HG23 VAL 33 HG23 VAL 33 3.884 -2.257 3.068 274 H VAL 34 HN VAL 34 2.759 -4.347 3.506 275 HA VAL 34 HA VAL 34 0.951 -6.248 2.641 276 HB VAL 34 HB VAL 34 2.602 -7.756 2.915 277 HG11 VAL 34 HG11 VAL 34 3.897 -5.863 2.220 278 HG12 VAL 34 HG12 VAL 34 4.843 -6.900 3.286 279 HG13 VAL 34 HG13 VAL 34 4.152 -5.397 3.899 280 HG21 VAL 34 HG21 VAL 34 2.017 -8.168 5.252 281 HG22 VAL 34 HG22 VAL 34 3.106 -6.863 5.736 282 HG23 VAL 34 HG23 VAL 34 3.754 -8.309 4.959 283 H HIS 35 HN HIS 35 1.596 -5.202 5.961 284 HA HIS 35 HA HIS 35 0.009 -7.171 7.231 285 HB2 HIS 35 HB2 HIS 35 1.841 -5.892 8.326 286 HB3 HIS 35 HB1 HIS 35 0.842 -4.448 8.250 287 HD1 HIS 35 HD1 HIS 35 1.372 -7.571 10.164 288 HD2 HIS 35 HD2 HIS 35 -1.325 -4.407 10.076 289 HE1 HIS 35 HE1 HIS 35 0.087 -7.722 12.318 290 HE2 HIS 35 HE2 HIS 35 -1.630 -5.883 12.184 291 H ILE 36 HN ILE 36 -0.573 -3.760 6.453 292 HA ILE 36 HA ILE 36 -3.221 -3.600 7.378 293 HB ILE 36 HB ILE 36 -1.920 -2.103 5.088 294 HG12 ILE 36 HG12 ILE 36 -2.339 -1.171 7.924 295 HG13 ILE 36 HG11 ILE 36 -0.869 -1.983 7.415 296 HG21 ILE 36 HG21 ILE 36 -3.746 -0.723 4.957 297 HG22 ILE 36 HG22 ILE 36 -4.160 -0.959 6.658 298 HG23 ILE 36 HG23 ILE 36 -4.551 -2.206 5.478 299 HD11 ILE 36 HD11 ILE 36 -0.638 -0.161 5.689 300 HD12 ILE 36 HD12 ILE 36 -0.417 0.317 7.367 301 HD13 ILE 36 HD13 ILE 36 -1.925 0.674 6.542 302 H ILE 37 HN ILE 37 -1.866 -4.375 4.237 303 HA ILE 37 HA ILE 37 -4.269 -4.728 2.849 304 HB ILE 37 HB ILE 37 -1.460 -5.605 2.423 305 HG12 ILE 37 HG12 ILE 37 -3.185 -3.939 0.634 306 HG13 ILE 37 HG11 ILE 37 -2.398 -3.252 2.040 307 HG21 ILE 37 HG21 ILE 37 -3.813 -6.791 1.243 308 HG22 ILE 37 HG22 ILE 37 -2.127 -7.319 1.177 309 HG23 ILE 37 HG23 ILE 37 -2.719 -6.115 0.034 310 HD11 ILE 37 HD11 ILE 37 -1.032 -2.812 0.188 311 HD12 ILE 37 HD12 ILE 37 -1.101 -4.501 -0.335 312 HD13 ILE 37 HD13 ILE 37 -0.238 -4.069 1.141 313 H GLN 38 HN GLN 38 -2.091 -7.323 4.065 314 HA GLN 38 HA GLN 38 -3.777 -9.463 3.592 315 HB2 GLN 38 HB2 GLN 38 -1.820 -9.099 5.872 316 HB3 GLN 38 HB1 GLN 38 -2.581 -10.628 5.462 317 HG2 GLN 38 HG2 GLN 38 -1.485 -10.585 3.279 318 HG3 GLN 38 HG1 GLN 38 -0.768 -9.035 3.687 319 HE21 GLN 38 HE21 GLN 38 -1.169 -11.640 5.981 320 HE22 GLN 38 HE22 GLN 38 0.512 -12.007 6.147 321 H SER 39 HN SER 39 -3.895 -7.201 6.308 322 HA SER 39 HA SER 39 -5.725 -8.829 7.821 323 HB2 SER 39 HB2 SER 39 -5.866 -6.863 9.330 324 HB3 SER 39 HB1 SER 39 -4.210 -7.339 8.997 325 HG SER 39 HG SER 39 -3.903 -5.599 7.780 326 H ARG 40 HN ARG 40 -5.991 -5.822 5.944 327 HA ARG 40 HA ARG 40 -8.834 -5.687 6.274 328 HB2 ARG 40 HB2 ARG 40 -6.959 -4.162 4.455 329 HB3 ARG 40 HB1 ARG 40 -8.675 -3.809 4.627 330 HG2 ARG 40 HG2 ARG 40 -8.365 -3.360 6.952 331 HG3 ARG 40 HG1 ARG 40 -6.665 -3.790 6.861 332 HD2 ARG 40 HD2 ARG 40 -6.453 -1.550 6.685 333 HD3 ARG 40 HD1 ARG 40 -6.756 -1.897 4.984 334 HE ARG 40 HE ARG 40 -9.193 -1.451 5.622 335 HH11 ARG 40 HH11 ARG 40 -6.449 0.152 7.109 336 HH12 ARG 40 HH12 ARG 40 -7.368 1.532 7.618 337 HH21 ARG 40 HH21 ARG 40 -10.417 0.344 6.367 338 HH22 ARG 40 HH22 ARG 40 -9.615 1.639 7.202 339 H GLU 41 HN GLU 41 -6.677 -7.157 4.060 340 HA GLU 41 HA GLU 41 -8.936 -8.066 2.397 341 HB2 GLU 41 HB2 GLU 41 -6.008 -8.293 1.709 342 HB3 GLU 41 HB1 GLU 41 -7.391 -8.455 0.636 343 HG2 GLU 41 HG2 GLU 41 -6.602 -5.897 1.984 344 HG3 GLU 41 HG1 GLU 41 -6.073 -6.380 0.369 345 HA PRO 42 HA PRO 42 -7.338 -11.502 5.123 346 HB2 PRO 42 HB2 PRO 42 -10.141 -12.398 5.169 347 HB3 PRO 42 HB1 PRO 42 -9.059 -12.035 6.515 348 HG2 PRO 42 HG2 PRO 42 -11.130 -10.438 5.879 349 HG3 PRO 42 HG1 PRO 42 -9.611 -9.798 6.533 350 HD2 PRO 42 HD2 PRO 42 -10.588 -9.843 3.701 351 HD3 PRO 42 HD1 PRO 42 -9.741 -8.553 4.582 352 H SER 43 HN SER 43 -8.916 -11.324 2.157 353 HA SER 43 HA SER 43 -9.077 -14.108 1.549 354 HB2 SER 43 HB2 SER 43 -9.249 -13.125 -0.848 355 HB3 SER 43 HB1 SER 43 -10.538 -12.769 0.301 356 HG SER 43 HG SER 43 -8.718 -11.084 -0.880 357 H LEU 44 HN LEU 44 -6.526 -11.854 1.709 358 HA LEU 44 HA LEU 44 -4.821 -13.731 0.227 359 HB2 LEU 44 HB2 LEU 44 -3.357 -11.838 -0.343 360 HB3 LEU 44 HB1 LEU 44 -4.957 -11.672 -1.001 361 HG LEU 44 HG LEU 44 -5.249 -10.212 1.223 362 HD11 LEU 44 HD11 LEU 44 -3.187 -8.822 1.374 363 HD12 LEU 44 HD12 LEU 44 -2.350 -10.058 0.443 364 HD13 LEU 44 HD13 LEU 44 -3.025 -10.450 2.024 365 HD21 LEU 44 HD21 LEU 44 -5.809 -9.473 -0.994 366 HD22 LEU 44 HD22 LEU 44 -4.106 -9.364 -1.434 367 HD23 LEU 44 HD23 LEU 44 -4.780 -8.260 -0.236 368 H LYS 45 HN LYS 45 -5.596 -13.613 3.098 369 HA LYS 45 HA LYS 45 -3.262 -12.816 4.557 370 HB2 LYS 45 HB2 LYS 45 -4.301 -13.684 6.482 371 HB3 LYS 45 HB1 LYS 45 -5.584 -12.980 5.521 372 HG2 LYS 45 HG2 LYS 45 -6.293 -15.160 4.786 373 HG3 LYS 45 HG1 LYS 45 -4.923 -15.912 5.608 374 HD2 LYS 45 HD2 LYS 45 -6.986 -14.295 7.078 375 HD3 LYS 45 HD1 LYS 45 -7.166 -16.026 6.788 376 HE2 LYS 45 HE2 LYS 45 -6.184 -15.961 8.889 377 HE3 LYS 45 HE1 LYS 45 -4.815 -16.212 7.808 378 HZ1 LYS 45 HZ1 LYS 45 -5.622 -13.536 8.804 379 HZ2 LYS 45 HZ2 LYS 45 -4.182 -13.956 8.019 380 HZ3 LYS 45 HZ3 LYS 45 -4.478 -14.509 9.583 381 H ASN 46 HN ASN 46 -4.067 -15.535 2.672 382 HA ASN 46 HA ASN 46 -2.349 -17.433 3.939 383 HB2 ASN 46 HB2 ASN 46 -4.217 -18.069 2.431 384 HB3 ASN 46 HB1 ASN 46 -3.351 -17.350 1.080 385 HD21 ASN 46 HD21 ASN 46 -1.662 -18.439 0.155 386 HD22 ASN 46 HD22 ASN 46 -1.252 -20.076 0.567 387 H SER 47 HN SER 47 -1.867 -14.721 1.967 388 HA SER 47 HA SER 47 0.566 -15.483 0.699 389 HB2 SER 47 HB2 SER 47 -0.658 -12.778 1.251 390 HB3 SER 47 HB1 SER 47 0.781 -13.020 0.256 391 HG SER 47 HG SER 47 -1.244 -14.672 -0.499 392 H ASN 48 HN ASN 48 2.675 -14.973 1.241 393 HA ASN 48 HA ASN 48 3.266 -14.835 4.047 394 HB2 ASN 48 HB2 ASN 48 5.164 -14.534 1.720 395 HB3 ASN 48 HB1 ASN 48 5.600 -14.925 3.371 396 HD21 ASN 48 HD21 ASN 48 5.365 -17.019 4.098 397 HD22 ASN 48 HD22 ASN 48 5.003 -18.336 3.035 398 HA PRO 49 HA PRO 49 3.230 -10.435 4.423 399 HB2 PRO 49 HB2 PRO 49 4.935 -10.244 6.573 400 HB3 PRO 49 HB1 PRO 49 3.217 -10.626 6.688 401 HG2 PRO 49 HG2 PRO 49 5.572 -12.448 6.758 402 HG3 PRO 49 HG1 PRO 49 4.071 -12.508 7.699 403 HD2 PRO 49 HD2 PRO 49 4.503 -14.129 5.593 404 HD3 PRO 49 HD1 PRO 49 2.887 -13.507 5.987 405 H ASP 50 HN ASP 50 6.123 -12.249 3.924 406 HA ASP 50 HA ASP 50 7.611 -9.787 3.342 407 HB2 ASP 50 HB2 ASP 50 8.571 -12.603 3.858 408 HB3 ASP 50 HB1 ASP 50 9.625 -11.292 3.336 409 H GLU 51 HN GLU 51 5.646 -11.703 1.703 410 HA GLU 51 HA GLU 51 7.126 -11.322 -0.785 411 HB2 GLU 51 HB2 GLU 51 5.960 -13.861 0.279 412 HB3 GLU 51 HB1 GLU 51 5.989 -13.573 -1.437 413 HG2 GLU 51 HG2 GLU 51 8.389 -13.403 -1.417 414 HG3 GLU 51 HG1 GLU 51 8.410 -13.531 0.338 415 H ILE 52 HN ILE 52 4.962 -9.905 0.571 416 HA ILE 52 HA ILE 52 2.448 -10.709 -0.403 417 HB ILE 52 HB ILE 52 3.100 -9.048 1.542 418 HG12 ILE 52 HG12 ILE 52 0.778 -8.266 1.532 419 HG13 ILE 52 HG11 ILE 52 0.611 -8.741 -0.147 420 HG21 ILE 52 HG21 ILE 52 2.474 -7.197 -0.740 421 HG22 ILE 52 HG22 ILE 52 4.038 -7.341 0.061 422 HG23 ILE 52 HG23 ILE 52 2.641 -6.733 0.950 423 HD11 ILE 52 HD11 ILE 52 1.203 -10.596 2.107 424 HD12 ILE 52 HD12 ILE 52 0.847 -11.040 0.441 425 HD13 ILE 52 HD13 ILE 52 -0.399 -10.304 1.445 426 H GLU 53 HN GLU 53 1.106 -9.772 -1.888 427 HA GLU 53 HA GLU 53 2.477 -8.300 -4.046 428 HB2 GLU 53 HB2 GLU 53 1.979 -10.802 -4.470 429 HB3 GLU 53 HB1 GLU 53 0.287 -10.344 -4.481 430 HG2 GLU 53 HG2 GLU 53 2.285 -9.101 -6.338 431 HG3 GLU 53 HG1 GLU 53 1.482 -10.620 -6.699 432 H ILE 54 HN ILE 54 1.718 -6.313 -3.505 433 HA ILE 54 HA ILE 54 -0.879 -5.789 -2.492 434 HB ILE 54 HB ILE 54 1.102 -3.888 -3.759 435 HG12 ILE 54 HG12 ILE 54 0.829 -4.783 -0.884 436 HG13 ILE 54 HG11 ILE 54 2.209 -5.026 -1.945 437 HG21 ILE 54 HG21 ILE 54 -1.123 -3.350 -1.824 438 HG22 ILE 54 HG22 ILE 54 -1.163 -3.005 -3.550 439 HG23 ILE 54 HG23 ILE 54 -0.017 -2.163 -2.507 440 HD11 ILE 54 HD11 ILE 54 2.696 -3.223 -0.419 441 HD12 ILE 54 HD12 ILE 54 1.206 -2.413 -0.869 442 HD13 ILE 54 HD13 ILE 54 2.507 -2.576 -2.044 443 H ASP 55 HN ASP 55 -2.569 -6.226 -3.828 444 HA ASP 55 HA ASP 55 -2.437 -5.346 -6.629 445 HB2 ASP 55 HB2 ASP 55 -3.086 -7.712 -6.239 446 HB3 ASP 55 HB1 ASP 55 -4.459 -7.161 -5.283 447 H PHE 56 HN PHE 56 -3.100 -3.321 -6.844 448 HA PHE 56 HA PHE 56 -4.601 -2.056 -4.784 449 HB2 PHE 56 HB2 PHE 56 -3.587 -1.034 -7.421 450 HB3 PHE 56 HB1 PHE 56 -4.337 -0.024 -6.191 451 HD1 PHE 56 HD1 PHE 56 -3.257 0.113 -3.946 452 HD2 PHE 56 HD2 PHE 56 -1.296 -1.612 -7.281 453 HE1 PHE 56 HE1 PHE 56 -1.139 0.381 -2.792 454 HE2 PHE 56 HE2 PHE 56 0.866 -1.345 -6.129 455 HZ PHE 56 HZ PHE 56 0.932 -0.338 -3.873 456 H GLU 57 HN GLU 57 -5.598 -3.815 -7.439 457 HA GLU 57 HA GLU 57 -8.022 -2.303 -7.913 458 HB2 GLU 57 HB2 GLU 57 -6.922 -4.881 -8.990 459 HB3 GLU 57 HB1 GLU 57 -8.590 -4.408 -9.297 460 HG2 GLU 57 HG2 GLU 57 -6.150 -2.804 -10.023 461 HG3 GLU 57 HG1 GLU 57 -7.109 -3.789 -11.128 462 H THR 58 HN THR 58 -7.021 -5.220 -6.238 463 HA THR 58 HA THR 58 -9.746 -5.823 -5.461 464 HB THR 58 HB THR 58 -8.605 -7.684 -4.145 465 HG1 THR 58 HG1 THR 58 -6.381 -6.861 -5.746 466 HG21 THR 58 HG21 THR 58 -8.240 -7.532 -7.137 467 HG22 THR 58 HG22 THR 58 -9.682 -8.088 -6.283 468 HG23 THR 58 HG23 THR 58 -8.185 -9.015 -6.181 469 H LEU 59 HN LEU 59 -6.883 -4.344 -4.108 470 HA LEU 59 HA LEU 59 -7.551 -4.284 -1.408 471 HB2 LEU 59 HB2 LEU 59 -6.172 -2.185 -3.043 472 HB3 LEU 59 HB1 LEU 59 -6.240 -2.216 -1.299 473 HG LEU 59 HG LEU 59 -4.924 -4.257 -3.068 474 HD11 LEU 59 HD11 LEU 59 -3.771 -2.347 -1.063 475 HD12 LEU 59 HD12 LEU 59 -3.721 -2.136 -2.813 476 HD13 LEU 59 HD13 LEU 59 -2.890 -3.496 -2.061 477 HD21 LEU 59 HD21 LEU 59 -5.470 -4.203 -0.114 478 HD22 LEU 59 HD22 LEU 59 -4.120 -5.112 -0.808 479 HD23 LEU 59 HD23 LEU 59 -5.771 -5.492 -1.288 480 H LYS 60 HN LYS 60 -9.212 -3.471 -0.397 481 HA LYS 60 HA LYS 60 -11.230 -1.991 -1.716 482 HB2 LYS 60 HB2 LYS 60 -10.717 -2.646 1.177 483 HB3 LYS 60 HB1 LYS 60 -12.136 -1.749 0.653 484 HG2 LYS 60 HG2 LYS 60 -12.906 -3.610 -0.634 485 HG3 LYS 60 HG1 LYS 60 -11.392 -4.467 -0.374 486 HD2 LYS 60 HD2 LYS 60 -13.220 -3.673 1.883 487 HD3 LYS 60 HD1 LYS 60 -13.357 -5.207 1.023 488 HE2 LYS 60 HE2 LYS 60 -10.739 -4.353 2.273 489 HE3 LYS 60 HE1 LYS 60 -11.981 -5.228 3.177 490 HZ1 LYS 60 HZ1 LYS 60 -10.555 -6.142 0.739 491 HZ2 LYS 60 HZ2 LYS 60 -11.854 -6.970 1.441 492 HZ3 LYS 60 HZ3 LYS 60 -10.414 -6.767 2.305 493 HA PRO 61 HA PRO 61 -10.028 2.267 -1.493 494 HB2 PRO 61 HB2 PRO 61 -12.600 2.650 -0.023 495 HB3 PRO 61 HB1 PRO 61 -11.946 3.549 -1.396 496 HG2 PRO 61 HG2 PRO 61 -13.882 1.718 -1.695 497 HG3 PRO 61 HG1 PRO 61 -12.641 2.007 -2.922 498 HD2 PRO 61 HD2 PRO 61 -12.984 -0.295 -1.108 499 HD3 PRO 61 HD1 PRO 61 -12.130 -0.203 -2.657 500 H SER 62 HN SER 62 -11.554 0.873 1.379 501 HA SER 62 HA SER 62 -10.563 2.522 3.355 502 HB2 SER 62 HB2 SER 62 -10.806 -0.478 3.614 503 HB3 SER 62 HB1 SER 62 -11.002 0.739 4.874 504 HG SER 62 HG SER 62 -12.885 1.442 3.860 505 H THR 63 HN THR 63 -9.047 -0.459 2.074 506 HA THR 63 HA THR 63 -6.716 -0.267 3.662 507 HB THR 63 HB THR 63 -6.644 -1.575 0.963 508 HG1 THR 63 HG1 THR 63 -7.931 -3.256 1.684 509 HG21 THR 63 HG21 THR 63 -4.679 -2.179 1.959 510 HG22 THR 63 HG22 THR 63 -5.710 -3.389 2.733 511 HG23 THR 63 HG23 THR 63 -5.319 -1.897 3.582 512 H LEU 64 HN LEU 64 -7.401 0.679 0.308 513 HA LEU 64 HA LEU 64 -4.832 1.505 -0.385 514 HB2 LEU 64 HB2 LEU 64 -7.500 2.514 -1.335 515 HB3 LEU 64 HB1 LEU 64 -5.979 2.895 -2.104 516 HG LEU 64 HG LEU 64 -7.090 0.109 -1.809 517 HD11 LEU 64 HD11 LEU 64 -7.827 2.201 -3.569 518 HD12 LEU 64 HD12 LEU 64 -8.380 0.526 -3.558 519 HD13 LEU 64 HD13 LEU 64 -6.957 0.980 -4.498 520 HD21 LEU 64 HD21 LEU 64 -4.686 1.269 -3.190 521 HD22 LEU 64 HD22 LEU 64 -5.364 -0.302 -3.622 522 HD23 LEU 64 HD23 LEU 64 -4.746 -0.027 -1.993 523 H ARG 65 HN ARG 65 -7.514 3.443 0.972 524 HA ARG 65 HA ARG 65 -6.085 5.872 1.041 525 HB2 ARG 65 HB2 ARG 65 -8.429 4.894 2.657 526 HB3 ARG 65 HB1 ARG 65 -7.770 6.516 2.808 527 HG2 ARG 65 HG2 ARG 65 -8.869 5.338 0.263 528 HG3 ARG 65 HG1 ARG 65 -9.757 6.397 1.353 529 HD2 ARG 65 HD2 ARG 65 -8.188 8.195 0.957 530 HD3 ARG 65 HD1 ARG 65 -7.187 7.146 -0.040 531 HE ARG 65 HE ARG 65 -9.891 7.361 -0.983 532 HH11 ARG 65 HH11 ARG 65 -6.750 8.943 -1.040 533 HH12 ARG 65 HH12 ARG 65 -7.011 9.670 -2.598 534 HH21 ARG 65 HH21 ARG 65 -10.216 8.351 -3.024 535 HH22 ARG 65 HH22 ARG 65 -8.955 9.325 -3.718 536 H GLU 66 HN GLU 66 -6.151 3.114 3.179 537 HA GLU 66 HA GLU 66 -4.767 4.388 5.327 538 HB2 GLU 66 HB2 GLU 66 -6.120 2.422 5.745 539 HB3 GLU 66 HB1 GLU 66 -5.161 1.477 4.613 540 HG2 GLU 66 HG2 GLU 66 -4.552 0.906 6.853 541 HG3 GLU 66 HG1 GLU 66 -3.212 1.750 6.075 542 H LEU 67 HN LEU 67 -3.745 1.994 2.880 543 HA LEU 67 HA LEU 67 -1.041 1.872 3.312 544 HB2 LEU 67 HB2 LEU 67 -2.193 2.075 0.520 545 HB3 LEU 67 HB1 LEU 67 -0.821 1.122 1.073 546 HG LEU 67 HG LEU 67 -3.662 0.571 1.896 547 HD11 LEU 67 HD11 LEU 67 -2.149 -1.184 0.067 548 HD12 LEU 67 HD12 LEU 67 -2.861 0.283 -0.605 549 HD13 LEU 67 HD13 LEU 67 -3.886 -0.911 0.195 550 HD21 LEU 67 HD21 LEU 67 -1.340 -0.194 3.093 551 HD22 LEU 67 HD22 LEU 67 -1.635 -1.527 1.983 552 HD23 LEU 67 HD23 LEU 67 -2.860 -1.082 3.171 553 H GLU 68 HN GLU 68 -2.678 4.219 1.160 554 HA GLU 68 HA GLU 68 -0.428 5.728 0.478 555 HB2 GLU 68 HB2 GLU 68 -2.644 5.922 -0.626 556 HB3 GLU 68 HB1 GLU 68 -3.266 6.715 0.811 557 HG2 GLU 68 HG2 GLU 68 -1.461 8.444 0.473 558 HG3 GLU 68 HG1 GLU 68 -1.217 7.732 -1.122 559 H ARG 69 HN ARG 69 -2.906 6.568 2.909 560 HA ARG 69 HA ARG 69 -1.632 8.798 3.973 561 HB2 ARG 69 HB2 ARG 69 -3.643 6.853 4.973 562 HB3 ARG 69 HB1 ARG 69 -3.004 8.045 6.089 563 HG2 ARG 69 HG2 ARG 69 -3.962 9.032 3.476 564 HG3 ARG 69 HG1 ARG 69 -5.184 8.450 4.607 565 HD2 ARG 69 HD2 ARG 69 -4.839 10.838 4.863 566 HD3 ARG 69 HD1 ARG 69 -4.325 9.975 6.308 567 HE ARG 69 HE ARG 69 -2.212 10.516 4.417 568 HH11 ARG 69 HH11 ARG 69 -4.023 11.696 7.160 569 HH12 ARG 69 HH12 ARG 69 -2.763 12.756 7.705 570 HH21 ARG 69 HH21 ARG 69 -0.534 11.902 5.133 571 HH22 ARG 69 HH22 ARG 69 -0.779 12.881 6.546 572 H TYR 70 HN TYR 70 -1.086 5.423 4.549 573 HA TYR 70 HA TYR 70 0.394 5.720 6.959 574 HB2 TYR 70 HB2 TYR 70 -0.496 3.562 6.525 575 HB3 TYR 70 HB1 TYR 70 0.196 3.529 4.909 576 HD1 TYR 70 HD2 TYR 70 1.411 3.997 8.416 577 HD2 TYR 70 HD1 TYR 70 1.984 2.196 4.613 578 HE1 TYR 70 HE2 TYR 70 3.442 2.901 9.258 579 HE2 TYR 70 HE1 TYR 70 4.005 1.083 5.436 580 HH TYR 70 HH TYR 70 5.552 1.086 7.117 581 H VAL 71 HN VAL 71 1.340 5.248 3.547 582 HA VAL 71 HA VAL 71 4.108 5.413 4.037 583 HB VAL 71 HB VAL 71 4.447 5.704 1.716 584 HG11 VAL 71 HG11 VAL 71 2.778 4.157 0.643 585 HG12 VAL 71 HG12 VAL 71 2.008 4.049 2.228 586 HG13 VAL 71 HG13 VAL 71 3.679 3.523 2.017 587 HG21 VAL 71 HG21 VAL 71 2.791 6.416 0.166 588 HG22 VAL 71 HG22 VAL 71 3.016 7.637 1.412 589 HG23 VAL 71 HG23 VAL 71 1.599 6.582 1.446 590 H THR 72 HN THR 72 1.610 7.845 3.560 591 HA THR 72 HA THR 72 3.345 9.956 2.950 592 HB THR 72 HB THR 72 1.519 11.494 3.445 593 HG1 THR 72 HG1 THR 72 0.449 9.224 4.728 594 HG21 THR 72 HG21 THR 72 1.073 9.012 1.877 595 HG22 THR 72 HG22 THR 72 1.328 10.666 1.310 596 HG23 THR 72 HG23 THR 72 -0.231 10.197 1.994 597 H SER 73 HN SER 73 2.510 8.458 5.929 598 HA SER 73 HA SER 73 3.377 10.568 7.641 599 HB2 SER 73 HB2 SER 73 3.072 9.036 9.422 600 HB3 SER 73 HB1 SER 73 1.850 8.590 8.227 601 HG SER 73 HG SER 73 3.095 6.860 7.601 602 H CYS 74 HN CYS 74 4.914 8.088 5.805 603 HA CYS 74 HA CYS 74 7.483 8.512 7.168 604 HB2 CYS 74 HB2 CYS 74 6.897 6.176 6.823 605 HB3 CYS 74 HB1 CYS 74 6.687 6.462 5.097 606 HG CYS 74 HG CYS 74 9.542 7.325 5.039 607 H LEU 75 HN LEU 75 5.792 9.273 4.262 608 HA LEU 75 HA LEU 75 8.260 9.947 2.855 609 HB2 LEU 75 HB2 LEU 75 5.433 9.793 1.824 610 HB3 LEU 75 HB1 LEU 75 6.866 9.970 0.855 611 HG LEU 75 HG LEU 75 5.987 7.555 2.398 612 HD11 LEU 75 HD11 LEU 75 5.101 8.080 0.078 613 HD12 LEU 75 HD12 LEU 75 5.859 6.505 0.303 614 HD13 LEU 75 HD13 LEU 75 6.743 7.803 -0.493 615 HD21 LEU 75 HD21 LEU 75 8.056 6.486 1.843 616 HD22 LEU 75 HD22 LEU 75 8.426 7.973 2.708 617 HD23 LEU 75 HD23 LEU 75 8.614 7.903 0.955 618 H ARG 76 HN ARG 76 5.053 11.393 3.489 619 HA ARG 76 HA ARG 76 5.926 13.868 2.306 620 HB2 ARG 76 HB2 ARG 76 3.302 13.057 3.518 621 HB3 ARG 76 HB1 ARG 76 3.610 14.635 2.799 622 HG2 ARG 76 HG2 ARG 76 4.179 13.500 0.676 623 HG3 ARG 76 HG1 ARG 76 3.733 11.972 1.433 624 HD2 ARG 76 HD2 ARG 76 1.500 12.866 1.844 625 HD3 ARG 76 HD1 ARG 76 1.932 14.329 0.967 626 HE ARG 76 HE ARG 76 2.406 11.989 -0.589 627 HH11 ARG 76 HH11 ARG 76 -0.161 14.127 0.482 628 HH12 ARG 76 HH12 ARG 76 -1.180 13.785 -0.877 629 HH21 ARG 76 HH21 ARG 76 1.058 11.538 -2.367 630 HH22 ARG 76 HH22 ARG 76 -0.485 12.321 -2.500 631 H LYS 77 HN LYS 77 4.789 12.842 5.514 632 HA LYS 77 HA LYS 77 5.864 15.337 6.627 633 HB2 LYS 77 HB2 LYS 77 3.491 14.302 7.153 634 HB3 LYS 77 HB1 LYS 77 4.416 13.292 8.252 635 HG2 LYS 77 HG2 LYS 77 4.458 16.297 8.307 636 HG3 LYS 77 HG1 LYS 77 3.400 15.304 9.304 637 HD2 LYS 77 HD2 LYS 77 5.324 14.281 10.372 638 HD3 LYS 77 HD1 LYS 77 6.416 15.179 9.316 639 HE2 LYS 77 HE2 LYS 77 4.475 16.452 11.239 640 HE3 LYS 77 HE1 LYS 77 6.174 16.147 11.599 641 HZ1 LYS 77 HZ1 LYS 77 5.235 17.813 9.330 642 HZ2 LYS 77 HZ2 LYS 77 6.825 17.631 9.870 643 HZ3 LYS 77 HZ3 LYS 77 5.695 18.435 10.832 644 H LYS 78 HN LYS 78 8.045 14.814 6.500 645 HA LYS 78 HA LYS 78 9.069 13.177 8.609 646 HB2 LYS 78 HB2 LYS 78 8.455 11.698 6.521 647 HB3 LYS 78 HB1 LYS 78 9.992 12.292 5.917 648 HG2 LYS 78 HG2 LYS 78 10.291 10.151 6.992 649 HG3 LYS 78 HG1 LYS 78 11.094 11.413 7.934 650 HD2 LYS 78 HD2 LYS 78 9.280 11.465 9.512 651 HD3 LYS 78 HD1 LYS 78 8.328 10.364 8.519 652 HE2 LYS 78 HE2 LYS 78 9.923 8.585 8.918 653 HE3 LYS 78 HE1 LYS 78 10.953 9.684 9.833 654 HZ1 LYS 78 HZ1 LYS 78 9.547 8.252 11.239 655 HZ2 LYS 78 HZ2 LYS 78 8.169 8.986 10.589 656 HZ3 LYS 78 HZ3 LYS 78 9.266 9.901 11.494 657 H ARG 79 HN ARG 79 11.315 13.446 8.929 658 HA ARG 79 HA ARG 79 12.658 15.373 7.174 659 HB2 ARG 79 HB2 ARG 79 13.714 16.281 9.345 660 HB3 ARG 79 HB1 ARG 79 12.107 16.816 8.896 661 HG2 ARG 79 HG2 ARG 79 11.866 16.409 11.145 662 HG3 ARG 79 HG1 ARG 79 11.304 14.896 10.440 663 HD2 ARG 79 HD2 ARG 79 13.593 13.965 10.806 664 HD3 ARG 79 HD1 ARG 79 14.000 15.449 11.667 665 HE ARG 79 HE ARG 79 11.742 14.549 12.905 666 HH11 ARG 79 HH11 ARG 79 14.891 13.179 12.236 667 HH12 ARG 79 HH12 ARG 79 14.874 12.142 13.628 668 HH21 ARG 79 HH21 ARG 79 11.708 13.175 14.727 669 HH22 ARG 79 HH22 ARG 79 13.056 12.124 15.033 670 H LYS 80 HN LYS 80 13.122 12.950 6.638 671 HA LYS 80 HA LYS 80 14.704 11.362 6.352 672 HB2 LYS 80 HB2 LYS 80 16.435 13.075 6.622 673 HB3 LYS 80 HB1 LYS 80 16.338 12.919 8.369 674 HG2 LYS 80 HG2 LYS 80 16.996 10.505 6.758 675 HG3 LYS 80 HG1 LYS 80 18.234 11.737 6.992 676 HD2 LYS 80 HD2 LYS 80 17.949 11.553 9.422 677 HD3 LYS 80 HD1 LYS 80 16.717 10.314 9.180 678 HE2 LYS 80 HE2 LYS 80 19.589 10.108 8.287 679 HE3 LYS 80 HE1 LYS 80 18.927 9.375 9.747 680 HZ1 LYS 80 HZ1 LYS 80 17.456 8.045 8.393 681 HZ2 LYS 80 HZ2 LYS 80 19.060 7.802 7.910 682 HZ3 LYS 80 HZ3 LYS 80 18.037 8.774 6.979 683 HA PRO 81 HA PRO 81 12.969 8.947 9.661 684 HB2 PRO 81 HB2 PRO 81 13.141 6.556 8.429 685 HB3 PRO 81 HB1 PRO 81 11.930 7.760 7.974 686 HG2 PRO 81 HG2 PRO 81 14.526 7.088 6.653 687 HG3 PRO 81 HG1 PRO 81 12.954 7.449 5.917 688 HD2 PRO 81 HD2 PRO 81 14.994 9.264 6.123 689 HD3 PRO 81 HD1 PRO 81 13.280 9.711 6.046 690 H GLN 82 HN GLN 82 13.820 7.963 11.366 691 HA GLN 82 HA GLN 82 16.238 6.375 11.148 692 HB2 GLN 82 HB2 GLN 82 17.129 8.624 11.494 693 HB3 GLN 82 HB1 GLN 82 16.087 8.844 12.892 694 HG2 GLN 82 HG2 GLN 82 17.278 7.163 14.116 695 HG3 GLN 82 HG1 GLN 82 18.234 6.750 12.693 696 HE21 GLN 82 HE21 GLN 82 19.872 8.102 12.032 697 HE22 GLN 82 HE22 GLN 82 20.502 9.360 13.039 698 H ALA 83 HN ALA 83 16.234 4.737 12.594 699 HA ALA 83 HA ALA 83 14.502 4.874 14.934 700 HB1 ALA 83 HB1 ALA 83 13.385 2.769 14.391 701 HB2 ALA 83 HB2 ALA 83 14.222 2.718 12.841 702 HB3 ALA 83 HB3 ALA 83 13.052 3.997 13.169 703 H1 VAL 201 HT1 VAL 201 -5.384 1.461 -15.663 704 H2 VAL 201 HT2 VAL 201 -6.272 1.361 -14.228 705 H3 VAL 201 HT3 VAL 201 -6.768 0.494 -15.589 706 HA VAL 201 HA VAL 201 -5.692 -0.904 -13.921 707 HB VAL 201 HB VAL 201 -4.097 -2.034 -15.424 708 HG11 VAL 201 HG11 VAL 201 -6.472 -2.453 -15.699 709 HG12 VAL 201 HG12 VAL 201 -5.657 -2.491 -17.260 710 HG13 VAL 201 HG13 VAL 201 -6.607 -1.080 -16.795 711 HG21 VAL 201 HG21 VAL 201 -4.534 0.310 -17.272 712 HG22 VAL 201 HG22 VAL 201 -3.615 -1.149 -17.639 713 HG23 VAL 201 HG23 VAL 201 -3.045 -0.037 -16.394 714 H VAL 202 HN VAL 202 -4.016 -1.301 -12.571 715 HA VAL 202 HA VAL 202 -1.769 0.599 -12.617 716 HB VAL 202 HB VAL 202 -3.359 -0.288 -10.201 717 HG11 VAL 202 HG11 VAL 202 -1.772 1.010 -8.854 718 HG12 VAL 202 HG12 VAL 202 -0.793 1.303 -10.292 719 HG13 VAL 202 HG13 VAL 202 -0.976 -0.337 -9.668 720 HG21 VAL 202 HG21 VAL 202 -2.773 2.472 -11.263 721 HG22 VAL 202 HG22 VAL 202 -3.795 2.065 -9.885 722 HG23 VAL 202 HG23 VAL 202 -4.283 1.595 -11.513 723 HA PRO 203 HA PRO 203 0.721 -3.139 -12.767 724 HB2 PRO 203 HB2 PRO 203 2.597 -1.194 -11.501 725 HB3 PRO 203 HB1 PRO 203 2.871 -2.306 -12.844 726 HG2 PRO 203 HG2 PRO 203 2.485 0.312 -13.248 727 HG3 PRO 203 HG1 PRO 203 1.879 -0.907 -14.382 728 HD2 PRO 203 HD2 PRO 203 0.397 0.774 -12.448 729 HD3 PRO 203 HD1 PRO 203 -0.151 0.036 -13.967 730 H LYS 204 HN LYS 204 -0.119 -4.448 -11.221 731 HA LYS 204 HA LYS 204 -0.269 -3.945 -8.484 732 HB2 LYS 204 HB2 LYS 204 -0.273 -6.563 -8.407 733 HB3 LYS 204 HB1 LYS 204 -1.611 -5.695 -9.145 734 HG2 LYS 204 HG2 LYS 204 -0.665 -6.093 -11.352 735 HG3 LYS 204 HG1 LYS 204 0.699 -6.938 -10.623 736 HD2 LYS 204 HD2 LYS 204 -0.860 -8.593 -9.681 737 HD3 LYS 204 HD1 LYS 204 -2.201 -7.753 -10.463 738 HE2 LYS 204 HE2 LYS 204 0.140 -9.055 -11.849 739 HE3 LYS 204 HE1 LYS 204 -1.502 -9.692 -11.762 740 HZ1 LYS 204 HZ1 LYS 204 -1.154 -8.621 -13.868 741 HZ2 LYS 204 HZ2 LYS 204 -0.650 -7.193 -13.122 742 HZ3 LYS 204 HZ3 LYS 204 -2.254 -7.703 -12.970 743 H LYS 205 HN LYS 205 1.026 -4.483 -6.747 744 HA LYS 205 HA LYS 205 3.838 -4.206 -7.459 745 HB2 LYS 205 HB2 LYS 205 2.093 -3.246 -5.351 746 HB3 LYS 205 HB1 LYS 205 3.585 -3.910 -4.703 747 HG2 LYS 205 HG2 LYS 205 3.525 -1.861 -6.899 748 HG3 LYS 205 HG1 LYS 205 3.582 -1.442 -5.186 749 HD2 LYS 205 HD2 LYS 205 5.654 -2.748 -4.956 750 HD3 LYS 205 HD1 LYS 205 5.603 -3.109 -6.681 751 HE2 LYS 205 HE2 LYS 205 5.698 -0.318 -5.559 752 HE3 LYS 205 HE1 LYS 205 7.134 -1.231 -6.019 753 HZ1 LYS 205 HZ1 LYS 205 6.234 -1.390 -8.273 754 HZ2 LYS 205 HZ2 LYS 205 6.462 0.217 -7.800 755 HZ3 LYS 205 HZ3 LYS 205 4.909 -0.444 -7.815 756 H LYS 206 HN LYS 206 4.810 -6.136 -7.722 757 HA LYS 206 HA LYS 206 4.444 -8.322 -5.884 758 HB2 LYS 206 HB2 LYS 206 6.659 -7.894 -7.904 759 HB3 LYS 206 HB1 LYS 206 6.254 -9.406 -7.105 760 HG2 LYS 206 HG2 LYS 206 4.097 -9.432 -8.234 761 HG3 LYS 206 HG1 LYS 206 4.495 -7.911 -9.032 762 HD2 LYS 206 HD2 LYS 206 6.504 -9.078 -10.005 763 HD3 LYS 206 HD1 LYS 206 5.830 -10.586 -9.381 764 HE2 LYS 206 HE2 LYS 206 4.542 -8.718 -11.366 765 HE3 LYS 206 HE1 LYS 206 5.218 -10.309 -11.707 766 HZ1 LYS 206 HZ1 LYS 206 3.525 -11.297 -10.306 767 HZ2 LYS 206 HZ2 LYS 206 2.807 -10.369 -11.522 768 HZ3 LYS 206 HZ3 LYS 206 2.890 -9.772 -9.943 769 H ILE 207 HN ILE 207 5.084 -7.969 -3.845 770 HA ILE 207 HA ILE 207 7.429 -6.295 -3.345 771 HB ILE 207 HB ILE 207 5.330 -7.368 -1.459 772 HG12 ILE 207 HG12 ILE 207 4.545 -5.696 -3.152 773 HG13 ILE 207 HG11 ILE 207 4.370 -5.174 -1.482 774 HG21 ILE 207 HG21 ILE 207 6.279 -5.541 0.053 775 HG22 ILE 207 HG22 ILE 207 7.687 -5.576 -1.013 776 HG23 ILE 207 HG23 ILE 207 7.215 -7.027 -0.130 777 HD11 ILE 207 HD11 ILE 207 6.321 -3.759 -1.698 778 HD12 ILE 207 HD12 ILE 207 5.144 -3.385 -2.957 779 HD13 ILE 207 HD13 ILE 207 6.578 -4.335 -3.345 780 H LYS 208 HN LYS 208 9.277 -7.040 -2.458 781 HA LYS 208 HA LYS 208 9.329 -9.755 -1.364 782 HB2 LYS 208 HB2 LYS 208 10.113 -9.815 -3.726 783 HB3 LYS 208 HB1 LYS 208 11.385 -8.679 -3.305 784 HG2 LYS 208 HG2 LYS 208 12.334 -10.856 -3.361 785 HG3 LYS 208 HG1 LYS 208 12.241 -10.355 -1.672 786 HD2 LYS 208 HD2 LYS 208 10.232 -11.689 -1.364 787 HD3 LYS 208 HD1 LYS 208 10.255 -12.148 -3.068 788 HE2 LYS 208 HE2 LYS 208 12.370 -12.806 -1.020 789 HE3 LYS 208 HE1 LYS 208 11.165 -13.923 -1.657 790 HZ1 LYS 208 HZ1 LYS 208 12.135 -13.641 -3.857 791 HZ2 LYS 208 HZ2 LYS 208 13.284 -14.207 -2.760 792 HZ3 LYS 208 HZ3 LYS 208 13.300 -12.588 -3.234 793 H LYS 209 HN LYS 209 11.928 -7.435 -2.064 794 HA LYS 209 HA LYS 209 12.191 -6.876 0.797 795 HB2 LYS 209 HB2 LYS 209 14.414 -7.927 -0.962 796 HB3 LYS 209 HB1 LYS 209 14.671 -7.212 0.621 797 HG2 LYS 209 HG2 LYS 209 13.420 -8.978 1.674 798 HG3 LYS 209 HG1 LYS 209 12.992 -9.657 0.104 799 HD2 LYS 209 HD2 LYS 209 14.801 -10.931 1.086 800 HD3 LYS 209 HD1 LYS 209 15.385 -10.067 -0.337 801 HE2 LYS 209 HE2 LYS 209 16.312 -8.324 1.128 802 HE3 LYS 209 HE1 LYS 209 15.761 -9.230 2.536 803 HZ1 LYS 209 HZ1 LYS 209 18.089 -9.644 2.095 804 HZ2 LYS 209 HZ2 LYS 209 17.739 -10.166 0.530 805 HZ3 LYS 209 HZ3 LYS 209 17.198 -11.061 1.857 806 H GLU 210 HN GLU 210 14.324 -6.253 -1.974 807 HA GLU 210 HA GLU 210 14.522 -3.486 -1.130 808 HB2 GLU 210 HB2 GLU 210 15.969 -5.048 -3.272 809 HB3 GLU 210 HB1 GLU 210 16.287 -3.360 -2.900 810 HG2 GLU 210 HG2 GLU 210 16.951 -3.984 -0.634 811 HG3 GLU 210 HG1 GLU 210 16.629 -5.676 -1.008 812 H GLN 211 HN GLN 211 12.103 -3.393 -1.823 813 HA GLN 211 HA GLN 211 11.690 -2.947 -4.642 814 HB2 GLN 211 HB2 GLN 211 9.872 -3.746 -3.129 815 HB3 GLN 211 HB1 GLN 211 9.900 -2.182 -2.323 816 HG2 GLN 211 HG2 GLN 211 8.084 -2.262 -3.904 817 HG3 GLN 211 HG1 GLN 211 9.292 -1.094 -4.442 818 HE21 GLN 211 HE21 GLN 211 10.564 -1.567 -6.227 819 HE22 GLN 211 HE22 GLN 211 10.133 -2.798 -7.361 820 H VAL 212 HN VAL 212 12.328 -1.050 -1.787 821 HA VAL 212 HA VAL 212 11.996 1.508 -3.009 822 HB VAL 212 HB VAL 212 11.835 1.125 -0.555 823 HG11 VAL 212 HG11 VAL 212 13.614 -0.476 -0.251 824 HG12 VAL 212 HG12 VAL 212 13.907 0.934 0.767 825 HG13 VAL 212 HG13 VAL 212 14.817 0.722 -0.728 826 HG21 VAL 212 HG21 VAL 212 13.101 3.123 0.145 827 HG22 VAL 212 HG22 VAL 212 12.193 3.377 -1.345 828 HG23 VAL 212 HG23 VAL 212 13.935 3.113 -1.409 829 H GLU 213 HN GLU 213 13.719 3.002 -3.534 830 HA GLU 213 HA GLU 213 16.066 1.665 -4.627 831 HB2 GLU 213 HB2 GLU 213 15.175 4.543 -4.884 832 HB3 GLU 213 HB1 GLU 213 16.518 3.803 -5.743 833 HG2 GLU 213 HG2 GLU 213 14.940 2.271 -6.842 834 HG3 GLU 213 HG1 GLU 213 13.610 3.088 -6.022 Start of MODEL 13 1 H1 SER 1 HT1 SER 1 -23.068 0.865 6.703 2 H2 SER 1 HT2 SER 1 -24.719 0.767 6.350 3 H3 SER 1 HT3 SER 1 -24.078 2.192 6.995 4 HA SER 1 HA SER 1 -23.393 1.065 4.350 5 HB2 SER 1 HB2 SER 1 -25.728 1.955 4.530 6 HB3 SER 1 HB1 SER 1 -25.051 3.504 5.033 7 HG SER 1 HG SER 1 -24.022 3.654 3.014 8 H GLU 2 HN GLU 2 -22.071 2.423 6.904 9 HA GLU 2 HA GLU 2 -21.141 4.900 5.787 10 HB2 GLU 2 HB2 GLU 2 -20.733 3.521 8.417 11 HB3 GLU 2 HB1 GLU 2 -19.859 4.975 7.987 12 HG2 GLU 2 HG2 GLU 2 -21.691 5.716 9.237 13 HG3 GLU 2 HG1 GLU 2 -22.118 6.035 7.554 14 H GLU 3 HN GLU 3 -19.970 1.661 6.001 15 HA GLU 3 HA GLU 3 -17.199 2.208 5.896 16 HB2 GLU 3 HB2 GLU 3 -18.746 -0.184 4.888 17 HB3 GLU 3 HB1 GLU 3 -16.995 -0.111 5.020 18 HG2 GLU 3 HG2 GLU 3 -18.911 0.187 7.322 19 HG3 GLU 3 HG1 GLU 3 -18.055 -1.294 6.895 20 H GLU 4 HN GLU 4 -19.664 2.568 3.594 21 HA GLU 4 HA GLU 4 -17.880 2.435 1.302 22 HB2 GLU 4 HB2 GLU 4 -20.822 3.120 1.458 23 HB3 GLU 4 HB1 GLU 4 -19.904 2.854 -0.016 24 HG2 GLU 4 HG2 GLU 4 -20.320 0.789 2.129 25 HG3 GLU 4 HG1 GLU 4 -21.298 0.930 0.671 26 H ASP 5 HN ASP 5 -19.342 4.814 3.392 27 HA ASP 5 HA ASP 5 -18.646 6.958 1.530 28 HB2 ASP 5 HB2 ASP 5 -20.908 7.124 2.264 29 HB3 ASP 5 HB1 ASP 5 -20.436 6.950 3.943 30 H LYS 6 HN LYS 6 -17.931 5.725 4.709 31 HA LYS 6 HA LYS 6 -16.456 7.860 5.752 32 HB2 LYS 6 HB2 LYS 6 -17.169 5.832 7.023 33 HB3 LYS 6 HB1 LYS 6 -15.948 4.903 6.169 34 HG2 LYS 6 HG2 LYS 6 -15.137 5.456 8.348 35 HG3 LYS 6 HG1 LYS 6 -14.208 6.357 7.149 36 HD2 LYS 6 HD2 LYS 6 -15.497 8.353 7.603 37 HD3 LYS 6 HD1 LYS 6 -16.539 7.463 8.714 38 HE2 LYS 6 HE2 LYS 6 -14.590 7.020 10.149 39 HE3 LYS 6 HE1 LYS 6 -13.585 7.963 9.050 40 HZ1 LYS 6 HZ1 LYS 6 -14.267 9.289 10.931 41 HZ2 LYS 6 HZ2 LYS 6 -15.898 8.979 10.607 42 HZ3 LYS 6 HZ3 LYS 6 -14.980 9.893 9.520 43 H CYS 7 HN CYS 7 -15.525 5.205 3.651 44 HA CYS 7 HA CYS 7 -12.813 6.283 3.449 45 HB2 CYS 7 HB2 CYS 7 -13.904 3.657 2.415 46 HB3 CYS 7 HB1 CYS 7 -12.208 4.136 2.488 47 HG CYS 7 HG CYS 7 -13.890 2.480 4.682 48 H LYS 8 HN LYS 8 -12.376 7.570 1.790 49 HA LYS 8 HA LYS 8 -14.242 7.879 -0.372 50 HB2 LYS 8 HB2 LYS 8 -11.751 9.253 0.507 51 HB3 LYS 8 HB1 LYS 8 -12.220 9.412 -1.178 52 HG2 LYS 8 HG2 LYS 8 -13.015 11.230 0.354 53 HG3 LYS 8 HG1 LYS 8 -14.249 10.450 -0.633 54 HD2 LYS 8 HD2 LYS 8 -14.974 9.119 1.245 55 HD3 LYS 8 HD1 LYS 8 -13.662 9.747 2.237 56 HE2 LYS 8 HE2 LYS 8 -14.612 11.978 2.121 57 HE3 LYS 8 HE1 LYS 8 -15.886 11.399 1.052 58 HZ1 LYS 8 HZ1 LYS 8 -16.743 11.552 3.258 59 HZ2 LYS 8 HZ2 LYS 8 -15.466 10.644 3.891 60 HZ3 LYS 8 HZ3 LYS 8 -16.603 9.907 2.875 61 HA PRO 9 HA PRO 9 -12.643 4.920 -3.110 62 HB2 PRO 9 HB2 PRO 9 -13.519 6.010 -5.461 63 HB3 PRO 9 HB1 PRO 9 -14.557 5.134 -4.334 64 HG2 PRO 9 HG2 PRO 9 -14.248 8.067 -4.743 65 HG3 PRO 9 HG1 PRO 9 -15.704 7.131 -4.367 66 HD2 PRO 9 HD2 PRO 9 -14.319 8.591 -2.513 67 HD3 PRO 9 HD1 PRO 9 -15.273 7.159 -2.094 68 H MET 10 HN MET 10 -10.759 4.566 -4.163 69 HA MET 10 HA MET 10 -9.068 6.906 -4.633 70 HB2 MET 10 HB2 MET 10 -8.250 5.071 -3.143 71 HB3 MET 10 HB1 MET 10 -8.263 3.996 -4.536 72 HG2 MET 10 HG2 MET 10 -6.083 4.624 -4.562 73 HG3 MET 10 HG1 MET 10 -6.768 5.896 -5.575 74 HE1 MET 10 HE1 MET 10 -5.664 4.805 -2.154 75 HE2 MET 10 HE2 MET 10 -7.015 5.732 -1.513 76 HE3 MET 10 HE3 MET 10 -5.360 6.284 -1.248 77 H SER 11 HN SER 11 -8.631 7.557 -6.666 78 HA SER 11 HA SER 11 -9.784 6.081 -8.861 79 HB2 SER 11 HB2 SER 11 -9.005 8.068 -10.206 80 HB3 SER 11 HB1 SER 11 -10.092 8.455 -8.873 81 HG SER 11 HG SER 11 -8.313 9.122 -7.649 82 H TYR 12 HN TYR 12 -8.361 6.170 -11.032 83 HA TYR 12 HA TYR 12 -6.386 4.218 -10.763 84 HB2 TYR 12 HB2 TYR 12 -7.039 4.169 -12.932 85 HB3 TYR 12 HB1 TYR 12 -7.457 5.880 -12.953 86 HD1 TYR 12 HD1 TYR 12 -4.592 3.536 -13.214 87 HD2 TYR 12 HD2 TYR 12 -6.036 7.437 -14.025 88 HE1 TYR 12 HE1 TYR 12 -2.583 3.979 -14.548 89 HE2 TYR 12 HE2 TYR 12 -4.030 7.905 -15.369 90 HH TYR 12 HH TYR 12 -1.914 5.507 -16.412 91 H GLU 13 HN GLU 13 -6.022 7.714 -11.314 92 HA GLU 13 HA GLU 13 -3.233 7.739 -11.532 93 HB2 GLU 13 HB2 GLU 13 -5.076 9.900 -10.465 94 HB3 GLU 13 HB1 GLU 13 -3.449 10.176 -11.066 95 HG2 GLU 13 HG2 GLU 13 -4.586 10.736 -12.953 96 HG3 GLU 13 HG1 GLU 13 -4.544 8.982 -13.217 97 H GLU 14 HN GLU 14 -5.354 7.729 -8.800 98 HA GLU 14 HA GLU 14 -3.368 8.513 -6.915 99 HB2 GLU 14 HB2 GLU 14 -6.155 7.432 -6.704 100 HB3 GLU 14 HB1 GLU 14 -5.179 7.777 -5.286 101 HG2 GLU 14 HG2 GLU 14 -5.004 10.123 -6.031 102 HG3 GLU 14 HG1 GLU 14 -6.054 9.742 -7.394 103 H LYS 15 HN LYS 15 -5.096 5.475 -7.646 104 HA LYS 15 HA LYS 15 -3.720 3.777 -5.937 105 HB2 LYS 15 HB2 LYS 15 -4.853 3.246 -8.672 106 HB3 LYS 15 HB1 LYS 15 -4.146 1.984 -7.669 107 HG2 LYS 15 HG2 LYS 15 -5.855 2.001 -6.174 108 HG3 LYS 15 HG1 LYS 15 -6.316 3.658 -6.544 109 HD2 LYS 15 HD2 LYS 15 -7.551 3.072 -8.329 110 HD3 LYS 15 HD1 LYS 15 -6.515 1.711 -8.752 111 HE2 LYS 15 HE2 LYS 15 -7.421 0.524 -6.755 112 HE3 LYS 15 HE1 LYS 15 -8.583 1.833 -6.559 113 HZ1 LYS 15 HZ1 LYS 15 -9.593 0.030 -7.759 114 HZ2 LYS 15 HZ2 LYS 15 -8.338 0.003 -8.893 115 HZ3 LYS 15 HZ3 LYS 15 -9.388 1.327 -8.826 116 H ARG 16 HN ARG 16 -2.861 4.870 -9.182 117 HA ARG 16 HA ARG 16 -0.463 3.449 -9.522 118 HB2 ARG 16 HB2 ARG 16 -1.544 4.704 -11.333 119 HB3 ARG 16 HB1 ARG 16 -1.185 6.211 -10.506 120 HG2 ARG 16 HG2 ARG 16 1.249 5.515 -10.656 121 HG3 ARG 16 HG1 ARG 16 0.703 4.317 -11.814 122 HD2 ARG 16 HD2 ARG 16 1.459 6.286 -12.972 123 HD3 ARG 16 HD1 ARG 16 -0.273 6.101 -13.154 124 HE ARG 16 HE ARG 16 0.721 7.889 -11.070 125 HH11 ARG 16 HH11 ARG 16 -0.888 7.483 -14.159 126 HH12 ARG 16 HH12 ARG 16 -1.454 9.120 -14.223 127 HH21 ARG 16 HH21 ARG 16 -0.050 10.043 -11.144 128 HH22 ARG 16 HH22 ARG 16 -0.980 10.575 -12.506 129 H GLN 17 HN GLN 17 -1.040 6.676 -8.197 130 HA GLN 17 HA GLN 17 1.634 7.297 -7.650 131 HB2 GLN 17 HB2 GLN 17 -0.670 8.675 -7.604 132 HB3 GLN 17 HB1 GLN 17 -0.457 8.394 -5.893 133 HG2 GLN 17 HG2 GLN 17 0.504 10.545 -6.652 134 HG3 GLN 17 HG1 GLN 17 1.704 9.479 -5.920 135 HE21 GLN 17 HE21 GLN 17 0.586 10.937 -8.857 136 HE22 GLN 17 HE22 GLN 17 1.977 10.549 -9.813 137 H LEU 18 HN LEU 18 -0.919 5.872 -5.795 138 HA LEU 18 HA LEU 18 0.274 5.505 -3.311 139 HB2 LEU 18 HB2 LEU 18 -2.114 5.024 -4.307 140 HB3 LEU 18 HB1 LEU 18 -1.461 3.431 -4.558 141 HG LEU 18 HG LEU 18 -1.898 4.840 -1.944 142 HD11 LEU 18 HD11 LEU 18 -3.183 2.563 -1.716 143 HD12 LEU 18 HD12 LEU 18 -3.217 2.680 -3.471 144 HD13 LEU 18 HD13 LEU 18 -3.912 3.966 -2.485 145 HD21 LEU 18 HD21 LEU 18 -0.040 3.694 -1.329 146 HD22 LEU 18 HD22 LEU 18 -0.233 2.476 -2.585 147 HD23 LEU 18 HD23 LEU 18 -1.232 2.412 -1.136 148 H SER 19 HN SER 19 0.234 3.303 -6.122 149 HA SER 19 HA SER 19 1.805 1.302 -4.944 150 HB2 SER 19 HB2 SER 19 1.857 0.309 -7.061 151 HB3 SER 19 HB1 SER 19 0.383 1.274 -7.103 152 HG SER 19 HG SER 19 1.810 2.965 -8.069 153 H LEU 20 HN LEU 20 2.594 4.356 -6.242 154 HA LEU 20 HA LEU 20 5.408 3.778 -6.587 155 HB2 LEU 20 HB2 LEU 20 3.806 6.290 -6.912 156 HB3 LEU 20 HB1 LEU 20 5.509 6.163 -7.285 157 HG LEU 20 HG LEU 20 3.233 4.783 -8.662 158 HD11 LEU 20 HD11 LEU 20 3.731 7.135 -9.213 159 HD12 LEU 20 HD12 LEU 20 3.898 6.029 -10.572 160 HD13 LEU 20 HD13 LEU 20 5.333 6.635 -9.740 161 HD21 LEU 20 HD21 LEU 20 4.940 3.166 -8.505 162 HD22 LEU 20 HD22 LEU 20 6.188 4.334 -8.938 163 HD23 LEU 20 HD23 LEU 20 4.997 3.824 -10.138 164 H ASP 21 HN ASP 21 3.287 5.403 -4.286 165 HA ASP 21 HA ASP 21 5.473 6.384 -2.677 166 HB2 ASP 21 HB2 ASP 21 3.797 7.075 -1.065 167 HB3 ASP 21 HB1 ASP 21 3.452 7.655 -2.666 168 H ILE 22 HN ILE 22 3.355 3.561 -2.595 169 HA ILE 22 HA ILE 22 4.454 2.380 -0.298 170 HB ILE 22 HB ILE 22 3.013 1.442 -2.690 171 HG12 ILE 22 HG12 ILE 22 2.753 0.727 0.215 172 HG13 ILE 22 HG11 ILE 22 1.978 2.122 -0.527 173 HG21 ILE 22 HG21 ILE 22 4.515 -0.533 -1.007 174 HG22 ILE 22 HG22 ILE 22 4.866 -0.140 -2.683 175 HG23 ILE 22 HG23 ILE 22 3.341 -0.911 -2.260 176 HD11 ILE 22 HD11 ILE 22 1.525 -0.716 -1.408 177 HD12 ILE 22 HD12 ILE 22 0.636 0.721 -1.904 178 HD13 ILE 22 HD13 ILE 22 0.509 0.138 -0.246 179 H ASN 23 HN ASN 23 5.529 2.534 -3.626 180 HA ASN 23 HA ASN 23 7.695 0.746 -3.406 181 HB2 ASN 23 HB2 ASN 23 6.746 1.425 -5.563 182 HB3 ASN 23 HB1 ASN 23 7.270 3.078 -5.285 183 HD21 ASN 23 HD21 ASN 23 9.389 3.633 -5.661 184 HD22 ASN 23 HD22 ASN 23 10.536 2.558 -6.376 185 H LYS 24 HN LYS 24 7.226 3.937 -2.285 186 HA LYS 24 HA LYS 24 10.006 4.682 -2.161 187 HB2 LYS 24 HB2 LYS 24 7.427 5.887 -1.287 188 HB3 LYS 24 HB1 LYS 24 8.925 6.506 -0.609 189 HG2 LYS 24 HG2 LYS 24 9.710 7.108 -2.811 190 HG3 LYS 24 HG1 LYS 24 8.297 6.356 -3.555 191 HD2 LYS 24 HD2 LYS 24 6.836 7.989 -2.666 192 HD3 LYS 24 HD1 LYS 24 8.060 8.587 -1.548 193 HE2 LYS 24 HE2 LYS 24 8.177 8.832 -4.559 194 HE3 LYS 24 HE1 LYS 24 7.698 10.109 -3.440 195 HZ1 LYS 24 HZ1 LYS 24 10.362 8.803 -3.583 196 HZ2 LYS 24 HZ2 LYS 24 9.914 9.955 -2.434 197 HZ3 LYS 24 HZ3 LYS 24 9.990 10.379 -4.066 198 H LEU 25 HN LEU 25 7.801 2.931 -0.198 199 HA LEU 25 HA LEU 25 8.968 3.509 2.334 200 HB2 LEU 25 HB2 LEU 25 7.160 1.287 1.408 201 HB3 LEU 25 HB1 LEU 25 7.714 1.448 3.062 202 HG LEU 25 HG LEU 25 5.851 3.242 1.541 203 HD11 LEU 25 HD11 LEU 25 5.742 1.900 4.212 204 HD12 LEU 25 HD12 LEU 25 4.955 1.306 2.750 205 HD13 LEU 25 HD13 LEU 25 4.441 2.830 3.480 206 HD21 LEU 25 HD21 LEU 25 7.239 3.842 4.129 207 HD22 LEU 25 HD22 LEU 25 5.931 4.787 3.427 208 HD23 LEU 25 HD23 LEU 25 7.490 4.695 2.610 209 HA PRO 26 HA PRO 26 12.432 0.696 2.164 210 HB2 PRO 26 HB2 PRO 26 13.001 0.682 4.821 211 HB3 PRO 26 HB1 PRO 26 13.465 2.005 3.748 212 HG2 PRO 26 HG2 PRO 26 11.176 1.814 5.659 213 HG3 PRO 26 HG1 PRO 26 12.216 3.203 5.298 214 HD2 PRO 26 HD2 PRO 26 9.702 2.902 4.275 215 HD3 PRO 26 HD1 PRO 26 10.992 3.795 3.442 216 H GLY 27 HN GLY 27 13.002 -1.417 3.051 217 HA2 GLY 27 HA2 GLY 27 10.986 -3.234 2.738 218 HA3 GLY 27 HA1 GLY 27 12.487 -3.592 3.562 219 H GLU 28 HN GLU 28 12.202 -2.049 5.864 220 HA GLU 28 HA GLU 28 10.562 -3.810 7.366 221 HB2 GLU 28 HB2 GLU 28 11.092 -2.109 9.252 222 HB3 GLU 28 HB1 GLU 28 12.354 -3.142 8.615 223 HG2 GLU 28 HG2 GLU 28 11.926 -0.328 7.669 224 HG3 GLU 28 HG1 GLU 28 12.925 -0.735 9.053 225 H LYS 29 HN LYS 29 10.126 -0.474 6.310 226 HA LYS 29 HA LYS 29 7.753 -0.070 7.874 227 HB2 LYS 29 HB2 LYS 29 9.329 1.460 5.905 228 HB3 LYS 29 HB1 LYS 29 7.605 1.837 5.934 229 HG2 LYS 29 HG2 LYS 29 9.047 3.314 7.372 230 HG3 LYS 29 HG1 LYS 29 7.747 2.508 8.247 231 HD2 LYS 29 HD2 LYS 29 9.165 1.385 9.560 232 HD3 LYS 29 HD1 LYS 29 10.225 0.966 8.208 233 HE2 LYS 29 HE2 LYS 29 11.154 3.313 8.352 234 HE3 LYS 29 HE1 LYS 29 10.241 3.512 9.851 235 HZ1 LYS 29 HZ1 LYS 29 12.357 1.504 9.354 236 HZ2 LYS 29 HZ2 LYS 29 11.435 1.609 10.766 237 HZ3 LYS 29 HZ3 LYS 29 12.475 2.870 10.341 238 H LEU 30 HN LEU 30 8.488 -1.300 4.707 239 HA LEU 30 HA LEU 30 5.792 -0.973 3.775 240 HB2 LEU 30 HB2 LEU 30 6.774 -1.037 1.832 241 HB3 LEU 30 HB1 LEU 30 8.303 -1.416 2.575 242 HG LEU 30 HG LEU 30 6.303 -3.427 1.529 243 HD11 LEU 30 HD11 LEU 30 7.867 -1.782 0.103 244 HD12 LEU 30 HD12 LEU 30 7.464 -3.419 -0.407 245 HD13 LEU 30 HD13 LEU 30 9.001 -3.099 0.391 246 HD21 LEU 30 HD21 LEU 30 7.671 -4.297 3.406 247 HD22 LEU 30 HD22 LEU 30 9.126 -3.854 2.516 248 HD23 LEU 30 HD23 LEU 30 8.038 -5.082 1.871 249 H GLY 31 HN GLY 31 7.380 -3.246 5.695 250 HA2 GLY 31 HA2 GLY 31 5.728 -5.509 5.177 251 HA3 GLY 31 HA1 GLY 31 6.570 -5.180 6.680 252 H ARG 32 HN ARG 32 5.168 -2.457 6.717 253 HA ARG 32 HA ARG 32 2.847 -3.234 8.178 254 HB2 ARG 32 HB2 ARG 32 3.935 -1.125 8.689 255 HB3 ARG 32 HB1 ARG 32 3.595 -0.527 7.074 256 HG2 ARG 32 HG2 ARG 32 1.690 0.308 7.837 257 HG3 ARG 32 HG1 ARG 32 1.135 -1.337 8.143 258 HD2 ARG 32 HD2 ARG 32 2.737 0.326 10.074 259 HD3 ARG 32 HD1 ARG 32 0.988 0.105 10.142 260 HE ARG 32 HE ARG 32 2.940 -2.096 10.454 261 HH11 ARG 32 HH11 ARG 32 -0.092 -0.535 11.289 262 HH12 ARG 32 HH12 ARG 32 -0.504 -1.707 12.499 263 HH21 ARG 32 HH21 ARG 32 2.404 -3.627 12.055 264 HH22 ARG 32 HH22 ARG 32 0.914 -3.463 12.934 265 H VAL 33 HN VAL 33 3.286 -1.877 4.899 266 HA VAL 33 HA VAL 33 0.542 -1.655 4.332 267 HB VAL 33 HB VAL 33 1.660 -2.299 1.872 268 HG11 VAL 33 HG11 VAL 33 1.183 0.285 3.314 269 HG12 VAL 33 HG12 VAL 33 0.159 -0.511 2.119 270 HG13 VAL 33 HG13 VAL 33 1.677 0.225 1.628 271 HG21 VAL 33 HG21 VAL 33 3.581 -0.446 3.211 272 HG22 VAL 33 HG22 VAL 33 3.731 -1.267 1.654 273 HG23 VAL 33 HG23 VAL 33 3.888 -2.183 3.154 274 H VAL 34 HN VAL 34 2.788 -4.294 3.572 275 HA VAL 34 HA VAL 34 1.027 -6.211 2.664 276 HB VAL 34 HB VAL 34 2.667 -7.723 2.986 277 HG11 VAL 34 HG11 VAL 34 3.951 -5.857 2.243 278 HG12 VAL 34 HG12 VAL 34 4.904 -6.833 3.359 279 HG13 VAL 34 HG13 VAL 34 4.185 -5.317 3.904 280 HG21 VAL 34 HG21 VAL 34 2.085 -8.113 5.321 281 HG22 VAL 34 HG22 VAL 34 3.140 -6.776 5.795 282 HG23 VAL 34 HG23 VAL 34 3.829 -8.216 5.048 283 H HIS 35 HN HIS 35 1.559 -5.197 6.024 284 HA HIS 35 HA HIS 35 -0.069 -7.239 7.153 285 HB2 HIS 35 HB2 HIS 35 1.700 -6.135 8.444 286 HB3 HIS 35 HB1 HIS 35 0.840 -4.604 8.335 287 HD1 HIS 35 HD1 HIS 35 0.704 -7.956 10.023 288 HD2 HIS 35 HD2 HIS 35 -1.242 -4.284 10.143 289 HE1 HIS 35 HE1 HIS 35 -0.739 -8.027 12.077 290 HE2 HIS 35 HE2 HIS 35 -2.050 -5.877 12.018 291 H ILE 36 HN ILE 36 -0.584 -3.776 6.544 292 HA ILE 36 HA ILE 36 -3.228 -3.577 7.393 293 HB ILE 36 HB ILE 36 -1.917 -2.155 5.060 294 HG12 ILE 36 HG12 ILE 36 -2.297 -1.184 7.891 295 HG13 ILE 36 HG11 ILE 36 -0.830 -1.978 7.348 296 HG21 ILE 36 HG21 ILE 36 -3.719 -0.728 4.933 297 HG22 ILE 36 HG22 ILE 36 -4.149 -0.972 6.629 298 HG23 ILE 36 HG23 ILE 36 -4.539 -2.210 5.438 299 HD11 ILE 36 HD11 ILE 36 -0.640 -0.165 5.626 300 HD12 ILE 36 HD12 ILE 36 -0.437 0.344 7.296 301 HD13 ILE 36 HD13 ILE 36 -1.950 0.650 6.460 302 H ILE 37 HN ILE 37 -1.915 -4.297 4.217 303 HA ILE 37 HA ILE 37 -4.297 -4.734 2.846 304 HB ILE 37 HB ILE 37 -1.479 -5.614 2.446 305 HG12 ILE 37 HG12 ILE 37 -3.171 -3.892 0.674 306 HG13 ILE 37 HG11 ILE 37 -2.390 -3.238 2.104 307 HG21 ILE 37 HG21 ILE 37 -3.809 -6.796 1.262 308 HG22 ILE 37 HG22 ILE 37 -2.114 -7.269 1.117 309 HG23 ILE 37 HG23 ILE 37 -2.784 -6.046 0.040 310 HD11 ILE 37 HD11 ILE 37 -1.012 -2.781 0.255 311 HD12 ILE 37 HD12 ILE 37 -1.075 -4.466 -0.277 312 HD13 ILE 37 HD13 ILE 37 -0.229 -4.042 1.210 313 H GLN 38 HN GLN 38 -2.079 -7.290 4.068 314 HA GLN 38 HA GLN 38 -3.678 -9.480 3.623 315 HB2 GLN 38 HB2 GLN 38 -1.794 -8.944 5.929 316 HB3 GLN 38 HB1 GLN 38 -2.561 -10.502 5.665 317 HG2 GLN 38 HG2 GLN 38 -1.453 -10.687 3.506 318 HG3 GLN 38 HG1 GLN 38 -0.727 -9.106 3.755 319 HE21 GLN 38 HE21 GLN 38 -1.171 -11.492 6.276 320 HE22 GLN 38 HE22 GLN 38 0.508 -11.830 6.513 321 H SER 39 HN SER 39 -3.896 -7.220 6.349 322 HA SER 39 HA SER 39 -5.775 -8.849 7.785 323 HB2 SER 39 HB2 SER 39 -5.893 -6.968 9.345 324 HB3 SER 39 HB1 SER 39 -4.224 -7.322 8.926 325 HG SER 39 HG SER 39 -4.906 -5.573 7.177 326 H ARG 40 HN ARG 40 -5.997 -5.971 5.736 327 HA ARG 40 HA ARG 40 -8.856 -5.772 6.133 328 HB2 ARG 40 HB2 ARG 40 -6.968 -4.206 4.359 329 HB3 ARG 40 HB1 ARG 40 -8.676 -3.839 4.570 330 HG2 ARG 40 HG2 ARG 40 -8.329 -3.453 6.896 331 HG3 ARG 40 HG1 ARG 40 -6.643 -3.922 6.782 332 HD2 ARG 40 HD2 ARG 40 -6.392 -1.674 6.677 333 HD3 ARG 40 HD1 ARG 40 -6.677 -1.983 4.966 334 HE ARG 40 HE ARG 40 -9.093 -1.472 5.525 335 HH11 ARG 40 HH11 ARG 40 -6.402 -0.020 7.251 336 HH12 ARG 40 HH12 ARG 40 -7.329 1.331 7.816 337 HH21 ARG 40 HH21 ARG 40 -10.314 0.291 6.309 338 HH22 ARG 40 HH22 ARG 40 -9.550 1.502 7.284 339 H GLU 41 HN GLU 41 -6.702 -7.308 4.032 340 HA GLU 41 HA GLU 41 -8.906 -8.140 2.261 341 HB2 GLU 41 HB2 GLU 41 -5.982 -8.367 1.592 342 HB3 GLU 41 HB1 GLU 41 -7.358 -8.438 0.503 343 HG2 GLU 41 HG2 GLU 41 -6.476 -5.972 1.965 344 HG3 GLU 41 HG1 GLU 41 -5.990 -6.399 0.322 345 HA PRO 42 HA PRO 42 -7.350 -11.610 4.960 346 HB2 PRO 42 HB2 PRO 42 -10.167 -12.487 4.873 347 HB3 PRO 42 HB1 PRO 42 -9.120 -12.215 6.267 348 HG2 PRO 42 HG2 PRO 42 -11.139 -10.545 5.671 349 HG3 PRO 42 HG1 PRO 42 -9.618 -9.962 6.372 350 HD2 PRO 42 HD2 PRO 42 -10.557 -9.867 3.530 351 HD3 PRO 42 HD1 PRO 42 -9.692 -8.635 4.473 352 H SER 43 HN SER 43 -8.938 -11.384 1.964 353 HA SER 43 HA SER 43 -9.051 -14.106 1.219 354 HB2 SER 43 HB2 SER 43 -8.581 -11.785 -0.655 355 HB3 SER 43 HB1 SER 43 -9.423 -13.299 -0.991 356 HG SER 43 HG SER 43 -11.050 -12.632 0.482 357 H LEU 44 HN LEU 44 -6.446 -11.822 1.471 358 HA LEU 44 HA LEU 44 -4.673 -13.734 0.104 359 HB2 LEU 44 HB2 LEU 44 -3.144 -11.826 -0.284 360 HB3 LEU 44 HB1 LEU 44 -4.683 -11.645 -1.068 361 HG LEU 44 HG LEU 44 -5.131 -10.267 1.208 362 HD11 LEU 44 HD11 LEU 44 -3.135 -8.824 1.484 363 HD12 LEU 44 HD12 LEU 44 -2.217 -9.981 0.523 364 HD13 LEU 44 HD13 LEU 44 -2.917 -10.473 2.066 365 HD21 LEU 44 HD21 LEU 44 -5.648 -9.494 -1.006 366 HD22 LEU 44 HD22 LEU 44 -3.938 -9.323 -1.395 367 HD23 LEU 44 HD23 LEU 44 -4.680 -8.268 -0.191 368 H LYS 45 HN LYS 45 -5.605 -13.714 2.907 369 HA LYS 45 HA LYS 45 -3.499 -12.899 4.618 370 HB2 LYS 45 HB2 LYS 45 -4.640 -14.072 6.352 371 HB3 LYS 45 HB1 LYS 45 -5.863 -13.355 5.321 372 HG2 LYS 45 HG2 LYS 45 -6.139 -15.559 4.208 373 HG3 LYS 45 HG1 LYS 45 -5.011 -16.236 5.386 374 HD2 LYS 45 HD2 LYS 45 -7.580 -14.848 6.126 375 HD3 LYS 45 HD1 LYS 45 -7.412 -16.594 5.945 376 HE2 LYS 45 HE2 LYS 45 -7.046 -16.420 8.187 377 HE3 LYS 45 HE1 LYS 45 -5.398 -16.213 7.594 378 HZ1 LYS 45 HZ1 LYS 45 -5.740 -13.790 7.737 379 HZ2 LYS 45 HZ2 LYS 45 -5.878 -14.551 9.237 380 HZ3 LYS 45 HZ3 LYS 45 -7.266 -14.053 8.416 381 H ASN 46 HN ASN 46 -3.845 -15.623 2.547 382 HA ASN 46 HA ASN 46 -2.046 -17.372 3.940 383 HB2 ASN 46 HB2 ASN 46 -3.760 -18.210 2.371 384 HB3 ASN 46 HB1 ASN 46 -2.947 -17.387 1.047 385 HD21 ASN 46 HD21 ASN 46 -1.393 -19.150 3.682 386 HD22 ASN 46 HD22 ASN 46 -0.727 -20.395 2.675 387 H SER 47 HN SER 47 -1.698 -14.648 1.943 388 HA SER 47 HA SER 47 0.811 -15.286 0.747 389 HB2 SER 47 HB2 SER 47 -0.532 -12.612 1.195 390 HB3 SER 47 HB1 SER 47 0.854 -12.886 0.136 391 HG SER 47 HG SER 47 -1.670 -13.078 -0.495 392 H ASN 48 HN ASN 48 2.827 -15.043 1.543 393 HA ASN 48 HA ASN 48 3.181 -14.495 4.319 394 HB2 ASN 48 HB2 ASN 48 5.218 -14.860 2.115 395 HB3 ASN 48 HB1 ASN 48 5.590 -14.808 3.832 396 HD21 ASN 48 HD21 ASN 48 5.073 -16.557 5.130 397 HD22 ASN 48 HD22 ASN 48 4.621 -18.095 4.475 398 HA PRO 49 HA PRO 49 3.497 -10.190 4.350 399 HB2 PRO 49 HB2 PRO 49 5.297 -9.814 6.374 400 HB3 PRO 49 HB1 PRO 49 3.611 -10.274 6.621 401 HG2 PRO 49 HG2 PRO 49 6.051 -11.994 6.591 402 HG3 PRO 49 HG1 PRO 49 4.660 -12.027 7.692 403 HD2 PRO 49 HD2 PRO 49 4.903 -13.785 5.681 404 HD3 PRO 49 HD1 PRO 49 3.321 -13.147 6.175 405 H ASP 50 HN ASP 50 6.450 -11.988 3.888 406 HA ASP 50 HA ASP 50 7.800 -9.539 2.985 407 HB2 ASP 50 HB2 ASP 50 8.956 -12.301 3.451 408 HB3 ASP 50 HB1 ASP 50 9.875 -10.874 2.991 409 H GLU 51 HN GLU 51 5.738 -11.557 1.721 410 HA GLU 51 HA GLU 51 6.944 -11.427 -0.939 411 HB2 GLU 51 HB2 GLU 51 5.642 -13.927 0.181 412 HB3 GLU 51 HB1 GLU 51 6.148 -13.705 -1.483 413 HG2 GLU 51 HG2 GLU 51 8.002 -14.758 -0.865 414 HG3 GLU 51 HG1 GLU 51 8.473 -13.227 -0.142 415 H ILE 52 HN ILE 52 4.969 -9.879 0.479 416 HA ILE 52 HA ILE 52 2.370 -10.744 -0.241 417 HB ILE 52 HB ILE 52 3.139 -9.057 1.625 418 HG12 ILE 52 HG12 ILE 52 0.832 -8.251 1.746 419 HG13 ILE 52 HG11 ILE 52 0.561 -8.736 0.083 420 HG21 ILE 52 HG21 ILE 52 2.485 -7.261 -0.692 421 HG22 ILE 52 HG22 ILE 52 4.007 -7.335 0.198 422 HG23 ILE 52 HG23 ILE 52 2.550 -6.741 0.988 423 HD11 ILE 52 HD11 ILE 52 1.257 -10.585 2.311 424 HD12 ILE 52 HD12 ILE 52 0.800 -11.031 0.670 425 HD13 ILE 52 HD13 ILE 52 -0.375 -10.272 1.740 426 H GLU 53 HN GLU 53 0.948 -9.883 -1.653 427 HA GLU 53 HA GLU 53 2.150 -8.567 -4.000 428 HB2 GLU 53 HB2 GLU 53 1.408 -10.931 -4.379 429 HB3 GLU 53 HB1 GLU 53 -0.216 -10.469 -3.894 430 HG2 GLU 53 HG2 GLU 53 -0.095 -10.622 -6.274 431 HG3 GLU 53 HG1 GLU 53 -0.313 -8.934 -5.828 432 H ILE 54 HN ILE 54 1.651 -6.432 -3.408 433 HA ILE 54 HA ILE 54 -0.910 -5.748 -2.372 434 HB ILE 54 HB ILE 54 1.134 -3.944 -3.672 435 HG12 ILE 54 HG12 ILE 54 0.831 -4.777 -0.783 436 HG13 ILE 54 HG11 ILE 54 2.211 -5.055 -1.834 437 HG21 ILE 54 HG21 ILE 54 -1.111 -3.336 -1.784 438 HG22 ILE 54 HG22 ILE 54 -1.076 -2.970 -3.506 439 HG23 ILE 54 HG23 ILE 54 0.053 -2.173 -2.410 440 HD11 ILE 54 HD11 ILE 54 2.701 -3.229 -0.321 441 HD12 ILE 54 HD12 ILE 54 1.237 -2.404 -0.825 442 HD13 ILE 54 HD13 ILE 54 2.560 -2.620 -1.965 443 H ASP 55 HN ASP 55 -2.581 -6.230 -3.718 444 HA ASP 55 HA ASP 55 -2.381 -5.450 -6.541 445 HB2 ASP 55 HB2 ASP 55 -3.033 -7.813 -5.999 446 HB3 ASP 55 HB1 ASP 55 -4.488 -7.185 -5.230 447 H PHE 56 HN PHE 56 -2.833 -3.331 -6.547 448 HA PHE 56 HA PHE 56 -4.587 -2.060 -4.756 449 HB2 PHE 56 HB2 PHE 56 -3.456 -1.078 -7.361 450 HB3 PHE 56 HB1 PHE 56 -4.233 -0.063 -6.153 451 HD1 PHE 56 HD1 PHE 56 -3.197 0.122 -3.905 452 HD2 PHE 56 HD2 PHE 56 -1.176 -1.670 -7.167 453 HE1 PHE 56 HE1 PHE 56 -1.099 0.411 -2.719 454 HE2 PHE 56 HE2 PHE 56 0.963 -1.373 -5.987 455 HZ PHE 56 HZ PHE 56 0.993 -0.320 -3.756 456 H GLU 57 HN GLU 57 -5.283 -3.838 -7.517 457 HA GLU 57 HA GLU 57 -7.627 -2.327 -8.284 458 HB2 GLU 57 HB2 GLU 57 -6.466 -4.946 -9.225 459 HB3 GLU 57 HB1 GLU 57 -7.911 -4.222 -9.925 460 HG2 GLU 57 HG2 GLU 57 -5.229 -2.860 -9.825 461 HG3 GLU 57 HG1 GLU 57 -5.781 -3.835 -11.185 462 H THR 58 HN THR 58 -6.809 -4.882 -6.146 463 HA THR 58 HA THR 58 -9.652 -5.530 -5.820 464 HB THR 58 HB THR 58 -8.801 -7.544 -4.549 465 HG1 THR 58 HG1 THR 58 -6.359 -6.967 -5.901 466 HG21 THR 58 HG21 THR 58 -8.079 -7.271 -7.468 467 HG22 THR 58 HG22 THR 58 -9.659 -7.718 -6.823 468 HG23 THR 58 HG23 THR 58 -8.281 -8.795 -6.604 469 H LEU 59 HN LEU 59 -6.836 -4.257 -4.224 470 HA LEU 59 HA LEU 59 -7.500 -4.380 -1.552 471 HB2 LEU 59 HB2 LEU 59 -6.208 -2.139 -3.059 472 HB3 LEU 59 HB1 LEU 59 -6.284 -2.247 -1.316 473 HG LEU 59 HG LEU 59 -4.910 -4.192 -3.153 474 HD11 LEU 59 HD11 LEU 59 -3.765 -2.340 -1.089 475 HD12 LEU 59 HD12 LEU 59 -3.784 -2.014 -2.821 476 HD13 LEU 59 HD13 LEU 59 -2.884 -3.393 -2.194 477 HD21 LEU 59 HD21 LEU 59 -5.439 -4.219 -0.193 478 HD22 LEU 59 HD22 LEU 59 -4.071 -5.077 -0.917 479 HD23 LEU 59 HD23 LEU 59 -5.714 -5.489 -1.394 480 H LYS 60 HN LYS 60 -9.032 -3.516 -0.300 481 HA LYS 60 HA LYS 60 -11.240 -2.112 -1.337 482 HB2 LYS 60 HB2 LYS 60 -10.232 -2.343 1.505 483 HB3 LYS 60 HB1 LYS 60 -11.800 -1.684 1.066 484 HG2 LYS 60 HG2 LYS 60 -12.497 -3.810 0.213 485 HG3 LYS 60 HG1 LYS 60 -10.890 -4.475 0.447 486 HD2 LYS 60 HD2 LYS 60 -11.150 -4.045 2.873 487 HD3 LYS 60 HD1 LYS 60 -12.819 -3.576 2.567 488 HE2 LYS 60 HE2 LYS 60 -13.352 -5.757 1.752 489 HE3 LYS 60 HE1 LYS 60 -11.659 -6.241 1.788 490 HZ1 LYS 60 HZ1 LYS 60 -13.237 -5.517 4.193 491 HZ2 LYS 60 HZ2 LYS 60 -11.669 -6.154 4.160 492 HZ3 LYS 60 HZ3 LYS 60 -12.977 -7.102 3.663 493 HA PRO 61 HA PRO 61 -9.942 2.164 -1.626 494 HB2 PRO 61 HB2 PRO 61 -12.533 2.603 -0.205 495 HB3 PRO 61 HB1 PRO 61 -11.878 3.420 -1.630 496 HG2 PRO 61 HG2 PRO 61 -13.769 1.564 -1.864 497 HG3 PRO 61 HG1 PRO 61 -12.463 1.726 -3.050 498 HD2 PRO 61 HD2 PRO 61 -12.875 -0.361 -0.971 499 HD3 PRO 61 HD1 PRO 61 -12.041 -0.471 -2.532 500 H SER 62 HN SER 62 -11.304 0.839 1.339 501 HA SER 62 HA SER 62 -10.320 2.824 3.100 502 HB2 SER 62 HB2 SER 62 -10.752 1.072 4.858 503 HB3 SER 62 HB1 SER 62 -12.143 1.284 3.786 504 HG SER 62 HG SER 62 -11.966 -0.793 3.576 505 H THR 63 HN THR 63 -9.027 -0.382 2.161 506 HA THR 63 HA THR 63 -6.653 -0.212 3.647 507 HB THR 63 HB THR 63 -6.651 -1.541 0.955 508 HG1 THR 63 HG1 THR 63 -7.915 -3.226 1.751 509 HG21 THR 63 HG21 THR 63 -4.687 -2.198 1.901 510 HG22 THR 63 HG22 THR 63 -5.722 -3.345 2.762 511 HG23 THR 63 HG23 THR 63 -5.258 -1.832 3.533 512 H LEU 64 HN LEU 64 -7.364 0.689 0.276 513 HA LEU 64 HA LEU 64 -4.800 1.520 -0.429 514 HB2 LEU 64 HB2 LEU 64 -7.468 2.512 -1.398 515 HB3 LEU 64 HB1 LEU 64 -5.946 2.898 -2.161 516 HG LEU 64 HG LEU 64 -7.054 0.109 -1.871 517 HD11 LEU 64 HD11 LEU 64 -7.872 2.134 -3.597 518 HD12 LEU 64 HD12 LEU 64 -8.198 0.410 -3.753 519 HD13 LEU 64 HD13 LEU 64 -6.797 1.119 -4.556 520 HD21 LEU 64 HD21 LEU 64 -4.626 1.270 -3.203 521 HD22 LEU 64 HD22 LEU 64 -5.278 -0.317 -3.619 522 HD23 LEU 64 HD23 LEU 64 -4.702 -0.003 -1.982 523 H ARG 65 HN ARG 65 -7.482 3.449 0.936 524 HA ARG 65 HA ARG 65 -6.055 5.881 0.997 525 HB2 ARG 65 HB2 ARG 65 -8.384 4.896 2.632 526 HB3 ARG 65 HB1 ARG 65 -7.733 6.524 2.767 527 HG2 ARG 65 HG2 ARG 65 -8.847 5.322 0.239 528 HG3 ARG 65 HG1 ARG 65 -9.730 6.386 1.328 529 HD2 ARG 65 HD2 ARG 65 -8.202 8.189 0.903 530 HD3 ARG 65 HD1 ARG 65 -7.158 7.140 -0.048 531 HE ARG 65 HE ARG 65 -9.808 7.260 -1.108 532 HH11 ARG 65 HH11 ARG 65 -6.774 9.010 -0.932 533 HH12 ARG 65 HH12 ARG 65 -6.986 9.784 -2.473 534 HH21 ARG 65 HH21 ARG 65 -10.078 8.317 -3.151 535 HH22 ARG 65 HH22 ARG 65 -8.842 9.401 -3.712 536 H GLU 66 HN GLU 66 -6.230 3.169 3.215 537 HA GLU 66 HA GLU 66 -4.798 4.400 5.328 538 HB2 GLU 66 HB2 GLU 66 -6.163 2.429 5.716 539 HB3 GLU 66 HB1 GLU 66 -5.177 1.489 4.604 540 HG2 GLU 66 HG2 GLU 66 -4.627 0.951 6.887 541 HG3 GLU 66 HG1 GLU 66 -3.263 1.737 6.086 542 H LEU 67 HN LEU 67 -3.762 2.015 2.868 543 HA LEU 67 HA LEU 67 -1.053 1.916 3.326 544 HB2 LEU 67 HB2 LEU 67 -2.179 2.097 0.523 545 HB3 LEU 67 HB1 LEU 67 -0.811 1.151 1.097 546 HG LEU 67 HG LEU 67 -3.662 0.588 1.876 547 HD11 LEU 67 HD11 LEU 67 -2.131 -1.188 0.098 548 HD12 LEU 67 HD12 LEU 67 -2.776 0.292 -0.610 549 HD13 LEU 67 HD13 LEU 67 -3.863 -0.866 0.160 550 HD21 LEU 67 HD21 LEU 67 -1.355 -0.172 3.111 551 HD22 LEU 67 HD22 LEU 67 -1.638 -1.508 2.004 552 HD23 LEU 67 HD23 LEU 67 -2.877 -1.055 3.173 553 H GLU 68 HN GLU 68 -2.746 4.252 1.212 554 HA GLU 68 HA GLU 68 -0.503 5.771 0.505 555 HB2 GLU 68 HB2 GLU 68 -2.704 5.935 -0.612 556 HB3 GLU 68 HB1 GLU 68 -3.355 6.725 0.817 557 HG2 GLU 68 HG2 GLU 68 -1.622 8.503 0.506 558 HG3 GLU 68 HG1 GLU 68 -1.249 7.762 -1.051 559 H ARG 69 HN ARG 69 -2.984 6.600 2.956 560 HA ARG 69 HA ARG 69 -1.684 8.830 4.027 561 HB2 ARG 69 HB2 ARG 69 -3.742 6.920 4.971 562 HB3 ARG 69 HB1 ARG 69 -3.046 8.003 6.159 563 HG2 ARG 69 HG2 ARG 69 -4.003 9.217 3.639 564 HG3 ARG 69 HG1 ARG 69 -5.228 8.586 4.741 565 HD2 ARG 69 HD2 ARG 69 -4.875 10.895 5.257 566 HD3 ARG 69 HD1 ARG 69 -4.199 9.924 6.559 567 HE ARG 69 HE ARG 69 -2.448 10.962 4.437 568 HH11 ARG 69 HH11 ARG 69 -3.370 10.807 7.811 569 HH12 ARG 69 HH12 ARG 69 -1.999 11.712 8.359 570 HH21 ARG 69 HH21 ARG 69 -0.651 12.163 5.152 571 HH22 ARG 69 HH22 ARG 69 -0.456 12.503 6.843 572 H TYR 70 HN TYR 70 -1.142 5.445 4.547 573 HA TYR 70 HA TYR 70 0.320 5.738 6.974 574 HB2 TYR 70 HB2 TYR 70 -0.550 3.572 6.574 575 HB3 TYR 70 HB1 TYR 70 0.125 3.527 4.950 576 HD1 TYR 70 HD2 TYR 70 1.359 4.049 8.439 577 HD2 TYR 70 HD1 TYR 70 1.940 2.236 4.648 578 HE1 TYR 70 HE2 TYR 70 3.436 3.032 9.266 579 HE2 TYR 70 HE1 TYR 70 4.001 1.196 5.449 580 HH TYR 70 HH TYR 70 4.861 1.016 8.685 581 H VAL 71 HN VAL 71 1.272 5.242 3.567 582 HA VAL 71 HA VAL 71 4.037 5.385 4.044 583 HB VAL 71 HB VAL 71 4.382 5.732 1.727 584 HG11 VAL 71 HG11 VAL 71 2.704 4.198 0.630 585 HG12 VAL 71 HG12 VAL 71 1.976 4.036 2.230 586 HG13 VAL 71 HG13 VAL 71 3.650 3.547 1.964 587 HG21 VAL 71 HG21 VAL 71 2.757 6.474 0.176 588 HG22 VAL 71 HG22 VAL 71 2.904 7.659 1.468 589 HG23 VAL 71 HG23 VAL 71 1.522 6.562 1.424 590 H THR 72 HN THR 72 1.566 7.847 3.623 591 HA THR 72 HA THR 72 3.317 9.955 3.038 592 HB THR 72 HB THR 72 1.500 11.494 3.621 593 HG1 THR 72 HG1 THR 72 0.541 9.253 4.935 594 HG21 THR 72 HG21 THR 72 1.054 9.100 1.933 595 HG22 THR 72 HG22 THR 72 1.333 10.774 1.445 596 HG23 THR 72 HG23 THR 72 -0.237 10.290 2.091 597 H SER 73 HN SER 73 2.403 8.462 6.025 598 HA SER 73 HA SER 73 3.324 10.529 7.740 599 HB2 SER 73 HB2 SER 73 3.029 8.980 9.508 600 HB3 SER 73 HB1 SER 73 1.794 8.563 8.318 601 HG SER 73 HG SER 73 3.149 6.877 7.592 602 H CYS 74 HN CYS 74 4.816 8.114 5.837 603 HA CYS 74 HA CYS 74 7.404 8.407 7.193 604 HB2 CYS 74 HB2 CYS 74 6.717 6.110 6.796 605 HB3 CYS 74 HB1 CYS 74 6.493 6.446 5.082 606 HG CYS 74 HG CYS 74 9.510 6.589 6.684 607 H LEU 75 HN LEU 75 5.734 9.210 4.260 608 HA LEU 75 HA LEU 75 8.213 9.914 2.891 609 HB2 LEU 75 HB2 LEU 75 5.393 9.788 1.839 610 HB3 LEU 75 HB1 LEU 75 6.839 9.958 0.881 611 HG LEU 75 HG LEU 75 5.922 7.542 2.399 612 HD11 LEU 75 HD11 LEU 75 5.064 8.096 0.074 613 HD12 LEU 75 HD12 LEU 75 5.797 6.507 0.299 614 HD13 LEU 75 HD13 LEU 75 6.709 7.795 -0.480 615 HD21 LEU 75 HD21 LEU 75 7.989 6.458 1.854 616 HD22 LEU 75 HD22 LEU 75 8.361 7.935 2.736 617 HD23 LEU 75 HD23 LEU 75 8.564 7.879 0.985 618 H ARG 76 HN ARG 76 5.147 11.359 3.911 619 HA ARG 76 HA ARG 76 6.013 13.934 2.849 620 HB2 ARG 76 HB2 ARG 76 3.354 13.043 3.924 621 HB3 ARG 76 HB1 ARG 76 3.701 14.675 3.360 622 HG2 ARG 76 HG2 ARG 76 4.278 13.728 1.147 623 HG3 ARG 76 HG1 ARG 76 3.794 12.145 1.757 624 HD2 ARG 76 HD2 ARG 76 1.993 13.121 0.490 625 HD3 ARG 76 HD1 ARG 76 1.576 12.989 2.191 626 HE ARG 76 HE ARG 76 2.151 15.427 2.323 627 HH11 ARG 76 HH11 ARG 76 1.108 13.985 -0.694 628 HH12 ARG 76 HH12 ARG 76 0.384 15.446 -1.286 629 HH21 ARG 76 HH21 ARG 76 1.194 17.343 1.549 630 HH22 ARG 76 HH22 ARG 76 0.440 17.358 -0.015 631 H LYS 77 HN LYS 77 5.183 12.328 5.837 632 HA LYS 77 HA LYS 77 5.534 14.740 7.425 633 HB2 LYS 77 HB2 LYS 77 3.762 12.919 7.787 634 HB3 LYS 77 HB1 LYS 77 5.061 11.958 8.474 635 HG2 LYS 77 HG2 LYS 77 5.485 13.937 10.013 636 HG3 LYS 77 HG1 LYS 77 3.914 14.534 9.481 637 HD2 LYS 77 HD2 LYS 77 2.839 12.500 10.256 638 HD3 LYS 77 HD1 LYS 77 4.401 11.825 10.721 639 HE2 LYS 77 HE2 LYS 77 4.684 13.685 12.320 640 HE3 LYS 77 HE1 LYS 77 3.075 14.263 11.897 641 HZ1 LYS 77 HZ1 LYS 77 2.135 12.218 12.725 642 HZ2 LYS 77 HZ2 LYS 77 3.084 12.927 13.929 643 HZ3 LYS 77 HZ3 LYS 77 3.671 11.597 13.065 644 H LYS 78 HN LYS 78 7.635 12.759 6.000 645 HA LYS 78 HA LYS 78 9.720 13.292 7.908 646 HB2 LYS 78 HB2 LYS 78 8.620 11.179 8.728 647 HB3 LYS 78 HB1 LYS 78 9.119 10.408 7.229 648 HG2 LYS 78 HG2 LYS 78 10.648 9.834 9.000 649 HG3 LYS 78 HG1 LYS 78 11.466 10.851 7.813 650 HD2 LYS 78 HD2 LYS 78 11.235 12.783 9.242 651 HD3 LYS 78 HD1 LYS 78 10.274 11.856 10.395 652 HE2 LYS 78 HE2 LYS 78 13.119 11.187 9.663 653 HE3 LYS 78 HE1 LYS 78 12.676 12.203 11.031 654 HZ1 LYS 78 HZ1 LYS 78 11.528 10.388 12.037 655 HZ2 LYS 78 HZ2 LYS 78 13.070 9.841 11.606 656 HZ3 LYS 78 HZ3 LYS 78 11.730 9.414 10.670 657 H ARG 79 HN ARG 79 11.828 12.898 7.042 658 HA ARG 79 HA ARG 79 11.884 12.367 4.154 659 HB2 ARG 79 HB2 ARG 79 13.566 14.067 3.822 660 HB3 ARG 79 HB1 ARG 79 12.180 14.799 4.619 661 HG2 ARG 79 HG2 ARG 79 14.574 13.856 6.167 662 HG3 ARG 79 HG1 ARG 79 14.508 15.456 5.432 663 HD2 ARG 79 HD2 ARG 79 12.685 16.106 6.783 664 HD3 ARG 79 HD1 ARG 79 12.369 14.452 7.297 665 HE ARG 79 HE ARG 79 14.928 15.046 8.145 666 HH11 ARG 79 HH11 ARG 79 11.711 16.294 8.678 667 HH12 ARG 79 HH12 ARG 79 12.024 16.779 10.312 668 HH21 ARG 79 HH21 ARG 79 15.357 15.681 10.308 669 HH22 ARG 79 HH22 ARG 79 14.103 16.432 11.244 670 H LYS 80 HN LYS 80 13.475 11.031 3.457 671 HA LYS 80 HA LYS 80 14.989 9.338 3.577 672 HB2 LYS 80 HB2 LYS 80 16.352 11.436 5.260 673 HB3 LYS 80 HB1 LYS 80 17.142 9.960 4.729 674 HG2 LYS 80 HG2 LYS 80 15.983 12.070 2.923 675 HG3 LYS 80 HG1 LYS 80 17.693 11.866 3.305 676 HD2 LYS 80 HD2 LYS 80 17.632 9.616 2.317 677 HD3 LYS 80 HD1 LYS 80 15.931 9.849 1.911 678 HE2 LYS 80 HE2 LYS 80 17.348 10.258 -0.023 679 HE3 LYS 80 HE1 LYS 80 16.530 11.735 0.482 680 HZ1 LYS 80 HZ1 LYS 80 18.562 12.427 1.600 681 HZ2 LYS 80 HZ2 LYS 80 18.842 12.153 -0.042 682 HZ3 LYS 80 HZ3 LYS 80 19.343 11.014 1.101 683 HA PRO 81 HA PRO 81 13.738 7.727 7.688 684 HB2 PRO 81 HB2 PRO 81 11.899 5.966 6.923 685 HB3 PRO 81 HB1 PRO 81 11.531 7.696 6.942 686 HG2 PRO 81 HG2 PRO 81 12.136 5.912 4.632 687 HG3 PRO 81 HG1 PRO 81 11.026 7.288 4.729 688 HD2 PRO 81 HD2 PRO 81 13.650 7.310 3.692 689 HD3 PRO 81 HD1 PRO 81 12.642 8.725 4.051 690 H GLN 82 HN GLN 82 16.059 6.988 6.122 691 HA GLN 82 HA GLN 82 16.069 4.081 6.583 692 HB2 GLN 82 HB2 GLN 82 17.409 5.579 4.327 693 HB3 GLN 82 HB1 GLN 82 17.644 3.872 4.675 694 HG2 GLN 82 HG2 GLN 82 15.280 3.453 4.246 695 HG3 GLN 82 HG1 GLN 82 15.037 5.167 3.910 696 HE21 GLN 82 HE21 GLN 82 14.345 4.783 1.822 697 HE22 GLN 82 HE22 GLN 82 15.431 4.303 0.564 698 H ALA 83 HN ALA 83 16.768 5.522 8.639 699 HA ALA 83 HA ALA 83 19.704 5.391 8.663 700 HB1 ALA 83 HB1 ALA 83 17.986 7.427 10.082 701 HB2 ALA 83 HB2 ALA 83 19.036 7.732 8.700 702 HB3 ALA 83 HB3 ALA 83 19.733 7.266 10.251 703 H1 VAL 201 HT1 VAL 201 -6.198 -2.330 -13.678 704 H2 VAL 201 HT2 VAL 201 -5.149 -2.962 -14.852 705 H3 VAL 201 HT3 VAL 201 -6.717 -2.503 -15.284 706 HA VAL 201 HA VAL 201 -5.171 -0.852 -16.034 707 HB VAL 201 HB VAL 201 -6.724 0.136 -13.629 708 HG11 VAL 201 HG11 VAL 201 -6.749 2.290 -14.778 709 HG12 VAL 201 HG12 VAL 201 -5.762 1.617 -16.075 710 HG13 VAL 201 HG13 VAL 201 -5.097 1.767 -14.450 711 HG21 VAL 201 HG21 VAL 201 -7.570 -0.121 -16.512 712 HG22 VAL 201 HG22 VAL 201 -8.516 0.619 -15.223 713 HG23 VAL 201 HG23 VAL 201 -8.148 -1.103 -15.168 714 H VAL 202 HN VAL 202 -5.060 -1.225 -12.495 715 HA VAL 202 HA VAL 202 -2.456 0.101 -12.446 716 HB VAL 202 HB VAL 202 -4.227 -0.879 -10.200 717 HG11 VAL 202 HG11 VAL 202 -1.584 0.577 -10.071 718 HG12 VAL 202 HG12 VAL 202 -1.900 -1.070 -9.524 719 HG13 VAL 202 HG13 VAL 202 -2.655 0.295 -8.700 720 HG21 VAL 202 HG21 VAL 202 -3.454 1.939 -10.902 721 HG22 VAL 202 HG22 VAL 202 -4.704 1.403 -9.778 722 HG23 VAL 202 HG23 VAL 202 -4.916 1.165 -11.513 723 HA PRO 203 HA PRO 203 -0.452 -3.890 -12.639 724 HB2 PRO 203 HB2 PRO 203 2.071 -2.947 -12.201 725 HB3 PRO 203 HB1 PRO 203 1.263 -2.881 -13.770 726 HG2 PRO 203 HG2 PRO 203 1.583 -0.742 -11.709 727 HG3 PRO 203 HG1 PRO 203 1.713 -0.627 -13.472 728 HD2 PRO 203 HD2 PRO 203 -0.485 0.167 -12.117 729 HD3 PRO 203 HD1 PRO 203 -0.568 -0.509 -13.756 730 H LYS 204 HN LYS 204 -0.127 -5.352 -11.105 731 HA LYS 204 HA LYS 204 -0.363 -4.776 -8.367 732 HB2 LYS 204 HB2 LYS 204 0.270 -7.154 -8.035 733 HB3 LYS 204 HB1 LYS 204 -0.996 -6.942 -9.238 734 HG2 LYS 204 HG2 LYS 204 0.619 -7.227 -11.025 735 HG3 LYS 204 HG1 LYS 204 1.925 -7.363 -9.846 736 HD2 LYS 204 HD2 LYS 204 0.858 -9.373 -8.919 737 HD3 LYS 204 HD1 LYS 204 -0.419 -9.241 -10.130 738 HE2 LYS 204 HE2 LYS 204 2.513 -9.575 -10.747 739 HE3 LYS 204 HE1 LYS 204 1.337 -10.887 -10.719 740 HZ1 LYS 204 HZ1 LYS 204 1.669 -10.138 -12.960 741 HZ2 LYS 204 HZ2 LYS 204 1.317 -8.543 -12.537 742 HZ3 LYS 204 HZ3 LYS 204 0.104 -9.719 -12.475 743 H LYS 205 HN LYS 205 1.123 -4.687 -6.713 744 HA LYS 205 HA LYS 205 3.862 -4.102 -7.576 745 HB2 LYS 205 HB2 LYS 205 2.634 -2.355 -6.318 746 HB3 LYS 205 HB1 LYS 205 2.484 -3.460 -4.964 747 HG2 LYS 205 HG2 LYS 205 4.254 -1.966 -4.473 748 HG3 LYS 205 HG1 LYS 205 4.977 -3.530 -4.851 749 HD2 LYS 205 HD2 LYS 205 5.605 -2.788 -7.037 750 HD3 LYS 205 HD1 LYS 205 4.696 -1.287 -6.845 751 HE2 LYS 205 HE2 LYS 205 7.033 -0.827 -6.521 752 HE3 LYS 205 HE1 LYS 205 6.201 -0.670 -4.976 753 HZ1 LYS 205 HZ1 LYS 205 6.952 -2.987 -4.495 754 HZ2 LYS 205 HZ2 LYS 205 8.200 -1.849 -4.590 755 HZ3 LYS 205 HZ3 LYS 205 7.921 -2.910 -5.879 756 H LYS 206 HN LYS 206 4.850 -6.036 -7.655 757 HA LYS 206 HA LYS 206 4.472 -8.149 -5.815 758 HB2 LYS 206 HB2 LYS 206 6.799 -7.617 -7.669 759 HB3 LYS 206 HB1 LYS 206 6.442 -9.152 -6.891 760 HG2 LYS 206 HG2 LYS 206 4.385 -9.353 -8.146 761 HG3 LYS 206 HG1 LYS 206 4.641 -7.762 -8.867 762 HD2 LYS 206 HD2 LYS 206 6.417 -10.177 -9.223 763 HD3 LYS 206 HD1 LYS 206 5.277 -9.544 -10.413 764 HE2 LYS 206 HE2 LYS 206 6.540 -7.409 -10.404 765 HE3 LYS 206 HE1 LYS 206 7.719 -8.150 -9.326 766 HZ1 LYS 206 HZ1 LYS 206 8.505 -8.253 -11.570 767 HZ2 LYS 206 HZ2 LYS 206 7.085 -9.001 -12.095 768 HZ3 LYS 206 HZ3 LYS 206 8.137 -9.821 -11.057 769 H ILE 207 HN ILE 207 5.040 -8.094 -3.744 770 HA ILE 207 HA ILE 207 7.420 -6.529 -2.977 771 HB ILE 207 HB ILE 207 5.128 -7.356 -1.203 772 HG12 ILE 207 HG12 ILE 207 4.549 -5.774 -3.133 773 HG13 ILE 207 HG11 ILE 207 4.120 -5.260 -1.510 774 HG21 ILE 207 HG21 ILE 207 6.009 -5.553 0.270 775 HG22 ILE 207 HG22 ILE 207 7.390 -5.403 -0.818 776 HG23 ILE 207 HG23 ILE 207 7.118 -6.908 0.059 777 HD11 ILE 207 HD11 ILE 207 5.989 -3.764 -1.441 778 HD12 ILE 207 HD12 ILE 207 5.055 -3.460 -2.900 779 HD13 ILE 207 HD13 ILE 207 6.570 -4.358 -2.994 780 H LYS 208 HN LYS 208 8.145 -8.872 -3.904 781 HA LYS 208 HA LYS 208 8.452 -10.626 -1.586 782 HB2 LYS 208 HB2 LYS 208 9.476 -12.218 -3.268 783 HB3 LYS 208 HB1 LYS 208 7.762 -11.887 -3.461 784 HG2 LYS 208 HG2 LYS 208 8.416 -10.182 -5.206 785 HG3 LYS 208 HG1 LYS 208 10.045 -10.856 -5.116 786 HD2 LYS 208 HD2 LYS 208 7.522 -12.349 -5.825 787 HD3 LYS 208 HD1 LYS 208 8.805 -11.880 -6.940 788 HE2 LYS 208 HE2 LYS 208 10.373 -13.328 -5.790 789 HE3 LYS 208 HE1 LYS 208 9.149 -13.740 -4.587 790 HZ1 LYS 208 HZ1 LYS 208 9.072 -14.398 -7.482 791 HZ2 LYS 208 HZ2 LYS 208 7.819 -14.711 -6.391 792 HZ3 LYS 208 HZ3 LYS 208 9.310 -15.483 -6.206 793 H LYS 209 HN LYS 209 9.768 -9.256 -0.481 794 HA LYS 209 HA LYS 209 11.709 -8.454 0.338 795 HB2 LYS 209 HB2 LYS 209 12.754 -10.571 -0.283 796 HB3 LYS 209 HB1 LYS 209 13.034 -9.973 -1.914 797 HG2 LYS 209 HG2 LYS 209 14.564 -8.314 -1.106 798 HG3 LYS 209 HG1 LYS 209 14.193 -8.728 0.566 799 HD2 LYS 209 HD2 LYS 209 15.106 -10.982 0.186 800 HD3 LYS 209 HD1 LYS 209 15.525 -10.514 -1.464 801 HE2 LYS 209 HE2 LYS 209 17.448 -10.356 0.047 802 HE3 LYS 209 HE1 LYS 209 17.007 -8.788 -0.623 803 HZ1 LYS 209 HZ1 LYS 209 16.208 -9.752 2.070 804 HZ2 LYS 209 HZ2 LYS 209 15.927 -8.214 1.428 805 HZ3 LYS 209 HZ3 LYS 209 17.504 -8.711 1.767 806 H GLU 210 HN GLU 210 11.279 -8.175 -3.131 807 HA GLU 210 HA GLU 210 12.902 -5.860 -3.428 808 HB2 GLU 210 HB2 GLU 210 10.714 -6.986 -5.177 809 HB3 GLU 210 HB1 GLU 210 11.781 -5.667 -5.639 810 HG2 GLU 210 HG2 GLU 210 12.692 -8.445 -4.934 811 HG3 GLU 210 HG1 GLU 210 12.451 -7.846 -6.573 812 H GLN 211 HN GLN 211 12.343 -4.251 -2.047 813 HA GLN 211 HA GLN 211 9.688 -3.357 -1.619 814 HB2 GLN 211 HB2 GLN 211 10.809 -1.308 -0.673 815 HB3 GLN 211 HB1 GLN 211 11.316 -2.829 0.046 816 HG2 GLN 211 HG2 GLN 211 13.330 -2.787 -1.388 817 HG3 GLN 211 HG1 GLN 211 12.830 -1.208 -1.989 818 HE21 GLN 211 HE21 GLN 211 14.065 -2.983 0.732 819 HE22 GLN 211 HE22 GLN 211 14.557 -1.609 1.659 820 H VAL 212 HN VAL 212 12.177 -2.575 -3.925 821 HA VAL 212 HA VAL 212 10.469 -0.557 -5.178 822 HB VAL 212 HB VAL 212 12.439 -0.136 -6.654 823 HG11 VAL 212 HG11 VAL 212 12.055 1.220 -4.662 824 HG12 VAL 212 HG12 VAL 212 13.780 0.998 -4.954 825 HG13 VAL 212 HG13 VAL 212 12.973 0.067 -3.693 826 HG21 VAL 212 HG21 VAL 212 14.619 -1.067 -5.957 827 HG22 VAL 212 HG22 VAL 212 13.506 -2.302 -6.546 828 HG23 VAL 212 HG23 VAL 212 13.779 -2.114 -4.815 829 H GLU 213 HN GLU 213 10.553 -0.654 -7.676 830 HA GLU 213 HA GLU 213 9.597 -3.261 -8.481 831 HB2 GLU 213 HB2 GLU 213 9.937 -0.762 -10.146 832 HB3 GLU 213 HB1 GLU 213 9.012 -2.190 -10.583 833 HG2 GLU 213 HG2 GLU 213 7.465 -1.754 -8.750 834 HG3 GLU 213 HG1 GLU 213 8.397 -0.326 -8.302 Start of MODEL 14 1 H1 SER 1 HT1 SER 1 -18.761 -0.558 7.512 2 H2 SER 1 HT2 SER 1 -19.832 -1.349 8.562 3 H3 SER 1 HT3 SER 1 -19.280 0.204 8.937 4 HA SER 1 HA SER 1 -20.900 -0.462 6.575 5 HB2 SER 1 HB2 SER 1 -22.241 -0.847 8.561 6 HB3 SER 1 HB1 SER 1 -21.784 0.721 9.204 7 HG SER 1 HG SER 1 -23.118 1.708 7.839 8 H GLU 2 HN GLU 2 -20.508 2.303 8.742 9 HA GLU 2 HA GLU 2 -20.558 4.069 6.501 10 HB2 GLU 2 HB2 GLU 2 -20.195 4.378 9.435 11 HB3 GLU 2 HB1 GLU 2 -19.783 5.705 8.372 12 HG2 GLU 2 HG2 GLU 2 -22.006 6.059 9.125 13 HG3 GLU 2 HG1 GLU 2 -22.079 5.579 7.429 14 H GLU 3 HN GLU 3 -18.124 2.426 8.280 15 HA GLU 3 HA GLU 3 -15.885 4.010 7.822 16 HB2 GLU 3 HB2 GLU 3 -16.069 0.987 7.873 17 HB3 GLU 3 HB1 GLU 3 -14.577 1.905 7.990 18 HG2 GLU 3 HG2 GLU 3 -15.233 1.151 10.169 19 HG3 GLU 3 HG1 GLU 3 -15.387 2.904 10.089 20 H GLU 4 HN GLU 4 -17.571 1.761 5.750 21 HA GLU 4 HA GLU 4 -15.576 1.663 3.720 22 HB2 GLU 4 HB2 GLU 4 -18.461 0.806 3.832 23 HB3 GLU 4 HB1 GLU 4 -17.494 0.645 2.373 24 HG2 GLU 4 HG2 GLU 4 -17.607 -1.431 3.653 25 HG3 GLU 4 HG1 GLU 4 -15.959 -0.830 3.504 26 H ASP 5 HN ASP 5 -18.322 3.735 4.356 27 HA ASP 5 HA ASP 5 -18.127 4.887 1.687 28 HB2 ASP 5 HB2 ASP 5 -20.374 4.348 2.472 29 HB3 ASP 5 HB1 ASP 5 -20.155 5.415 3.846 30 H LYS 6 HN LYS 6 -17.389 5.572 4.977 31 HA LYS 6 HA LYS 6 -16.893 8.352 4.732 32 HB2 LYS 6 HB2 LYS 6 -17.113 7.064 6.887 33 HB3 LYS 6 HB1 LYS 6 -15.519 6.391 6.584 34 HG2 LYS 6 HG2 LYS 6 -15.408 8.220 8.164 35 HG3 LYS 6 HG1 LYS 6 -14.546 8.625 6.681 36 HD2 LYS 6 HD2 LYS 6 -16.253 10.085 5.969 37 HD3 LYS 6 HD1 LYS 6 -17.401 9.445 7.145 38 HE2 LYS 6 HE2 LYS 6 -14.900 10.993 7.812 39 HE3 LYS 6 HE1 LYS 6 -16.533 11.658 7.784 40 HZ1 LYS 6 HZ1 LYS 6 -15.908 11.095 10.025 41 HZ2 LYS 6 HZ2 LYS 6 -15.549 9.505 9.580 42 HZ3 LYS 6 HZ3 LYS 6 -17.144 10.059 9.520 43 H CYS 7 HN CYS 7 -14.984 5.471 4.192 44 HA CYS 7 HA CYS 7 -12.528 6.749 3.611 45 HB2 CYS 7 HB2 CYS 7 -13.647 4.049 2.841 46 HB3 CYS 7 HB1 CYS 7 -11.993 4.555 2.491 47 HG CYS 7 HG CYS 7 -13.406 3.879 5.517 48 H LYS 8 HN LYS 8 -12.010 7.936 1.883 49 HA LYS 8 HA LYS 8 -13.866 8.334 -0.225 50 HB2 LYS 8 HB2 LYS 8 -11.380 9.524 0.618 51 HB3 LYS 8 HB1 LYS 8 -11.562 9.437 -1.136 52 HG2 LYS 8 HG2 LYS 8 -13.096 11.015 -1.132 53 HG3 LYS 8 HG1 LYS 8 -14.029 10.203 0.108 54 HD2 LYS 8 HD2 LYS 8 -12.719 11.130 1.821 55 HD3 LYS 8 HD1 LYS 8 -11.603 11.879 0.675 56 HE2 LYS 8 HE2 LYS 8 -13.513 13.225 -0.190 57 HE3 LYS 8 HE1 LYS 8 -14.518 12.549 1.090 58 HZ1 LYS 8 HZ1 LYS 8 -12.082 14.205 1.473 59 HZ2 LYS 8 HZ2 LYS 8 -12.999 13.525 2.719 60 HZ3 LYS 8 HZ3 LYS 8 -13.679 14.708 1.718 61 HA PRO 9 HA PRO 9 -12.643 5.143 -2.926 62 HB2 PRO 9 HB2 PRO 9 -13.710 6.093 -5.237 63 HB3 PRO 9 HB1 PRO 9 -14.690 5.441 -3.922 64 HG2 PRO 9 HG2 PRO 9 -14.230 8.260 -4.726 65 HG3 PRO 9 HG1 PRO 9 -15.664 7.515 -4.002 66 HD2 PRO 9 HD2 PRO 9 -13.747 9.042 -2.641 67 HD3 PRO 9 HD1 PRO 9 -14.931 7.967 -1.876 68 H MET 10 HN MET 10 -10.626 4.808 -3.633 69 HA MET 10 HA MET 10 -8.970 7.030 -4.388 70 HB2 MET 10 HB2 MET 10 -8.143 5.104 -3.018 71 HB3 MET 10 HB1 MET 10 -8.286 4.085 -4.447 72 HG2 MET 10 HG2 MET 10 -6.081 4.623 -4.567 73 HG3 MET 10 HG1 MET 10 -6.772 5.945 -5.512 74 HE1 MET 10 HE1 MET 10 -5.509 4.749 -2.161 75 HE2 MET 10 HE2 MET 10 -6.836 5.678 -1.474 76 HE3 MET 10 HE3 MET 10 -5.169 6.208 -1.238 77 H SER 11 HN SER 11 -8.513 7.706 -6.389 78 HA SER 11 HA SER 11 -9.868 6.423 -8.589 79 HB2 SER 11 HB2 SER 11 -8.977 8.412 -9.877 80 HB3 SER 11 HB1 SER 11 -10.009 8.806 -8.506 81 HG SER 11 HG SER 11 -8.172 9.309 -7.301 82 H TYR 12 HN TYR 12 -8.528 6.466 -10.797 83 HA TYR 12 HA TYR 12 -6.671 4.369 -10.582 84 HB2 TYR 12 HB2 TYR 12 -7.485 4.234 -12.670 85 HB3 TYR 12 HB1 TYR 12 -7.936 5.934 -12.696 86 HD1 TYR 12 HD1 TYR 12 -4.975 3.698 -13.099 87 HD2 TYR 12 HD2 TYR 12 -6.816 7.386 -14.118 88 HE1 TYR 12 HE1 TYR 12 -3.192 4.127 -14.731 89 HE2 TYR 12 HE2 TYR 12 -5.035 7.831 -15.750 90 HH TYR 12 HH TYR 12 -2.798 7.194 -16.256 91 H GLU 13 HN GLU 13 -6.187 7.808 -11.331 92 HA GLU 13 HA GLU 13 -3.401 7.811 -11.582 93 HB2 GLU 13 HB2 GLU 13 -5.349 9.909 -10.590 94 HB3 GLU 13 HB1 GLU 13 -3.644 10.251 -10.848 95 HG2 GLU 13 HG2 GLU 13 -5.272 9.082 -13.063 96 HG3 GLU 13 HG1 GLU 13 -5.381 10.811 -12.707 97 H GLU 14 HN GLU 14 -5.460 7.891 -8.759 98 HA GLU 14 HA GLU 14 -3.401 8.582 -6.926 99 HB2 GLU 14 HB2 GLU 14 -6.224 7.638 -6.676 100 HB3 GLU 14 HB1 GLU 14 -5.196 7.756 -5.260 101 HG2 GLU 14 HG2 GLU 14 -4.830 10.156 -5.810 102 HG3 GLU 14 HG1 GLU 14 -6.000 9.985 -7.117 103 H LYS 15 HN LYS 15 -5.115 5.558 -7.708 104 HA LYS 15 HA LYS 15 -3.748 3.871 -5.959 105 HB2 LYS 15 HB2 LYS 15 -4.900 3.294 -8.681 106 HB3 LYS 15 HB1 LYS 15 -4.199 2.050 -7.652 107 HG2 LYS 15 HG2 LYS 15 -5.896 2.101 -6.157 108 HG3 LYS 15 HG1 LYS 15 -6.326 3.765 -6.533 109 HD2 LYS 15 HD2 LYS 15 -7.567 3.200 -8.331 110 HD3 LYS 15 HD1 LYS 15 -6.597 1.776 -8.701 111 HE2 LYS 15 HE2 LYS 15 -7.552 0.712 -6.669 112 HE3 LYS 15 HE1 LYS 15 -8.652 2.078 -6.517 113 HZ1 LYS 15 HZ1 LYS 15 -8.480 0.222 -8.838 114 HZ2 LYS 15 HZ2 LYS 15 -9.539 1.537 -8.706 115 HZ3 LYS 15 HZ3 LYS 15 -9.695 0.223 -7.658 116 H ARG 16 HN ARG 16 -2.858 4.986 -9.197 117 HA ARG 16 HA ARG 16 -0.488 3.488 -9.475 118 HB2 ARG 16 HB2 ARG 16 -1.455 4.670 -11.373 119 HB3 ARG 16 HB1 ARG 16 -1.158 6.212 -10.584 120 HG2 ARG 16 HG2 ARG 16 1.278 5.525 -10.556 121 HG3 ARG 16 HG1 ARG 16 0.821 4.294 -11.717 122 HD2 ARG 16 HD2 ARG 16 1.657 6.251 -12.851 123 HD3 ARG 16 HD1 ARG 16 -0.055 6.041 -13.165 124 HE ARG 16 HE ARG 16 0.954 7.951 -11.164 125 HH11 ARG 16 HH11 ARG 16 -1.092 7.150 -13.876 126 HH12 ARG 16 HH12 ARG 16 -1.951 8.661 -13.852 127 HH21 ARG 16 HH21 ARG 16 -0.162 9.955 -11.116 128 HH22 ARG 16 HH22 ARG 16 -1.413 10.261 -12.287 129 H GLN 17 HN GLN 17 -0.994 6.809 -8.316 130 HA GLN 17 HA GLN 17 1.647 7.359 -7.610 131 HB2 GLN 17 HB2 GLN 17 -0.298 8.976 -7.769 132 HB3 GLN 17 HB1 GLN 17 -0.778 8.416 -6.172 133 HG2 GLN 17 HG2 GLN 17 0.471 10.459 -5.970 134 HG3 GLN 17 HG1 GLN 17 1.405 9.121 -5.300 135 HE21 GLN 17 HE21 GLN 17 1.101 11.333 -7.973 136 HE22 GLN 17 HE22 GLN 17 2.712 11.140 -8.567 137 H LEU 18 HN LEU 18 -0.953 5.834 -5.872 138 HA LEU 18 HA LEU 18 0.186 5.504 -3.344 139 HB2 LEU 18 HB2 LEU 18 -2.180 4.993 -4.367 140 HB3 LEU 18 HB1 LEU 18 -1.503 3.406 -4.616 141 HG LEU 18 HG LEU 18 -2.033 4.795 -2.010 142 HD11 LEU 18 HD11 LEU 18 -3.299 2.597 -1.729 143 HD12 LEU 18 HD12 LEU 18 -3.123 2.432 -3.470 144 HD13 LEU 18 HD13 LEU 18 -3.977 3.818 -2.796 145 HD21 LEU 18 HD21 LEU 18 -0.122 3.733 -1.362 146 HD22 LEU 18 HD22 LEU 18 -0.255 2.494 -2.605 147 HD23 LEU 18 HD23 LEU 18 -1.273 2.414 -1.169 148 H SER 19 HN SER 19 0.207 3.317 -6.151 149 HA SER 19 HA SER 19 1.740 1.300 -4.949 150 HB2 SER 19 HB2 SER 19 1.779 0.299 -7.054 151 HB3 SER 19 HB1 SER 19 0.346 1.319 -7.146 152 HG SER 19 HG SER 19 1.738 2.936 -8.145 153 H LEU 20 HN LEU 20 2.572 4.348 -6.238 154 HA LEU 20 HA LEU 20 5.382 3.735 -6.553 155 HB2 LEU 20 HB2 LEU 20 3.843 6.283 -6.908 156 HB3 LEU 20 HB1 LEU 20 5.538 6.093 -7.280 157 HG LEU 20 HG LEU 20 3.214 4.789 -8.648 158 HD11 LEU 20 HD11 LEU 20 3.852 7.124 -9.208 159 HD12 LEU 20 HD12 LEU 20 3.897 5.995 -10.558 160 HD13 LEU 20 HD13 LEU 20 5.397 6.504 -9.778 161 HD21 LEU 20 HD21 LEU 20 4.884 3.110 -8.441 162 HD22 LEU 20 HD22 LEU 20 6.148 4.225 -8.960 163 HD23 LEU 20 HD23 LEU 20 4.902 3.708 -10.099 164 H ASP 21 HN ASP 21 3.257 5.432 -4.307 165 HA ASP 21 HA ASP 21 5.420 6.424 -2.688 166 HB2 ASP 21 HB2 ASP 21 3.739 7.135 -1.109 167 HB3 ASP 21 HB1 ASP 21 3.334 7.632 -2.728 168 H ILE 22 HN ILE 22 3.319 3.590 -2.579 169 HA ILE 22 HA ILE 22 4.398 2.426 -0.270 170 HB ILE 22 HB ILE 22 2.998 1.468 -2.685 171 HG12 ILE 22 HG12 ILE 22 2.654 0.800 0.222 172 HG13 ILE 22 HG11 ILE 22 1.911 2.190 -0.561 173 HG21 ILE 22 HG21 ILE 22 4.466 -0.476 -0.932 174 HG22 ILE 22 HG22 ILE 22 4.825 -0.131 -2.618 175 HG23 ILE 22 HG23 ILE 22 3.296 -0.886 -2.179 176 HD11 ILE 22 HD11 ILE 22 1.454 -0.661 -1.399 177 HD12 ILE 22 HD12 ILE 22 0.604 0.774 -1.963 178 HD13 ILE 22 HD13 ILE 22 0.411 0.235 -0.297 179 H ASN 23 HN ASN 23 5.485 2.516 -3.590 180 HA ASN 23 HA ASN 23 7.658 0.746 -3.336 181 HB2 ASN 23 HB2 ASN 23 6.745 1.311 -5.507 182 HB3 ASN 23 HB1 ASN 23 7.132 3.008 -5.271 183 HD21 ASN 23 HD21 ASN 23 9.152 3.735 -5.721 184 HD22 ASN 23 HD22 ASN 23 10.403 2.740 -6.386 185 H LYS 24 HN LYS 24 7.188 3.964 -2.287 186 HA LYS 24 HA LYS 24 9.969 4.707 -2.185 187 HB2 LYS 24 HB2 LYS 24 7.395 5.932 -1.340 188 HB3 LYS 24 HB1 LYS 24 8.890 6.559 -0.666 189 HG2 LYS 24 HG2 LYS 24 9.693 7.129 -2.860 190 HG3 LYS 24 HG1 LYS 24 8.298 6.349 -3.612 191 HD2 LYS 24 HD2 LYS 24 6.808 7.972 -2.746 192 HD3 LYS 24 HD1 LYS 24 8.030 8.623 -1.659 193 HE2 LYS 24 HE2 LYS 24 8.101 8.775 -4.678 194 HE3 LYS 24 HE1 LYS 24 7.650 10.083 -3.583 195 HZ1 LYS 24 HZ1 LYS 24 9.945 10.259 -4.340 196 HZ2 LYS 24 HZ2 LYS 24 10.303 8.755 -3.662 197 HZ3 LYS 24 HZ3 LYS 24 9.871 10.047 -2.665 198 H LEU 25 HN LEU 25 7.794 2.980 -0.185 199 HA LEU 25 HA LEU 25 8.974 3.593 2.332 200 HB2 LEU 25 HB2 LEU 25 7.203 1.330 1.432 201 HB3 LEU 25 HB1 LEU 25 7.755 1.525 3.084 202 HG LEU 25 HG LEU 25 5.863 3.270 1.540 203 HD11 LEU 25 HD11 LEU 25 5.765 1.945 4.221 204 HD12 LEU 25 HD12 LEU 25 4.994 1.326 2.760 205 HD13 LEU 25 HD13 LEU 25 4.451 2.847 3.476 206 HD21 LEU 25 HD21 LEU 25 7.241 3.904 4.124 207 HD22 LEU 25 HD22 LEU 25 5.910 4.821 3.427 208 HD23 LEU 25 HD23 LEU 25 7.467 4.760 2.603 209 HA PRO 26 HA PRO 26 12.450 0.756 2.222 210 HB2 PRO 26 HB2 PRO 26 12.902 0.686 4.912 211 HB3 PRO 26 HB1 PRO 26 13.456 2.008 3.880 212 HG2 PRO 26 HG2 PRO 26 11.072 1.859 5.672 213 HG3 PRO 26 HG1 PRO 26 12.164 3.221 5.394 214 HD2 PRO 26 HD2 PRO 26 9.703 3.032 4.242 215 HD3 PRO 26 HD1 PRO 26 11.063 3.866 3.464 216 H GLY 27 HN GLY 27 12.882 -1.422 3.002 217 HA2 GLY 27 HA2 GLY 27 10.746 -3.109 2.658 218 HA3 GLY 27 HA1 GLY 27 12.242 -3.584 3.437 219 H GLU 28 HN GLU 28 12.188 -2.235 5.783 220 HA GLU 28 HA GLU 28 10.507 -3.820 7.358 221 HB2 GLU 28 HB2 GLU 28 11.086 -1.944 9.121 222 HB3 GLU 28 HB1 GLU 28 12.277 -3.124 8.601 223 HG2 GLU 28 HG2 GLU 28 12.027 -0.486 7.242 224 HG3 GLU 28 HG1 GLU 28 12.906 -0.642 8.751 225 H LYS 29 HN LYS 29 10.098 -0.481 6.257 226 HA LYS 29 HA LYS 29 7.736 -0.050 7.823 227 HB2 LYS 29 HB2 LYS 29 9.300 1.470 5.844 228 HB3 LYS 29 HB1 LYS 29 7.588 1.842 5.877 229 HG2 LYS 29 HG2 LYS 29 8.900 3.354 7.278 230 HG3 LYS 29 HG1 LYS 29 7.723 2.434 8.213 231 HD2 LYS 29 HD2 LYS 29 9.315 1.257 9.321 232 HD3 LYS 29 HD1 LYS 29 10.459 1.315 7.973 233 HE2 LYS 29 HE2 LYS 29 11.188 2.654 9.916 234 HE3 LYS 29 HE1 LYS 29 10.973 3.620 8.454 235 HZ1 LYS 29 HZ1 LYS 29 8.858 4.388 9.295 236 HZ2 LYS 29 HZ2 LYS 29 10.049 4.681 10.457 237 HZ3 LYS 29 HZ3 LYS 29 8.981 3.388 10.652 238 H LEU 30 HN LEU 30 8.458 -1.323 4.683 239 HA LEU 30 HA LEU 30 5.765 -0.983 3.745 240 HB2 LEU 30 HB2 LEU 30 6.789 -1.009 1.825 241 HB3 LEU 30 HB1 LEU 30 8.294 -1.494 2.559 242 HG LEU 30 HG LEU 30 6.179 -3.360 1.464 243 HD11 LEU 30 HD11 LEU 30 7.826 -1.749 0.079 244 HD12 LEU 30 HD12 LEU 30 7.299 -3.331 -0.489 245 HD13 LEU 30 HD13 LEU 30 8.869 -3.154 0.292 246 HD21 LEU 30 HD21 LEU 30 7.537 -4.352 3.300 247 HD22 LEU 30 HD22 LEU 30 8.992 -3.972 2.383 248 HD23 LEU 30 HD23 LEU 30 7.819 -5.116 1.737 249 H GLY 31 HN GLY 31 7.393 -3.299 5.630 250 HA2 GLY 31 HA2 GLY 31 5.709 -5.531 5.140 251 HA3 GLY 31 HA1 GLY 31 6.555 -5.206 6.640 252 H ARG 32 HN ARG 32 5.153 -2.479 6.695 253 HA ARG 32 HA ARG 32 2.841 -3.284 8.151 254 HB2 ARG 32 HB2 ARG 32 3.969 -1.185 8.682 255 HB3 ARG 32 HB1 ARG 32 3.542 -0.546 7.108 256 HG2 ARG 32 HG2 ARG 32 1.567 0.117 7.853 257 HG3 ARG 32 HG1 ARG 32 1.198 -1.493 8.478 258 HD2 ARG 32 HD2 ARG 32 2.901 0.550 9.881 259 HD3 ARG 32 HD1 ARG 32 1.190 0.269 10.224 260 HE ARG 32 HE ARG 32 2.388 -2.179 10.494 261 HH11 ARG 32 HH11 ARG 32 2.788 0.976 11.946 262 HH12 ARG 32 HH12 ARG 32 3.454 0.354 13.423 263 HH21 ARG 32 HH21 ARG 32 3.251 -3.010 12.439 264 HH22 ARG 32 HH22 ARG 32 3.718 -1.918 13.704 265 H VAL 33 HN VAL 33 3.281 -1.875 4.890 266 HA VAL 33 HA VAL 33 0.533 -1.633 4.331 267 HB VAL 33 HB VAL 33 1.639 -2.269 1.865 268 HG11 VAL 33 HG11 VAL 33 1.166 0.308 3.318 269 HG12 VAL 33 HG12 VAL 33 0.139 -0.485 2.123 270 HG13 VAL 33 HG13 VAL 33 1.653 0.256 1.630 271 HG21 VAL 33 HG21 VAL 33 3.568 -0.421 3.203 272 HG22 VAL 33 HG22 VAL 33 3.708 -1.226 1.637 273 HG23 VAL 33 HG23 VAL 33 3.876 -2.156 3.128 274 H VAL 34 HN VAL 34 2.766 -4.262 3.566 275 HA VAL 34 HA VAL 34 0.996 -6.156 2.626 276 HB VAL 34 HB VAL 34 2.645 -7.666 2.899 277 HG11 VAL 34 HG11 VAL 34 3.909 -5.772 2.177 278 HG12 VAL 34 HG12 VAL 34 4.880 -6.769 3.256 279 HG13 VAL 34 HG13 VAL 34 4.163 -5.270 3.846 280 HG21 VAL 34 HG21 VAL 34 2.118 -8.135 5.211 281 HG22 VAL 34 HG22 VAL 34 3.099 -6.756 5.723 282 HG23 VAL 34 HG23 VAL 34 3.866 -8.143 4.950 283 H HIS 35 HN HIS 35 1.576 -5.218 6.009 284 HA HIS 35 HA HIS 35 -0.082 -7.256 7.104 285 HB2 HIS 35 HB2 HIS 35 1.698 -6.233 8.427 286 HB3 HIS 35 HB1 HIS 35 0.902 -4.667 8.323 287 HD1 HIS 35 HD1 HIS 35 0.539 -8.050 9.954 288 HD2 HIS 35 HD2 HIS 35 -1.110 -4.237 10.160 289 HE1 HIS 35 HE1 HIS 35 -0.904 -8.047 12.011 290 HE2 HIS 35 HE2 HIS 35 -1.748 -5.682 12.205 291 H ILE 36 HN ILE 36 -0.564 -3.781 6.509 292 HA ILE 36 HA ILE 36 -3.207 -3.589 7.391 293 HB ILE 36 HB ILE 36 -1.901 -2.132 5.076 294 HG12 ILE 36 HG12 ILE 36 -2.309 -1.193 7.915 295 HG13 ILE 36 HG11 ILE 36 -0.829 -1.965 7.374 296 HG21 ILE 36 HG21 ILE 36 -3.707 -0.687 4.991 297 HG22 ILE 36 HG22 ILE 36 -4.179 -1.038 6.657 298 HG23 ILE 36 HG23 ILE 36 -4.508 -2.212 5.389 299 HD11 ILE 36 HD11 ILE 36 -0.672 -0.133 5.660 300 HD12 ILE 36 HD12 ILE 36 -0.448 0.354 7.334 301 HD13 ILE 36 HD13 ILE 36 -1.976 0.661 6.522 302 H ILE 37 HN ILE 37 -1.886 -4.323 4.225 303 HA ILE 37 HA ILE 37 -4.293 -4.722 2.868 304 HB ILE 37 HB ILE 37 -1.477 -5.571 2.414 305 HG12 ILE 37 HG12 ILE 37 -3.217 -3.874 0.669 306 HG13 ILE 37 HG11 ILE 37 -2.425 -3.211 2.087 307 HG21 ILE 37 HG21 ILE 37 -3.823 -6.759 1.239 308 HG22 ILE 37 HG22 ILE 37 -2.128 -7.247 1.115 309 HG23 ILE 37 HG23 ILE 37 -2.776 -6.025 0.023 310 HD11 ILE 37 HD11 ILE 37 -1.075 -2.742 0.218 311 HD12 ILE 37 HD12 ILE 37 -1.130 -4.428 -0.310 312 HD13 ILE 37 HD13 ILE 37 -0.266 -3.993 1.164 313 H GLN 38 HN GLN 38 -2.048 -7.294 4.011 314 HA GLN 38 HA GLN 38 -3.661 -9.477 3.569 315 HB2 GLN 38 HB2 GLN 38 -1.753 -9.012 5.871 316 HB3 GLN 38 HB1 GLN 38 -2.481 -10.569 5.507 317 HG2 GLN 38 HG2 GLN 38 -1.352 -10.576 3.333 318 HG3 GLN 38 HG1 GLN 38 -0.653 -9.006 3.714 319 HE21 GLN 38 HE21 GLN 38 -1.114 -11.564 6.039 320 HE22 GLN 38 HE22 GLN 38 0.559 -11.892 6.300 321 H SER 39 HN SER 39 -3.829 -7.251 6.323 322 HA SER 39 HA SER 39 -5.643 -8.925 7.793 323 HB2 SER 39 HB2 SER 39 -5.754 -7.060 9.381 324 HB3 SER 39 HB1 SER 39 -4.086 -7.397 8.934 325 HG SER 39 HG SER 39 -4.000 -5.589 7.745 326 H ARG 40 HN ARG 40 -5.941 -5.943 5.890 327 HA ARG 40 HA ARG 40 -8.790 -5.814 6.287 328 HB2 ARG 40 HB2 ARG 40 -6.941 -4.225 4.497 329 HB3 ARG 40 HB1 ARG 40 -8.655 -3.883 4.704 330 HG2 ARG 40 HG2 ARG 40 -8.293 -3.533 7.055 331 HG3 ARG 40 HG1 ARG 40 -6.586 -3.899 6.884 332 HD2 ARG 40 HD2 ARG 40 -6.611 -1.591 6.874 333 HD3 ARG 40 HD1 ARG 40 -6.644 -1.973 5.151 334 HE ARG 40 HE ARG 40 -9.127 -1.677 5.337 335 HH11 ARG 40 HH11 ARG 40 -6.918 0.015 7.475 336 HH12 ARG 40 HH12 ARG 40 -8.092 1.201 7.948 337 HH21 ARG 40 HH21 ARG 40 -10.673 -0.150 5.999 338 HH22 ARG 40 HH22 ARG 40 -10.227 1.106 7.109 339 H GLU 41 HN GLU 41 -6.672 -7.354 4.165 340 HA GLU 41 HA GLU 41 -8.892 -8.187 2.411 341 HB2 GLU 41 HB2 GLU 41 -5.963 -8.321 1.712 342 HB3 GLU 41 HB1 GLU 41 -7.345 -8.474 0.635 343 HG2 GLU 41 HG2 GLU 41 -6.582 -5.950 2.066 344 HG3 GLU 41 HG1 GLU 41 -6.086 -6.366 0.423 345 HA PRO 42 HA PRO 42 -7.161 -11.630 5.002 346 HB2 PRO 42 HB2 PRO 42 -9.695 -12.820 5.353 347 HB3 PRO 42 HB1 PRO 42 -8.780 -11.905 6.544 348 HG2 PRO 42 HG2 PRO 42 -11.163 -11.143 5.117 349 HG3 PRO 42 HG1 PRO 42 -10.321 -10.269 6.400 350 HD2 PRO 42 HD2 PRO 42 -10.391 -9.674 3.593 351 HD3 PRO 42 HD1 PRO 42 -9.560 -8.798 4.885 352 H SER 43 HN SER 43 -8.815 -11.422 2.092 353 HA SER 43 HA SER 43 -8.941 -14.180 1.411 354 HB2 SER 43 HB2 SER 43 -9.111 -13.255 -0.945 355 HB3 SER 43 HB1 SER 43 -10.320 -12.653 0.188 356 HG SER 43 HG SER 43 -8.305 -11.316 -1.120 357 H LEU 44 HN LEU 44 -6.424 -11.779 1.451 358 HA LEU 44 HA LEU 44 -4.660 -13.651 0.024 359 HB2 LEU 44 HB2 LEU 44 -3.190 -11.718 -0.414 360 HB3 LEU 44 HB1 LEU 44 -4.771 -11.541 -1.113 361 HG LEU 44 HG LEU 44 -5.128 -10.202 1.189 362 HD11 LEU 44 HD11 LEU 44 -3.124 -8.767 1.433 363 HD12 LEU 44 HD12 LEU 44 -2.238 -9.904 0.421 364 HD13 LEU 44 HD13 LEU 44 -2.890 -10.428 1.974 365 HD21 LEU 44 HD21 LEU 44 -5.707 -9.398 -1.009 366 HD22 LEU 44 HD22 LEU 44 -4.005 -9.194 -1.422 367 HD23 LEU 44 HD23 LEU 44 -4.741 -8.178 -0.182 368 H LYS 45 HN LYS 45 -5.523 -13.432 2.928 369 HA LYS 45 HA LYS 45 -3.241 -12.878 4.509 370 HB2 LYS 45 HB2 LYS 45 -5.699 -13.584 5.291 371 HB3 LYS 45 HB1 LYS 45 -4.979 -15.198 5.358 372 HG2 LYS 45 HG2 LYS 45 -3.397 -14.538 6.986 373 HG3 LYS 45 HG1 LYS 45 -3.828 -12.824 6.819 374 HD2 LYS 45 HD2 LYS 45 -4.812 -13.764 8.823 375 HD3 LYS 45 HD1 LYS 45 -6.094 -13.406 7.663 376 HE2 LYS 45 HE2 LYS 45 -6.204 -15.699 6.989 377 HE3 LYS 45 HE1 LYS 45 -4.792 -16.088 7.970 378 HZ1 LYS 45 HZ1 LYS 45 -6.859 -16.772 9.034 379 HZ2 LYS 45 HZ2 LYS 45 -7.427 -15.180 9.008 380 HZ3 LYS 45 HZ3 LYS 45 -6.083 -15.582 9.952 381 H ASN 46 HN ASN 46 -3.847 -15.443 2.321 382 HA ASN 46 HA ASN 46 -2.081 -17.381 3.446 383 HB2 ASN 46 HB2 ASN 46 -2.270 -18.513 1.219 384 HB3 ASN 46 HB1 ASN 46 -3.847 -18.056 1.864 385 HD21 ASN 46 HD21 ASN 46 -2.866 -18.561 -0.885 386 HD22 ASN 46 HD22 ASN 46 -3.300 -17.147 -1.791 387 H SER 47 HN SER 47 -1.582 -14.463 1.834 388 HA SER 47 HA SER 47 0.892 -15.200 0.538 389 HB2 SER 47 HB2 SER 47 -0.445 -12.519 0.934 390 HB3 SER 47 HB1 SER 47 0.993 -12.785 -0.054 391 HG SER 47 HG SER 47 -1.158 -14.443 -0.598 392 H ASN 48 HN ASN 48 2.935 -14.731 1.209 393 HA ASN 48 HA ASN 48 3.366 -14.367 4.025 394 HB2 ASN 48 HB2 ASN 48 5.344 -14.435 1.743 395 HB3 ASN 48 HB1 ASN 48 5.741 -14.561 3.449 396 HD21 ASN 48 HD21 ASN 48 5.643 -16.501 4.420 397 HD22 ASN 48 HD22 ASN 48 5.199 -17.962 3.610 398 HA PRO 49 HA PRO 49 3.560 -10.037 4.257 399 HB2 PRO 49 HB2 PRO 49 5.483 -9.680 6.172 400 HB3 PRO 49 HB1 PRO 49 3.830 -10.193 6.512 401 HG2 PRO 49 HG2 PRO 49 6.308 -11.839 6.265 402 HG3 PRO 49 HG1 PRO 49 4.985 -11.962 7.439 403 HD2 PRO 49 HD2 PRO 49 5.171 -13.625 5.339 404 HD3 PRO 49 HD1 PRO 49 3.603 -13.075 5.958 405 H ASP 50 HN ASP 50 6.677 -11.630 3.761 406 HA ASP 50 HA ASP 50 7.844 -9.086 2.874 407 HB2 ASP 50 HB2 ASP 50 9.988 -10.206 2.993 408 HB3 ASP 50 HB1 ASP 50 9.081 -10.710 4.411 409 H GLU 51 HN GLU 51 5.977 -11.338 1.594 410 HA GLU 51 HA GLU 51 7.163 -11.114 -1.073 411 HB2 GLU 51 HB2 GLU 51 6.035 -13.535 0.309 412 HB3 GLU 51 HB1 GLU 51 6.277 -13.448 -1.412 413 HG2 GLU 51 HG2 GLU 51 8.634 -13.249 -1.147 414 HG3 GLU 51 HG1 GLU 51 8.488 -13.083 0.602 415 H ILE 52 HN ILE 52 5.087 -9.597 0.288 416 HA ILE 52 HA ILE 52 2.534 -10.631 -0.382 417 HB ILE 52 HB ILE 52 3.241 -8.913 1.477 418 HG12 ILE 52 HG12 ILE 52 0.903 -8.196 1.627 419 HG13 ILE 52 HG11 ILE 52 0.632 -8.691 -0.033 420 HG21 ILE 52 HG21 ILE 52 2.396 -7.119 -0.776 421 HG22 ILE 52 HG22 ILE 52 4.011 -7.189 -0.073 422 HG23 ILE 52 HG23 ILE 52 2.649 -6.621 0.892 423 HD11 ILE 52 HD11 ILE 52 1.425 -10.514 2.186 424 HD12 ILE 52 HD12 ILE 52 0.973 -10.975 0.549 425 HD13 ILE 52 HD13 ILE 52 -0.224 -10.268 1.629 426 H GLU 53 HN GLU 53 1.035 -9.855 -1.779 427 HA GLU 53 HA GLU 53 2.091 -8.423 -4.124 428 HB2 GLU 53 HB2 GLU 53 -0.142 -10.460 -3.934 429 HB3 GLU 53 HB1 GLU 53 0.250 -9.553 -5.388 430 HG2 GLU 53 HG2 GLU 53 2.219 -11.332 -3.990 431 HG3 GLU 53 HG1 GLU 53 1.140 -11.904 -5.266 432 H ILE 54 HN ILE 54 1.546 -6.342 -3.584 433 HA ILE 54 HA ILE 54 -1.006 -5.695 -2.459 434 HB ILE 54 HB ILE 54 1.025 -3.865 -3.744 435 HG12 ILE 54 HG12 ILE 54 0.735 -4.732 -0.863 436 HG13 ILE 54 HG11 ILE 54 2.111 -5.012 -1.923 437 HG21 ILE 54 HG21 ILE 54 -1.197 -3.287 -1.817 438 HG22 ILE 54 HG22 ILE 54 -1.206 -2.919 -3.538 439 HG23 ILE 54 HG23 ILE 54 -0.057 -2.115 -2.469 440 HD11 ILE 54 HD11 ILE 54 2.609 -3.185 -0.392 441 HD12 ILE 54 HD12 ILE 54 1.148 -2.358 -0.898 442 HD13 ILE 54 HD13 ILE 54 2.471 -2.575 -2.037 443 H ASP 55 HN ASP 55 -2.697 -6.131 -3.797 444 HA ASP 55 HA ASP 55 -2.524 -5.211 -6.580 445 HB2 ASP 55 HB2 ASP 55 -3.130 -7.601 -6.286 446 HB3 ASP 55 HB1 ASP 55 -4.536 -7.109 -5.343 447 H PHE 56 HN PHE 56 -3.152 -3.196 -6.707 448 HA PHE 56 HA PHE 56 -4.729 -1.975 -4.697 449 HB2 PHE 56 HB2 PHE 56 -3.731 -0.924 -7.331 450 HB3 PHE 56 HB1 PHE 56 -4.457 0.065 -6.068 451 HD1 PHE 56 HD1 PHE 56 -3.326 0.201 -3.863 452 HD2 PHE 56 HD2 PHE 56 -1.443 -1.542 -7.229 453 HE1 PHE 56 HE1 PHE 56 -1.191 0.448 -2.744 454 HE2 PHE 56 HE2 PHE 56 0.740 -1.297 -6.113 455 HZ PHE 56 HZ PHE 56 0.854 -0.292 -3.858 456 H GLU 57 HN GLU 57 -5.577 -3.656 -7.475 457 HA GLU 57 HA GLU 57 -8.009 -2.198 -8.004 458 HB2 GLU 57 HB2 GLU 57 -6.815 -4.729 -9.098 459 HB3 GLU 57 HB1 GLU 57 -8.429 -4.191 -9.554 460 HG2 GLU 57 HG2 GLU 57 -5.877 -2.639 -9.929 461 HG3 GLU 57 HG1 GLU 57 -6.762 -3.510 -11.184 462 H THR 58 HN THR 58 -7.032 -4.976 -6.148 463 HA THR 58 HA THR 58 -9.837 -5.591 -5.586 464 HB THR 58 HB THR 58 -8.870 -7.598 -4.382 465 HG1 THR 58 HG1 THR 58 -6.511 -6.946 -5.848 466 HG21 THR 58 HG21 THR 58 -8.343 -7.250 -7.332 467 HG22 THR 58 HG22 THR 58 -9.839 -7.818 -6.586 468 HG23 THR 58 HG23 THR 58 -8.378 -8.802 -6.493 469 H LEU 59 HN LEU 59 -6.984 -4.226 -4.143 470 HA LEU 59 HA LEU 59 -7.596 -4.343 -1.437 471 HB2 LEU 59 HB2 LEU 59 -6.286 -2.139 -2.982 472 HB3 LEU 59 HB1 LEU 59 -6.353 -2.225 -1.239 473 HG LEU 59 HG LEU 59 -5.014 -4.209 -3.055 474 HD11 LEU 59 HD11 LEU 59 -3.857 -2.312 -1.040 475 HD12 LEU 59 HD12 LEU 59 -3.842 -2.067 -2.785 476 HD13 LEU 59 HD13 LEU 59 -2.976 -3.428 -2.078 477 HD21 LEU 59 HD21 LEU 59 -5.531 -4.191 -0.094 478 HD22 LEU 59 HD22 LEU 59 -4.171 -5.071 -0.808 479 HD23 LEU 59 HD23 LEU 59 -5.820 -5.476 -1.278 480 H LYS 60 HN LYS 60 -9.174 -3.485 -0.228 481 HA LYS 60 HA LYS 60 -11.333 -2.033 -1.304 482 HB2 LYS 60 HB2 LYS 60 -10.389 -2.248 1.563 483 HB3 LYS 60 HB1 LYS 60 -11.953 -1.613 1.074 484 HG2 LYS 60 HG2 LYS 60 -12.621 -3.751 0.260 485 HG3 LYS 60 HG1 LYS 60 -11.005 -4.396 0.484 486 HD2 LYS 60 HD2 LYS 60 -11.271 -3.933 2.920 487 HD3 LYS 60 HD1 LYS 60 -12.957 -3.551 2.595 488 HE2 LYS 60 HE2 LYS 60 -13.421 -5.751 1.881 489 HE3 LYS 60 HE1 LYS 60 -11.708 -6.160 1.784 490 HZ1 LYS 60 HZ1 LYS 60 -13.149 -5.530 4.301 491 HZ2 LYS 60 HZ2 LYS 60 -11.545 -6.055 4.157 492 HZ3 LYS 60 HZ3 LYS 60 -12.814 -7.093 3.748 493 HA PRO 61 HA PRO 61 -9.961 2.232 -1.606 494 HB2 PRO 61 HB2 PRO 61 -12.535 2.674 -0.149 495 HB3 PRO 61 HB1 PRO 61 -11.877 3.526 -1.551 496 HG2 PRO 61 HG2 PRO 61 -13.781 1.697 -1.843 497 HG3 PRO 61 HG1 PRO 61 -12.471 1.878 -3.017 498 HD2 PRO 61 HD2 PRO 61 -12.924 -0.275 -1.027 499 HD3 PRO 61 HD1 PRO 61 -12.050 -0.326 -2.573 500 H SER 62 HN SER 62 -11.407 0.993 1.348 501 HA SER 62 HA SER 62 -10.403 2.858 3.165 502 HB2 SER 62 HB2 SER 62 -10.945 -0.070 3.676 503 HB3 SER 62 HB1 SER 62 -10.989 1.245 4.853 504 HG SER 62 HG SER 62 -12.806 2.054 3.880 505 H THR 63 HN THR 63 -9.071 -0.324 2.170 506 HA THR 63 HA THR 63 -6.726 -0.167 3.724 507 HB THR 63 HB THR 63 -6.703 -1.528 1.043 508 HG1 THR 63 HG1 THR 63 -7.981 -3.192 1.838 509 HG21 THR 63 HG21 THR 63 -4.743 -2.188 1.984 510 HG22 THR 63 HG22 THR 63 -5.774 -3.301 2.895 511 HG23 THR 63 HG23 THR 63 -5.295 -1.766 3.609 512 H LEU 64 HN LEU 64 -7.415 0.736 0.363 513 HA LEU 64 HA LEU 64 -4.840 1.486 -0.376 514 HB2 LEU 64 HB2 LEU 64 -7.492 2.558 -1.312 515 HB3 LEU 64 HB1 LEU 64 -5.970 2.870 -2.108 516 HG LEU 64 HG LEU 64 -7.102 0.110 -1.709 517 HD11 LEU 64 HD11 LEU 64 -7.796 2.194 -3.597 518 HD12 LEU 64 HD12 LEU 64 -8.603 0.666 -3.254 519 HD13 LEU 64 HD13 LEU 64 -7.252 0.716 -4.388 520 HD21 LEU 64 HD21 LEU 64 -4.758 1.262 -3.180 521 HD22 LEU 64 HD22 LEU 64 -5.498 -0.257 -3.689 522 HD23 LEU 64 HD23 LEU 64 -4.819 -0.108 -2.067 523 H ARG 65 HN ARG 65 -7.442 3.520 1.002 524 HA ARG 65 HA ARG 65 -5.905 5.889 1.031 525 HB2 ARG 65 HB2 ARG 65 -8.277 5.039 2.677 526 HB3 ARG 65 HB1 ARG 65 -7.548 6.636 2.782 527 HG2 ARG 65 HG2 ARG 65 -8.720 5.437 0.283 528 HG3 ARG 65 HG1 ARG 65 -9.543 6.571 1.347 529 HD2 ARG 65 HD2 ARG 65 -7.861 8.263 0.885 530 HD3 ARG 65 HD1 ARG 65 -6.982 7.131 -0.138 531 HE ARG 65 HE ARG 65 -9.705 7.485 -0.954 532 HH11 ARG 65 HH11 ARG 65 -6.494 8.888 -1.178 533 HH12 ARG 65 HH12 ARG 65 -6.797 9.631 -2.722 534 HH21 ARG 65 HH21 ARG 65 -10.085 8.490 -2.979 535 HH22 ARG 65 HH22 ARG 65 -8.813 9.394 -3.740 536 H GLU 66 HN GLU 66 -6.225 3.215 3.294 537 HA GLU 66 HA GLU 66 -4.756 4.397 5.405 538 HB2 GLU 66 HB2 GLU 66 -6.147 2.444 5.786 539 HB3 GLU 66 HB1 GLU 66 -5.201 1.501 4.642 540 HG2 GLU 66 HG2 GLU 66 -4.530 0.819 6.779 541 HG3 GLU 66 HG1 GLU 66 -3.232 1.833 6.153 542 H LEU 67 HN LEU 67 -3.768 2.038 2.899 543 HA LEU 67 HA LEU 67 -1.049 1.929 3.315 544 HB2 LEU 67 HB2 LEU 67 -2.216 2.124 0.528 545 HB3 LEU 67 HB1 LEU 67 -0.845 1.170 1.086 546 HG LEU 67 HG LEU 67 -3.691 0.618 1.895 547 HD11 LEU 67 HD11 LEU 67 -2.194 -1.165 0.103 548 HD12 LEU 67 HD12 LEU 67 -2.821 0.324 -0.601 549 HD13 LEU 67 HD13 LEU 67 -3.920 -0.820 0.174 550 HD21 LEU 67 HD21 LEU 67 -1.375 -0.156 3.106 551 HD22 LEU 67 HD22 LEU 67 -1.670 -1.483 1.991 552 HD23 LEU 67 HD23 LEU 67 -2.898 -1.039 3.174 553 H GLU 68 HN GLU 68 -2.741 4.224 1.166 554 HA GLU 68 HA GLU 68 -0.556 5.785 0.432 555 HB2 GLU 68 HB2 GLU 68 -2.790 5.908 -0.616 556 HB3 GLU 68 HB1 GLU 68 -3.422 6.674 0.830 557 HG2 GLU 68 HG2 GLU 68 -1.763 8.511 0.454 558 HG3 GLU 68 HG1 GLU 68 -1.424 7.777 -1.114 559 H ARG 69 HN ARG 69 -2.963 6.550 2.960 560 HA ARG 69 HA ARG 69 -1.664 8.818 3.975 561 HB2 ARG 69 HB2 ARG 69 -3.707 6.916 4.986 562 HB3 ARG 69 HB1 ARG 69 -3.058 8.111 6.089 563 HG2 ARG 69 HG2 ARG 69 -3.947 9.118 3.472 564 HG3 ARG 69 HG1 ARG 69 -5.218 8.506 4.532 565 HD2 ARG 69 HD2 ARG 69 -4.827 10.923 4.803 566 HD3 ARG 69 HD1 ARG 69 -4.530 10.015 6.283 567 HE ARG 69 HE ARG 69 -2.215 10.569 4.615 568 HH11 ARG 69 HH11 ARG 69 -4.163 11.521 7.362 569 HH12 ARG 69 HH12 ARG 69 -2.881 12.403 8.126 570 HH21 ARG 69 HH21 ARG 69 -0.523 11.701 5.619 571 HH22 ARG 69 HH22 ARG 69 -0.804 12.505 7.133 572 H TYR 70 HN TYR 70 -1.123 5.449 4.530 573 HA TYR 70 HA TYR 70 0.335 5.746 6.960 574 HB2 TYR 70 HB2 TYR 70 -0.540 3.587 6.545 575 HB3 TYR 70 HB1 TYR 70 0.134 3.553 4.921 576 HD1 TYR 70 HD2 TYR 70 1.383 4.040 8.407 577 HD2 TYR 70 HD1 TYR 70 1.925 2.232 4.611 578 HE1 TYR 70 HE2 TYR 70 3.428 2.960 9.234 579 HE2 TYR 70 HE1 TYR 70 3.956 1.128 5.412 580 HH TYR 70 HH TYR 70 5.529 1.144 7.093 581 H VAL 71 HN VAL 71 1.279 5.269 3.553 582 HA VAL 71 HA VAL 71 4.045 5.410 4.040 583 HB VAL 71 HB VAL 71 4.392 5.724 1.723 584 HG11 VAL 71 HG11 VAL 71 2.662 4.221 0.637 585 HG12 VAL 71 HG12 VAL 71 1.973 4.059 2.255 586 HG13 VAL 71 HG13 VAL 71 3.634 3.553 1.944 587 HG21 VAL 71 HG21 VAL 71 2.768 6.478 0.171 588 HG22 VAL 71 HG22 VAL 71 2.954 7.671 1.452 589 HG23 VAL 71 HG23 VAL 71 1.547 6.604 1.430 590 H THR 72 HN THR 72 1.563 7.869 3.631 591 HA THR 72 HA THR 72 3.315 9.975 3.033 592 HB THR 72 HB THR 72 1.517 11.524 3.628 593 HG1 THR 72 HG1 THR 72 0.524 9.288 4.945 594 HG21 THR 72 HG21 THR 72 1.037 9.134 1.935 595 HG22 THR 72 HG22 THR 72 1.319 10.813 1.456 596 HG23 THR 72 HG23 THR 72 -0.248 10.333 2.114 597 H SER 73 HN SER 73 2.445 8.453 6.009 598 HA SER 73 HA SER 73 3.370 10.509 7.733 599 HB2 SER 73 HB2 SER 73 3.069 8.960 9.490 600 HB3 SER 73 HB1 SER 73 1.845 8.523 8.290 601 HG SER 73 HG SER 73 3.117 6.811 7.632 602 H CYS 74 HN CYS 74 4.878 8.068 5.835 603 HA CYS 74 HA CYS 74 7.477 8.486 7.143 604 HB2 CYS 74 HB2 CYS 74 6.910 6.157 6.824 605 HB3 CYS 74 HB1 CYS 74 6.593 6.431 5.114 606 HG CYS 74 HG CYS 74 9.536 7.422 5.219 607 H LEU 75 HN LEU 75 5.739 9.260 4.262 608 HA LEU 75 HA LEU 75 8.192 9.941 2.836 609 HB2 LEU 75 HB2 LEU 75 5.362 9.817 1.821 610 HB3 LEU 75 HB1 LEU 75 6.797 9.995 0.854 611 HG LEU 75 HG LEU 75 5.890 7.567 2.351 612 HD11 LEU 75 HD11 LEU 75 5.044 8.151 0.023 613 HD12 LEU 75 HD12 LEU 75 5.767 6.557 0.239 614 HD13 LEU 75 HD13 LEU 75 6.691 7.846 -0.523 615 HD21 LEU 75 HD21 LEU 75 7.959 6.491 1.799 616 HD22 LEU 75 HD22 LEU 75 8.327 7.958 2.697 617 HD23 LEU 75 HD23 LEU 75 8.535 7.922 0.947 618 H ARG 76 HN ARG 76 5.018 11.365 3.578 619 HA ARG 76 HA ARG 76 5.882 13.956 2.656 620 HB2 ARG 76 HB2 ARG 76 3.320 12.992 3.884 621 HB3 ARG 76 HB1 ARG 76 3.605 14.669 3.436 622 HG2 ARG 76 HG2 ARG 76 4.050 13.903 1.115 623 HG3 ARG 76 HG1 ARG 76 3.585 12.279 1.629 624 HD2 ARG 76 HD2 ARG 76 1.723 13.393 0.565 625 HD3 ARG 76 HD1 ARG 76 1.411 13.094 2.268 626 HE ARG 76 HE ARG 76 2.190 15.553 2.490 627 HH11 ARG 76 HH11 ARG 76 0.361 14.228 -0.179 628 HH12 ARG 76 HH12 ARG 76 -0.512 15.695 -0.478 629 HH21 ARG 76 HH21 ARG 76 1.047 17.495 2.102 630 HH22 ARG 76 HH22 ARG 76 -0.107 17.563 0.807 631 H LYS 77 HN LYS 77 6.085 12.175 5.456 632 HA LYS 77 HA LYS 77 6.807 14.564 7.006 633 HB2 LYS 77 HB2 LYS 77 4.636 13.315 7.694 634 HB3 LYS 77 HB1 LYS 77 5.710 12.043 8.252 635 HG2 LYS 77 HG2 LYS 77 5.879 14.887 9.210 636 HG3 LYS 77 HG1 LYS 77 4.912 13.645 10.004 637 HD2 LYS 77 HD2 LYS 77 6.989 12.292 10.263 638 HD3 LYS 77 HD1 LYS 77 7.904 13.654 9.613 639 HE2 LYS 77 HE2 LYS 77 8.007 13.701 12.020 640 HE3 LYS 77 HE1 LYS 77 7.040 15.061 11.452 641 HZ1 LYS 77 HZ1 LYS 77 5.040 13.799 11.968 642 HZ2 LYS 77 HZ2 LYS 77 6.005 13.986 13.340 643 HZ3 LYS 77 HZ3 LYS 77 5.975 12.504 12.524 644 H LYS 78 HN LYS 78 8.880 14.535 7.540 645 HA LYS 78 HA LYS 78 10.986 13.820 8.119 646 HB2 LYS 78 HB2 LYS 78 9.803 12.040 9.475 647 HB3 LYS 78 HB1 LYS 78 9.921 10.993 8.076 648 HG2 LYS 78 HG2 LYS 78 11.698 10.380 9.479 649 HG3 LYS 78 HG1 LYS 78 12.417 11.331 8.178 650 HD2 LYS 78 HD2 LYS 78 13.413 12.043 10.222 651 HD3 LYS 78 HD1 LYS 78 12.317 13.319 9.693 652 HE2 LYS 78 HE2 LYS 78 10.606 12.455 11.243 653 HE3 LYS 78 HE1 LYS 78 11.752 11.238 11.802 654 HZ1 LYS 78 HZ1 LYS 78 12.005 14.179 12.068 655 HZ2 LYS 78 HZ2 LYS 78 13.227 13.081 12.470 656 HZ3 LYS 78 HZ3 LYS 78 11.763 13.061 13.313 657 H ARG 79 HN ARG 79 12.841 13.069 6.999 658 HA ARG 79 HA ARG 79 12.322 11.582 4.530 659 HB2 ARG 79 HB2 ARG 79 14.240 12.869 3.483 660 HB3 ARG 79 HB1 ARG 79 12.718 13.718 3.659 661 HG2 ARG 79 HG2 ARG 79 14.291 15.295 4.275 662 HG3 ARG 79 HG1 ARG 79 13.728 14.666 5.821 663 HD2 ARG 79 HD2 ARG 79 15.687 13.177 5.898 664 HD3 ARG 79 HD1 ARG 79 16.255 13.873 4.380 665 HE ARG 79 HE ARG 79 16.009 16.052 5.911 666 HH11 ARG 79 HH11 ARG 79 17.467 12.942 6.569 667 HH12 ARG 79 HH12 ARG 79 18.672 13.585 7.634 668 HH21 ARG 79 HH21 ARG 79 17.593 16.909 7.313 669 HH22 ARG 79 HH22 ARG 79 18.737 15.844 8.070 670 H LYS 80 HN LYS 80 13.666 9.933 4.099 671 HA LYS 80 HA LYS 80 15.031 8.197 4.586 672 HB2 LYS 80 HB2 LYS 80 16.821 10.342 5.749 673 HB3 LYS 80 HB1 LYS 80 17.313 8.702 5.353 674 HG2 LYS 80 HG2 LYS 80 16.334 10.767 3.393 675 HG3 LYS 80 HG1 LYS 80 18.014 10.302 3.650 676 HD2 LYS 80 HD2 LYS 80 15.947 8.268 2.878 677 HD3 LYS 80 HD1 LYS 80 16.719 9.278 1.662 678 HE2 LYS 80 HE2 LYS 80 17.937 7.243 1.755 679 HE3 LYS 80 HE1 LYS 80 18.930 8.474 2.526 680 HZ1 LYS 80 HZ1 LYS 80 17.215 6.574 4.025 681 HZ2 LYS 80 HZ2 LYS 80 18.387 7.616 4.657 682 HZ3 LYS 80 HZ3 LYS 80 18.850 6.305 3.701 683 HA PRO 81 HA PRO 81 13.429 8.018 8.890 684 HB2 PRO 81 HB2 PRO 81 12.169 5.629 8.617 685 HB3 PRO 81 HB1 PRO 81 11.429 7.162 8.144 686 HG2 PRO 81 HG2 PRO 81 12.728 5.080 6.449 687 HG3 PRO 81 HG1 PRO 81 11.290 6.063 6.118 688 HD2 PRO 81 HD2 PRO 81 13.770 6.579 5.082 689 HD3 PRO 81 HD1 PRO 81 12.526 7.817 5.329 690 H GLN 82 HN GLN 82 15.721 7.804 9.363 691 HA GLN 82 HA GLN 82 16.976 5.224 9.358 692 HB2 GLN 82 HB2 GLN 82 17.679 7.731 10.905 693 HB3 GLN 82 HB1 GLN 82 18.722 6.333 10.682 694 HG2 GLN 82 HG2 GLN 82 18.984 6.765 8.383 695 HG3 GLN 82 HG1 GLN 82 17.664 7.934 8.376 696 HE21 GLN 82 HE21 GLN 82 20.986 7.365 9.212 697 HE22 GLN 82 HE22 GLN 82 21.407 9.022 9.482 698 H ALA 83 HN ALA 83 15.705 7.332 11.917 699 HA ALA 83 HA ALA 83 15.464 4.976 13.655 700 HB1 ALA 83 HB1 ALA 83 15.471 7.908 14.369 701 HB2 ALA 83 HB2 ALA 83 16.807 6.778 14.591 702 HB3 ALA 83 HB3 ALA 83 15.318 6.575 15.512 703 H1 VAL 201 HT1 VAL 201 -6.005 0.984 -16.706 704 H2 VAL 201 HT2 VAL 201 -4.526 1.763 -16.453 705 H3 VAL 201 HT3 VAL 201 -5.666 1.692 -15.210 706 HA VAL 201 HA VAL 201 -5.440 -0.664 -15.045 707 HB VAL 201 HB VAL 201 -3.583 -1.791 -16.302 708 HG11 VAL 201 HG11 VAL 201 -5.917 -2.104 -16.931 709 HG12 VAL 201 HG12 VAL 201 -4.883 -2.089 -18.359 710 HG13 VAL 201 HG13 VAL 201 -5.846 -0.668 -17.954 711 HG21 VAL 201 HG21 VAL 201 -2.789 -0.775 -18.369 712 HG22 VAL 201 HG22 VAL 201 -2.362 0.223 -16.979 713 HG23 VAL 201 HG23 VAL 201 -3.709 0.687 -18.018 714 H VAL 202 HN VAL 202 -4.325 -1.175 -13.279 715 HA VAL 202 HA VAL 202 -1.834 0.299 -12.719 716 HB VAL 202 HB VAL 202 -3.834 -0.839 -10.748 717 HG11 VAL 202 HG11 VAL 202 -2.439 0.231 -9.024 718 HG12 VAL 202 HG12 VAL 202 -1.253 0.646 -10.260 719 HG13 VAL 202 HG13 VAL 202 -1.577 -1.046 -9.883 720 HG21 VAL 202 HG21 VAL 202 -3.092 2.032 -11.298 721 HG22 VAL 202 HG22 VAL 202 -4.299 1.455 -10.148 722 HG23 VAL 202 HG23 VAL 202 -4.557 1.240 -11.879 723 HA PRO 203 HA PRO 203 0.054 -3.718 -13.177 724 HB2 PRO 203 HB2 PRO 203 2.488 -3.005 -12.119 725 HB3 PRO 203 HB1 PRO 203 2.003 -2.696 -13.789 726 HG2 PRO 203 HG2 PRO 203 1.977 -0.853 -11.435 727 HG3 PRO 203 HG1 PRO 203 2.453 -0.525 -13.112 728 HD2 PRO 203 HD2 PRO 203 0.067 0.236 -12.139 729 HD3 PRO 203 HD1 PRO 203 0.264 -0.299 -13.821 730 H LYS 204 HN LYS 204 0.699 -5.433 -11.861 731 HA LYS 204 HA LYS 204 -0.277 -5.300 -9.152 732 HB2 LYS 204 HB2 LYS 204 0.943 -7.549 -10.765 733 HB3 LYS 204 HB1 LYS 204 0.439 -7.733 -9.094 734 HG2 LYS 204 HG2 LYS 204 -1.319 -8.595 -10.387 735 HG3 LYS 204 HG1 LYS 204 -1.870 -7.008 -9.846 736 HD2 LYS 204 HD2 LYS 204 -2.469 -6.933 -12.061 737 HD3 LYS 204 HD1 LYS 204 -0.853 -6.235 -12.149 738 HE2 LYS 204 HE2 LYS 204 -1.560 -9.119 -12.679 739 HE3 LYS 204 HE1 LYS 204 -1.242 -7.904 -13.910 740 HZ1 LYS 204 HZ1 LYS 204 1.016 -7.689 -13.007 741 HZ2 LYS 204 HZ2 LYS 204 0.693 -9.248 -13.565 742 HZ3 LYS 204 HZ3 LYS 204 0.693 -8.934 -11.906 743 H LYS 205 HN LYS 205 0.927 -4.780 -7.448 744 HA LYS 205 HA LYS 205 3.732 -4.263 -7.876 745 HB2 LYS 205 HB2 LYS 205 2.192 -2.693 -6.668 746 HB3 LYS 205 HB1 LYS 205 2.114 -3.862 -5.361 747 HG2 LYS 205 HG2 LYS 205 3.688 -2.105 -4.835 748 HG3 LYS 205 HG1 LYS 205 4.528 -3.645 -5.025 749 HD2 LYS 205 HD2 LYS 205 5.194 -3.012 -7.286 750 HD3 LYS 205 HD1 LYS 205 4.329 -1.483 -7.124 751 HE2 LYS 205 HE2 LYS 205 5.807 -0.796 -5.341 752 HE3 LYS 205 HE1 LYS 205 6.618 -2.360 -5.367 753 HZ1 LYS 205 HZ1 LYS 205 7.895 -0.669 -6.537 754 HZ2 LYS 205 HZ2 LYS 205 6.602 -0.395 -7.596 755 HZ3 LYS 205 HZ3 LYS 205 7.395 -1.888 -7.600 756 H LYS 206 HN LYS 206 4.787 -6.178 -7.991 757 HA LYS 206 HA LYS 206 4.447 -8.290 -6.084 758 HB2 LYS 206 HB2 LYS 206 6.677 -7.829 -8.072 759 HB3 LYS 206 HB1 LYS 206 6.353 -9.331 -7.219 760 HG2 LYS 206 HG2 LYS 206 4.161 -9.445 -8.361 761 HG3 LYS 206 HG1 LYS 206 4.610 -8.013 -9.284 762 HD2 LYS 206 HD2 LYS 206 6.144 -10.612 -9.278 763 HD3 LYS 206 HD1 LYS 206 4.984 -10.136 -10.513 764 HE2 LYS 206 HE2 LYS 206 6.976 -9.523 -11.491 765 HE3 LYS 206 HE1 LYS 206 6.485 -8.019 -10.721 766 HZ1 LYS 206 HZ1 LYS 206 8.829 -8.529 -10.357 767 HZ2 LYS 206 HZ2 LYS 206 8.413 -9.968 -9.576 768 HZ3 LYS 206 HZ3 LYS 206 7.982 -8.482 -8.898 769 H ILE 207 HN ILE 207 4.900 -7.580 -4.041 770 HA ILE 207 HA ILE 207 7.178 -5.910 -3.496 771 HB ILE 207 HB ILE 207 5.255 -7.291 -1.626 772 HG12 ILE 207 HG12 ILE 207 4.332 -5.575 -3.251 773 HG13 ILE 207 HG11 ILE 207 4.042 -5.263 -1.545 774 HG21 ILE 207 HG21 ILE 207 6.063 -5.538 0.002 775 HG22 ILE 207 HG22 ILE 207 7.390 -5.236 -1.121 776 HG23 ILE 207 HG23 ILE 207 7.208 -6.825 -0.379 777 HD11 ILE 207 HD11 ILE 207 5.751 -3.588 -1.511 778 HD12 ILE 207 HD12 ILE 207 4.657 -3.258 -2.852 779 HD13 ILE 207 HD13 ILE 207 6.234 -3.987 -3.159 780 H LYS 208 HN LYS 208 9.143 -6.522 -2.891 781 HA LYS 208 HA LYS 208 9.523 -9.172 -1.718 782 HB2 LYS 208 HB2 LYS 208 10.078 -8.982 -4.273 783 HB3 LYS 208 HB1 LYS 208 11.505 -8.122 -3.719 784 HG2 LYS 208 HG2 LYS 208 11.984 -10.471 -4.124 785 HG3 LYS 208 HG1 LYS 208 12.196 -10.063 -2.424 786 HD2 LYS 208 HD2 LYS 208 11.067 -12.203 -2.644 787 HD3 LYS 208 HD1 LYS 208 9.979 -11.014 -1.934 788 HE2 LYS 208 HE2 LYS 208 8.756 -12.290 -3.550 789 HE3 LYS 208 HE1 LYS 208 8.987 -10.666 -4.189 790 HZ1 LYS 208 HZ1 LYS 208 10.876 -11.542 -5.481 791 HZ2 LYS 208 HZ2 LYS 208 9.404 -12.257 -5.902 792 HZ3 LYS 208 HZ3 LYS 208 10.508 -13.101 -4.939 793 H LYS 209 HN LYS 209 11.909 -9.267 -0.848 794 HA LYS 209 HA LYS 209 12.038 -7.390 1.201 795 HB2 LYS 209 HB2 LYS 209 13.023 -9.657 1.290 796 HB3 LYS 209 HB1 LYS 209 14.286 -9.134 0.184 797 HG2 LYS 209 HG2 LYS 209 15.018 -7.479 1.839 798 HG3 LYS 209 HG1 LYS 209 13.776 -8.053 2.947 799 HD2 LYS 209 HD2 LYS 209 14.811 -10.232 3.038 800 HD3 LYS 209 HD1 LYS 209 15.997 -9.755 1.819 801 HE2 LYS 209 HE2 LYS 209 16.932 -9.680 4.087 802 HE3 LYS 209 HE1 LYS 209 16.910 -8.088 3.331 803 HZ1 LYS 209 HZ1 LYS 209 14.937 -9.090 5.310 804 HZ2 LYS 209 HZ2 LYS 209 14.913 -7.562 4.586 805 HZ3 LYS 209 HZ3 LYS 209 16.178 -7.983 5.623 806 H GLU 210 HN GLU 210 13.041 -5.529 1.523 807 HA GLU 210 HA GLU 210 14.222 -3.634 1.246 808 HB2 GLU 210 HB2 GLU 210 15.825 -5.244 -0.738 809 HB3 GLU 210 HB1 GLU 210 16.243 -3.623 -0.203 810 HG2 GLU 210 HG2 GLU 210 16.208 -6.153 1.404 811 HG3 GLU 210 HG1 GLU 210 17.574 -5.108 1.042 812 H GLN 211 HN GLN 211 12.229 -4.845 -1.026 813 HA GLN 211 HA GLN 211 11.095 -4.001 -2.794 814 HB2 GLN 211 HB2 GLN 211 10.633 -2.214 -1.142 815 HB3 GLN 211 HB1 GLN 211 12.053 -1.344 -1.695 816 HG2 GLN 211 HG2 GLN 211 9.974 -0.419 -2.592 817 HG3 GLN 211 HG1 GLN 211 11.050 -0.998 -3.862 818 HE21 GLN 211 HE21 GLN 211 9.082 -3.075 -1.849 819 HE22 GLN 211 HE22 GLN 211 8.027 -3.604 -3.109 820 H VAL 212 HN VAL 212 13.780 -4.841 -3.249 821 HA VAL 212 HA VAL 212 15.084 -2.932 -4.937 822 HB VAL 212 HB VAL 212 16.559 -4.888 -5.574 823 HG11 VAL 212 HG11 VAL 212 17.667 -4.942 -3.380 824 HG12 VAL 212 HG12 VAL 212 16.237 -4.207 -2.656 825 HG13 VAL 212 HG13 VAL 212 17.184 -3.312 -3.844 826 HG21 VAL 212 HG21 VAL 212 16.420 -6.892 -4.174 827 HG22 VAL 212 HG22 VAL 212 14.967 -6.692 -5.151 828 HG23 VAL 212 HG23 VAL 212 14.942 -6.277 -3.437 829 H GLU 213 HN GLU 213 13.181 -5.865 -5.531 830 HA GLU 213 HA GLU 213 13.009 -5.056 -8.353 831 HB2 GLU 213 HB2 GLU 213 12.719 -7.813 -7.138 832 HB3 GLU 213 HB1 GLU 213 12.463 -7.432 -8.835 833 HG2 GLU 213 HG2 GLU 213 14.818 -6.671 -8.965 834 HG3 GLU 213 HG1 GLU 213 15.043 -7.215 -7.304 Start of MODEL 15 1 H1 SER 1 HT1 SER 1 -23.566 4.082 10.973 2 H2 SER 1 HT2 SER 1 -22.102 3.400 11.480 3 H3 SER 1 HT3 SER 1 -23.560 2.645 11.863 4 HA SER 1 HA SER 1 -22.422 1.507 10.074 5 HB2 SER 1 HB2 SER 1 -24.945 1.629 10.256 6 HB3 SER 1 HB1 SER 1 -24.890 2.916 9.052 7 HG SER 1 HG SER 1 -25.088 0.433 8.520 8 H GLU 2 HN GLU 2 -21.904 4.722 10.052 9 HA GLU 2 HA GLU 2 -21.753 5.166 7.208 10 HB2 GLU 2 HB2 GLU 2 -22.006 6.831 9.366 11 HB3 GLU 2 HB1 GLU 2 -20.310 7.022 8.939 12 HG2 GLU 2 HG2 GLU 2 -20.945 7.581 6.649 13 HG3 GLU 2 HG1 GLU 2 -22.645 7.426 7.096 14 H GLU 3 HN GLU 3 -19.826 3.540 9.364 15 HA GLU 3 HA GLU 3 -17.231 4.278 8.639 16 HB2 GLU 3 HB2 GLU 3 -18.329 1.601 9.497 17 HB3 GLU 3 HB1 GLU 3 -16.615 1.908 9.251 18 HG2 GLU 3 HG2 GLU 3 -18.394 3.327 11.220 19 HG3 GLU 3 HG1 GLU 3 -17.216 2.072 11.599 20 H GLU 4 HN GLU 4 -19.593 2.317 6.969 21 HA GLU 4 HA GLU 4 -17.821 1.171 5.079 22 HB2 GLU 4 HB2 GLU 4 -20.124 0.334 5.567 23 HB3 GLU 4 HB1 GLU 4 -20.780 1.737 4.744 24 HG2 GLU 4 HG2 GLU 4 -20.871 0.019 3.177 25 HG3 GLU 4 HG1 GLU 4 -19.462 0.972 2.719 26 H ASP 5 HN ASP 5 -19.483 4.262 5.277 27 HA ASP 5 HA ASP 5 -18.610 4.922 2.562 28 HB2 ASP 5 HB2 ASP 5 -21.032 5.280 3.333 29 HB3 ASP 5 HB1 ASP 5 -20.398 6.624 4.275 30 H LYS 6 HN LYS 6 -17.253 4.931 5.394 31 HA LYS 6 HA LYS 6 -16.428 7.657 5.723 32 HB2 LYS 6 HB2 LYS 6 -16.431 5.422 7.325 33 HB3 LYS 6 HB1 LYS 6 -14.728 5.569 6.923 34 HG2 LYS 6 HG2 LYS 6 -16.447 7.694 8.189 35 HG3 LYS 6 HG1 LYS 6 -15.247 6.699 9.009 36 HD2 LYS 6 HD2 LYS 6 -14.657 8.619 6.761 37 HD3 LYS 6 HD1 LYS 6 -14.433 8.974 8.475 38 HE2 LYS 6 HE2 LYS 6 -12.835 7.116 8.635 39 HE3 LYS 6 HE1 LYS 6 -13.049 6.791 6.916 40 HZ1 LYS 6 HZ1 LYS 6 -11.937 9.269 8.110 41 HZ2 LYS 6 HZ2 LYS 6 -12.212 9.033 6.457 42 HZ3 LYS 6 HZ3 LYS 6 -11.072 8.083 7.272 43 H CYS 7 HN CYS 7 -15.244 4.831 4.073 44 HA CYS 7 HA CYS 7 -12.680 6.060 3.534 45 HB2 CYS 7 HB2 CYS 7 -13.817 3.400 2.651 46 HB3 CYS 7 HB1 CYS 7 -12.160 3.942 2.378 47 HG CYS 7 HG CYS 7 -11.610 4.138 5.162 48 H LYS 8 HN LYS 8 -12.144 7.093 1.714 49 HA LYS 8 HA LYS 8 -14.277 7.534 -0.242 50 HB2 LYS 8 HB2 LYS 8 -11.724 8.983 0.425 51 HB3 LYS 8 HB1 LYS 8 -12.535 9.263 -1.107 52 HG2 LYS 8 HG2 LYS 8 -13.146 10.950 0.501 53 HG3 LYS 8 HG1 LYS 8 -14.539 9.969 0.053 54 HD2 LYS 8 HD2 LYS 8 -14.151 8.636 2.150 55 HD3 LYS 8 HD1 LYS 8 -12.915 9.814 2.593 56 HE2 LYS 8 HE2 LYS 8 -15.810 10.455 2.058 57 HE3 LYS 8 HE1 LYS 8 -15.099 10.248 3.657 58 HZ1 LYS 8 HZ1 LYS 8 -15.279 12.581 3.013 59 HZ2 LYS 8 HZ2 LYS 8 -14.279 12.304 1.680 60 HZ3 LYS 8 HZ3 LYS 8 -13.666 12.127 3.244 61 HA PRO 9 HA PRO 9 -12.765 4.779 -3.214 62 HB2 PRO 9 HB2 PRO 9 -13.642 6.090 -5.470 63 HB3 PRO 9 HB1 PRO 9 -14.655 5.077 -4.439 64 HG2 PRO 9 HG2 PRO 9 -14.405 8.044 -4.526 65 HG3 PRO 9 HG1 PRO 9 -15.843 7.045 -4.255 66 HD2 PRO 9 HD2 PRO 9 -14.536 8.316 -2.246 67 HD3 PRO 9 HD1 PRO 9 -15.374 6.773 -2.000 68 H MET 10 HN MET 10 -10.841 4.460 -4.134 69 HA MET 10 HA MET 10 -9.165 6.793 -4.671 70 HB2 MET 10 HB2 MET 10 -8.340 4.950 -3.184 71 HB3 MET 10 HB1 MET 10 -8.358 3.885 -4.585 72 HG2 MET 10 HG2 MET 10 -6.176 4.528 -4.590 73 HG3 MET 10 HG1 MET 10 -6.876 5.771 -5.633 74 HE1 MET 10 HE1 MET 10 -5.745 4.779 -2.179 75 HE2 MET 10 HE2 MET 10 -7.134 5.679 -1.579 76 HE3 MET 10 HE3 MET 10 -5.502 6.288 -1.305 77 H SER 11 HN SER 11 -8.647 7.392 -6.709 78 HA SER 11 HA SER 11 -9.865 5.917 -8.882 79 HB2 SER 11 HB2 SER 11 -9.109 7.882 -10.249 80 HB3 SER 11 HB1 SER 11 -10.149 8.301 -8.890 81 HG SER 11 HG SER 11 -8.330 8.949 -7.729 82 H TYR 12 HN TYR 12 -8.424 6.020 -11.067 83 HA TYR 12 HA TYR 12 -6.433 4.053 -10.650 84 HB2 TYR 12 HB2 TYR 12 -6.950 3.644 -12.777 85 HB3 TYR 12 HB1 TYR 12 -7.875 5.138 -12.857 86 HD1 TYR 12 HD1 TYR 12 -4.423 3.779 -13.294 87 HD2 TYR 12 HD2 TYR 12 -7.191 6.855 -14.265 88 HE1 TYR 12 HE1 TYR 12 -2.849 4.662 -14.965 89 HE2 TYR 12 HE2 TYR 12 -5.627 7.747 -15.931 90 HH TYR 12 HH TYR 12 -3.227 7.726 -16.386 91 H GLU 13 HN GLU 13 -6.222 7.471 -11.570 92 HA GLU 13 HA GLU 13 -3.452 7.749 -11.746 93 HB2 GLU 13 HB2 GLU 13 -5.585 9.660 -10.757 94 HB3 GLU 13 HB1 GLU 13 -3.913 10.148 -10.981 95 HG2 GLU 13 HG2 GLU 13 -5.525 8.958 -13.217 96 HG3 GLU 13 HG1 GLU 13 -5.574 10.680 -12.846 97 H GLU 14 HN GLU 14 -5.550 7.631 -8.947 98 HA GLU 14 HA GLU 14 -3.575 8.486 -7.083 99 HB2 GLU 14 HB2 GLU 14 -6.330 7.343 -6.867 100 HB3 GLU 14 HB1 GLU 14 -5.343 7.601 -5.438 101 HG2 GLU 14 HG2 GLU 14 -5.202 9.977 -5.962 102 HG3 GLU 14 HG1 GLU 14 -6.169 9.719 -7.413 103 H LYS 15 HN LYS 15 -5.141 5.367 -7.795 104 HA LYS 15 HA LYS 15 -3.705 3.784 -6.013 105 HB2 LYS 15 HB2 LYS 15 -4.824 3.108 -8.722 106 HB3 LYS 15 HB1 LYS 15 -4.094 1.910 -7.661 107 HG2 LYS 15 HG2 LYS 15 -5.806 1.943 -6.177 108 HG3 LYS 15 HG1 LYS 15 -6.282 3.586 -6.598 109 HD2 LYS 15 HD2 LYS 15 -7.456 2.944 -8.426 110 HD3 LYS 15 HD1 LYS 15 -6.464 1.515 -8.705 111 HE2 LYS 15 HE2 LYS 15 -7.468 0.514 -6.681 112 HE3 LYS 15 HE1 LYS 15 -8.568 1.886 -6.581 113 HZ1 LYS 15 HZ1 LYS 15 -9.398 1.295 -8.794 114 HZ2 LYS 15 HZ2 LYS 15 -9.626 0.036 -7.692 115 HZ3 LYS 15 HZ3 LYS 15 -8.378 -0.054 -8.833 116 H ARG 16 HN ARG 16 -2.847 4.944 -9.222 117 HA ARG 16 HA ARG 16 -0.428 3.532 -9.522 118 HB2 ARG 16 HB2 ARG 16 -1.461 4.730 -11.388 119 HB3 ARG 16 HB1 ARG 16 -1.164 6.260 -10.576 120 HG2 ARG 16 HG2 ARG 16 1.269 5.636 -10.598 121 HG3 ARG 16 HG1 ARG 16 0.831 4.365 -11.723 122 HD2 ARG 16 HD2 ARG 16 1.610 6.319 -12.913 123 HD3 ARG 16 HD1 ARG 16 -0.096 6.049 -13.208 124 HE ARG 16 HE ARG 16 0.844 8.032 -11.254 125 HH11 ARG 16 HH11 ARG 16 -1.119 7.148 -14.013 126 HH12 ARG 16 HH12 ARG 16 -1.999 8.647 -14.032 127 HH21 ARG 16 HH21 ARG 16 -0.275 10.016 -11.293 128 HH22 ARG 16 HH22 ARG 16 -1.516 10.283 -12.486 129 H GLN 17 HN GLN 17 -1.014 6.845 -8.345 130 HA GLN 17 HA GLN 17 1.587 7.444 -7.571 131 HB2 GLN 17 HB2 GLN 17 -0.245 9.091 -7.680 132 HB3 GLN 17 HB1 GLN 17 -0.974 8.352 -6.260 133 HG2 GLN 17 HG2 GLN 17 0.176 10.269 -5.508 134 HG3 GLN 17 HG1 GLN 17 1.137 8.872 -5.030 135 HE21 GLN 17 HE21 GLN 17 1.911 11.660 -5.415 136 HE22 GLN 17 HE22 GLN 17 3.183 11.648 -6.588 137 H LEU 18 HN LEU 18 -0.971 5.782 -5.893 138 HA LEU 18 HA LEU 18 0.207 5.479 -3.371 139 HB2 LEU 18 HB2 LEU 18 -2.182 4.936 -4.402 140 HB3 LEU 18 HB1 LEU 18 -1.491 3.335 -4.528 141 HG LEU 18 HG LEU 18 -1.881 4.920 -2.002 142 HD11 LEU 18 HD11 LEU 18 -3.185 2.506 -1.824 143 HD12 LEU 18 HD12 LEU 18 -3.490 3.028 -3.480 144 HD13 LEU 18 HD13 LEU 18 -3.923 4.076 -2.130 145 HD21 LEU 18 HD21 LEU 18 -0.074 3.707 -1.374 146 HD22 LEU 18 HD22 LEU 18 -0.354 2.451 -2.575 147 HD23 LEU 18 HD23 LEU 18 -1.319 2.493 -1.103 148 H SER 19 HN SER 19 0.226 3.314 -6.195 149 HA SER 19 HA SER 19 1.798 1.308 -5.017 150 HB2 SER 19 HB2 SER 19 1.871 0.333 -7.136 151 HB3 SER 19 HB1 SER 19 0.403 1.307 -7.207 152 HG SER 19 HG SER 19 1.789 2.990 -8.166 153 H LEU 20 HN LEU 20 2.569 4.396 -6.239 154 HA LEU 20 HA LEU 20 5.388 3.842 -6.611 155 HB2 LEU 20 HB2 LEU 20 3.782 6.361 -6.868 156 HB3 LEU 20 HB1 LEU 20 5.481 6.236 -7.258 157 HG LEU 20 HG LEU 20 3.188 4.904 -8.653 158 HD11 LEU 20 HD11 LEU 20 3.706 7.272 -9.140 159 HD12 LEU 20 HD12 LEU 20 3.844 6.202 -10.532 160 HD13 LEU 20 HD13 LEU 20 5.296 6.767 -9.699 161 HD21 LEU 20 HD21 LEU 20 4.946 3.293 -8.501 162 HD22 LEU 20 HD22 LEU 20 6.139 4.477 -9.034 163 HD23 LEU 20 HD23 LEU 20 4.884 3.923 -10.146 164 H ASP 21 HN ASP 21 3.257 5.368 -4.282 165 HA ASP 21 HA ASP 21 5.444 6.364 -2.685 166 HB2 ASP 21 HB2 ASP 21 3.779 7.096 -1.103 167 HB3 ASP 21 HB1 ASP 21 3.389 7.609 -2.720 168 H ILE 22 HN ILE 22 3.348 3.546 -2.639 169 HA ILE 22 HA ILE 22 4.415 2.381 -0.313 170 HB ILE 22 HB ILE 22 2.949 1.449 -2.693 171 HG12 ILE 22 HG12 ILE 22 2.702 0.780 0.223 172 HG13 ILE 22 HG11 ILE 22 1.909 2.144 -0.555 173 HG21 ILE 22 HG21 ILE 22 4.429 -0.540 -1.007 174 HG22 ILE 22 HG22 ILE 22 4.778 -0.158 -2.688 175 HG23 ILE 22 HG23 ILE 22 3.242 -0.904 -2.254 176 HD11 ILE 22 HD11 ILE 22 1.495 -0.685 -1.452 177 HD12 ILE 22 HD12 ILE 22 0.525 0.740 -1.822 178 HD13 ILE 22 HD13 ILE 22 0.517 0.070 -0.193 179 H ASN 23 HN ASN 23 5.476 2.479 -3.642 180 HA ASN 23 HA ASN 23 7.593 0.630 -3.415 181 HB2 ASN 23 HB2 ASN 23 6.589 1.317 -5.556 182 HB3 ASN 23 HB1 ASN 23 7.217 2.941 -5.329 183 HD21 ASN 23 HD21 ASN 23 9.351 3.363 -5.741 184 HD22 ASN 23 HD22 ASN 23 10.410 2.216 -6.487 185 H LYS 24 HN LYS 24 7.196 3.819 -2.309 186 HA LYS 24 HA LYS 24 9.986 4.513 -2.233 187 HB2 LYS 24 HB2 LYS 24 7.444 5.787 -1.339 188 HB3 LYS 24 HB1 LYS 24 8.978 6.406 -0.739 189 HG2 LYS 24 HG2 LYS 24 9.698 6.937 -2.953 190 HG3 LYS 24 HG1 LYS 24 8.312 6.105 -3.661 191 HD2 LYS 24 HD2 LYS 24 6.798 7.737 -2.764 192 HD3 LYS 24 HD1 LYS 24 8.084 8.512 -1.846 193 HE2 LYS 24 HE2 LYS 24 7.549 9.798 -3.841 194 HE3 LYS 24 HE1 LYS 24 9.180 9.147 -3.961 195 HZ1 LYS 24 HZ1 LYS 24 8.226 7.311 -5.315 196 HZ2 LYS 24 HZ2 LYS 24 8.108 8.832 -6.039 197 HZ3 LYS 24 HZ3 LYS 24 6.745 8.132 -5.324 198 H LEU 25 HN LEU 25 7.746 2.874 -0.220 199 HA LEU 25 HA LEU 25 8.888 3.455 2.301 200 HB2 LEU 25 HB2 LEU 25 7.168 1.162 1.379 201 HB3 LEU 25 HB1 LEU 25 7.658 1.400 3.044 202 HG LEU 25 HG LEU 25 5.782 3.062 1.396 203 HD11 LEU 25 HD11 LEU 25 5.650 1.820 4.117 204 HD12 LEU 25 HD12 LEU 25 4.911 1.155 2.660 205 HD13 LEU 25 HD13 LEU 25 4.340 2.686 3.327 206 HD21 LEU 25 HD21 LEU 25 7.082 3.814 3.985 207 HD22 LEU 25 HD22 LEU 25 5.757 4.682 3.220 208 HD23 LEU 25 HD23 LEU 25 7.336 4.617 2.440 209 HA PRO 26 HA PRO 26 12.399 0.670 2.259 210 HB2 PRO 26 HB2 PRO 26 12.910 0.786 4.933 211 HB3 PRO 26 HB1 PRO 26 13.421 2.037 3.796 212 HG2 PRO 26 HG2 PRO 26 11.103 2.003 5.669 213 HG3 PRO 26 HG1 PRO 26 12.162 3.351 5.227 214 HD2 PRO 26 HD2 PRO 26 9.653 3.001 4.204 215 HD3 PRO 26 HD1 PRO 26 10.956 3.835 3.335 216 H GLY 27 HN GLY 27 12.957 -1.390 3.262 217 HA2 GLY 27 HA2 GLY 27 10.980 -3.249 3.042 218 HA3 GLY 27 HA1 GLY 27 12.457 -3.524 3.938 219 H GLU 28 HN GLU 28 12.239 -2.103 6.171 220 HA GLU 28 HA GLU 28 10.494 -3.620 7.731 221 HB2 GLU 28 HB2 GLU 28 10.968 -1.582 9.394 222 HB3 GLU 28 HB1 GLU 28 12.126 -2.864 9.090 223 HG2 GLU 28 HG2 GLU 28 12.151 -0.379 7.453 224 HG3 GLU 28 HG1 GLU 28 12.855 -0.399 9.059 225 H LYS 29 HN LYS 29 10.099 -0.345 6.433 226 HA LYS 29 HA LYS 29 7.679 0.133 7.891 227 HB2 LYS 29 HB2 LYS 29 9.273 1.576 5.865 228 HB3 LYS 29 HB1 LYS 29 7.560 1.946 5.890 229 HG2 LYS 29 HG2 LYS 29 8.815 3.533 7.213 230 HG3 LYS 29 HG1 LYS 29 7.732 2.595 8.241 231 HD2 LYS 29 HD2 LYS 29 9.431 1.595 9.341 232 HD3 LYS 29 HD1 LYS 29 10.479 1.552 7.918 233 HE2 LYS 29 HE2 LYS 29 11.325 3.063 9.672 234 HE3 LYS 29 HE1 LYS 29 10.970 3.907 8.168 235 HZ1 LYS 29 HZ1 LYS 29 9.254 3.833 10.591 236 HZ2 LYS 29 HZ2 LYS 29 8.859 4.619 9.149 237 HZ3 LYS 29 HZ3 LYS 29 10.177 5.149 10.068 238 H LEU 30 HN LEU 30 8.510 -1.287 4.833 239 HA LEU 30 HA LEU 30 5.834 -0.968 3.804 240 HB2 LEU 30 HB2 LEU 30 6.859 -1.029 1.886 241 HB3 LEU 30 HB1 LEU 30 8.378 -1.361 2.671 242 HG LEU 30 HG LEU 30 6.464 -3.420 1.560 243 HD11 LEU 30 HD11 LEU 30 8.074 -1.762 0.193 244 HD12 LEU 30 HD12 LEU 30 7.717 -3.407 -0.323 245 HD13 LEU 30 HD13 LEU 30 9.209 -3.061 0.546 246 HD21 LEU 30 HD21 LEU 30 7.749 -4.267 3.502 247 HD22 LEU 30 HD22 LEU 30 9.237 -3.799 2.686 248 HD23 LEU 30 HD23 LEU 30 8.208 -5.047 1.989 249 H GLY 31 HN GLY 31 7.424 -3.245 5.749 250 HA2 GLY 31 HA2 GLY 31 5.789 -5.509 5.183 251 HA3 GLY 31 HA1 GLY 31 6.609 -5.195 6.702 252 H ARG 32 HN ARG 32 5.175 -2.485 6.754 253 HA ARG 32 HA ARG 32 2.850 -3.340 8.165 254 HB2 ARG 32 HB2 ARG 32 3.949 -1.268 8.788 255 HB3 ARG 32 HB1 ARG 32 3.597 -0.580 7.218 256 HG2 ARG 32 HG2 ARG 32 1.607 0.095 7.905 257 HG3 ARG 32 HG1 ARG 32 1.189 -1.530 8.452 258 HD2 ARG 32 HD2 ARG 32 2.878 0.395 10.026 259 HD3 ARG 32 HD1 ARG 32 1.136 0.218 10.240 260 HE ARG 32 HE ARG 32 2.748 -2.196 10.501 261 HH11 ARG 32 HH11 ARG 32 1.091 0.439 12.093 262 HH12 ARG 32 HH12 ARG 32 0.982 -0.377 13.620 263 HH21 ARG 32 HH21 ARG 32 2.604 -3.283 12.505 264 HH22 ARG 32 HH22 ARG 32 1.833 -2.505 13.850 265 H VAL 33 HN VAL 33 3.343 -1.895 4.933 266 HA VAL 33 HA VAL 33 0.602 -1.639 4.345 267 HB VAL 33 HB VAL 33 1.739 -2.269 1.887 268 HG11 VAL 33 HG11 VAL 33 1.238 0.304 3.342 269 HG12 VAL 33 HG12 VAL 33 0.235 -0.486 2.125 270 HG13 VAL 33 HG13 VAL 33 1.757 0.258 1.664 271 HG21 VAL 33 HG21 VAL 33 3.648 -0.430 3.264 272 HG22 VAL 33 HG22 VAL 33 3.809 -1.223 1.694 273 HG23 VAL 33 HG23 VAL 33 3.956 -2.165 3.179 274 H VAL 34 HN VAL 34 2.842 -4.281 3.573 275 HA VAL 34 HA VAL 34 1.073 -6.187 2.636 276 HB VAL 34 HB VAL 34 2.721 -7.695 2.941 277 HG11 VAL 34 HG11 VAL 34 4.023 -5.825 2.253 278 HG12 VAL 34 HG12 VAL 34 4.955 -6.819 3.371 279 HG13 VAL 34 HG13 VAL 34 4.228 -5.312 3.926 280 HG21 VAL 34 HG21 VAL 34 2.099 -8.128 5.260 281 HG22 VAL 34 HG22 VAL 34 3.162 -6.812 5.774 282 HG23 VAL 34 HG23 VAL 34 3.845 -8.244 5.004 283 H HIS 35 HN HIS 35 1.610 -5.210 6.007 284 HA HIS 35 HA HIS 35 -0.047 -7.246 7.107 285 HB2 HIS 35 HB2 HIS 35 1.735 -6.197 8.422 286 HB3 HIS 35 HB1 HIS 35 0.909 -4.647 8.328 287 HD1 HIS 35 HD1 HIS 35 0.474 -8.092 9.841 288 HD2 HIS 35 HD2 HIS 35 -0.967 -4.215 10.261 289 HE1 HIS 35 HE1 HIS 35 -0.948 -8.124 11.913 290 HE2 HIS 35 HE2 HIS 35 -1.759 -5.753 12.192 291 H ILE 36 HN ILE 36 -0.537 -3.775 6.485 292 HA ILE 36 HA ILE 36 -3.195 -3.599 7.361 293 HB ILE 36 HB ILE 36 -1.876 -2.104 5.078 294 HG12 ILE 36 HG12 ILE 36 -2.297 -1.202 7.924 295 HG13 ILE 36 HG11 ILE 36 -0.818 -1.978 7.385 296 HG21 ILE 36 HG21 ILE 36 -3.694 -0.717 4.944 297 HG22 ILE 36 HG22 ILE 36 -4.114 -0.949 6.644 298 HG23 ILE 36 HG23 ILE 36 -4.510 -2.195 5.465 299 HD11 ILE 36 HD11 ILE 36 -0.657 -0.137 5.674 300 HD12 ILE 36 HD12 ILE 36 -0.407 0.328 7.353 301 HD13 ILE 36 HD13 ILE 36 -1.941 0.668 6.562 302 H ILE 37 HN ILE 37 -1.819 -4.345 4.223 303 HA ILE 37 HA ILE 37 -4.205 -4.710 2.813 304 HB ILE 37 HB ILE 37 -1.393 -5.614 2.420 305 HG12 ILE 37 HG12 ILE 37 -3.075 -3.892 0.639 306 HG13 ILE 37 HG11 ILE 37 -2.295 -3.236 2.065 307 HG21 ILE 37 HG21 ILE 37 -3.743 -6.759 1.206 308 HG22 ILE 37 HG22 ILE 37 -2.059 -7.287 1.123 309 HG23 ILE 37 HG23 ILE 37 -2.652 -6.059 0.009 310 HD11 ILE 37 HD11 ILE 37 -0.919 -2.786 0.214 311 HD12 ILE 37 HD12 ILE 37 -0.981 -4.474 -0.309 312 HD13 ILE 37 HD13 ILE 37 -0.134 -4.041 1.176 313 H GLN 38 HN GLN 38 -2.025 -7.314 3.998 314 HA GLN 38 HA GLN 38 -3.690 -9.457 3.540 315 HB2 GLN 38 HB2 GLN 38 -1.758 -9.038 5.835 316 HB3 GLN 38 HB1 GLN 38 -2.525 -10.577 5.478 317 HG2 GLN 38 HG2 GLN 38 -1.432 -10.628 3.303 318 HG3 GLN 38 HG1 GLN 38 -0.714 -9.057 3.636 319 HE21 GLN 38 HE21 GLN 38 -1.110 -11.593 6.009 320 HE22 GLN 38 HE22 GLN 38 0.571 -11.924 6.212 321 H SER 39 HN SER 39 -3.780 -7.252 6.330 322 HA SER 39 HA SER 39 -5.636 -8.868 7.799 323 HB2 SER 39 HB2 SER 39 -5.740 -6.964 9.355 324 HB3 SER 39 HB1 SER 39 -4.079 -7.368 8.947 325 HG SER 39 HG SER 39 -3.915 -5.590 7.711 326 H ARG 40 HN ARG 40 -5.903 -5.901 5.871 327 HA ARG 40 HA ARG 40 -8.754 -5.751 6.260 328 HB2 ARG 40 HB2 ARG 40 -6.876 -4.172 4.486 329 HB3 ARG 40 HB1 ARG 40 -8.595 -3.830 4.654 330 HG2 ARG 40 HG2 ARG 40 -8.287 -3.461 7.008 331 HG3 ARG 40 HG1 ARG 40 -6.578 -3.838 6.886 332 HD2 ARG 40 HD2 ARG 40 -6.491 -1.562 6.806 333 HD3 ARG 40 HD1 ARG 40 -6.684 -1.909 5.087 334 HE ARG 40 HE ARG 40 -9.197 -1.627 5.693 335 HH11 ARG 40 HH11 ARG 40 -6.533 0.266 6.967 336 HH12 ARG 40 HH12 ARG 40 -7.529 1.626 7.365 337 HH21 ARG 40 HH21 ARG 40 -10.512 0.155 6.284 338 HH22 ARG 40 HH22 ARG 40 -9.777 1.563 6.985 339 H GLU 41 HN GLU 41 -6.660 -7.357 4.169 340 HA GLU 41 HA GLU 41 -8.888 -8.117 2.392 341 HB2 GLU 41 HB2 GLU 41 -5.967 -8.292 1.674 342 HB3 GLU 41 HB1 GLU 41 -7.361 -8.394 0.605 343 HG2 GLU 41 HG2 GLU 41 -6.568 -5.914 2.090 344 HG3 GLU 41 HG1 GLU 41 -6.031 -6.307 0.455 345 HA PRO 42 HA PRO 42 -7.271 -11.683 4.884 346 HB2 PRO 42 HB2 PRO 42 -9.835 -12.835 5.121 347 HB3 PRO 42 HB1 PRO 42 -8.945 -11.978 6.371 348 HG2 PRO 42 HG2 PRO 42 -11.268 -11.128 4.887 349 HG3 PRO 42 HG1 PRO 42 -10.468 -10.323 6.242 350 HD2 PRO 42 HD2 PRO 42 -10.423 -9.593 3.473 351 HD3 PRO 42 HD1 PRO 42 -9.614 -8.799 4.829 352 H SER 43 HN SER 43 -8.878 -11.306 1.955 353 HA SER 43 HA SER 43 -9.039 -14.042 1.167 354 HB2 SER 43 HB2 SER 43 -8.910 -11.567 -0.572 355 HB3 SER 43 HB1 SER 43 -9.500 -13.161 -1.049 356 HG SER 43 HG SER 43 -11.164 -12.927 0.502 357 H LEU 44 HN LEU 44 -6.468 -11.786 1.450 358 HA LEU 44 HA LEU 44 -4.758 -13.603 -0.106 359 HB2 LEU 44 HB2 LEU 44 -3.245 -11.688 -0.485 360 HB3 LEU 44 HB1 LEU 44 -4.819 -11.466 -1.187 361 HG LEU 44 HG LEU 44 -5.170 -10.169 1.135 362 HD11 LEU 44 HD11 LEU 44 -3.121 -8.785 1.424 363 HD12 LEU 44 HD12 LEU 44 -2.259 -9.945 0.417 364 HD13 LEU 44 HD13 LEU 44 -2.956 -10.457 1.953 365 HD21 LEU 44 HD21 LEU 44 -5.695 -9.301 -1.054 366 HD22 LEU 44 HD22 LEU 44 -3.981 -9.131 -1.436 367 HD23 LEU 44 HD23 LEU 44 -4.711 -8.124 -0.185 368 H LYS 45 HN LYS 45 -5.585 -13.705 2.722 369 HA LYS 45 HA LYS 45 -3.474 -12.897 4.415 370 HB2 LYS 45 HB2 LYS 45 -4.505 -14.246 6.110 371 HB3 LYS 45 HB1 LYS 45 -5.769 -13.447 5.194 372 HG2 LYS 45 HG2 LYS 45 -6.268 -15.469 4.005 373 HG3 LYS 45 HG1 LYS 45 -4.883 -16.283 4.737 374 HD2 LYS 45 HD2 LYS 45 -7.133 -15.162 6.381 375 HD3 LYS 45 HD1 LYS 45 -7.169 -16.797 5.717 376 HE2 LYS 45 HE2 LYS 45 -6.277 -17.185 7.801 377 HE3 LYS 45 HE1 LYS 45 -4.823 -16.994 6.824 378 HZ1 LYS 45 HZ1 LYS 45 -6.051 -14.820 8.429 379 HZ2 LYS 45 HZ2 LYS 45 -4.570 -14.763 7.619 380 HZ3 LYS 45 HZ3 LYS 45 -4.761 -15.776 8.953 381 H ASN 46 HN ASN 46 -3.790 -15.617 2.298 382 HA ASN 46 HA ASN 46 -1.932 -17.304 3.692 383 HB2 ASN 46 HB2 ASN 46 -3.672 -18.242 2.215 384 HB3 ASN 46 HB1 ASN 46 -2.923 -17.455 0.834 385 HD21 ASN 46 HD21 ASN 46 -1.086 -18.324 -0.067 386 HD22 ASN 46 HD22 ASN 46 -0.468 -19.884 0.383 387 H SER 47 HN SER 47 -1.686 -14.651 1.577 388 HA SER 47 HA SER 47 0.833 -15.238 0.404 389 HB2 SER 47 HB2 SER 47 -0.562 -12.598 0.884 390 HB3 SER 47 HB1 SER 47 0.878 -12.800 -0.119 391 HG SER 47 HG SER 47 -1.575 -14.177 -0.543 392 H ASN 48 HN ASN 48 2.879 -14.800 1.094 393 HA ASN 48 HA ASN 48 3.249 -14.641 3.925 394 HB2 ASN 48 HB2 ASN 48 5.422 -14.369 1.851 395 HB3 ASN 48 HB1 ASN 48 5.564 -14.987 3.487 396 HD21 ASN 48 HD21 ASN 48 4.908 -17.099 3.929 397 HD22 ASN 48 HD22 ASN 48 4.603 -18.245 2.670 398 HA PRO 49 HA PRO 49 3.400 -10.229 4.333 399 HB2 PRO 49 HB2 PRO 49 4.991 -10.159 6.593 400 HB3 PRO 49 HB1 PRO 49 3.241 -10.380 6.593 401 HG2 PRO 49 HG2 PRO 49 5.409 -12.404 6.846 402 HG3 PRO 49 HG1 PRO 49 3.830 -12.332 7.648 403 HD2 PRO 49 HD2 PRO 49 4.316 -13.995 5.587 404 HD3 PRO 49 HD1 PRO 49 2.727 -13.246 5.839 405 H ASP 50 HN ASP 50 6.205 -12.208 4.012 406 HA ASP 50 HA ASP 50 7.950 -9.900 3.603 407 HB2 ASP 50 HB2 ASP 50 8.494 -12.870 3.701 408 HB3 ASP 50 HB1 ASP 50 9.721 -11.684 3.282 409 H GLU 51 HN GLU 51 5.808 -11.640 1.767 410 HA GLU 51 HA GLU 51 7.291 -11.168 -0.702 411 HB2 GLU 51 HB2 GLU 51 6.123 -13.762 0.270 412 HB3 GLU 51 HB1 GLU 51 6.387 -13.447 -1.423 413 HG2 GLU 51 HG2 GLU 51 8.691 -13.435 -1.205 414 HG3 GLU 51 HG1 GLU 51 8.616 -13.108 0.524 415 H ILE 52 HN ILE 52 5.099 -9.793 0.585 416 HA ILE 52 HA ILE 52 2.598 -10.691 -0.350 417 HB ILE 52 HB ILE 52 3.213 -9.009 1.574 418 HG12 ILE 52 HG12 ILE 52 0.890 -8.222 1.554 419 HG13 ILE 52 HG11 ILE 52 0.730 -8.709 -0.123 420 HG21 ILE 52 HG21 ILE 52 2.589 -7.183 -0.722 421 HG22 ILE 52 HG22 ILE 52 4.142 -7.299 0.104 422 HG23 ILE 52 HG23 ILE 52 2.725 -6.699 0.965 423 HD11 ILE 52 HD11 ILE 52 1.313 -10.556 2.140 424 HD12 ILE 52 HD12 ILE 52 0.955 -11.002 0.476 425 HD13 ILE 52 HD13 ILE 52 -0.288 -10.259 1.479 426 H GLU 53 HN GLU 53 1.246 -9.903 -1.857 427 HA GLU 53 HA GLU 53 2.462 -8.373 -4.056 428 HB2 GLU 53 HB2 GLU 53 0.285 -10.476 -4.161 429 HB3 GLU 53 HB1 GLU 53 0.823 -9.522 -5.533 430 HG2 GLU 53 HG2 GLU 53 2.626 -11.342 -3.969 431 HG3 GLU 53 HG1 GLU 53 1.738 -11.845 -5.409 432 H ILE 54 HN ILE 54 1.789 -6.346 -3.515 433 HA ILE 54 HA ILE 54 -0.792 -5.790 -2.443 434 HB ILE 54 HB ILE 54 1.190 -3.909 -3.735 435 HG12 ILE 54 HG12 ILE 54 0.892 -4.775 -0.856 436 HG13 ILE 54 HG11 ILE 54 2.277 -5.048 -1.907 437 HG21 ILE 54 HG21 ILE 54 -1.058 -3.365 -1.822 438 HG22 ILE 54 HG22 ILE 54 -1.065 -3.009 -3.547 439 HG23 ILE 54 HG23 ILE 54 0.063 -2.178 -2.478 440 HD11 ILE 54 HD11 ILE 54 2.682 -3.213 -0.332 441 HD12 ILE 54 HD12 ILE 54 1.284 -2.376 -0.975 442 HD13 ILE 54 HD13 ILE 54 2.689 -2.656 -2.000 443 H ASP 55 HN ASP 55 -2.468 -6.289 -3.764 444 HA ASP 55 HA ASP 55 -2.353 -5.487 -6.582 445 HB2 ASP 55 HB2 ASP 55 -3.036 -7.826 -6.078 446 HB3 ASP 55 HB1 ASP 55 -4.407 -7.205 -5.161 447 H PHE 56 HN PHE 56 -2.845 -3.387 -6.697 448 HA PHE 56 HA PHE 56 -4.500 -2.078 -4.814 449 HB2 PHE 56 HB2 PHE 56 -3.380 -1.131 -7.435 450 HB3 PHE 56 HB1 PHE 56 -4.172 -0.091 -6.257 451 HD1 PHE 56 HD1 PHE 56 -3.170 0.081 -3.969 452 HD2 PHE 56 HD2 PHE 56 -1.094 -1.655 -7.230 453 HE1 PHE 56 HE1 PHE 56 -1.084 0.393 -2.766 454 HE2 PHE 56 HE2 PHE 56 1.030 -1.336 -6.027 455 HZ PHE 56 HZ PHE 56 1.027 -0.302 -3.790 456 H GLU 57 HN GLU 57 -5.356 -3.924 -7.465 457 HA GLU 57 HA GLU 57 -7.689 -2.345 -8.153 458 HB2 GLU 57 HB2 GLU 57 -6.618 -4.972 -9.171 459 HB3 GLU 57 HB1 GLU 57 -8.112 -4.250 -9.762 460 HG2 GLU 57 HG2 GLU 57 -5.379 -2.986 -9.904 461 HG3 GLU 57 HG1 GLU 57 -6.186 -3.826 -11.223 462 H THR 58 HN THR 58 -6.807 -5.124 -6.268 463 HA THR 58 HA THR 58 -9.623 -5.702 -5.734 464 HB THR 58 HB THR 58 -8.696 -7.668 -4.447 465 HG1 THR 58 HG1 THR 58 -6.283 -6.919 -5.780 466 HG21 THR 58 HG21 THR 58 -8.013 -7.435 -7.381 467 HG22 THR 58 HG22 THR 58 -9.561 -7.939 -6.702 468 HG23 THR 58 HG23 THR 58 -8.132 -8.948 -6.482 469 H LEU 59 HN LEU 59 -6.768 -4.358 -4.213 470 HA LEU 59 HA LEU 59 -7.476 -4.383 -1.535 471 HB2 LEU 59 HB2 LEU 59 -6.093 -2.228 -3.088 472 HB3 LEU 59 HB1 LEU 59 -6.224 -2.266 -1.350 473 HG LEU 59 HG LEU 59 -4.844 -4.317 -3.056 474 HD11 LEU 59 HD11 LEU 59 -3.721 -2.351 -1.088 475 HD12 LEU 59 HD12 LEU 59 -3.664 -2.173 -2.840 476 HD13 LEU 59 HD13 LEU 59 -2.827 -3.513 -2.059 477 HD21 LEU 59 HD21 LEU 59 -5.460 -4.185 -0.119 478 HD22 LEU 59 HD22 LEU 59 -4.071 -5.084 -0.745 479 HD23 LEU 59 HD23 LEU 59 -5.698 -5.516 -1.262 480 H LYS 60 HN LYS 60 -9.072 -3.514 -0.411 481 HA LYS 60 HA LYS 60 -11.177 -2.105 -1.670 482 HB2 LYS 60 HB2 LYS 60 -10.513 -2.464 1.256 483 HB3 LYS 60 HB1 LYS 60 -12.010 -1.754 0.665 484 HG2 LYS 60 HG2 LYS 60 -12.518 -3.864 -0.494 485 HG3 LYS 60 HG1 LYS 60 -11.045 -4.558 0.179 486 HD2 LYS 60 HD2 LYS 60 -13.352 -3.480 1.787 487 HD3 LYS 60 HD1 LYS 60 -13.041 -5.186 1.463 488 HE2 LYS 60 HE2 LYS 60 -10.850 -4.954 2.597 489 HE3 LYS 60 HE1 LYS 60 -11.272 -3.289 2.998 490 HZ1 LYS 60 HZ1 LYS 60 -12.773 -5.697 3.855 491 HZ2 LYS 60 HZ2 LYS 60 -13.160 -4.099 4.253 492 HZ3 LYS 60 HZ3 LYS 60 -11.729 -4.792 4.829 493 HA PRO 61 HA PRO 61 -9.986 2.186 -1.606 494 HB2 PRO 61 HB2 PRO 61 -12.570 2.580 -0.172 495 HB3 PRO 61 HB1 PRO 61 -11.932 3.417 -1.591 496 HG2 PRO 61 HG2 PRO 61 -13.848 1.541 -1.778 497 HG3 PRO 61 HG1 PRO 61 -12.634 1.805 -3.036 498 HD2 PRO 61 HD2 PRO 61 -12.903 -0.424 -1.120 499 HD3 PRO 61 HD1 PRO 61 -12.082 -0.382 -2.692 500 H SER 62 HN SER 62 -11.445 0.711 1.232 501 HA SER 62 HA SER 62 -10.589 2.410 3.242 502 HB2 SER 62 HB2 SER 62 -10.661 -0.594 3.495 503 HB3 SER 62 HB1 SER 62 -11.045 0.616 4.718 504 HG SER 62 HG SER 62 -12.894 1.160 3.545 505 H THR 63 HN THR 63 -8.971 -0.530 2.023 506 HA THR 63 HA THR 63 -6.663 -0.270 3.619 507 HB THR 63 HB THR 63 -6.570 -1.618 0.940 508 HG1 THR 63 HG1 THR 63 -7.854 -3.286 1.684 509 HG21 THR 63 HG21 THR 63 -4.621 -2.248 1.917 510 HG22 THR 63 HG22 THR 63 -5.648 -3.372 2.815 511 HG23 THR 63 HG23 THR 63 -5.206 -1.826 3.531 512 H LEU 64 HN LEU 64 -7.349 0.629 0.252 513 HA LEU 64 HA LEU 64 -4.791 1.512 -0.423 514 HB2 LEU 64 HB2 LEU 64 -7.473 2.438 -1.426 515 HB3 LEU 64 HB1 LEU 64 -5.949 2.850 -2.175 516 HG LEU 64 HG LEU 64 -6.987 0.037 -1.866 517 HD11 LEU 64 HD11 LEU 64 -7.798 2.054 -3.645 518 HD12 LEU 64 HD12 LEU 64 -8.191 0.338 -3.698 519 HD13 LEU 64 HD13 LEU 64 -6.779 0.947 -4.561 520 HD21 LEU 64 HD21 LEU 64 -4.597 1.254 -3.214 521 HD22 LEU 64 HD22 LEU 64 -5.208 -0.352 -3.617 522 HD23 LEU 64 HD23 LEU 64 -4.635 -0.011 -1.984 523 H ARG 65 HN ARG 65 -7.533 3.368 0.916 524 HA ARG 65 HA ARG 65 -6.165 5.838 0.962 525 HB2 ARG 65 HB2 ARG 65 -8.519 4.824 2.536 526 HB3 ARG 65 HB1 ARG 65 -7.899 6.462 2.687 527 HG2 ARG 65 HG2 ARG 65 -8.867 5.248 0.109 528 HG3 ARG 65 HG1 ARG 65 -9.846 6.255 1.168 529 HD2 ARG 65 HD2 ARG 65 -8.357 8.125 0.855 530 HD3 ARG 65 HD1 ARG 65 -7.252 7.130 -0.085 531 HE ARG 65 HE ARG 65 -9.887 7.210 -1.202 532 HH11 ARG 65 HH11 ARG 65 -6.853 8.956 -0.972 533 HH12 ARG 65 HH12 ARG 65 -7.028 9.716 -2.523 534 HH21 ARG 65 HH21 ARG 65 -10.107 8.242 -3.263 535 HH22 ARG 65 HH22 ARG 65 -8.847 9.308 -3.814 536 H GLU 66 HN GLU 66 -6.177 3.103 3.115 537 HA GLU 66 HA GLU 66 -4.826 4.429 5.253 538 HB2 GLU 66 HB2 GLU 66 -6.129 2.431 5.697 539 HB3 GLU 66 HB1 GLU 66 -5.142 1.499 4.576 540 HG2 GLU 66 HG2 GLU 66 -4.531 0.992 6.846 541 HG3 GLU 66 HG1 GLU 66 -3.204 1.817 6.028 542 H LEU 67 HN LEU 67 -3.734 1.992 2.862 543 HA LEU 67 HA LEU 67 -1.031 1.952 3.295 544 HB2 LEU 67 HB2 LEU 67 -2.167 2.093 0.497 545 HB3 LEU 67 HB1 LEU 67 -0.785 1.169 1.072 546 HG LEU 67 HG LEU 67 -3.624 0.579 1.883 547 HD11 LEU 67 HD11 LEU 67 -2.079 -1.156 0.058 548 HD12 LEU 67 HD12 LEU 67 -2.821 0.295 -0.615 549 HD13 LEU 67 HD13 LEU 67 -3.820 -0.917 0.189 550 HD21 LEU 67 HD21 LEU 67 -1.292 -0.163 3.084 551 HD22 LEU 67 HD22 LEU 67 -1.577 -1.497 1.977 552 HD23 LEU 67 HD23 LEU 67 -2.805 -1.061 3.163 553 H GLU 68 HN GLU 68 -2.753 4.249 1.165 554 HA GLU 68 HA GLU 68 -0.572 5.828 0.414 555 HB2 GLU 68 HB2 GLU 68 -2.758 5.951 -0.670 556 HB3 GLU 68 HB1 GLU 68 -3.473 6.611 0.790 557 HG2 GLU 68 HG2 GLU 68 -1.864 8.540 0.532 558 HG3 GLU 68 HG1 GLU 68 -1.534 7.915 -1.086 559 H ARG 69 HN ARG 69 -2.990 6.585 2.944 560 HA ARG 69 HA ARG 69 -1.684 8.848 3.979 561 HB2 ARG 69 HB2 ARG 69 -3.782 6.985 4.882 562 HB3 ARG 69 HB1 ARG 69 -3.031 7.963 6.130 563 HG2 ARG 69 HG2 ARG 69 -3.956 9.349 3.681 564 HG3 ARG 69 HG1 ARG 69 -5.188 8.743 4.789 565 HD2 ARG 69 HD2 ARG 69 -4.588 11.055 5.305 566 HD3 ARG 69 HD1 ARG 69 -4.164 9.963 6.622 567 HE ARG 69 HE ARG 69 -2.024 10.522 4.759 568 HH11 ARG 69 HH11 ARG 69 -3.613 11.495 7.718 569 HH12 ARG 69 HH12 ARG 69 -2.204 12.271 8.368 570 HH21 ARG 69 HH21 ARG 69 -0.171 11.540 5.605 571 HH22 ARG 69 HH22 ARG 69 -0.251 12.301 7.163 572 H TYR 70 HN TYR 70 -1.160 5.472 4.499 573 HA TYR 70 HA TYR 70 0.310 5.752 6.922 574 HB2 TYR 70 HB2 TYR 70 -0.625 3.610 6.525 575 HB3 TYR 70 HB1 TYR 70 0.055 3.539 4.905 576 HD1 TYR 70 HD2 TYR 70 1.203 3.928 8.433 577 HD2 TYR 70 HD1 TYR 70 1.907 2.295 4.580 578 HE1 TYR 70 HE2 TYR 70 3.226 2.830 9.289 579 HE2 TYR 70 HE1 TYR 70 3.924 1.185 5.409 580 HH TYR 70 HH TYR 70 5.435 1.146 7.144 581 H VAL 71 HN VAL 71 1.240 5.258 3.507 582 HA VAL 71 HA VAL 71 4.009 5.322 3.992 583 HB VAL 71 HB VAL 71 4.367 5.708 1.680 584 HG11 VAL 71 HG11 VAL 71 2.635 4.210 0.583 585 HG12 VAL 71 HG12 VAL 71 1.972 4.008 2.206 586 HG13 VAL 71 HG13 VAL 71 3.635 3.530 1.859 587 HG21 VAL 71 HG21 VAL 71 2.767 6.509 0.153 588 HG22 VAL 71 HG22 VAL 71 2.878 7.650 1.486 589 HG23 VAL 71 HG23 VAL 71 1.508 6.542 1.379 590 H THR 72 HN THR 72 1.604 7.855 3.610 591 HA THR 72 HA THR 72 3.420 9.911 3.047 592 HB THR 72 HB THR 72 1.654 11.505 3.644 593 HG1 THR 72 HG1 THR 72 0.585 9.254 4.887 594 HG21 THR 72 HG21 THR 72 1.101 9.130 1.936 595 HG22 THR 72 HG22 THR 72 1.517 10.779 1.452 596 HG23 THR 72 HG23 THR 72 -0.099 10.420 2.069 597 H SER 73 HN SER 73 2.445 8.418 6.015 598 HA SER 73 HA SER 73 3.492 10.404 7.764 599 HB2 SER 73 HB2 SER 73 3.103 8.839 9.505 600 HB3 SER 73 HB1 SER 73 1.835 8.533 8.313 601 HG SER 73 HG SER 73 2.991 6.760 7.570 602 H CYS 74 HN CYS 74 4.841 7.961 5.796 603 HA CYS 74 HA CYS 74 7.429 8.029 7.168 604 HB2 CYS 74 HB2 CYS 74 6.684 5.812 6.648 605 HB3 CYS 74 HB1 CYS 74 6.386 6.256 4.968 606 HG CYS 74 HG CYS 74 9.252 6.855 4.675 607 H LEU 75 HN LEU 75 5.810 9.114 4.304 608 HA LEU 75 HA LEU 75 8.323 9.746 2.959 609 HB2 LEU 75 HB2 LEU 75 5.498 9.754 1.904 610 HB3 LEU 75 HB1 LEU 75 6.935 9.951 0.946 611 HG LEU 75 HG LEU 75 5.959 7.471 2.312 612 HD11 LEU 75 HD11 LEU 75 5.138 8.116 0.022 613 HD12 LEU 75 HD12 LEU 75 5.928 6.545 0.136 614 HD13 LEU 75 HD13 LEU 75 6.797 7.921 -0.535 615 HD21 LEU 75 HD21 LEU 75 8.010 6.363 1.727 616 HD22 LEU 75 HD22 LEU 75 8.389 7.751 2.741 617 HD23 LEU 75 HD23 LEU 75 8.650 7.834 0.998 618 H ARG 76 HN ARG 76 5.322 11.319 4.045 619 HA ARG 76 HA ARG 76 6.274 13.818 2.876 620 HB2 ARG 76 HB2 ARG 76 3.563 13.048 3.892 621 HB3 ARG 76 HB1 ARG 76 3.978 14.646 3.282 622 HG2 ARG 76 HG2 ARG 76 4.693 13.508 1.151 623 HG3 ARG 76 HG1 ARG 76 3.938 12.051 1.799 624 HD2 ARG 76 HD2 ARG 76 2.376 13.170 0.368 625 HD3 ARG 76 HD1 ARG 76 1.848 13.278 2.042 626 HE ARG 76 HE ARG 76 3.235 15.579 1.670 627 HH11 ARG 76 HH11 ARG 76 0.591 14.049 -0.031 628 HH12 ARG 76 HH12 ARG 76 -0.106 15.546 -0.560 629 HH21 ARG 76 HH21 ARG 76 2.321 17.562 0.977 630 HH22 ARG 76 HH22 ARG 76 0.888 17.545 -0.002 631 H LYS 77 HN LYS 77 4.854 12.662 5.935 632 HA LYS 77 HA LYS 77 5.911 15.058 7.268 633 HB2 LYS 77 HB2 LYS 77 3.475 14.124 7.518 634 HB3 LYS 77 HB1 LYS 77 4.234 12.970 8.601 635 HG2 LYS 77 HG2 LYS 77 4.497 15.938 8.957 636 HG3 LYS 77 HG1 LYS 77 3.191 14.999 9.673 637 HD2 LYS 77 HD2 LYS 77 4.829 13.634 10.872 638 HD3 LYS 77 HD1 LYS 77 6.140 14.569 10.149 639 HE2 LYS 77 HE2 LYS 77 5.314 16.586 11.242 640 HE3 LYS 77 HE1 LYS 77 3.980 15.672 11.942 641 HZ1 LYS 77 HZ1 LYS 77 5.540 14.375 13.205 642 HZ2 LYS 77 HZ2 LYS 77 5.824 16.015 13.497 643 HZ3 LYS 77 HZ3 LYS 77 6.850 15.151 12.472 644 H LYS 78 HN LYS 78 8.077 14.416 7.237 645 HA LYS 78 HA LYS 78 8.999 12.835 9.387 646 HB2 LYS 78 HB2 LYS 78 8.138 11.108 7.795 647 HB3 LYS 78 HB1 LYS 78 9.373 11.606 6.662 648 HG2 LYS 78 HG2 LYS 78 10.098 9.623 7.807 649 HG3 LYS 78 HG1 LYS 78 11.097 10.986 8.314 650 HD2 LYS 78 HD2 LYS 78 9.979 11.146 10.399 651 HD3 LYS 78 HD1 LYS 78 8.695 10.056 9.872 652 HE2 LYS 78 HE2 LYS 78 10.219 8.912 11.378 653 HE3 LYS 78 HE1 LYS 78 10.306 8.216 9.763 654 HZ1 LYS 78 HZ1 LYS 78 12.341 9.485 9.375 655 HZ2 LYS 78 HZ2 LYS 78 12.498 8.470 10.718 656 HZ3 LYS 78 HZ3 LYS 78 12.254 10.125 10.940 657 H ARG 79 HN ARG 79 11.271 12.842 9.558 658 HA ARG 79 HA ARG 79 12.627 14.719 7.761 659 HB2 ARG 79 HB2 ARG 79 14.298 14.973 9.597 660 HB3 ARG 79 HB1 ARG 79 12.684 15.497 10.046 661 HG2 ARG 79 HG2 ARG 79 13.621 12.742 10.722 662 HG3 ARG 79 HG1 ARG 79 14.089 14.117 11.716 663 HD2 ARG 79 HD2 ARG 79 11.814 14.613 12.229 664 HD3 ARG 79 HD1 ARG 79 11.228 13.451 11.044 665 HE ARG 79 HE ARG 79 12.875 12.325 13.133 666 HH11 ARG 79 HH11 ARG 79 9.617 13.163 12.153 667 HH12 ARG 79 HH12 ARG 79 8.869 11.994 13.195 668 HH21 ARG 79 HH21 ARG 79 11.895 10.792 14.508 669 HH22 ARG 79 HH22 ARG 79 10.164 10.649 14.538 670 H LYS 80 HN LYS 80 12.586 12.764 6.341 671 HA LYS 80 HA LYS 80 13.651 11.104 5.233 672 HB2 LYS 80 HB2 LYS 80 15.869 11.575 7.229 673 HB3 LYS 80 HB1 LYS 80 15.987 10.493 5.848 674 HG2 LYS 80 HG2 LYS 80 15.474 13.454 5.679 675 HG3 LYS 80 HG1 LYS 80 17.043 12.680 5.455 676 HD2 LYS 80 HD2 LYS 80 16.146 11.422 3.557 677 HD3 LYS 80 HD1 LYS 80 14.578 12.200 3.782 678 HE2 LYS 80 HE2 LYS 80 15.608 14.380 3.366 679 HE3 LYS 80 HE1 LYS 80 17.169 13.598 3.128 680 HZ1 LYS 80 HZ1 LYS 80 16.103 14.070 1.022 681 HZ2 LYS 80 HZ2 LYS 80 14.745 13.174 1.473 682 HZ3 LYS 80 HZ3 LYS 80 16.228 12.398 1.247 683 HA PRO 81 HA PRO 81 12.481 7.660 7.838 684 HB2 PRO 81 HB2 PRO 81 12.047 5.869 5.906 685 HB3 PRO 81 HB1 PRO 81 10.960 7.245 6.132 686 HG2 PRO 81 HG2 PRO 81 13.120 6.849 4.106 687 HG3 PRO 81 HG1 PRO 81 11.519 7.580 3.910 688 HD2 PRO 81 HD2 PRO 81 13.886 8.992 4.260 689 HD3 PRO 81 HD1 PRO 81 12.258 9.627 4.561 690 H GLN 82 HN GLN 82 15.160 7.803 5.661 691 HA GLN 82 HA GLN 82 16.296 5.343 6.816 692 HB2 GLN 82 HB2 GLN 82 16.754 6.538 4.078 693 HB3 GLN 82 HB1 GLN 82 17.582 5.128 4.711 694 HG2 GLN 82 HG2 GLN 82 14.608 5.303 4.324 695 HG3 GLN 82 HG1 GLN 82 15.729 4.623 3.145 696 HE21 GLN 82 HE21 GLN 82 16.740 2.670 3.581 697 HE22 GLN 82 HE22 GLN 82 16.173 1.602 4.817 698 H ALA 83 HN ALA 83 18.755 5.335 6.587 699 HA ALA 83 HA ALA 83 19.941 7.987 6.925 700 HB1 ALA 83 HB1 ALA 83 20.273 5.709 8.875 701 HB2 ALA 83 HB2 ALA 83 19.452 7.239 9.179 702 HB3 ALA 83 HB3 ALA 83 21.192 7.213 8.900 703 H1 VAL 201 HT1 VAL 201 -5.554 -3.026 -14.408 704 H2 VAL 201 HT2 VAL 201 -7.074 -2.415 -14.822 705 H3 VAL 201 HT3 VAL 201 -6.400 -2.046 -13.311 706 HA VAL 201 HA VAL 201 -5.398 -1.172 -15.964 707 HB VAL 201 HB VAL 201 -6.513 0.447 -13.661 708 HG11 VAL 201 HG11 VAL 201 -5.635 1.284 -16.421 709 HG12 VAL 201 HG12 VAL 201 -4.809 1.648 -14.906 710 HG13 VAL 201 HG13 VAL 201 -6.404 2.331 -15.228 711 HG21 VAL 201 HG21 VAL 201 -7.743 -0.188 -16.342 712 HG22 VAL 201 HG22 VAL 201 -8.411 0.914 -15.138 713 HG23 VAL 201 HG23 VAL 201 -8.278 -0.808 -14.780 714 H VAL 202 HN VAL 202 -5.016 -0.954 -12.441 715 HA VAL 202 HA VAL 202 -2.396 0.218 -12.629 716 HB VAL 202 HB VAL 202 -3.920 -0.925 -10.284 717 HG11 VAL 202 HG11 VAL 202 -1.386 0.715 -10.257 718 HG12 VAL 202 HG12 VAL 202 -1.494 -1.004 -9.880 719 HG13 VAL 202 HG13 VAL 202 -2.296 0.178 -8.845 720 HG21 VAL 202 HG21 VAL 202 -3.374 1.941 -11.030 721 HG22 VAL 202 HG22 VAL 202 -4.384 1.358 -9.706 722 HG23 VAL 202 HG23 VAL 202 -4.878 1.086 -11.376 723 HA PRO 203 HA PRO 203 -0.156 -3.617 -13.159 724 HB2 PRO 203 HB2 PRO 203 2.276 -2.642 -12.337 725 HB3 PRO 203 HB1 PRO 203 1.621 -2.419 -13.962 726 HG2 PRO 203 HG2 PRO 203 1.583 -0.543 -11.630 727 HG3 PRO 203 HG1 PRO 203 1.923 -0.200 -13.337 728 HD2 PRO 203 HD2 PRO 203 -0.459 0.359 -12.259 729 HD3 PRO 203 HD1 PRO 203 -0.325 -0.251 -13.923 730 H LYS 204 HN LYS 204 0.654 -5.241 -11.857 731 HA LYS 204 HA LYS 204 -0.148 -5.111 -9.109 732 HB2 LYS 204 HB2 LYS 204 1.452 -7.310 -10.421 733 HB3 LYS 204 HB1 LYS 204 0.425 -7.432 -9.001 734 HG2 LYS 204 HG2 LYS 204 -0.471 -6.978 -11.838 735 HG3 LYS 204 HG1 LYS 204 -0.670 -8.450 -10.887 736 HD2 LYS 204 HD2 LYS 204 -2.118 -7.235 -9.325 737 HD3 LYS 204 HD1 LYS 204 -1.915 -5.767 -10.282 738 HE2 LYS 204 HE2 LYS 204 -2.938 -6.891 -12.206 739 HE3 LYS 204 HE1 LYS 204 -3.160 -8.343 -11.233 740 HZ1 LYS 204 HZ1 LYS 204 -4.552 -7.013 -9.713 741 HZ2 LYS 204 HZ2 LYS 204 -5.195 -7.120 -11.279 742 HZ3 LYS 204 HZ3 LYS 204 -4.429 -5.700 -10.783 743 H LYS 205 HN LYS 205 1.100 -4.714 -7.352 744 HA LYS 205 HA LYS 205 3.892 -4.035 -7.885 745 HB2 LYS 205 HB2 LYS 205 2.481 -2.343 -6.784 746 HB3 LYS 205 HB1 LYS 205 2.196 -3.453 -5.450 747 HG2 LYS 205 HG2 LYS 205 3.867 -1.943 -4.738 748 HG3 LYS 205 HG1 LYS 205 4.683 -3.471 -5.077 749 HD2 LYS 205 HD2 LYS 205 5.236 -2.557 -7.350 750 HD3 LYS 205 HD1 LYS 205 4.615 -0.999 -6.801 751 HE2 LYS 205 HE2 LYS 205 6.933 -0.878 -6.466 752 HE3 LYS 205 HE1 LYS 205 6.257 -1.207 -4.871 753 HZ1 LYS 205 HZ1 LYS 205 6.783 -3.582 -5.246 754 HZ2 LYS 205 HZ2 LYS 205 8.156 -2.598 -5.217 755 HZ3 LYS 205 HZ3 LYS 205 7.553 -3.163 -6.694 756 H LYS 206 HN LYS 206 5.187 -5.725 -7.700 757 HA LYS 206 HA LYS 206 4.726 -7.809 -5.770 758 HB2 LYS 206 HB2 LYS 206 5.647 -8.388 -7.944 759 HB3 LYS 206 HB1 LYS 206 7.017 -7.320 -7.681 760 HG2 LYS 206 HG2 LYS 206 7.862 -8.716 -5.938 761 HG3 LYS 206 HG1 LYS 206 6.407 -9.712 -5.965 762 HD2 LYS 206 HD2 LYS 206 8.361 -9.426 -8.244 763 HD3 LYS 206 HD1 LYS 206 8.309 -10.780 -7.114 764 HE2 LYS 206 HE2 LYS 206 6.138 -9.949 -9.036 765 HE3 LYS 206 HE1 LYS 206 7.169 -11.372 -9.162 766 HZ1 LYS 206 HZ1 LYS 206 4.961 -11.886 -8.279 767 HZ2 LYS 206 HZ2 LYS 206 5.238 -10.866 -6.956 768 HZ3 LYS 206 HZ3 LYS 206 6.181 -12.255 -7.171 769 H ILE 207 HN ILE 207 5.579 -7.985 -3.823 770 HA ILE 207 HA ILE 207 7.664 -6.062 -3.013 771 HB ILE 207 HB ILE 207 5.479 -7.261 -1.310 772 HG12 ILE 207 HG12 ILE 207 4.703 -5.604 -3.026 773 HG13 ILE 207 HG11 ILE 207 4.389 -5.133 -1.362 774 HG21 ILE 207 HG21 ILE 207 6.235 -5.466 0.306 775 HG22 ILE 207 HG22 ILE 207 7.671 -5.303 -0.707 776 HG23 ILE 207 HG23 ILE 207 7.323 -6.838 0.087 777 HD11 ILE 207 HD11 ILE 207 6.191 -3.559 -1.418 778 HD12 ILE 207 HD12 ILE 207 5.156 -3.287 -2.816 779 HD13 ILE 207 HD13 ILE 207 6.695 -4.127 -3.007 780 H LYS 208 HN LYS 208 9.440 -7.372 -3.266 781 HA LYS 208 HA LYS 208 9.347 -10.036 -2.038 782 HB2 LYS 208 HB2 LYS 208 9.917 -9.915 -4.454 783 HB3 LYS 208 HB1 LYS 208 11.323 -8.944 -4.048 784 HG2 LYS 208 HG2 LYS 208 12.015 -11.209 -4.424 785 HG3 LYS 208 HG1 LYS 208 12.198 -10.832 -2.711 786 HD2 LYS 208 HD2 LYS 208 11.254 -13.042 -2.953 787 HD3 LYS 208 HD1 LYS 208 10.042 -11.959 -2.268 788 HE2 LYS 208 HE2 LYS 208 9.029 -13.371 -3.951 789 HE3 LYS 208 HE1 LYS 208 9.042 -11.698 -4.502 790 HZ1 LYS 208 HZ1 LYS 208 10.957 -13.813 -5.330 791 HZ2 LYS 208 HZ2 LYS 208 10.991 -12.206 -5.854 792 HZ3 LYS 208 HZ3 LYS 208 9.691 -13.202 -6.268 793 H LYS 209 HN LYS 209 9.789 -9.573 0.051 794 HA LYS 209 HA LYS 209 11.056 -9.325 1.894 795 HB2 LYS 209 HB2 LYS 209 13.380 -9.505 -0.026 796 HB3 LYS 209 HB1 LYS 209 13.476 -9.687 1.719 797 HG2 LYS 209 HG2 LYS 209 12.030 -11.666 1.578 798 HG3 LYS 209 HG1 LYS 209 11.981 -11.486 -0.176 799 HD2 LYS 209 HD2 LYS 209 13.616 -13.171 0.479 800 HD3 LYS 209 HD1 LYS 209 14.405 -11.787 -0.276 801 HE2 LYS 209 HE2 LYS 209 15.023 -10.922 1.912 802 HE3 LYS 209 HE1 LYS 209 14.183 -12.260 2.694 803 HZ1 LYS 209 HZ1 LYS 209 16.591 -12.597 2.554 804 HZ2 LYS 209 HZ2 LYS 209 16.499 -12.557 0.865 805 HZ3 LYS 209 HZ3 LYS 209 15.732 -13.794 1.723 806 H GLU 210 HN GLU 210 13.588 -7.718 0.108 807 HA GLU 210 HA GLU 210 13.078 -5.353 1.764 808 HB2 GLU 210 HB2 GLU 210 15.592 -6.300 0.381 809 HB3 GLU 210 HB1 GLU 210 15.459 -4.787 1.265 810 HG2 GLU 210 HG2 GLU 210 15.150 -7.557 2.397 811 HG3 GLU 210 HG1 GLU 210 16.513 -6.464 2.636 812 H GLN 211 HN GLN 211 12.791 -3.371 0.923 813 HA GLN 211 HA GLN 211 13.566 -2.713 -1.750 814 HB2 GLN 211 HB2 GLN 211 11.426 -3.790 -2.251 815 HB3 GLN 211 HB1 GLN 211 10.618 -2.776 -1.064 816 HG2 GLN 211 HG2 GLN 211 10.676 -0.924 -2.387 817 HG3 GLN 211 HG1 GLN 211 12.123 -1.445 -3.244 818 HE21 GLN 211 HE21 GLN 211 11.275 -1.039 -5.221 819 HE22 GLN 211 HE22 GLN 211 10.041 -2.010 -5.940 820 H VAL 212 HN VAL 212 13.707 -0.500 -2.057 821 HA VAL 212 HA VAL 212 12.455 1.403 -0.362 822 HB VAL 212 HB VAL 212 14.190 0.548 1.203 823 HG11 VAL 212 HG11 VAL 212 16.544 1.078 0.819 824 HG12 VAL 212 HG12 VAL 212 16.145 1.661 -0.796 825 HG13 VAL 212 HG13 VAL 212 15.918 -0.039 -0.393 826 HG21 VAL 212 HG21 VAL 212 13.357 2.812 1.445 827 HG22 VAL 212 HG22 VAL 212 14.572 3.399 0.309 828 HG23 VAL 212 HG23 VAL 212 15.068 2.736 1.867 829 H GLU 213 HN GLU 213 12.758 3.529 -1.120 830 HA GLU 213 HA GLU 213 13.645 3.694 -3.858 831 HB2 GLU 213 HB2 GLU 213 11.607 4.847 -3.086 832 HB3 GLU 213 HB1 GLU 213 12.578 5.847 -2.019 833 HG2 GLU 213 HG2 GLU 213 12.037 7.122 -3.951 834 HG3 GLU 213 HG1 GLU 213 13.752 6.727 -4.024 Start of MODEL 16 1 H1 SER 1 HT1 SER 1 -20.591 -0.703 10.373 2 H2 SER 1 HT2 SER 1 -20.321 0.940 10.676 3 H3 SER 1 HT3 SER 1 -19.027 -0.078 10.282 4 HA SER 1 HA SER 1 -19.795 -0.382 8.086 5 HB2 SER 1 HB2 SER 1 -22.148 1.332 8.892 6 HB3 SER 1 HB1 SER 1 -21.884 0.594 7.312 7 HG SER 1 HG SER 1 -22.523 -1.283 8.059 8 H GLU 2 HN GLU 2 -18.643 1.809 10.033 9 HA GLU 2 HA GLU 2 -18.988 4.182 8.422 10 HB2 GLU 2 HB2 GLU 2 -17.745 3.613 11.085 11 HB3 GLU 2 HB1 GLU 2 -17.466 5.135 10.263 12 HG2 GLU 2 HG2 GLU 2 -19.289 5.263 11.904 13 HG3 GLU 2 HG1 GLU 2 -19.816 5.633 10.262 14 H GLU 3 HN GLU 3 -16.599 1.718 8.913 15 HA GLU 3 HA GLU 3 -14.403 3.198 7.852 16 HB2 GLU 3 HB2 GLU 3 -14.870 0.229 8.145 17 HB3 GLU 3 HB1 GLU 3 -13.407 0.896 7.439 18 HG2 GLU 3 HG2 GLU 3 -14.395 1.565 10.197 19 HG3 GLU 3 HG1 GLU 3 -13.203 0.315 9.840 20 H GLU 4 HN GLU 4 -17.203 2.168 6.455 21 HA GLU 4 HA GLU 4 -16.039 1.850 3.798 22 HB2 GLU 4 HB2 GLU 4 -17.818 0.289 4.614 23 HB3 GLU 4 HB1 GLU 4 -18.936 1.641 4.648 24 HG2 GLU 4 HG2 GLU 4 -18.585 1.941 2.225 25 HG3 GLU 4 HG1 GLU 4 -17.566 0.502 2.228 26 H ASP 5 HN ASP 5 -17.808 4.131 5.764 27 HA ASP 5 HA ASP 5 -18.346 5.816 3.438 28 HB2 ASP 5 HB2 ASP 5 -20.298 5.445 4.774 29 HB3 ASP 5 HB1 ASP 5 -19.449 5.915 6.233 30 H LYS 6 HN LYS 6 -16.429 5.658 6.305 31 HA LYS 6 HA LYS 6 -15.597 8.399 6.293 32 HB2 LYS 6 HB2 LYS 6 -15.476 6.904 8.300 33 HB3 LYS 6 HB1 LYS 6 -14.190 6.006 7.509 34 HG2 LYS 6 HG2 LYS 6 -13.275 7.546 9.124 35 HG3 LYS 6 HG1 LYS 6 -12.797 8.019 7.493 36 HD2 LYS 6 HD2 LYS 6 -14.488 9.747 7.461 37 HD3 LYS 6 HD1 LYS 6 -15.089 9.229 9.037 38 HE2 LYS 6 HE2 LYS 6 -13.687 11.204 9.256 39 HE3 LYS 6 HE1 LYS 6 -12.940 9.818 10.046 40 HZ1 LYS 6 HZ1 LYS 6 -11.485 9.545 8.152 41 HZ2 LYS 6 HZ2 LYS 6 -11.349 11.119 8.754 42 HZ3 LYS 6 HZ3 LYS 6 -12.235 10.829 7.344 43 H CYS 7 HN CYS 7 -14.776 5.604 4.522 44 HA CYS 7 HA CYS 7 -12.183 6.655 3.722 45 HB2 CYS 7 HB2 CYS 7 -13.504 4.006 3.123 46 HB3 CYS 7 HB1 CYS 7 -11.856 4.452 2.669 47 HG CYS 7 HG CYS 7 -12.947 3.141 5.469 48 H LYS 8 HN LYS 8 -11.827 7.569 1.791 49 HA LYS 8 HA LYS 8 -14.099 7.826 -0.051 50 HB2 LYS 8 HB2 LYS 8 -11.575 9.406 0.384 51 HB3 LYS 8 HB1 LYS 8 -12.461 9.543 -1.124 52 HG2 LYS 8 HG2 LYS 8 -13.051 11.330 0.378 53 HG3 LYS 8 HG1 LYS 8 -14.429 10.281 0.070 54 HD2 LYS 8 HD2 LYS 8 -14.069 9.180 2.231 55 HD3 LYS 8 HD1 LYS 8 -12.675 10.218 2.526 56 HE2 LYS 8 HE2 LYS 8 -15.523 11.143 2.165 57 HE3 LYS 8 HE1 LYS 8 -14.669 11.018 3.702 58 HZ1 LYS 8 HZ1 LYS 8 -13.955 12.809 1.443 59 HZ2 LYS 8 HZ2 LYS 8 -13.075 12.664 2.877 60 HZ3 LYS 8 HZ3 LYS 8 -14.648 13.281 2.911 61 HA PRO 9 HA PRO 9 -12.566 5.017 -2.975 62 HB2 PRO 9 HB2 PRO 9 -13.476 6.190 -5.280 63 HB3 PRO 9 HB1 PRO 9 -14.486 5.258 -4.171 64 HG2 PRO 9 HG2 PRO 9 -14.196 8.213 -4.449 65 HG3 PRO 9 HG1 PRO 9 -15.649 7.254 -4.116 66 HD2 PRO 9 HD2 PRO 9 -14.303 8.621 -2.190 67 HD3 PRO 9 HD1 PRO 9 -15.183 7.121 -1.849 68 H MET 10 HN MET 10 -10.741 4.654 -4.112 69 HA MET 10 HA MET 10 -9.029 6.969 -4.673 70 HB2 MET 10 HB2 MET 10 -8.181 5.133 -3.196 71 HB3 MET 10 HB1 MET 10 -8.279 4.043 -4.572 72 HG2 MET 10 HG2 MET 10 -6.093 4.613 -4.706 73 HG3 MET 10 HG1 MET 10 -6.788 5.903 -5.693 74 HE1 MET 10 HE1 MET 10 -5.568 4.796 -2.296 75 HE2 MET 10 HE2 MET 10 -6.891 5.750 -1.638 76 HE3 MET 10 HE3 MET 10 -5.223 6.278 -1.409 77 H SER 11 HN SER 11 -8.536 7.526 -6.763 78 HA SER 11 HA SER 11 -9.780 5.972 -8.873 79 HB2 SER 11 HB2 SER 11 -9.069 7.888 -10.332 80 HB3 SER 11 HB1 SER 11 -10.104 8.352 -8.983 81 HG SER 11 HG SER 11 -8.305 9.113 -7.883 82 H TYR 12 HN TYR 12 -8.342 6.066 -11.071 83 HA TYR 12 HA TYR 12 -6.474 4.023 -10.678 84 HB2 TYR 12 HB2 TYR 12 -7.209 3.832 -12.806 85 HB3 TYR 12 HB1 TYR 12 -7.483 5.563 -12.983 86 HD1 TYR 12 HD1 TYR 12 -4.695 3.054 -12.901 87 HD2 TYR 12 HD2 TYR 12 -6.089 6.786 -14.390 88 HE1 TYR 12 HE1 TYR 12 -2.712 3.212 -14.327 89 HE2 TYR 12 HE2 TYR 12 -4.098 6.953 -15.824 90 HH TYR 12 HH TYR 12 -1.834 6.080 -15.940 91 H GLU 13 HN GLU 13 -5.902 7.435 -11.539 92 HA GLU 13 HA GLU 13 -3.093 7.237 -11.597 93 HB2 GLU 13 HB2 GLU 13 -5.066 9.472 -11.424 94 HB3 GLU 13 HB1 GLU 13 -3.372 9.820 -11.102 95 HG2 GLU 13 HG2 GLU 13 -4.321 8.422 -13.584 96 HG3 GLU 13 HG1 GLU 13 -4.118 10.181 -13.474 97 H GLU 14 HN GLU 14 -5.351 7.639 -9.015 98 HA GLU 14 HA GLU 14 -3.448 8.485 -7.085 99 HB2 GLU 14 HB2 GLU 14 -6.255 7.467 -6.989 100 HB3 GLU 14 HB1 GLU 14 -5.338 7.706 -5.510 101 HG2 GLU 14 HG2 GLU 14 -5.002 10.063 -6.136 102 HG3 GLU 14 HG1 GLU 14 -5.977 9.796 -7.579 103 H LYS 15 HN LYS 15 -5.033 5.399 -7.847 104 HA LYS 15 HA LYS 15 -3.650 3.806 -6.013 105 HB2 LYS 15 HB2 LYS 15 -4.789 3.113 -8.715 106 HB3 LYS 15 HB1 LYS 15 -4.091 1.918 -7.627 107 HG2 LYS 15 HG2 LYS 15 -5.804 2.013 -6.156 108 HG3 LYS 15 HG1 LYS 15 -6.234 3.666 -6.584 109 HD2 LYS 15 HD2 LYS 15 -7.423 3.040 -8.420 110 HD3 LYS 15 HD1 LYS 15 -6.497 1.558 -8.658 111 HE2 LYS 15 HE2 LYS 15 -7.536 0.675 -6.597 112 HE3 LYS 15 HE1 LYS 15 -8.580 2.089 -6.545 113 HZ1 LYS 15 HZ1 LYS 15 -9.479 1.450 -8.697 114 HZ2 LYS 15 HZ2 LYS 15 -9.670 0.189 -7.587 115 HZ3 LYS 15 HZ3 LYS 15 -8.451 0.102 -8.760 116 H ARG 16 HN ARG 16 -2.746 4.910 -9.260 117 HA ARG 16 HA ARG 16 -0.329 3.456 -9.462 118 HB2 ARG 16 HB2 ARG 16 -1.282 4.606 -11.411 119 HB3 ARG 16 HB1 ARG 16 -0.947 6.158 -10.652 120 HG2 ARG 16 HG2 ARG 16 1.449 5.541 -10.597 121 HG3 ARG 16 HG1 ARG 16 1.052 4.107 -11.514 122 HD2 ARG 16 HD2 ARG 16 1.937 5.918 -12.914 123 HD3 ARG 16 HD1 ARG 16 0.313 5.434 -13.352 124 HE ARG 16 HE ARG 16 -0.477 7.508 -12.750 125 HH11 ARG 16 HH11 ARG 16 2.866 7.170 -11.714 126 HH12 ARG 16 HH12 ARG 16 3.064 8.857 -11.375 127 HH21 ARG 16 HH21 ARG 16 -0.193 9.729 -12.360 128 HH22 ARG 16 HH22 ARG 16 1.326 10.314 -11.753 129 H GLN 17 HN GLN 17 -0.975 6.746 -8.315 130 HA GLN 17 HA GLN 17 1.596 7.471 -7.558 131 HB2 GLN 17 HB2 GLN 17 -0.745 8.728 -7.492 132 HB3 GLN 17 HB1 GLN 17 -0.700 8.204 -5.822 133 HG2 GLN 17 HG2 GLN 17 0.176 10.399 -5.882 134 HG3 GLN 17 HG1 GLN 17 1.534 9.308 -5.614 135 HE21 GLN 17 HE21 GLN 17 -0.050 9.759 -8.691 136 HE22 GLN 17 HE22 GLN 17 1.273 10.544 -9.476 137 H LEU 18 HN LEU 18 -0.940 5.875 -5.804 138 HA LEU 18 HA LEU 18 0.220 5.485 -3.316 139 HB2 LEU 18 HB2 LEU 18 -2.146 4.995 -4.360 140 HB3 LEU 18 HB1 LEU 18 -1.476 3.408 -4.617 141 HG LEU 18 HG LEU 18 -2.015 4.784 -2.006 142 HD11 LEU 18 HD11 LEU 18 -3.280 2.567 -1.755 143 HD12 LEU 18 HD12 LEU 18 -3.129 2.461 -3.503 144 HD13 LEU 18 HD13 LEU 18 -3.965 3.828 -2.769 145 HD21 LEU 18 HD21 LEU 18 -0.125 3.708 -1.344 146 HD22 LEU 18 HD22 LEU 18 -0.244 2.486 -2.606 147 HD23 LEU 18 HD23 LEU 18 -1.279 2.386 -1.182 148 H SER 19 HN SER 19 0.236 3.294 -6.140 149 HA SER 19 HA SER 19 1.799 1.307 -4.912 150 HB2 SER 19 HB2 SER 19 1.814 0.251 -6.984 151 HB3 SER 19 HB1 SER 19 0.369 1.256 -7.082 152 HG SER 19 HG SER 19 1.804 2.866 -8.109 153 H LEU 20 HN LEU 20 2.597 4.344 -6.212 154 HA LEU 20 HA LEU 20 5.411 3.742 -6.552 155 HB2 LEU 20 HB2 LEU 20 3.813 6.251 -6.938 156 HB3 LEU 20 HB1 LEU 20 5.529 6.145 -7.241 157 HG LEU 20 HG LEU 20 3.314 4.773 -8.711 158 HD11 LEU 20 HD11 LEU 20 3.906 7.096 -9.273 159 HD12 LEU 20 HD12 LEU 20 4.131 5.964 -10.602 160 HD13 LEU 20 HD13 LEU 20 5.525 6.549 -9.691 161 HD21 LEU 20 HD21 LEU 20 5.017 3.123 -8.399 162 HD22 LEU 20 HD22 LEU 20 6.272 4.257 -8.893 163 HD23 LEU 20 HD23 LEU 20 5.077 3.696 -10.064 164 H ASP 21 HN ASP 21 3.274 5.441 -4.317 165 HA ASP 21 HA ASP 21 5.442 6.409 -2.683 166 HB2 ASP 21 HB2 ASP 21 3.745 7.163 -1.125 167 HB3 ASP 21 HB1 ASP 21 3.407 7.682 -2.749 168 H ILE 22 HN ILE 22 3.354 3.583 -2.665 169 HA ILE 22 HA ILE 22 4.354 2.448 -0.291 170 HB ILE 22 HB ILE 22 2.965 1.471 -2.702 171 HG12 ILE 22 HG12 ILE 22 2.606 0.862 0.221 172 HG13 ILE 22 HG11 ILE 22 1.859 2.225 -0.605 173 HG21 ILE 22 HG21 ILE 22 4.374 -0.481 -0.909 174 HG22 ILE 22 HG22 ILE 22 4.796 -0.139 -2.581 175 HG23 ILE 22 HG23 ILE 22 3.242 -0.874 -2.197 176 HD11 ILE 22 HD11 ILE 22 1.418 -0.650 -1.368 177 HD12 ILE 22 HD12 ILE 22 0.560 0.765 -1.966 178 HD13 ILE 22 HD13 ILE 22 0.371 0.265 -0.288 179 H ASN 23 HN ASN 23 5.525 2.468 -3.610 180 HA ASN 23 HA ASN 23 7.675 0.680 -3.161 181 HB2 ASN 23 HB2 ASN 23 6.727 1.153 -5.395 182 HB3 ASN 23 HB1 ASN 23 7.351 2.792 -5.299 183 HD21 ASN 23 HD21 ASN 23 9.514 3.162 -5.689 184 HD22 ASN 23 HD22 ASN 23 10.593 1.938 -6.260 185 H LYS 24 HN LYS 24 7.164 3.965 -2.388 186 HA LYS 24 HA LYS 24 9.916 4.754 -2.217 187 HB2 LYS 24 HB2 LYS 24 7.304 5.922 -1.416 188 HB3 LYS 24 HB1 LYS 24 8.759 6.565 -0.675 189 HG2 LYS 24 HG2 LYS 24 9.632 7.174 -2.849 190 HG3 LYS 24 HG1 LYS 24 8.246 6.423 -3.641 191 HD2 LYS 24 HD2 LYS 24 6.746 8.033 -2.721 192 HD3 LYS 24 HD1 LYS 24 7.992 8.675 -1.654 193 HE2 LYS 24 HE2 LYS 24 8.076 8.814 -4.672 194 HE3 LYS 24 HE1 LYS 24 7.527 10.114 -3.613 195 HZ1 LYS 24 HZ1 LYS 24 9.723 10.184 -2.616 196 HZ2 LYS 24 HZ2 LYS 24 9.825 10.414 -4.287 197 HZ3 LYS 24 HZ3 LYS 24 10.247 8.922 -3.615 198 H LEU 25 HN LEU 25 7.733 3.016 -0.222 199 HA LEU 25 HA LEU 25 8.925 3.598 2.298 200 HB2 LEU 25 HB2 LEU 25 7.143 1.353 1.383 201 HB3 LEU 25 HB1 LEU 25 7.704 1.526 3.034 202 HG LEU 25 HG LEU 25 5.815 3.299 1.518 203 HD11 LEU 25 HD11 LEU 25 5.710 1.944 4.182 204 HD12 LEU 25 HD12 LEU 25 4.948 1.335 2.713 205 HD13 LEU 25 HD13 LEU 25 4.399 2.849 3.438 206 HD21 LEU 25 HD21 LEU 25 7.201 3.889 4.109 207 HD22 LEU 25 HD22 LEU 25 5.874 4.824 3.430 208 HD23 LEU 25 HD23 LEU 25 7.429 4.765 2.602 209 HA PRO 26 HA PRO 26 12.411 0.790 2.130 210 HB2 PRO 26 HB2 PRO 26 12.894 0.715 4.814 211 HB3 PRO 26 HB1 PRO 26 13.427 2.043 3.777 212 HG2 PRO 26 HG2 PRO 26 11.061 1.872 5.594 213 HG3 PRO 26 HG1 PRO 26 12.140 3.244 5.307 214 HD2 PRO 26 HD2 PRO 26 9.670 3.037 4.186 215 HD3 PRO 26 HD1 PRO 26 11.015 3.881 3.392 216 H GLY 27 HN GLY 27 12.871 -1.384 2.854 217 HA2 GLY 27 HA2 GLY 27 10.762 -3.097 2.539 218 HA3 GLY 27 HA1 GLY 27 12.274 -3.554 3.296 219 H GLU 28 HN GLU 28 12.192 -2.190 5.663 220 HA GLU 28 HA GLU 28 10.549 -3.868 7.200 221 HB2 GLU 28 HB2 GLU 28 11.155 -1.907 8.966 222 HB3 GLU 28 HB1 GLU 28 12.208 -3.250 8.571 223 HG2 GLU 28 HG2 GLU 28 12.320 -0.606 7.163 224 HG3 GLU 28 HG1 GLU 28 13.242 -0.970 8.612 225 H LYS 29 HN LYS 29 10.100 -0.522 6.165 226 HA LYS 29 HA LYS 29 7.753 -0.138 7.768 227 HB2 LYS 29 HB2 LYS 29 9.247 1.442 5.758 228 HB3 LYS 29 HB1 LYS 29 7.545 1.830 5.948 229 HG2 LYS 29 HG2 LYS 29 9.003 3.260 7.307 230 HG3 LYS 29 HG1 LYS 29 7.885 2.321 8.291 231 HD2 LYS 29 HD2 LYS 29 9.529 1.017 9.176 232 HD3 LYS 29 HD1 LYS 29 10.579 1.187 7.761 233 HE2 LYS 29 HE2 LYS 29 11.522 2.356 9.672 234 HE3 LYS 29 HE1 LYS 29 11.057 3.503 8.414 235 HZ1 LYS 29 HZ1 LYS 29 10.412 4.261 10.620 236 HZ2 LYS 29 HZ2 LYS 29 9.481 2.871 10.856 237 HZ3 LYS 29 HZ3 LYS 29 9.045 3.986 9.666 238 H LEU 30 HN LEU 30 8.443 -1.406 4.627 239 HA LEU 30 HA LEU 30 5.744 -1.049 3.705 240 HB2 LEU 30 HB2 LEU 30 6.713 -1.138 1.758 241 HB3 LEU 30 HB1 LEU 30 8.240 -1.556 2.484 242 HG LEU 30 HG LEU 30 6.181 -3.515 1.473 243 HD11 LEU 30 HD11 LEU 30 7.707 -1.940 -0.006 244 HD12 LEU 30 HD12 LEU 30 7.360 -3.607 -0.459 245 HD13 LEU 30 HD13 LEU 30 8.884 -3.209 0.330 246 HD21 LEU 30 HD21 LEU 30 8.956 -3.990 2.477 247 HD22 LEU 30 HD22 LEU 30 7.909 -5.201 1.755 248 HD23 LEU 30 HD23 LEU 30 7.485 -4.472 3.305 249 H GLY 31 HN GLY 31 7.366 -3.374 5.591 250 HA2 GLY 31 HA2 GLY 31 5.674 -5.602 5.115 251 HA3 GLY 31 HA1 GLY 31 6.516 -5.272 6.617 252 H ARG 32 HN ARG 32 5.158 -2.561 6.715 253 HA ARG 32 HA ARG 32 2.823 -3.264 8.165 254 HB2 ARG 32 HB2 ARG 32 3.972 -1.110 8.515 255 HB3 ARG 32 HB1 ARG 32 3.516 -0.614 6.898 256 HG2 ARG 32 HG2 ARG 32 1.710 0.313 7.815 257 HG3 ARG 32 HG1 ARG 32 1.096 -1.331 7.984 258 HD2 ARG 32 HD2 ARG 32 1.127 -1.143 10.220 259 HD3 ARG 32 HD1 ARG 32 2.853 -0.737 10.169 260 HE ARG 32 HE ARG 32 0.948 1.395 9.600 261 HH11 ARG 32 HH11 ARG 32 3.126 -0.124 11.887 262 HH12 ARG 32 HH12 ARG 32 3.230 1.278 12.906 263 HH21 ARG 32 HH21 ARG 32 1.066 3.221 10.943 264 HH22 ARG 32 HH22 ARG 32 2.043 3.180 12.376 265 H VAL 33 HN VAL 33 3.224 -1.915 4.872 266 HA VAL 33 HA VAL 33 0.480 -1.706 4.330 267 HB VAL 33 HB VAL 33 1.568 -2.316 1.854 268 HG11 VAL 33 HG11 VAL 33 1.121 0.246 3.349 269 HG12 VAL 33 HG12 VAL 33 0.095 -0.513 2.128 270 HG13 VAL 33 HG13 VAL 33 1.621 0.223 1.661 271 HG21 VAL 33 HG21 VAL 33 3.527 -0.492 3.174 272 HG22 VAL 33 HG22 VAL 33 3.651 -1.322 1.621 273 HG23 VAL 33 HG23 VAL 33 3.813 -2.232 3.123 274 H VAL 34 HN VAL 34 2.718 -4.335 3.558 275 HA VAL 34 HA VAL 34 0.952 -6.224 2.601 276 HB VAL 34 HB VAL 34 2.595 -7.742 2.877 277 HG11 VAL 34 HG11 VAL 34 3.856 -5.823 2.181 278 HG12 VAL 34 HG12 VAL 34 4.828 -6.869 3.216 279 HG13 VAL 34 HG13 VAL 34 4.138 -5.380 3.863 280 HG21 VAL 34 HG21 VAL 34 2.047 -8.208 5.191 281 HG22 VAL 34 HG22 VAL 34 3.059 -6.853 5.704 282 HG23 VAL 34 HG23 VAL 34 3.793 -8.254 4.923 283 H HIS 35 HN HIS 35 1.494 -5.292 5.990 284 HA HIS 35 HA HIS 35 -0.187 -7.319 7.070 285 HB2 HIS 35 HB2 HIS 35 1.555 -6.331 8.441 286 HB3 HIS 35 HB1 HIS 35 0.833 -4.734 8.277 287 HD1 HIS 35 HD1 HIS 35 0.157 -8.099 9.891 288 HD2 HIS 35 HD2 HIS 35 -1.086 -4.137 10.150 289 HE1 HIS 35 HE1 HIS 35 -1.315 -7.981 11.926 290 HE2 HIS 35 HE2 HIS 35 -2.176 -5.615 11.970 291 H ILE 36 HN ILE 36 -0.656 -3.835 6.471 292 HA ILE 36 HA ILE 36 -3.311 -3.658 7.335 293 HB ILE 36 HB ILE 36 -2.000 -2.138 5.062 294 HG12 ILE 36 HG12 ILE 36 -2.330 -1.323 7.947 295 HG13 ILE 36 HG11 ILE 36 -0.874 -2.075 7.325 296 HG21 ILE 36 HG21 ILE 36 -3.797 -0.702 5.012 297 HG22 ILE 36 HG22 ILE 36 -4.198 -0.994 6.707 298 HG23 ILE 36 HG23 ILE 36 -4.624 -2.190 5.485 299 HD11 ILE 36 HD11 ILE 36 -0.727 -0.152 5.714 300 HD12 ILE 36 HD12 ILE 36 -0.490 0.251 7.410 301 HD13 ILE 36 HD13 ILE 36 -2.023 0.598 6.627 302 H ILE 37 HN ILE 37 -1.915 -4.496 4.242 303 HA ILE 37 HA ILE 37 -4.327 -4.818 2.822 304 HB ILE 37 HB ILE 37 -1.505 -5.652 2.387 305 HG12 ILE 37 HG12 ILE 37 -3.248 -3.933 0.661 306 HG13 ILE 37 HG11 ILE 37 -2.445 -3.290 2.083 307 HG21 ILE 37 HG21 ILE 37 -3.820 -6.860 1.198 308 HG22 ILE 37 HG22 ILE 37 -2.118 -7.302 1.041 309 HG23 ILE 37 HG23 ILE 37 -2.810 -6.077 -0.018 310 HD11 ILE 37 HD11 ILE 37 -1.110 -2.796 0.214 311 HD12 ILE 37 HD12 ILE 37 -1.164 -4.476 -0.335 312 HD13 ILE 37 HD13 ILE 37 -0.294 -4.056 1.140 313 H GLN 38 HN GLN 38 -2.086 -7.404 3.973 314 HA GLN 38 HA GLN 38 -3.686 -9.587 3.457 315 HB2 GLN 38 HB2 GLN 38 -1.786 -9.135 5.770 316 HB3 GLN 38 HB1 GLN 38 -2.546 -10.685 5.446 317 HG2 GLN 38 HG2 GLN 38 -1.446 -10.772 3.272 318 HG3 GLN 38 HG1 GLN 38 -0.736 -9.197 3.581 319 HE21 GLN 38 HE21 GLN 38 -1.129 -11.686 6.007 320 HE22 GLN 38 HE22 GLN 38 0.554 -12.019 6.211 321 H SER 39 HN SER 39 -3.935 -7.376 6.205 322 HA SER 39 HA SER 39 -5.785 -9.031 7.650 323 HB2 SER 39 HB2 SER 39 -5.975 -7.098 9.170 324 HB3 SER 39 HB1 SER 39 -4.293 -7.477 8.821 325 HG SER 39 HG SER 39 -4.154 -5.742 7.489 326 H ARG 40 HN ARG 40 -6.055 -6.045 5.730 327 HA ARG 40 HA ARG 40 -8.922 -5.991 6.016 328 HB2 ARG 40 HB2 ARG 40 -6.998 -4.270 4.432 329 HB3 ARG 40 HB1 ARG 40 -8.744 -4.037 4.412 330 HG2 ARG 40 HG2 ARG 40 -8.712 -3.701 6.791 331 HG3 ARG 40 HG1 ARG 40 -6.980 -3.973 6.837 332 HD2 ARG 40 HD2 ARG 40 -6.652 -2.028 5.423 333 HD3 ARG 40 HD1 ARG 40 -8.397 -1.748 5.392 334 HE ARG 40 HE ARG 40 -7.440 -1.937 8.062 335 HH11 ARG 40 HH11 ARG 40 -7.497 0.293 5.374 336 HH12 ARG 40 HH12 ARG 40 -7.570 1.696 6.384 337 HH21 ARG 40 HH21 ARG 40 -7.555 -0.100 9.381 338 HH22 ARG 40 HH22 ARG 40 -7.581 1.477 8.660 339 H GLU 41 HN GLU 41 -6.741 -7.527 3.991 340 HA GLU 41 HA GLU 41 -8.899 -8.256 2.117 341 HB2 GLU 41 HB2 GLU 41 -5.980 -8.440 1.447 342 HB3 GLU 41 HB1 GLU 41 -7.357 -8.416 0.357 343 HG2 GLU 41 HG2 GLU 41 -6.419 -6.077 1.982 344 HG3 GLU 41 HG1 GLU 41 -5.970 -6.397 0.307 345 HA PRO 42 HA PRO 42 -7.353 -11.893 4.557 346 HB2 PRO 42 HB2 PRO 42 -10.136 -12.825 4.356 347 HB3 PRO 42 HB1 PRO 42 -9.138 -12.586 5.792 348 HG2 PRO 42 HG2 PRO 42 -11.207 -10.963 5.191 349 HG3 PRO 42 HG1 PRO 42 -9.749 -10.383 6.013 350 HD2 PRO 42 HD2 PRO 42 -10.544 -10.100 3.145 351 HD3 PRO 42 HD1 PRO 42 -9.753 -8.928 4.219 352 H SER 43 HN SER 43 -8.824 -11.433 1.546 353 HA SER 43 HA SER 43 -8.928 -14.094 0.587 354 HB2 SER 43 HB2 SER 43 -8.541 -11.501 -0.924 355 HB3 SER 43 HB1 SER 43 -9.012 -13.041 -1.639 356 HG SER 43 HG SER 43 -10.985 -12.790 -0.901 357 H LEU 44 HN LEU 44 -6.332 -11.991 1.275 358 HA LEU 44 HA LEU 44 -4.506 -13.749 -0.211 359 HB2 LEU 44 HB2 LEU 44 -3.037 -11.779 -0.517 360 HB3 LEU 44 HB1 LEU 44 -4.574 -11.628 -1.312 361 HG LEU 44 HG LEU 44 -5.094 -10.367 1.013 362 HD11 LEU 44 HD11 LEU 44 -3.161 -8.862 1.363 363 HD12 LEU 44 HD12 LEU 44 -2.202 -9.906 0.326 364 HD13 LEU 44 HD13 LEU 44 -2.855 -10.527 1.841 365 HD21 LEU 44 HD21 LEU 44 -3.996 -9.329 -1.583 366 HD22 LEU 44 HD22 LEU 44 -4.679 -8.294 -0.334 367 HD23 LEU 44 HD23 LEU 44 -5.686 -9.507 -1.124 368 H LYS 45 HN LYS 45 -5.479 -13.903 2.543 369 HA LYS 45 HA LYS 45 -3.441 -13.044 4.336 370 HB2 LYS 45 HB2 LYS 45 -4.579 -14.329 6.009 371 HB3 LYS 45 HB1 LYS 45 -5.790 -13.550 5.008 372 HG2 LYS 45 HG2 LYS 45 -6.092 -15.676 3.783 373 HG3 LYS 45 HG1 LYS 45 -4.940 -16.431 4.885 374 HD2 LYS 45 HD2 LYS 45 -7.474 -15.094 5.806 375 HD3 LYS 45 HD1 LYS 45 -7.356 -16.815 5.439 376 HE2 LYS 45 HE2 LYS 45 -6.962 -16.849 7.694 377 HE3 LYS 45 HE1 LYS 45 -5.318 -16.701 7.072 378 HZ1 LYS 45 HZ1 LYS 45 -5.420 -14.317 7.478 379 HZ2 LYS 45 HZ2 LYS 45 -5.714 -15.177 8.902 380 HZ3 LYS 45 HZ3 LYS 45 -6.997 -14.460 8.069 381 H ASN 46 HN ASN 46 -3.729 -15.723 2.196 382 HA ASN 46 HA ASN 46 -1.914 -17.462 3.604 383 HB2 ASN 46 HB2 ASN 46 -3.712 -18.282 2.064 384 HB3 ASN 46 HB1 ASN 46 -2.819 -17.590 0.716 385 HD21 ASN 46 HD21 ASN 46 -2.441 -19.486 -0.326 386 HD22 ASN 46 HD22 ASN 46 -1.399 -20.729 0.294 387 H SER 47 HN SER 47 -1.498 -14.651 1.947 388 HA SER 47 HA SER 47 0.938 -15.290 0.550 389 HB2 SER 47 HB2 SER 47 -0.355 -12.635 1.185 390 HB3 SER 47 HB1 SER 47 1.025 -12.856 0.108 391 HG SER 47 HG SER 47 -1.132 -12.748 -0.889 392 H ASN 48 HN ASN 48 3.013 -14.773 1.154 393 HA ASN 48 HA ASN 48 3.541 -14.648 3.974 394 HB2 ASN 48 HB2 ASN 48 5.471 -14.376 1.671 395 HB3 ASN 48 HB1 ASN 48 5.897 -14.716 3.334 396 HD21 ASN 48 HD21 ASN 48 5.710 -16.788 4.099 397 HD22 ASN 48 HD22 ASN 48 5.353 -18.139 3.080 398 HA PRO 49 HA PRO 49 3.509 -10.295 4.504 399 HB2 PRO 49 HB2 PRO 49 5.380 -10.114 6.519 400 HB3 PRO 49 HB1 PRO 49 3.683 -10.543 6.749 401 HG2 PRO 49 HG2 PRO 49 6.079 -12.306 6.587 402 HG3 PRO 49 HG1 PRO 49 4.650 -12.433 7.629 403 HD2 PRO 49 HD2 PRO 49 4.967 -13.979 5.450 404 HD3 PRO 49 HD1 PRO 49 3.370 -13.403 5.971 405 H ASP 50 HN ASP 50 6.467 -11.922 3.687 406 HA ASP 50 HA ASP 50 7.666 -9.320 3.002 407 HB2 ASP 50 HB2 ASP 50 9.004 -12.001 3.407 408 HB3 ASP 50 HB1 ASP 50 9.834 -10.547 2.867 409 H GLU 51 HN GLU 51 5.767 -11.403 1.540 410 HA GLU 51 HA GLU 51 7.092 -11.081 -1.050 411 HB2 GLU 51 HB2 GLU 51 6.058 -13.601 0.194 412 HB3 GLU 51 HB1 GLU 51 6.064 -13.404 -1.535 413 HG2 GLU 51 HG2 GLU 51 8.426 -13.230 -1.594 414 HG3 GLU 51 HG1 GLU 51 8.521 -13.096 0.159 415 H ILE 52 HN ILE 52 4.960 -9.685 0.349 416 HA ILE 52 HA ILE 52 2.424 -10.630 -0.464 417 HB ILE 52 HB ILE 52 3.102 -8.960 1.449 418 HG12 ILE 52 HG12 ILE 52 0.782 -8.186 1.532 419 HG13 ILE 52 HG11 ILE 52 0.555 -8.642 -0.147 420 HG21 ILE 52 HG21 ILE 52 2.411 -7.112 -0.814 421 HG22 ILE 52 HG22 ILE 52 3.977 -7.224 -0.013 422 HG23 ILE 52 HG23 ILE 52 2.567 -6.642 0.874 423 HD11 ILE 52 HD11 ILE 52 1.252 -10.535 2.043 424 HD12 ILE 52 HD12 ILE 52 0.792 -10.938 0.391 425 HD13 ILE 52 HD13 ILE 52 -0.385 -10.219 1.486 426 H GLU 53 HN GLU 53 0.997 -9.774 -1.917 427 HA GLU 53 HA GLU 53 2.241 -8.286 -4.142 428 HB2 GLU 53 HB2 GLU 53 1.657 -10.781 -4.538 429 HB3 GLU 53 HB1 GLU 53 -0.022 -10.272 -4.458 430 HG2 GLU 53 HG2 GLU 53 1.962 -9.150 -6.419 431 HG3 GLU 53 HG1 GLU 53 0.966 -10.562 -6.741 432 H ILE 54 HN ILE 54 1.543 -6.281 -3.583 433 HA ILE 54 HA ILE 54 -1.015 -5.749 -2.481 434 HB ILE 54 HB ILE 54 0.938 -3.846 -3.783 435 HG12 ILE 54 HG12 ILE 54 0.703 -4.758 -0.914 436 HG13 ILE 54 HG11 ILE 54 2.076 -4.979 -1.990 437 HG21 ILE 54 HG21 ILE 54 -1.225 -3.292 -1.788 438 HG22 ILE 54 HG22 ILE 54 -1.352 -2.995 -3.518 439 HG23 ILE 54 HG23 ILE 54 -0.164 -2.115 -2.556 440 HD11 ILE 54 HD11 ILE 54 2.528 -3.187 -0.411 441 HD12 ILE 54 HD12 ILE 54 1.057 -2.369 -0.917 442 HD13 ILE 54 HD13 ILE 54 2.394 -2.546 -2.048 443 H ASP 55 HN ASP 55 -2.741 -6.170 -3.718 444 HA ASP 55 HA ASP 55 -2.718 -5.420 -6.556 445 HB2 ASP 55 HB2 ASP 55 -3.375 -7.752 -6.024 446 HB3 ASP 55 HB1 ASP 55 -4.688 -7.140 -5.024 447 H PHE 56 HN PHE 56 -3.169 -3.301 -6.593 448 HA PHE 56 HA PHE 56 -4.729 -1.991 -4.653 449 HB2 PHE 56 HB2 PHE 56 -3.731 -1.054 -7.326 450 HB3 PHE 56 HB1 PHE 56 -4.449 -0.003 -6.112 451 HD1 PHE 56 HD1 PHE 56 -3.314 0.173 -3.878 452 HD2 PHE 56 HD2 PHE 56 -1.449 -1.647 -7.217 453 HE1 PHE 56 HE1 PHE 56 -1.176 0.444 -2.781 454 HE2 PHE 56 HE2 PHE 56 0.737 -1.370 -6.121 455 HZ PHE 56 HZ PHE 56 0.864 -0.313 -3.894 456 H GLU 57 HN GLU 57 -5.763 -3.816 -7.244 457 HA GLU 57 HA GLU 57 -8.120 -2.237 -7.825 458 HB2 GLU 57 HB2 GLU 57 -7.122 -4.910 -8.794 459 HB3 GLU 57 HB1 GLU 57 -8.676 -4.242 -9.287 460 HG2 GLU 57 HG2 GLU 57 -6.004 -2.915 -9.706 461 HG3 GLU 57 HG1 GLU 57 -6.882 -3.841 -10.923 462 H THR 58 HN THR 58 -7.266 -5.246 -6.182 463 HA THR 58 HA THR 58 -10.013 -5.679 -5.363 464 HB THR 58 HB THR 58 -9.023 -7.637 -4.101 465 HG1 THR 58 HG1 THR 58 -6.699 -6.850 -5.572 466 HG21 THR 58 HG21 THR 58 -8.541 -7.462 -7.074 467 HG22 THR 58 HG22 THR 58 -10.052 -7.917 -6.287 468 HG23 THR 58 HG23 THR 58 -8.636 -8.958 -6.145 469 H LEU 59 HN LEU 59 -7.083 -4.314 -4.047 470 HA LEU 59 HA LEU 59 -7.630 -4.307 -1.327 471 HB2 LEU 59 HB2 LEU 59 -6.378 -2.136 -2.977 472 HB3 LEU 59 HB1 LEU 59 -6.369 -2.198 -1.234 473 HG LEU 59 HG LEU 59 -5.051 -4.144 -3.104 474 HD11 LEU 59 HD11 LEU 59 -3.875 -2.288 -1.060 475 HD12 LEU 59 HD12 LEU 59 -3.934 -1.966 -2.792 476 HD13 LEU 59 HD13 LEU 59 -3.009 -3.333 -2.181 477 HD21 LEU 59 HD21 LEU 59 -5.485 -4.206 -0.133 478 HD22 LEU 59 HD22 LEU 59 -4.134 -5.044 -0.911 479 HD23 LEU 59 HD23 LEU 59 -5.790 -5.465 -1.338 480 H LYS 60 HN LYS 60 -9.199 -3.435 -0.153 481 HA LYS 60 HA LYS 60 -11.321 -1.975 -1.330 482 HB2 LYS 60 HB2 LYS 60 -10.557 -2.323 1.572 483 HB3 LYS 60 HB1 LYS 60 -12.069 -1.617 1.022 484 HG2 LYS 60 HG2 LYS 60 -12.634 -3.740 -0.080 485 HG3 LYS 60 HG1 LYS 60 -11.134 -4.433 0.536 486 HD2 LYS 60 HD2 LYS 60 -13.373 -3.329 2.226 487 HD3 LYS 60 HD1 LYS 60 -13.062 -5.040 1.928 488 HE2 LYS 60 HE2 LYS 60 -10.868 -4.825 2.989 489 HE3 LYS 60 HE1 LYS 60 -11.177 -3.115 3.285 490 HZ1 LYS 60 HZ1 LYS 60 -12.730 -5.379 4.405 491 HZ2 LYS 60 HZ2 LYS 60 -13.063 -3.743 4.666 492 HZ3 LYS 60 HZ3 LYS 60 -11.627 -4.415 5.251 493 HA PRO 61 HA PRO 61 -9.967 2.276 -1.388 494 HB2 PRO 61 HB2 PRO 61 -12.530 2.719 0.088 495 HB3 PRO 61 HB1 PRO 61 -11.871 3.584 -1.305 496 HG2 PRO 61 HG2 PRO 61 -13.817 1.773 -1.578 497 HG3 PRO 61 HG1 PRO 61 -12.555 2.000 -2.798 498 HD2 PRO 61 HD2 PRO 61 -12.951 -0.232 -0.898 499 HD3 PRO 61 HD1 PRO 61 -12.095 -0.211 -2.451 500 H SER 62 HN SER 62 -11.450 0.968 1.555 501 HA SER 62 HA SER 62 -10.417 2.729 3.438 502 HB2 SER 62 HB2 SER 62 -10.759 -0.238 3.901 503 HB3 SER 62 HB1 SER 62 -10.952 1.076 5.064 504 HG SER 62 HG SER 62 -12.895 1.525 4.277 505 H THR 63 HN THR 63 -9.026 -0.331 2.232 506 HA THR 63 HA THR 63 -6.639 -0.189 3.736 507 HB THR 63 HB THR 63 -6.679 -1.494 1.034 508 HG1 THR 63 HG1 THR 63 -7.935 -3.206 1.872 509 HG21 THR 63 HG21 THR 63 -4.727 -2.200 1.985 510 HG22 THR 63 HG22 THR 63 -5.794 -3.348 2.806 511 HG23 THR 63 HG23 THR 63 -5.312 -1.864 3.621 512 H LEU 64 HN LEU 64 -7.372 0.681 0.357 513 HA LEU 64 HA LEU 64 -4.826 1.485 -0.396 514 HB2 LEU 64 HB2 LEU 64 -7.494 2.528 -1.308 515 HB3 LEU 64 HB1 LEU 64 -5.982 2.869 -2.110 516 HG LEU 64 HG LEU 64 -7.099 0.098 -1.744 517 HD11 LEU 64 HD11 LEU 64 -7.820 2.195 -3.581 518 HD12 LEU 64 HD12 LEU 64 -8.546 0.606 -3.348 519 HD13 LEU 64 HD13 LEU 64 -7.167 0.797 -4.432 520 HD21 LEU 64 HD21 LEU 64 -4.740 1.268 -3.178 521 HD22 LEU 64 HD22 LEU 64 -5.459 -0.261 -3.687 522 HD23 LEU 64 HD23 LEU 64 -4.802 -0.096 -2.059 523 H ARG 65 HN ARG 65 -7.439 3.465 0.997 524 HA ARG 65 HA ARG 65 -5.952 5.866 0.939 525 HB2 ARG 65 HB2 ARG 65 -8.347 5.020 2.542 526 HB3 ARG 65 HB1 ARG 65 -7.630 6.622 2.673 527 HG2 ARG 65 HG2 ARG 65 -8.667 5.429 0.112 528 HG3 ARG 65 HG1 ARG 65 -9.576 6.520 1.146 529 HD2 ARG 65 HD2 ARG 65 -7.915 8.257 0.827 530 HD3 ARG 65 HD1 ARG 65 -6.947 7.170 -0.162 531 HE ARG 65 HE ARG 65 -9.602 7.484 -1.171 532 HH11 ARG 65 HH11 ARG 65 -6.444 8.994 -1.024 533 HH12 ARG 65 HH12 ARG 65 -6.621 9.796 -2.551 534 HH21 ARG 65 HH21 ARG 65 -9.833 8.576 -3.196 535 HH22 ARG 65 HH22 ARG 65 -8.525 9.564 -3.776 536 H GLU 66 HN GLU 66 -6.066 3.209 3.232 537 HA GLU 66 HA GLU 66 -4.600 4.686 5.202 538 HB2 GLU 66 HB2 GLU 66 -6.004 2.901 5.982 539 HB3 GLU 66 HB1 GLU 66 -5.156 1.733 4.968 540 HG2 GLU 66 HG2 GLU 66 -3.275 1.754 6.280 541 HG3 GLU 66 HG1 GLU 66 -3.641 3.332 6.974 542 H LEU 67 HN LEU 67 -3.758 2.064 2.913 543 HA LEU 67 HA LEU 67 -1.044 1.915 3.306 544 HB2 LEU 67 HB2 LEU 67 -2.205 2.082 0.516 545 HB3 LEU 67 HB1 LEU 67 -0.850 1.115 1.087 546 HG LEU 67 HG LEU 67 -3.707 0.621 1.898 547 HD11 LEU 67 HD11 LEU 67 -2.208 -1.195 0.118 548 HD12 LEU 67 HD12 LEU 67 -2.881 0.275 -0.588 549 HD13 LEU 67 HD13 LEU 67 -3.940 -0.882 0.220 550 HD21 LEU 67 HD21 LEU 67 -1.406 -0.170 3.130 551 HD22 LEU 67 HD22 LEU 67 -1.729 -1.517 2.044 552 HD23 LEU 67 HD23 LEU 67 -2.948 -1.017 3.216 553 H GLU 68 HN GLU 68 -2.749 4.215 1.203 554 HA GLU 68 HA GLU 68 -0.591 5.791 0.403 555 HB2 GLU 68 HB2 GLU 68 -2.826 5.891 -0.602 556 HB3 GLU 68 HB1 GLU 68 -3.475 6.578 0.875 557 HG2 GLU 68 HG2 GLU 68 -1.811 8.467 0.504 558 HG3 GLU 68 HG1 GLU 68 -1.661 7.834 -1.139 559 H ARG 69 HN ARG 69 -2.941 6.526 3.009 560 HA ARG 69 HA ARG 69 -1.550 8.816 3.933 561 HB2 ARG 69 HB2 ARG 69 -3.694 7.070 5.034 562 HB3 ARG 69 HB1 ARG 69 -3.060 8.401 5.995 563 HG2 ARG 69 HG2 ARG 69 -3.604 9.511 3.496 564 HG3 ARG 69 HG1 ARG 69 -4.933 8.412 3.778 565 HD2 ARG 69 HD2 ARG 69 -5.059 9.580 6.094 566 HD3 ARG 69 HD1 ARG 69 -4.189 10.890 5.274 567 HE ARG 69 HE ARG 69 -6.081 10.673 3.570 568 HH11 ARG 69 HH11 ARG 69 -6.474 10.141 7.014 569 HH12 ARG 69 HH12 ARG 69 -8.126 10.668 7.030 570 HH21 ARG 69 HH21 ARG 69 -8.251 11.360 3.597 571 HH22 ARG 69 HH22 ARG 69 -9.137 11.357 5.090 572 H TYR 70 HN TYR 70 -1.072 5.481 4.491 573 HA TYR 70 HA TYR 70 0.367 5.778 6.945 574 HB2 TYR 70 HB2 TYR 70 -0.503 3.612 6.541 575 HB3 TYR 70 HB1 TYR 70 0.161 3.575 4.914 576 HD1 TYR 70 HD2 TYR 70 1.507 4.157 8.357 577 HD2 TYR 70 HD1 TYR 70 1.886 2.172 4.626 578 HE1 TYR 70 HE2 TYR 70 3.560 3.073 9.161 579 HE2 TYR 70 HE1 TYR 70 3.923 1.068 5.412 580 HH TYR 70 HH TYR 70 5.572 1.164 7.019 581 H VAL 71 HN VAL 71 1.287 5.322 3.528 582 HA VAL 71 HA VAL 71 4.059 5.451 4.000 583 HB VAL 71 HB VAL 71 4.393 5.767 1.678 584 HG11 VAL 71 HG11 VAL 71 2.638 4.240 0.625 585 HG12 VAL 71 HG12 VAL 71 2.028 4.055 2.270 586 HG13 VAL 71 HG13 VAL 71 3.684 3.590 1.881 587 HG21 VAL 71 HG21 VAL 71 2.758 6.488 0.131 588 HG22 VAL 71 HG22 VAL 71 2.919 7.691 1.406 589 HG23 VAL 71 HG23 VAL 71 1.533 6.595 1.386 590 H THR 72 HN THR 72 1.586 7.914 3.585 591 HA THR 72 HA THR 72 3.307 10.024 2.935 592 HB THR 72 HB THR 72 1.477 11.539 3.641 593 HG1 THR 72 HG1 THR 72 -0.446 10.609 4.393 594 HG21 THR 72 HG21 THR 72 1.024 9.198 1.855 595 HG22 THR 72 HG22 THR 72 1.341 10.883 1.423 596 HG23 THR 72 HG23 THR 72 -0.239 10.414 2.057 597 H SER 73 HN SER 73 2.296 8.659 5.982 598 HA SER 73 HA SER 73 3.338 10.658 7.670 599 HB2 SER 73 HB2 SER 73 2.999 9.119 9.436 600 HB3 SER 73 HB1 SER 73 1.765 8.714 8.236 601 HG SER 73 HG SER 73 3.089 7.012 7.527 602 H CYS 74 HN CYS 74 4.802 8.186 5.788 603 HA CYS 74 HA CYS 74 7.386 8.471 7.156 604 HB2 CYS 74 HB2 CYS 74 6.707 6.174 6.802 605 HB3 CYS 74 HB1 CYS 74 6.454 6.480 5.085 606 HG CYS 74 HG CYS 74 9.365 7.251 5.020 607 H LEU 75 HN LEU 75 5.739 9.313 4.244 608 HA LEU 75 HA LEU 75 8.237 9.906 2.849 609 HB2 LEU 75 HB2 LEU 75 5.405 9.854 1.815 610 HB3 LEU 75 HB1 LEU 75 6.843 10.002 0.846 611 HG LEU 75 HG LEU 75 5.888 7.596 2.351 612 HD11 LEU 75 HD11 LEU 75 5.036 8.168 0.033 613 HD12 LEU 75 HD12 LEU 75 5.763 6.575 0.236 614 HD13 LEU 75 HD13 LEU 75 6.678 7.869 -0.529 615 HD21 LEU 75 HD21 LEU 75 7.932 6.479 1.817 616 HD22 LEU 75 HD22 LEU 75 8.333 7.950 2.690 617 HD23 LEU 75 HD23 LEU 75 8.535 7.882 0.941 618 H ARG 76 HN ARG 76 5.067 11.433 3.424 619 HA ARG 76 HA ARG 76 6.023 13.991 2.571 620 HB2 ARG 76 HB2 ARG 76 3.460 13.154 3.890 621 HB3 ARG 76 HB1 ARG 76 3.808 14.804 3.380 622 HG2 ARG 76 HG2 ARG 76 4.182 13.886 1.072 623 HG3 ARG 76 HG1 ARG 76 3.541 12.361 1.678 624 HD2 ARG 76 HD2 ARG 76 1.774 13.583 0.613 625 HD3 ARG 76 HD1 ARG 76 1.503 13.516 2.351 626 HE ARG 76 HE ARG 76 2.694 15.854 2.193 627 HH11 ARG 76 HH11 ARG 76 0.233 14.507 0.108 628 HH12 ARG 76 HH12 ARG 76 -0.409 16.051 -0.348 629 HH21 ARG 76 HH21 ARG 76 1.839 17.902 1.602 630 HH22 ARG 76 HH22 ARG 76 0.510 17.977 0.489 631 H LYS 77 HN LYS 77 5.303 12.397 5.595 632 HA LYS 77 HA LYS 77 6.255 14.686 7.140 633 HB2 LYS 77 HB2 LYS 77 4.152 13.356 7.722 634 HB3 LYS 77 HB1 LYS 77 5.226 12.037 8.166 635 HG2 LYS 77 HG2 LYS 77 6.296 13.515 9.828 636 HG3 LYS 77 HG1 LYS 77 5.118 14.766 9.427 637 HD2 LYS 77 HD2 LYS 77 3.324 13.083 9.994 638 HD3 LYS 77 HD1 LYS 77 4.607 12.065 10.650 639 HE2 LYS 77 HE2 LYS 77 3.621 13.314 12.443 640 HE3 LYS 77 HE1 LYS 77 5.247 13.928 12.152 641 HZ1 LYS 77 HZ1 LYS 77 4.297 15.765 10.914 642 HZ2 LYS 77 HZ2 LYS 77 3.649 15.714 12.473 643 HZ3 LYS 77 HZ3 LYS 77 2.735 15.167 11.162 644 H LYS 78 HN LYS 78 7.971 14.454 8.657 645 HA LYS 78 HA LYS 78 9.956 13.708 9.518 646 HB2 LYS 78 HB2 LYS 78 8.805 11.570 9.918 647 HB3 LYS 78 HB1 LYS 78 9.195 11.053 8.286 648 HG2 LYS 78 HG2 LYS 78 10.742 9.995 9.714 649 HG3 LYS 78 HG1 LYS 78 11.619 11.296 8.906 650 HD2 LYS 78 HD2 LYS 78 11.425 12.698 10.860 651 HD3 LYS 78 HD1 LYS 78 10.422 11.493 11.666 652 HE2 LYS 78 HE2 LYS 78 12.685 11.379 12.511 653 HE3 LYS 78 HE1 LYS 78 12.307 9.915 11.608 654 HZ1 LYS 78 HZ1 LYS 78 13.542 10.769 9.734 655 HZ2 LYS 78 HZ2 LYS 78 14.520 10.783 11.110 656 HZ3 LYS 78 HZ3 LYS 78 13.845 12.223 10.543 657 H ARG 79 HN ARG 79 11.922 14.214 8.753 658 HA ARG 79 HA ARG 79 12.443 13.743 5.920 659 HB2 ARG 79 HB2 ARG 79 14.348 15.225 6.145 660 HB3 ARG 79 HB1 ARG 79 12.920 15.995 6.809 661 HG2 ARG 79 HG2 ARG 79 14.329 16.535 8.474 662 HG3 ARG 79 HG1 ARG 79 13.947 14.912 9.050 663 HD2 ARG 79 HD2 ARG 79 15.934 14.026 8.000 664 HD3 ARG 79 HD1 ARG 79 16.287 15.590 7.270 665 HE ARG 79 HE ARG 79 16.129 15.802 10.098 666 HH11 ARG 79 HH11 ARG 79 18.218 14.659 7.536 667 HH12 ARG 79 HH12 ARG 79 19.677 14.932 8.431 668 HH21 ARG 79 HH21 ARG 79 18.048 16.152 11.283 669 HH22 ARG 79 HH22 ARG 79 19.583 15.763 10.570 670 H LYS 80 HN LYS 80 13.534 12.040 5.266 671 HA LYS 80 HA LYS 80 14.812 10.186 5.199 672 HB2 LYS 80 HB2 LYS 80 16.624 11.779 5.694 673 HB3 LYS 80 HB1 LYS 80 16.363 11.535 7.412 674 HG2 LYS 80 HG2 LYS 80 18.298 10.288 6.546 675 HG3 LYS 80 HG1 LYS 80 17.067 9.241 7.252 676 HD2 LYS 80 HD2 LYS 80 17.893 8.263 5.202 677 HD3 LYS 80 HD1 LYS 80 16.218 8.761 4.987 678 HE2 LYS 80 HE2 LYS 80 17.033 10.840 3.902 679 HE3 LYS 80 HE1 LYS 80 18.677 10.215 4.023 680 HZ1 LYS 80 HZ1 LYS 80 16.447 8.937 2.540 681 HZ2 LYS 80 HZ2 LYS 80 18.022 8.340 2.646 682 HZ3 LYS 80 HZ3 LYS 80 17.724 9.798 1.844 683 HA PRO 81 HA PRO 81 12.799 7.963 8.597 684 HB2 PRO 81 HB2 PRO 81 11.810 5.969 7.110 685 HB3 PRO 81 HB1 PRO 81 11.064 7.571 7.108 686 HG2 PRO 81 HG2 PRO 81 12.837 6.300 5.075 687 HG3 PRO 81 HG1 PRO 81 11.452 7.381 4.840 688 HD2 PRO 81 HD2 PRO 81 14.143 8.132 4.778 689 HD3 PRO 81 HD1 PRO 81 12.765 9.231 4.958 690 H GLN 82 HN GLN 82 14.997 7.557 9.368 691 HA GLN 82 HA GLN 82 15.911 4.848 8.652 692 HB2 GLN 82 HB2 GLN 82 17.561 7.269 9.383 693 HB3 GLN 82 HB1 GLN 82 18.206 5.635 9.355 694 HG2 GLN 82 HG2 GLN 82 16.956 7.005 6.990 695 HG3 GLN 82 HG1 GLN 82 18.687 6.954 7.317 696 HE21 GLN 82 HE21 GLN 82 15.894 5.129 6.349 697 HE22 GLN 82 HE22 GLN 82 16.757 3.751 5.764 698 H ALA 83 HN ALA 83 17.021 3.713 10.409 699 HA ALA 83 HA ALA 83 15.703 4.201 12.949 700 HB1 ALA 83 HB1 ALA 83 17.521 1.956 12.078 701 HB2 ALA 83 HB2 ALA 83 15.759 1.927 12.068 702 HB3 ALA 83 HB3 ALA 83 16.630 2.029 13.598 703 H1 VAL 201 HT1 VAL 201 -5.732 1.596 -14.105 704 H2 VAL 201 HT2 VAL 201 -6.506 1.222 -15.558 705 H3 VAL 201 HT3 VAL 201 -4.921 1.812 -15.572 706 HA VAL 201 HA VAL 201 -5.784 -0.765 -14.415 707 HB VAL 201 HB VAL 201 -4.130 -0.259 -16.894 708 HG11 VAL 201 HG11 VAL 201 -4.356 -2.679 -17.245 709 HG12 VAL 201 HG12 VAL 201 -5.199 -2.816 -15.703 710 HG13 VAL 201 HG13 VAL 201 -3.511 -2.306 -15.743 711 HG21 VAL 201 HG21 VAL 201 -6.053 -1.163 -18.137 712 HG22 VAL 201 HG22 VAL 201 -6.439 0.347 -17.313 713 HG23 VAL 201 HG23 VAL 201 -6.988 -1.188 -16.642 714 H VAL 202 HN VAL 202 -4.524 -1.237 -12.743 715 HA VAL 202 HA VAL 202 -1.798 -0.158 -12.649 716 HB VAL 202 HB VAL 202 -3.380 -1.523 -10.456 717 HG11 VAL 202 HG11 VAL 202 -1.645 -0.605 -8.964 718 HG12 VAL 202 HG12 VAL 202 -0.757 -0.034 -10.376 719 HG13 VAL 202 HG13 VAL 202 -0.992 -1.763 -10.121 720 HG21 VAL 202 HG21 VAL 202 -2.826 1.410 -10.902 721 HG22 VAL 202 HG22 VAL 202 -3.634 0.714 -9.496 722 HG23 VAL 202 HG23 VAL 202 -4.385 0.606 -11.087 723 HA PRO 203 HA PRO 203 -0.414 -4.213 -13.888 724 HB2 PRO 203 HB2 PRO 203 2.232 -3.734 -13.831 725 HB3 PRO 203 HB1 PRO 203 1.183 -3.050 -15.077 726 HG2 PRO 203 HG2 PRO 203 2.252 -1.769 -12.590 727 HG3 PRO 203 HG1 PRO 203 2.149 -1.107 -14.232 728 HD2 PRO 203 HD2 PRO 203 0.348 -0.524 -12.273 729 HD3 PRO 203 HD1 PRO 203 -0.066 -0.544 -13.998 730 H LYS 204 HN LYS 204 -1.076 -3.768 -11.073 731 HA LYS 204 HA LYS 204 -0.881 -4.813 -9.068 732 HB2 LYS 204 HB2 LYS 204 1.083 -6.687 -10.387 733 HB3 LYS 204 HB1 LYS 204 0.096 -6.999 -8.969 734 HG2 LYS 204 HG2 LYS 204 -0.859 -6.704 -11.806 735 HG3 LYS 204 HG1 LYS 204 -0.796 -8.186 -10.854 736 HD2 LYS 204 HD2 LYS 204 -2.429 -7.201 -9.283 737 HD3 LYS 204 HD1 LYS 204 -2.529 -5.774 -10.318 738 HE2 LYS 204 HE2 LYS 204 -3.261 -7.237 -12.181 739 HE3 LYS 204 HE1 LYS 204 -3.265 -8.601 -11.064 740 HZ1 LYS 204 HZ1 LYS 204 -5.471 -7.783 -11.229 741 HZ2 LYS 204 HZ2 LYS 204 -4.984 -6.192 -10.956 742 HZ3 LYS 204 HZ3 LYS 204 -4.889 -7.328 -9.701 743 H LYS 205 HN LYS 205 0.880 -5.602 -7.384 744 HA LYS 205 HA LYS 205 3.450 -4.301 -7.864 745 HB2 LYS 205 HB2 LYS 205 2.115 -2.610 -6.715 746 HB3 LYS 205 HB1 LYS 205 1.772 -3.742 -5.420 747 HG2 LYS 205 HG2 LYS 205 3.522 -2.128 -4.823 748 HG3 LYS 205 HG1 LYS 205 4.105 -3.794 -4.793 749 HD2 LYS 205 HD2 LYS 205 5.109 -3.485 -7.000 750 HD3 LYS 205 HD1 LYS 205 4.512 -1.827 -7.044 751 HE2 LYS 205 HE2 LYS 205 5.888 -1.259 -5.122 752 HE3 LYS 205 HE1 LYS 205 6.441 -2.929 -5.005 753 HZ1 LYS 205 HZ1 LYS 205 7.486 -2.712 -7.160 754 HZ2 LYS 205 HZ2 LYS 205 8.061 -1.510 -6.118 755 HZ3 LYS 205 HZ3 LYS 205 6.928 -1.123 -7.311 756 H LYS 206 HN LYS 206 4.503 -6.191 -7.930 757 HA LYS 206 HA LYS 206 4.133 -8.244 -5.951 758 HB2 LYS 206 HB2 LYS 206 4.725 -8.735 -8.310 759 HB3 LYS 206 HB1 LYS 206 6.277 -7.954 -8.063 760 HG2 LYS 206 HG2 LYS 206 6.920 -9.631 -6.463 761 HG3 LYS 206 HG1 LYS 206 5.325 -10.375 -6.550 762 HD2 LYS 206 HD2 LYS 206 7.018 -10.073 -9.004 763 HD3 LYS 206 HD1 LYS 206 7.269 -11.419 -7.896 764 HE2 LYS 206 HE2 LYS 206 5.825 -12.156 -9.653 765 HE3 LYS 206 HE1 LYS 206 4.871 -12.020 -8.179 766 HZ1 LYS 206 HZ1 LYS 206 3.907 -10.000 -8.963 767 HZ2 LYS 206 HZ2 LYS 206 3.769 -11.142 -10.198 768 HZ3 LYS 206 HZ3 LYS 206 4.949 -9.937 -10.295 769 H ILE 207 HN ILE 207 4.741 -7.709 -3.960 770 HA ILE 207 HA ILE 207 7.165 -6.175 -3.492 771 HB ILE 207 HB ILE 207 5.133 -7.264 -1.545 772 HG12 ILE 207 HG12 ILE 207 4.368 -5.531 -3.263 773 HG13 ILE 207 HG11 ILE 207 4.075 -5.165 -1.569 774 HG21 ILE 207 HG21 ILE 207 6.131 -5.511 -0.027 775 HG22 ILE 207 HG22 ILE 207 7.458 -5.396 -1.186 776 HG23 ILE 207 HG23 ILE 207 7.142 -6.919 -0.356 777 HD11 ILE 207 HD11 ILE 207 5.842 -3.590 -1.524 778 HD12 ILE 207 HD12 ILE 207 4.887 -3.260 -2.967 779 HD13 ILE 207 HD13 ILE 207 6.427 -4.106 -3.105 780 H LYS 208 HN LYS 208 8.557 -7.838 -4.306 781 HA LYS 208 HA LYS 208 9.301 -9.698 -2.178 782 HB2 LYS 208 HB2 LYS 208 8.013 -10.909 -3.973 783 HB3 LYS 208 HB1 LYS 208 9.272 -10.453 -5.108 784 HG2 LYS 208 HG2 LYS 208 10.897 -11.751 -3.908 785 HG3 LYS 208 HG1 LYS 208 9.728 -12.106 -2.636 786 HD2 LYS 208 HD2 LYS 208 8.317 -13.261 -4.313 787 HD3 LYS 208 HD1 LYS 208 9.569 -12.978 -5.521 788 HE2 LYS 208 HE2 LYS 208 9.904 -14.555 -2.973 789 HE3 LYS 208 HE1 LYS 208 9.689 -15.241 -4.581 790 HZ1 LYS 208 HZ1 LYS 208 12.008 -15.207 -3.918 791 HZ2 LYS 208 HZ2 LYS 208 11.959 -13.530 -3.731 792 HZ3 LYS 208 HZ3 LYS 208 11.758 -14.214 -5.262 793 H LYS 209 HN LYS 209 10.846 -8.133 -1.671 794 HA LYS 209 HA LYS 209 12.842 -7.070 -1.709 795 HB2 LYS 209 HB2 LYS 209 13.456 -8.987 -3.967 796 HB3 LYS 209 HB1 LYS 209 14.638 -7.935 -3.201 797 HG2 LYS 209 HG2 LYS 209 13.085 -10.122 -1.831 798 HG3 LYS 209 HG1 LYS 209 14.767 -10.215 -2.351 799 HD2 LYS 209 HD2 LYS 209 15.304 -8.332 -0.847 800 HD3 LYS 209 HD1 LYS 209 13.630 -8.330 -0.288 801 HE2 LYS 209 HE2 LYS 209 15.529 -10.660 -0.063 802 HE3 LYS 209 HE1 LYS 209 15.160 -9.529 1.236 803 HZ1 LYS 209 HZ1 LYS 209 12.892 -10.242 1.223 804 HZ2 LYS 209 HZ2 LYS 209 13.878 -11.607 1.347 805 HZ3 LYS 209 HZ3 LYS 209 13.145 -11.228 -0.126 806 H GLU 210 HN GLU 210 14.488 -6.307 -3.880 807 HA GLU 210 HA GLU 210 14.721 -4.721 -5.477 808 HB2 GLU 210 HB2 GLU 210 11.843 -5.363 -6.146 809 HB3 GLU 210 HB1 GLU 210 12.909 -4.367 -7.124 810 HG2 GLU 210 HG2 GLU 210 14.387 -6.292 -7.454 811 HG3 GLU 210 HG1 GLU 210 13.282 -7.287 -6.505 812 H GLN 211 HN GLN 211 13.740 -4.126 -2.761 813 HA GLN 211 HA GLN 211 13.117 -1.352 -3.173 814 HB2 GLN 211 HB2 GLN 211 10.946 -3.072 -2.983 815 HB3 GLN 211 HB1 GLN 211 11.119 -2.439 -1.353 816 HG2 GLN 211 HG2 GLN 211 11.102 -0.148 -2.300 817 HG3 GLN 211 HG1 GLN 211 10.767 -0.854 -3.880 818 HE21 GLN 211 HE21 GLN 211 9.510 -0.053 -0.776 819 HE22 GLN 211 HE22 GLN 211 7.853 -0.411 -1.125 820 H VAL 212 HN VAL 212 15.075 -1.132 -2.039 821 HA VAL 212 HA VAL 212 16.420 -0.823 -0.234 822 HB VAL 212 HB VAL 212 13.830 -0.663 1.319 823 HG11 VAL 212 HG11 VAL 212 16.543 0.534 1.869 824 HG12 VAL 212 HG12 VAL 212 15.811 -0.815 2.736 825 HG13 VAL 212 HG13 VAL 212 15.088 0.791 2.829 826 HG21 VAL 212 HG21 VAL 212 13.922 1.752 0.882 827 HG22 VAL 212 HG22 VAL 212 13.758 0.824 -0.610 828 HG23 VAL 212 HG23 VAL 212 15.322 1.503 -0.161 829 H GLU 213 HN GLU 213 17.240 -2.963 -0.401 830 HA GLU 213 HA GLU 213 16.275 -4.777 1.700 831 HB2 GLU 213 HB2 GLU 213 17.101 -6.636 0.197 832 HB3 GLU 213 HB1 GLU 213 15.669 -5.782 -0.362 833 HG2 GLU 213 HG2 GLU 213 17.126 -4.427 -1.843 834 HG3 GLU 213 HG1 GLU 213 18.488 -5.432 -1.354 Start of MODEL 17 1 H1 SER 1 HT1 SER 1 -17.174 1.543 12.164 2 H2 SER 1 HT2 SER 1 -18.256 0.313 12.583 3 H3 SER 1 HT3 SER 1 -18.840 1.771 11.947 4 HA SER 1 HA SER 1 -17.099 -0.116 10.478 5 HB2 SER 1 HB2 SER 1 -20.063 0.367 10.155 6 HB3 SER 1 HB1 SER 1 -19.084 -0.812 9.280 7 HG SER 1 HG SER 1 -20.387 -1.214 11.505 8 H GLU 2 HN GLU 2 -17.390 2.927 10.972 9 HA GLU 2 HA GLU 2 -18.406 3.879 8.457 10 HB2 GLU 2 HB2 GLU 2 -17.314 5.261 10.898 11 HB3 GLU 2 HB1 GLU 2 -17.799 6.121 9.453 12 HG2 GLU 2 HG2 GLU 2 -19.637 6.247 10.896 13 HG3 GLU 2 HG1 GLU 2 -20.053 5.021 9.697 14 H GLU 3 HN GLU 3 -15.382 2.936 9.683 15 HA GLU 3 HA GLU 3 -13.765 4.747 8.192 16 HB2 GLU 3 HB2 GLU 3 -12.948 1.988 9.102 17 HB3 GLU 3 HB1 GLU 3 -11.907 3.374 8.831 18 HG2 GLU 3 HG2 GLU 3 -13.869 2.954 11.065 19 HG3 GLU 3 HG1 GLU 3 -12.117 3.073 11.170 20 H GLU 4 HN GLU 4 -15.593 1.993 7.407 21 HA GLU 4 HA GLU 4 -14.099 1.458 4.969 22 HB2 GLU 4 HB2 GLU 4 -16.561 0.124 6.104 23 HB3 GLU 4 HB1 GLU 4 -15.705 -0.394 4.661 24 HG2 GLU 4 HG2 GLU 4 -14.577 -0.330 7.451 25 HG3 GLU 4 HG1 GLU 4 -15.137 -1.762 6.593 26 H ASP 5 HN ASP 5 -17.016 3.081 6.011 27 HA ASP 5 HA ASP 5 -17.952 3.239 3.246 28 HB2 ASP 5 HB2 ASP 5 -19.592 2.506 4.928 29 HB3 ASP 5 HB1 ASP 5 -19.412 4.043 5.754 30 H LYS 6 HN LYS 6 -16.965 5.302 5.926 31 HA LYS 6 HA LYS 6 -17.468 7.750 4.510 32 HB2 LYS 6 HB2 LYS 6 -17.419 7.543 7.020 33 HB3 LYS 6 HB1 LYS 6 -15.681 7.319 6.918 34 HG2 LYS 6 HG2 LYS 6 -16.240 9.598 7.534 35 HG3 LYS 6 HG1 LYS 6 -15.434 9.547 5.965 36 HD2 LYS 6 HD2 LYS 6 -17.580 9.759 4.838 37 HD3 LYS 6 HD1 LYS 6 -18.413 9.746 6.394 38 HE2 LYS 6 HE2 LYS 6 -17.354 11.822 7.022 39 HE3 LYS 6 HE1 LYS 6 -16.384 11.811 5.552 40 HZ1 LYS 6 HZ1 LYS 6 -19.345 12.008 5.657 41 HZ2 LYS 6 HZ2 LYS 6 -18.402 12.029 4.254 42 HZ3 LYS 6 HZ3 LYS 6 -18.285 13.291 5.368 43 H CYS 7 HN CYS 7 -15.293 5.365 4.103 44 HA CYS 7 HA CYS 7 -12.843 6.650 3.573 45 HB2 CYS 7 HB2 CYS 7 -12.215 4.565 2.639 46 HB3 CYS 7 HB1 CYS 7 -13.544 4.092 3.713 47 HG CYS 7 HG CYS 7 -14.870 2.876 1.926 48 H LYS 8 HN LYS 8 -12.023 7.535 1.662 49 HA LYS 8 HA LYS 8 -14.024 8.232 -0.341 50 HB2 LYS 8 HB2 LYS 8 -11.647 9.522 0.646 51 HB3 LYS 8 HB1 LYS 8 -11.727 9.470 -1.122 52 HG2 LYS 8 HG2 LYS 8 -13.309 10.991 -1.154 53 HG3 LYS 8 HG1 LYS 8 -14.305 10.058 -0.066 54 HD2 LYS 8 HD2 LYS 8 -13.891 12.212 0.903 55 HD3 LYS 8 HD1 LYS 8 -13.085 10.943 1.821 56 HE2 LYS 8 HE2 LYS 8 -10.959 11.510 0.821 57 HE3 LYS 8 HE1 LYS 8 -11.736 12.685 -0.239 58 HZ1 LYS 8 HZ1 LYS 8 -11.625 12.856 2.721 59 HZ2 LYS 8 HZ2 LYS 8 -12.333 13.993 1.693 60 HZ3 LYS 8 HZ3 LYS 8 -10.663 13.743 1.655 61 HA PRO 9 HA PRO 9 -12.651 5.154 -3.061 62 HB2 PRO 9 HB2 PRO 9 -13.587 6.161 -5.408 63 HB3 PRO 9 HB1 PRO 9 -14.629 5.449 -4.174 64 HG2 PRO 9 HG2 PRO 9 -14.160 8.301 -4.844 65 HG3 PRO 9 HG1 PRO 9 -15.629 7.510 -4.254 66 HD2 PRO 9 HD2 PRO 9 -13.874 9.013 -2.691 67 HD3 PRO 9 HD1 PRO 9 -15.040 7.838 -2.056 68 H MET 10 HN MET 10 -10.686 4.751 -3.849 69 HA MET 10 HA MET 10 -8.989 6.984 -4.597 70 HB2 MET 10 HB2 MET 10 -8.180 5.163 -3.074 71 HB3 MET 10 HB1 MET 10 -8.275 4.053 -4.438 72 HG2 MET 10 HG2 MET 10 -6.081 4.607 -4.555 73 HG3 MET 10 HG1 MET 10 -6.762 5.875 -5.578 74 HE1 MET 10 HE1 MET 10 -5.571 4.843 -2.161 75 HE2 MET 10 HE2 MET 10 -6.894 5.814 -1.524 76 HE3 MET 10 HE3 MET 10 -5.224 6.339 -1.300 77 H SER 11 HN SER 11 -8.656 7.561 -6.656 78 HA SER 11 HA SER 11 -9.913 6.019 -8.736 79 HB2 SER 11 HB2 SER 11 -9.198 7.925 -10.197 80 HB3 SER 11 HB1 SER 11 -10.173 8.405 -8.811 81 HG SER 11 HG SER 11 -8.267 9.037 -7.747 82 H TYR 12 HN TYR 12 -8.597 6.001 -10.959 83 HA TYR 12 HA TYR 12 -6.677 3.998 -10.673 84 HB2 TYR 12 HB2 TYR 12 -7.518 3.789 -12.748 85 HB3 TYR 12 HB1 TYR 12 -7.933 5.494 -12.853 86 HD1 TYR 12 HD1 TYR 12 -4.937 3.250 -13.069 87 HD2 TYR 12 HD2 TYR 12 -6.858 6.785 -14.429 88 HE1 TYR 12 HE1 TYR 12 -3.155 3.565 -14.724 89 HE2 TYR 12 HE2 TYR 12 -5.074 7.115 -16.089 90 HH TYR 12 HH TYR 12 -2.782 6.482 -16.486 91 H GLU 13 HN GLU 13 -6.225 7.419 -11.527 92 HA GLU 13 HA GLU 13 -3.437 7.433 -11.775 93 HB2 GLU 13 HB2 GLU 13 -5.363 9.566 -10.810 94 HB3 GLU 13 HB1 GLU 13 -3.678 9.888 -11.188 95 HG2 GLU 13 HG2 GLU 13 -5.489 8.637 -13.216 96 HG3 GLU 13 HG1 GLU 13 -5.482 10.387 -12.967 97 H GLU 14 HN GLU 14 -5.501 7.650 -8.967 98 HA GLU 14 HA GLU 14 -3.491 8.465 -7.144 99 HB2 GLU 14 HB2 GLU 14 -6.261 7.373 -6.888 100 HB3 GLU 14 HB1 GLU 14 -5.274 7.676 -5.467 101 HG2 GLU 14 HG2 GLU 14 -5.093 10.033 -6.129 102 HG3 GLU 14 HG1 GLU 14 -6.107 9.710 -7.532 103 H LYS 15 HN LYS 15 -5.108 5.378 -7.811 104 HA LYS 15 HA LYS 15 -3.722 3.790 -5.996 105 HB2 LYS 15 HB2 LYS 15 -4.860 3.096 -8.696 106 HB3 LYS 15 HB1 LYS 15 -4.169 1.897 -7.609 107 HG2 LYS 15 HG2 LYS 15 -5.874 2.020 -6.127 108 HG3 LYS 15 HG1 LYS 15 -6.294 3.669 -6.573 109 HD2 LYS 15 HD2 LYS 15 -7.501 3.031 -8.388 110 HD3 LYS 15 HD1 LYS 15 -6.577 1.548 -8.626 111 HE2 LYS 15 HE2 LYS 15 -7.596 0.674 -6.549 112 HE3 LYS 15 HE1 LYS 15 -8.641 2.091 -6.498 113 HZ1 LYS 15 HZ1 LYS 15 -9.554 1.441 -8.638 114 HZ2 LYS 15 HZ2 LYS 15 -9.745 0.191 -7.515 115 HZ3 LYS 15 HZ3 LYS 15 -8.534 0.088 -8.698 116 H ARG 16 HN ARG 16 -2.803 4.871 -9.226 117 HA ARG 16 HA ARG 16 -0.413 3.369 -9.421 118 HB2 ARG 16 HB2 ARG 16 -1.381 4.450 -11.384 119 HB3 ARG 16 HB1 ARG 16 -1.075 6.029 -10.674 120 HG2 ARG 16 HG2 ARG 16 1.331 5.424 -10.609 121 HG3 ARG 16 HG1 ARG 16 0.939 4.012 -11.567 122 HD2 ARG 16 HD2 ARG 16 1.750 5.808 -12.971 123 HD3 ARG 16 HD1 ARG 16 0.067 5.465 -13.300 124 HE ARG 16 HE ARG 16 0.979 7.749 -11.685 125 HH11 ARG 16 HH11 ARG 16 -1.195 6.317 -14.028 126 HH12 ARG 16 HH12 ARG 16 -2.143 7.762 -14.228 127 HH21 ARG 16 HH21 ARG 16 -0.256 9.650 -11.945 128 HH22 ARG 16 HH22 ARG 16 -1.602 9.662 -13.049 129 H GLN 17 HN GLN 17 -0.984 6.730 -8.401 130 HA GLN 17 HA GLN 17 1.607 7.387 -7.654 131 HB2 GLN 17 HB2 GLN 17 -0.319 8.970 -7.761 132 HB3 GLN 17 HB1 GLN 17 -0.940 8.261 -6.278 133 HG2 GLN 17 HG2 GLN 17 0.161 10.202 -5.598 134 HG3 GLN 17 HG1 GLN 17 1.279 8.893 -5.229 135 HE21 GLN 17 HE21 GLN 17 0.656 10.228 -8.410 136 HE22 GLN 17 HE22 GLN 17 2.238 10.885 -8.643 137 H LEU 18 HN LEU 18 -0.936 5.786 -5.899 138 HA LEU 18 HA LEU 18 0.217 5.524 -3.372 139 HB2 LEU 18 HB2 LEU 18 -2.146 4.976 -4.410 140 HB3 LEU 18 HB1 LEU 18 -1.459 3.382 -4.585 141 HG LEU 18 HG LEU 18 -1.998 4.875 -2.036 142 HD11 LEU 18 HD11 LEU 18 -3.260 2.618 -1.741 143 HD12 LEU 18 HD12 LEU 18 -3.187 2.580 -3.497 144 HD13 LEU 18 HD13 LEU 18 -3.971 3.926 -2.673 145 HD21 LEU 18 HD21 LEU 18 -0.122 3.795 -1.342 146 HD22 LEU 18 HD22 LEU 18 -0.262 2.530 -2.558 147 HD23 LEU 18 HD23 LEU 18 -1.292 2.496 -1.128 148 H SER 19 HN SER 19 0.268 3.284 -6.138 149 HA SER 19 HA SER 19 1.815 1.312 -4.871 150 HB2 SER 19 HB2 SER 19 1.855 0.243 -6.933 151 HB3 SER 19 HB1 SER 19 0.423 1.258 -7.072 152 HG SER 19 HG SER 19 1.881 2.848 -8.091 153 H LEU 20 HN LEU 20 2.613 4.334 -6.225 154 HA LEU 20 HA LEU 20 5.429 3.750 -6.535 155 HB2 LEU 20 HB2 LEU 20 3.841 6.263 -6.931 156 HB3 LEU 20 HB1 LEU 20 5.541 6.110 -7.296 157 HG LEU 20 HG LEU 20 3.245 4.753 -8.648 158 HD11 LEU 20 HD11 LEU 20 3.842 7.040 -9.301 159 HD12 LEU 20 HD12 LEU 20 4.026 5.874 -10.604 160 HD13 LEU 20 HD13 LEU 20 5.445 6.474 -9.743 161 HD21 LEU 20 HD21 LEU 20 4.930 3.080 -8.360 162 HD22 LEU 20 HD22 LEU 20 6.181 4.178 -8.943 163 HD23 LEU 20 HD23 LEU 20 4.924 3.605 -10.042 164 H ASP 21 HN ASP 21 3.285 5.462 -4.314 165 HA ASP 21 HA ASP 21 5.448 6.458 -2.697 166 HB2 ASP 21 HB2 ASP 21 3.755 7.181 -1.120 167 HB3 ASP 21 HB1 ASP 21 3.394 7.703 -2.741 168 H ILE 22 HN ILE 22 3.383 3.616 -2.639 169 HA ILE 22 HA ILE 22 4.370 2.494 -0.265 170 HB ILE 22 HB ILE 22 3.062 1.484 -2.712 171 HG12 ILE 22 HG12 ILE 22 2.590 0.955 0.210 172 HG13 ILE 22 HG11 ILE 22 1.864 2.281 -0.690 173 HG21 ILE 22 HG21 ILE 22 4.426 -0.410 -0.827 174 HG22 ILE 22 HG22 ILE 22 4.876 -0.121 -2.502 175 HG23 ILE 22 HG23 ILE 22 3.321 -0.853 -2.120 176 HD11 ILE 22 HD11 ILE 22 1.467 -0.640 -1.312 177 HD12 ILE 22 HD12 ILE 22 0.672 0.730 -2.085 178 HD13 ILE 22 HD13 ILE 22 0.351 0.369 -0.391 179 H ASN 23 HN ASN 23 5.612 2.524 -3.556 180 HA ASN 23 HA ASN 23 7.733 0.709 -3.085 181 HB2 ASN 23 HB2 ASN 23 6.868 1.188 -5.332 182 HB3 ASN 23 HB1 ASN 23 7.437 2.846 -5.200 183 HD21 ASN 23 HD21 ASN 23 9.547 3.299 -5.617 184 HD22 ASN 23 HD22 ASN 23 10.701 2.119 -6.134 185 H LYS 24 HN LYS 24 7.269 3.998 -2.284 186 HA LYS 24 HA LYS 24 10.038 4.729 -2.106 187 HB2 LYS 24 HB2 LYS 24 7.449 5.958 -1.297 188 HB3 LYS 24 HB1 LYS 24 8.940 6.600 -0.628 189 HG2 LYS 24 HG2 LYS 24 9.748 7.149 -2.821 190 HG3 LYS 24 HG1 LYS 24 8.370 6.344 -3.576 191 HD2 LYS 24 HD2 LYS 24 6.854 7.970 -2.755 192 HD3 LYS 24 HD1 LYS 24 8.058 8.648 -1.663 193 HE2 LYS 24 HE2 LYS 24 8.191 8.744 -4.685 194 HE3 LYS 24 HE1 LYS 24 7.663 10.062 -3.636 195 HZ1 LYS 24 HZ1 LYS 24 9.868 10.076 -2.627 196 HZ2 LYS 24 HZ2 LYS 24 9.958 10.340 -4.293 197 HZ3 LYS 24 HZ3 LYS 24 10.364 8.827 -3.658 198 H LEU 25 HN LEU 25 7.818 3.032 -0.129 199 HA LEU 25 HA LEU 25 8.942 3.627 2.413 200 HB2 LEU 25 HB2 LEU 25 7.240 1.334 1.461 201 HB3 LEU 25 HB1 LEU 25 7.724 1.561 3.131 202 HG LEU 25 HG LEU 25 5.874 3.260 1.490 203 HD11 LEU 25 HD11 LEU 25 5.675 1.937 4.165 204 HD12 LEU 25 HD12 LEU 25 4.977 1.311 2.669 205 HD13 LEU 25 HD13 LEU 25 4.384 2.823 3.363 206 HD21 LEU 25 HD21 LEU 25 7.121 3.924 4.132 207 HD22 LEU 25 HD22 LEU 25 5.813 4.820 3.370 208 HD23 LEU 25 HD23 LEU 25 7.406 4.776 2.619 209 HA PRO 26 HA PRO 26 12.478 0.871 2.382 210 HB2 PRO 26 HB2 PRO 26 12.852 0.810 5.087 211 HB3 PRO 26 HB1 PRO 26 13.424 2.124 4.055 212 HG2 PRO 26 HG2 PRO 26 11.012 1.987 5.801 213 HG3 PRO 26 HG1 PRO 26 12.089 3.355 5.495 214 HD2 PRO 26 HD2 PRO 26 9.641 3.087 4.324 215 HD3 PRO 26 HD1 PRO 26 10.993 3.943 3.559 216 H GLY 27 HN GLY 27 13.026 -1.253 3.344 217 HA2 GLY 27 HA2 GLY 27 10.990 -3.045 2.813 218 HA3 GLY 27 HA1 GLY 27 12.463 -3.453 3.669 219 H GLU 28 HN GLU 28 12.229 -2.174 6.036 220 HA GLU 28 HA GLU 28 10.486 -3.858 7.444 221 HB2 GLU 28 HB2 GLU 28 10.938 -1.996 9.304 222 HB3 GLU 28 HB1 GLU 28 12.112 -3.228 8.876 223 HG2 GLU 28 HG2 GLU 28 12.085 -0.524 7.600 224 HG3 GLU 28 HG1 GLU 28 12.915 -0.844 9.115 225 H LYS 29 HN LYS 29 10.070 -0.529 6.351 226 HA LYS 29 HA LYS 29 7.669 -0.115 7.864 227 HB2 LYS 29 HB2 LYS 29 9.286 1.398 5.930 228 HB3 LYS 29 HB1 LYS 29 7.568 1.756 5.886 229 HG2 LYS 29 HG2 LYS 29 8.758 3.303 7.323 230 HG3 LYS 29 HG1 LYS 29 7.621 2.332 8.251 231 HD2 LYS 29 HD2 LYS 29 9.246 1.265 9.396 232 HD3 LYS 29 HD1 LYS 29 10.395 1.321 8.049 233 HE2 LYS 29 HE2 LYS 29 11.089 2.748 9.928 234 HE3 LYS 29 HE1 LYS 29 10.792 3.678 8.458 235 HZ1 LYS 29 HZ1 LYS 29 8.548 4.177 9.371 236 HZ2 LYS 29 HZ2 LYS 29 9.812 4.823 10.287 237 HZ3 LYS 29 HZ3 LYS 29 9.006 3.437 10.822 238 H LEU 30 HN LEU 30 8.464 -1.346 4.701 239 HA LEU 30 HA LEU 30 5.782 -1.009 3.744 240 HB2 LEU 30 HB2 LEU 30 6.771 -1.066 1.808 241 HB3 LEU 30 HB1 LEU 30 8.296 -1.452 2.558 242 HG LEU 30 HG LEU 30 6.300 -3.470 1.522 243 HD11 LEU 30 HD11 LEU 30 7.877 -1.791 0.096 244 HD12 LEU 30 HD12 LEU 30 7.361 -3.378 -0.456 245 HD13 LEU 30 HD13 LEU 30 8.944 -3.177 0.292 246 HD21 LEU 30 HD21 LEU 30 7.728 -4.309 3.375 247 HD22 LEU 30 HD22 LEU 30 9.152 -3.868 2.433 248 HD23 LEU 30 HD23 LEU 30 8.048 -5.108 1.837 249 H GLY 31 HN GLY 31 7.349 -3.298 5.661 250 HA2 GLY 31 HA2 GLY 31 5.668 -5.538 5.186 251 HA3 GLY 31 HA1 GLY 31 6.482 -5.179 6.695 252 H ARG 32 HN ARG 32 5.140 -2.454 6.713 253 HA ARG 32 HA ARG 32 2.806 -3.180 8.167 254 HB2 ARG 32 HB2 ARG 32 3.953 -1.111 8.691 255 HB3 ARG 32 HB1 ARG 32 3.622 -0.484 7.089 256 HG2 ARG 32 HG2 ARG 32 1.649 0.282 7.741 257 HG3 ARG 32 HG1 ARG 32 1.185 -1.299 8.374 258 HD2 ARG 32 HD2 ARG 32 2.937 0.655 9.840 259 HD3 ARG 32 HD1 ARG 32 1.190 0.551 10.065 260 HE ARG 32 HE ARG 32 2.939 -1.771 10.543 261 HH11 ARG 32 HH11 ARG 32 0.575 0.544 11.697 262 HH12 ARG 32 HH12 ARG 32 0.261 -0.320 13.166 263 HH21 ARG 32 HH21 ARG 32 2.553 -2.897 12.481 264 HH22 ARG 32 HH22 ARG 32 1.394 -2.282 13.618 265 H VAL 33 HN VAL 33 3.283 -1.916 4.861 266 HA VAL 33 HA VAL 33 0.524 -1.658 4.300 267 HB VAL 33 HB VAL 33 1.647 -2.320 1.850 268 HG11 VAL 33 HG11 VAL 33 1.169 0.284 3.260 269 HG12 VAL 33 HG12 VAL 33 0.135 -0.536 2.087 270 HG13 VAL 33 HG13 VAL 33 1.647 0.194 1.570 271 HG21 VAL 33 HG21 VAL 33 3.562 -0.456 3.188 272 HG22 VAL 33 HG22 VAL 33 3.712 -1.264 1.625 273 HG23 VAL 33 HG23 VAL 33 3.874 -2.191 3.118 274 H VAL 34 HN VAL 34 2.766 -4.306 3.566 275 HA VAL 34 HA VAL 34 0.956 -6.216 2.712 276 HB VAL 34 HB VAL 34 2.617 -7.709 2.942 277 HG11 VAL 34 HG11 VAL 34 3.890 -5.815 2.240 278 HG12 VAL 34 HG12 VAL 34 4.859 -6.841 3.297 279 HG13 VAL 34 HG13 VAL 34 4.161 -5.346 3.916 280 HG21 VAL 34 HG21 VAL 34 2.089 -8.203 5.250 281 HG22 VAL 34 HG22 VAL 34 3.100 -6.851 5.776 282 HG23 VAL 34 HG23 VAL 34 3.834 -8.243 4.975 283 H HIS 35 HN HIS 35 1.670 -5.243 6.063 284 HA HIS 35 HA HIS 35 0.003 -7.123 7.336 285 HB2 HIS 35 HB2 HIS 35 1.703 -5.924 8.588 286 HB3 HIS 35 HB1 HIS 35 0.936 -4.384 8.230 287 HD1 HIS 35 HD1 HIS 35 0.759 -7.306 10.527 288 HD2 HIS 35 HD2 HIS 35 -1.368 -3.817 9.773 289 HE1 HIS 35 HE1 HIS 35 -0.767 -7.004 12.501 290 HE2 HIS 35 HE2 HIS 35 -2.181 -5.000 11.924 291 H ILE 36 HN ILE 36 -0.576 -3.712 6.510 292 HA ILE 36 HA ILE 36 -3.230 -3.551 7.363 293 HB ILE 36 HB ILE 36 -1.938 -2.103 5.033 294 HG12 ILE 36 HG12 ILE 36 -2.321 -1.111 7.854 295 HG13 ILE 36 HG11 ILE 36 -0.857 -1.927 7.343 296 HG21 ILE 36 HG21 ILE 36 -3.757 -0.685 4.936 297 HG22 ILE 36 HG22 ILE 36 -4.186 -0.975 6.626 298 HG23 ILE 36 HG23 ILE 36 -4.548 -2.193 5.407 299 HD11 ILE 36 HD11 ILE 36 -0.654 -0.129 5.581 300 HD12 ILE 36 HD12 ILE 36 -0.412 0.372 7.248 301 HD13 ILE 36 HD13 ILE 36 -1.932 0.710 6.439 302 H ILE 37 HN ILE 37 -1.870 -4.353 4.226 303 HA ILE 37 HA ILE 37 -4.285 -4.719 2.855 304 HB ILE 37 HB ILE 37 -1.472 -5.561 2.396 305 HG12 ILE 37 HG12 ILE 37 -3.201 -3.879 0.636 306 HG13 ILE 37 HG11 ILE 37 -2.442 -3.204 2.063 307 HG21 ILE 37 HG21 ILE 37 -3.830 -6.724 1.192 308 HG22 ILE 37 HG22 ILE 37 -2.144 -7.254 1.124 309 HG23 ILE 37 HG23 ILE 37 -2.728 -6.025 0.003 310 HD11 ILE 37 HD11 ILE 37 -1.066 -2.730 0.215 311 HD12 ILE 37 HD12 ILE 37 -1.088 -4.419 -0.301 312 HD13 ILE 37 HD13 ILE 37 -0.259 -3.961 1.185 313 H GLN 38 HN GLN 38 -2.050 -7.318 3.966 314 HA GLN 38 HA GLN 38 -3.701 -9.479 3.497 315 HB2 GLN 38 HB2 GLN 38 -1.772 -9.083 5.798 316 HB3 GLN 38 HB1 GLN 38 -2.524 -10.619 5.400 317 HG2 GLN 38 HG2 GLN 38 -1.417 -10.571 3.210 318 HG3 GLN 38 HG1 GLN 38 -0.664 -9.044 3.656 319 HE21 GLN 38 HE21 GLN 38 -1.203 -11.713 5.849 320 HE22 GLN 38 HE22 GLN 38 0.462 -12.113 6.079 321 H SER 39 HN SER 39 -3.763 -7.304 6.308 322 HA SER 39 HA SER 39 -5.584 -8.935 7.797 323 HB2 SER 39 HB2 SER 39 -5.693 -7.031 9.351 324 HB3 SER 39 HB1 SER 39 -4.028 -7.399 8.914 325 HG SER 39 HG SER 39 -3.928 -5.623 7.671 326 H ARG 40 HN ARG 40 -5.915 -5.937 5.917 327 HA ARG 40 HA ARG 40 -8.756 -5.823 6.327 328 HB2 ARG 40 HB2 ARG 40 -6.914 -4.251 4.514 329 HB3 ARG 40 HB1 ARG 40 -8.631 -3.913 4.696 330 HG2 ARG 40 HG2 ARG 40 -8.294 -3.524 7.049 331 HG3 ARG 40 HG1 ARG 40 -6.584 -3.886 6.898 332 HD2 ARG 40 HD2 ARG 40 -6.523 -1.614 6.800 333 HD3 ARG 40 HD1 ARG 40 -6.725 -1.980 5.089 334 HE ARG 40 HE ARG 40 -9.193 -1.639 5.553 335 HH11 ARG 40 HH11 ARG 40 -6.668 0.028 7.316 336 HH12 ARG 40 HH12 ARG 40 -7.711 1.294 7.872 337 HH21 ARG 40 HH21 ARG 40 -10.596 0.013 6.333 338 HH22 ARG 40 HH22 ARG 40 -9.931 1.290 7.310 339 H GLU 41 HN GLU 41 -6.658 -7.375 4.176 340 HA GLU 41 HA GLU 41 -8.917 -8.188 2.467 341 HB2 GLU 41 HB2 GLU 41 -6.018 -8.280 1.653 342 HB3 GLU 41 HB1 GLU 41 -7.444 -8.400 0.629 343 HG2 GLU 41 HG2 GLU 41 -6.677 -5.917 2.123 344 HG3 GLU 41 HG1 GLU 41 -6.155 -6.280 0.478 345 HA PRO 42 HA PRO 42 -7.158 -11.779 4.895 346 HB2 PRO 42 HB2 PRO 42 -9.983 -12.642 4.931 347 HB3 PRO 42 HB1 PRO 42 -8.845 -12.477 6.270 348 HG2 PRO 42 HG2 PRO 42 -10.879 -10.760 5.938 349 HG3 PRO 42 HG1 PRO 42 -9.303 -10.234 6.562 350 HD2 PRO 42 HD2 PRO 42 -10.447 -9.939 3.809 351 HD3 PRO 42 HD1 PRO 42 -9.506 -8.776 4.768 352 H SER 43 HN SER 43 -8.930 -11.341 2.037 353 HA SER 43 HA SER 43 -9.100 -14.005 1.104 354 HB2 SER 43 HB2 SER 43 -8.824 -11.473 -0.533 355 HB3 SER 43 HB1 SER 43 -9.486 -13.013 -1.077 356 HG SER 43 HG SER 43 -11.018 -12.634 0.805 357 H LEU 44 HN LEU 44 -6.481 -11.757 1.388 358 HA LEU 44 HA LEU 44 -4.808 -13.551 -0.233 359 HB2 LEU 44 HB2 LEU 44 -3.311 -11.618 -0.602 360 HB3 LEU 44 HB1 LEU 44 -4.902 -11.388 -1.261 361 HG LEU 44 HG LEU 44 -5.203 -10.151 1.099 362 HD11 LEU 44 HD11 LEU 44 -3.157 -8.767 1.370 363 HD12 LEU 44 HD12 LEU 44 -2.310 -9.906 0.328 364 HD13 LEU 44 HD13 LEU 44 -2.979 -10.446 1.870 365 HD21 LEU 44 HD21 LEU 44 -5.775 -9.234 -1.061 366 HD22 LEU 44 HD22 LEU 44 -4.070 -9.031 -1.462 367 HD23 LEU 44 HD23 LEU 44 -4.793 -8.072 -0.171 368 H LYS 45 HN LYS 45 -5.545 -13.682 2.652 369 HA LYS 45 HA LYS 45 -3.279 -12.985 4.217 370 HB2 LYS 45 HB2 LYS 45 -4.255 -14.351 5.960 371 HB3 LYS 45 HB1 LYS 45 -5.524 -13.427 5.173 372 HG2 LYS 45 HG2 LYS 45 -6.208 -15.392 3.913 373 HG3 LYS 45 HG1 LYS 45 -4.881 -16.312 4.633 374 HD2 LYS 45 HD2 LYS 45 -6.723 -14.988 6.512 375 HD3 LYS 45 HD1 LYS 45 -7.358 -16.369 5.606 376 HE2 LYS 45 HE2 LYS 45 -5.713 -17.808 6.429 377 HE3 LYS 45 HE1 LYS 45 -4.702 -16.475 6.970 378 HZ1 LYS 45 HZ1 LYS 45 -6.281 -16.002 8.711 379 HZ2 LYS 45 HZ2 LYS 45 -5.844 -17.633 8.801 380 HZ3 LYS 45 HZ3 LYS 45 -7.338 -17.193 8.142 381 H ASN 46 HN ASN 46 -3.911 -15.563 2.034 382 HA ASN 46 HA ASN 46 -2.110 -17.485 3.082 383 HB2 ASN 46 HB2 ASN 46 -3.893 -18.013 1.444 384 HB3 ASN 46 HB1 ASN 46 -3.026 -17.089 0.223 385 HD21 ASN 46 HD21 ASN 46 -1.239 -17.971 -0.757 386 HD22 ASN 46 HD22 ASN 46 -0.768 -19.629 -0.543 387 H SER 47 HN SER 47 -1.682 -14.568 1.310 388 HA SER 47 HA SER 47 0.862 -15.199 0.176 389 HB2 SER 47 HB2 SER 47 -0.550 -12.566 0.608 390 HB3 SER 47 HB1 SER 47 0.990 -12.726 -0.242 391 HG SER 47 HG SER 47 -1.573 -13.373 -1.056 392 H ASN 48 HN ASN 48 2.887 -14.738 0.910 393 HA ASN 48 HA ASN 48 3.194 -14.552 3.762 394 HB2 ASN 48 HB2 ASN 48 5.272 -14.557 1.565 395 HB3 ASN 48 HB1 ASN 48 5.611 -14.743 3.287 396 HD21 ASN 48 HD21 ASN 48 6.384 -16.808 3.416 397 HD22 ASN 48 HD22 ASN 48 5.532 -18.202 2.841 398 HA PRO 49 HA PRO 49 3.454 -10.245 4.277 399 HB2 PRO 49 HB2 PRO 49 5.323 -10.098 6.285 400 HB3 PRO 49 HB1 PRO 49 3.631 -10.532 6.525 401 HG2 PRO 49 HG2 PRO 49 6.017 -12.307 6.286 402 HG3 PRO 49 HG1 PRO 49 4.634 -12.419 7.390 403 HD2 PRO 49 HD2 PRO 49 4.815 -13.974 5.215 404 HD3 PRO 49 HD1 PRO 49 3.255 -13.337 5.775 405 H ASP 50 HN ASP 50 6.464 -11.951 3.702 406 HA ASP 50 HA ASP 50 7.846 -9.429 3.105 407 HB2 ASP 50 HB2 ASP 50 9.887 -10.725 3.135 408 HB3 ASP 50 HB1 ASP 50 8.913 -11.324 4.470 409 H GLU 51 HN GLU 51 5.889 -11.532 1.563 410 HA GLU 51 HA GLU 51 7.147 -11.038 -1.030 411 HB2 GLU 51 HB2 GLU 51 6.108 -13.619 0.102 412 HB3 GLU 51 HB1 GLU 51 6.262 -13.356 -1.616 413 HG2 GLU 51 HG2 GLU 51 8.673 -12.903 -1.293 414 HG3 GLU 51 HG1 GLU 51 8.485 -13.301 0.419 415 H ILE 52 HN ILE 52 5.000 -9.717 0.417 416 HA ILE 52 HA ILE 52 2.476 -10.627 -0.462 417 HB ILE 52 HB ILE 52 3.145 -8.967 1.481 418 HG12 ILE 52 HG12 ILE 52 0.811 -8.216 1.549 419 HG13 ILE 52 HG11 ILE 52 0.602 -8.702 -0.125 420 HG21 ILE 52 HG21 ILE 52 2.382 -7.095 -0.734 421 HG22 ILE 52 HG22 ILE 52 3.990 -7.225 -0.027 422 HG23 ILE 52 HG23 ILE 52 2.634 -6.660 0.951 423 HD11 ILE 52 HD11 ILE 52 1.347 -10.553 2.082 424 HD12 ILE 52 HD12 ILE 52 0.878 -10.983 0.441 425 HD13 ILE 52 HD13 ILE 52 -0.303 -10.277 1.540 426 H GLU 53 HN GLU 53 1.081 -9.747 -1.945 427 HA GLU 53 HA GLU 53 2.375 -8.228 -4.121 428 HB2 GLU 53 HB2 GLU 53 1.869 -10.682 -4.621 429 HB3 GLU 53 HB1 GLU 53 0.170 -10.291 -4.447 430 HG2 GLU 53 HG2 GLU 53 1.897 -8.889 -6.460 431 HG3 GLU 53 HG1 GLU 53 1.180 -10.458 -6.788 432 H ILE 54 HN ILE 54 1.671 -6.230 -3.494 433 HA ILE 54 HA ILE 54 -0.927 -5.693 -2.494 434 HB ILE 54 HB ILE 54 1.065 -3.782 -3.728 435 HG12 ILE 54 HG12 ILE 54 0.775 -4.719 -0.868 436 HG13 ILE 54 HG11 ILE 54 2.158 -4.946 -1.928 437 HG21 ILE 54 HG21 ILE 54 -1.178 -3.283 -1.800 438 HG22 ILE 54 HG22 ILE 54 -1.197 -2.899 -3.519 439 HG23 ILE 54 HG23 ILE 54 -0.065 -2.080 -2.443 440 HD11 ILE 54 HD11 ILE 54 2.686 -3.174 -0.407 441 HD12 ILE 54 HD12 ILE 54 1.163 -2.371 -0.760 442 HD13 ILE 54 HD13 ILE 54 2.412 -2.469 -1.997 443 H ASP 55 HN ASP 55 -2.601 -6.128 -3.826 444 HA ASP 55 HA ASP 55 -2.488 -5.202 -6.611 445 HB2 ASP 55 HB2 ASP 55 -3.109 -7.577 -6.304 446 HB3 ASP 55 HB1 ASP 55 -4.457 -7.085 -5.282 447 H PHE 56 HN PHE 56 -3.117 -3.157 -6.694 448 HA PHE 56 HA PHE 56 -4.711 -1.985 -4.671 449 HB2 PHE 56 HB2 PHE 56 -3.752 -0.862 -7.285 450 HB3 PHE 56 HB1 PHE 56 -4.468 0.081 -5.979 451 HD1 PHE 56 HD1 PHE 56 -3.305 0.211 -3.818 452 HD2 PHE 56 HD2 PHE 56 -1.463 -1.516 -7.209 453 HE1 PHE 56 HE1 PHE 56 -1.158 0.450 -2.719 454 HE2 PHE 56 HE2 PHE 56 0.729 -1.283 -6.117 455 HZ PHE 56 HZ PHE 56 0.875 -0.293 -3.860 456 H GLU 57 HN GLU 57 -5.633 -3.730 -7.362 457 HA GLU 57 HA GLU 57 -8.061 -2.240 -7.866 458 HB2 GLU 57 HB2 GLU 57 -6.963 -4.831 -8.936 459 HB3 GLU 57 HB1 GLU 57 -8.559 -4.234 -9.374 460 HG2 GLU 57 HG2 GLU 57 -5.959 -2.784 -9.831 461 HG3 GLU 57 HG1 GLU 57 -6.860 -3.689 -11.045 462 H THR 58 HN THR 58 -7.038 -5.189 -6.243 463 HA THR 58 HA THR 58 -9.754 -5.826 -5.469 464 HB THR 58 HB THR 58 -8.623 -7.684 -4.160 465 HG1 THR 58 HG1 THR 58 -6.348 -6.799 -5.645 466 HG21 THR 58 HG21 THR 58 -8.135 -7.490 -7.136 467 HG22 THR 58 HG22 THR 58 -9.592 -8.097 -6.346 468 HG23 THR 58 HG23 THR 58 -8.075 -8.982 -6.196 469 H LEU 59 HN LEU 59 -6.920 -4.294 -4.096 470 HA LEU 59 HA LEU 59 -7.623 -4.258 -1.400 471 HB2 LEU 59 HB2 LEU 59 -6.214 -2.156 -3.004 472 HB3 LEU 59 HB1 LEU 59 -6.302 -2.196 -1.260 473 HG LEU 59 HG LEU 59 -4.982 -4.238 -3.025 474 HD11 LEU 59 HD11 LEU 59 -3.849 -2.315 -1.020 475 HD12 LEU 59 HD12 LEU 59 -3.736 -2.164 -2.773 476 HD13 LEU 59 HD13 LEU 59 -2.952 -3.510 -1.949 477 HD21 LEU 59 HD21 LEU 59 -5.555 -4.196 -0.080 478 HD22 LEU 59 HD22 LEU 59 -4.214 -5.118 -0.766 479 HD23 LEU 59 HD23 LEU 59 -5.865 -5.474 -1.262 480 H LYS 60 HN LYS 60 -9.223 -3.362 -0.336 481 HA LYS 60 HA LYS 60 -11.260 -1.887 -1.663 482 HB2 LYS 60 HB2 LYS 60 -10.742 -2.590 1.218 483 HB3 LYS 60 HB1 LYS 60 -12.136 -1.636 0.731 484 HG2 LYS 60 HG2 LYS 60 -13.001 -3.430 -0.566 485 HG3 LYS 60 HG1 LYS 60 -11.501 -4.331 -0.403 486 HD2 LYS 60 HD2 LYS 60 -13.222 -3.614 1.949 487 HD3 LYS 60 HD1 LYS 60 -13.431 -5.107 1.032 488 HE2 LYS 60 HE2 LYS 60 -10.985 -5.563 1.471 489 HE3 LYS 60 HE1 LYS 60 -11.029 -4.221 2.611 490 HZ1 LYS 60 HZ1 LYS 60 -12.727 -5.374 3.865 491 HZ2 LYS 60 HZ2 LYS 60 -11.359 -6.353 3.705 492 HZ3 LYS 60 HZ3 LYS 60 -12.728 -6.650 2.759 493 HA PRO 61 HA PRO 61 -10.017 2.331 -1.563 494 HB2 PRO 61 HB2 PRO 61 -12.514 2.803 0.006 495 HB3 PRO 61 HB1 PRO 61 -11.886 3.671 -1.399 496 HG2 PRO 61 HG2 PRO 61 -13.865 1.890 -1.627 497 HG3 PRO 61 HG1 PRO 61 -12.639 2.113 -2.882 498 HD2 PRO 61 HD2 PRO 61 -13.009 -0.137 -1.001 499 HD3 PRO 61 HD1 PRO 61 -12.187 -0.106 -2.573 500 H SER 62 HN SER 62 -11.434 1.151 1.474 501 HA SER 62 HA SER 62 -10.213 2.991 3.187 502 HB2 SER 62 HB2 SER 62 -11.081 0.151 3.720 503 HB3 SER 62 HB1 SER 62 -10.667 1.331 4.966 504 HG SER 62 HG SER 62 -12.542 2.260 4.697 505 H THR 63 HN THR 63 -9.080 -0.250 2.136 506 HA THR 63 HA THR 63 -6.711 -0.202 3.679 507 HB THR 63 HB THR 63 -6.733 -1.530 0.990 508 HG1 THR 63 HG1 THR 63 -8.041 -3.196 1.785 509 HG21 THR 63 HG21 THR 63 -4.773 -2.168 1.992 510 HG22 THR 63 HG22 THR 63 -5.844 -3.389 2.694 511 HG23 THR 63 HG23 THR 63 -5.434 -1.947 3.617 512 H LEU 64 HN LEU 64 -7.398 0.723 0.324 513 HA LEU 64 HA LEU 64 -4.830 1.513 -0.407 514 HB2 LEU 64 HB2 LEU 64 -7.498 2.564 -1.322 515 HB3 LEU 64 HB1 LEU 64 -5.980 2.905 -2.117 516 HG LEU 64 HG LEU 64 -7.131 0.141 -1.773 517 HD11 LEU 64 HD11 LEU 64 -7.831 2.237 -3.581 518 HD12 LEU 64 HD12 LEU 64 -8.491 0.607 -3.457 519 HD13 LEU 64 HD13 LEU 64 -7.079 0.914 -4.469 520 HD21 LEU 64 HD21 LEU 64 -4.727 1.271 -3.163 521 HD22 LEU 64 HD22 LEU 64 -5.453 -0.259 -3.662 522 HD23 LEU 64 HD23 LEU 64 -4.822 -0.076 -2.025 523 H ARG 65 HN ARG 65 -7.463 3.483 0.976 524 HA ARG 65 HA ARG 65 -6.006 5.896 1.038 525 HB2 ARG 65 HB2 ARG 65 -8.351 4.936 2.663 526 HB3 ARG 65 HB1 ARG 65 -7.687 6.558 2.795 527 HG2 ARG 65 HG2 ARG 65 -8.805 5.354 0.272 528 HG3 ARG 65 HG1 ARG 65 -9.675 6.441 1.352 529 HD2 ARG 65 HD2 ARG 65 -8.100 8.211 0.926 530 HD3 ARG 65 HD1 ARG 65 -7.090 7.137 -0.032 531 HE ARG 65 HE ARG 65 -9.765 7.346 -1.040 532 HH11 ARG 65 HH11 ARG 65 -6.608 8.868 -1.002 533 HH12 ARG 65 HH12 ARG 65 -6.814 9.628 -2.547 534 HH21 ARG 65 HH21 ARG 65 -10.032 8.376 -3.092 535 HH22 ARG 65 HH22 ARG 65 -8.742 9.349 -3.728 536 H GLU 66 HN GLU 66 -6.181 3.174 3.215 537 HA GLU 66 HA GLU 66 -4.780 4.411 5.359 538 HB2 GLU 66 HB2 GLU 66 -6.153 2.460 5.760 539 HB3 GLU 66 HB1 GLU 66 -5.215 1.511 4.616 540 HG2 GLU 66 HG2 GLU 66 -4.597 0.886 6.827 541 HG3 GLU 66 HG1 GLU 66 -3.254 1.755 6.083 542 H LEU 67 HN LEU 67 -3.766 2.048 2.873 543 HA LEU 67 HA LEU 67 -1.046 1.954 3.304 544 HB2 LEU 67 HB2 LEU 67 -2.206 2.143 0.515 545 HB3 LEU 67 HB1 LEU 67 -0.833 1.192 1.072 546 HG LEU 67 HG LEU 67 -3.681 0.634 1.865 547 HD11 LEU 67 HD11 LEU 67 -2.182 -1.173 0.114 548 HD12 LEU 67 HD12 LEU 67 -2.751 0.324 -0.620 549 HD13 LEU 67 HD13 LEU 67 -3.898 -0.784 0.135 550 HD21 LEU 67 HD21 LEU 67 -1.356 -0.136 3.085 551 HD22 LEU 67 HD22 LEU 67 -1.686 -1.478 1.999 552 HD23 LEU 67 HD23 LEU 67 -2.895 -0.986 3.181 553 H GLU 68 HN GLU 68 -2.779 4.254 1.195 554 HA GLU 68 HA GLU 68 -0.620 5.846 0.435 555 HB2 GLU 68 HB2 GLU 68 -2.836 5.979 -0.604 556 HB3 GLU 68 HB1 GLU 68 -3.508 6.635 0.880 557 HG2 GLU 68 HG2 GLU 68 -1.846 8.536 0.585 558 HG3 GLU 68 HG1 GLU 68 -1.642 7.936 -1.063 559 H ARG 69 HN ARG 69 -3.011 6.586 2.993 560 HA ARG 69 HA ARG 69 -1.700 8.831 4.033 561 HB2 ARG 69 HB2 ARG 69 -3.746 6.932 4.995 562 HB3 ARG 69 HB1 ARG 69 -2.995 7.962 6.201 563 HG2 ARG 69 HG2 ARG 69 -4.040 9.224 3.728 564 HG3 ARG 69 HG1 ARG 69 -5.200 8.664 4.933 565 HD2 ARG 69 HD2 ARG 69 -4.659 10.989 5.333 566 HD3 ARG 69 HD1 ARG 69 -4.033 9.986 6.641 567 HE ARG 69 HE ARG 69 -1.953 10.250 4.866 568 HH11 ARG 69 HH11 ARG 69 -3.940 12.442 6.728 569 HH12 ARG 69 HH12 ARG 69 -2.695 13.640 6.877 570 HH21 ARG 69 HH21 ARG 69 -0.317 11.806 5.066 571 HH22 ARG 69 HH22 ARG 69 -0.631 13.280 5.934 572 H TYR 70 HN TYR 70 -1.148 5.450 4.548 573 HA TYR 70 HA TYR 70 0.354 5.742 6.943 574 HB2 TYR 70 HB2 TYR 70 -0.498 3.572 6.558 575 HB3 TYR 70 HB1 TYR 70 0.130 3.541 4.914 576 HD1 TYR 70 HD2 TYR 70 1.513 4.114 8.345 577 HD2 TYR 70 HD1 TYR 70 1.898 2.207 4.576 578 HE1 TYR 70 HE2 TYR 70 3.620 3.098 9.094 579 HE2 TYR 70 HE1 TYR 70 3.985 1.165 5.302 580 HH TYR 70 HH TYR 70 5.064 1.282 8.591 581 H VAL 71 HN VAL 71 1.257 5.292 3.515 582 HA VAL 71 HA VAL 71 4.029 5.420 3.968 583 HB VAL 71 HB VAL 71 4.350 5.785 1.652 584 HG11 VAL 71 HG11 VAL 71 2.605 4.279 0.574 585 HG12 VAL 71 HG12 VAL 71 1.971 4.074 2.209 586 HG13 VAL 71 HG13 VAL 71 3.631 3.604 1.835 587 HG21 VAL 71 HG21 VAL 71 2.717 6.559 0.133 588 HG22 VAL 71 HG22 VAL 71 2.868 7.721 1.445 589 HG23 VAL 71 HG23 VAL 71 1.488 6.621 1.387 590 H THR 72 HN THR 72 1.557 7.885 3.598 591 HA THR 72 HA THR 72 3.320 9.991 3.035 592 HB THR 72 HB THR 72 1.518 11.537 3.595 593 HG1 THR 72 HG1 THR 72 0.503 9.299 4.902 594 HG21 THR 72 HG21 THR 72 1.033 9.129 1.933 595 HG22 THR 72 HG22 THR 72 1.346 10.792 1.425 596 HG23 THR 72 HG23 THR 72 -0.236 10.348 2.073 597 H SER 73 HN SER 73 2.472 8.415 5.979 598 HA SER 73 HA SER 73 3.369 10.476 7.727 599 HB2 SER 73 HB2 SER 73 3.115 8.897 9.477 600 HB3 SER 73 HB1 SER 73 1.859 8.500 8.301 601 HG SER 73 HG SER 73 3.147 6.806 7.549 602 H CYS 74 HN CYS 74 4.877 8.056 5.810 603 HA CYS 74 HA CYS 74 7.471 8.445 7.118 604 HB2 CYS 74 HB2 CYS 74 6.928 6.130 6.745 605 HB3 CYS 74 HB1 CYS 74 6.560 6.445 5.051 606 HG CYS 74 HG CYS 74 9.488 7.450 5.071 607 H LEU 75 HN LEU 75 5.739 9.224 4.219 608 HA LEU 75 HA LEU 75 8.186 9.986 2.818 609 HB2 LEU 75 HB2 LEU 75 5.363 9.841 1.785 610 HB3 LEU 75 HB1 LEU 75 6.807 10.010 0.829 611 HG LEU 75 HG LEU 75 5.870 7.591 2.325 612 HD11 LEU 75 HD11 LEU 75 5.044 8.186 -0.006 613 HD12 LEU 75 HD12 LEU 75 5.750 6.584 0.211 614 HD13 LEU 75 HD13 LEU 75 6.691 7.865 -0.545 615 HD21 LEU 75 HD21 LEU 75 7.933 6.495 1.780 616 HD22 LEU 75 HD22 LEU 75 8.307 7.954 2.692 617 HD23 LEU 75 HD23 LEU 75 8.530 7.926 0.942 618 H ARG 76 HN ARG 76 5.247 11.362 4.133 619 HA ARG 76 HA ARG 76 5.968 13.962 2.987 620 HB2 ARG 76 HB2 ARG 76 3.335 12.937 3.993 621 HB3 ARG 76 HB1 ARG 76 3.620 14.603 3.503 622 HG2 ARG 76 HG2 ARG 76 4.297 13.752 1.265 623 HG3 ARG 76 HG1 ARG 76 3.816 12.141 1.804 624 HD2 ARG 76 HD2 ARG 76 2.054 13.232 0.507 625 HD3 ARG 76 HD1 ARG 76 1.580 12.890 2.166 626 HE ARG 76 HE ARG 76 2.538 15.469 2.174 627 HH11 ARG 76 HH11 ARG 76 -0.033 13.737 0.559 628 HH12 ARG 76 HH12 ARG 76 -1.096 15.105 0.517 629 HH21 ARG 76 HH21 ARG 76 1.159 17.272 2.112 630 HH22 ARG 76 HH22 ARG 76 -0.414 17.125 1.394 631 H LYS 77 HN LYS 77 5.343 12.241 5.939 632 HA LYS 77 HA LYS 77 5.656 14.648 7.563 633 HB2 LYS 77 HB2 LYS 77 3.963 12.692 7.941 634 HB3 LYS 77 HB1 LYS 77 5.342 11.878 8.666 635 HG2 LYS 77 HG2 LYS 77 5.602 13.914 10.135 636 HG3 LYS 77 HG1 LYS 77 4.020 14.422 9.549 637 HD2 LYS 77 HD2 LYS 77 4.629 11.828 10.970 638 HD3 LYS 77 HD1 LYS 77 3.843 13.235 11.686 639 HE2 LYS 77 HE2 LYS 77 2.778 11.606 9.380 640 HE3 LYS 77 HE1 LYS 77 2.229 11.498 11.051 641 HZ1 LYS 77 HZ1 LYS 77 2.007 13.875 9.283 642 HZ2 LYS 77 HZ2 LYS 77 1.536 13.827 10.905 643 HZ3 LYS 77 HZ3 LYS 77 0.743 12.862 9.767 644 H LYS 78 HN LYS 78 7.675 12.792 5.956 645 HA LYS 78 HA LYS 78 9.951 13.249 7.610 646 HB2 LYS 78 HB2 LYS 78 8.781 11.181 8.599 647 HB3 LYS 78 HB1 LYS 78 9.271 10.345 7.134 648 HG2 LYS 78 HG2 LYS 78 10.893 9.799 8.722 649 HG3 LYS 78 HG1 LYS 78 11.646 11.054 7.736 650 HD2 LYS 78 HD2 LYS 78 11.205 12.718 9.403 651 HD3 LYS 78 HD1 LYS 78 10.226 11.591 10.339 652 HE2 LYS 78 HE2 LYS 78 12.403 11.839 11.358 653 HE3 LYS 78 HE1 LYS 78 12.214 10.207 10.725 654 HZ1 LYS 78 HZ1 LYS 78 13.539 10.826 8.810 655 HZ2 LYS 78 HZ2 LYS 78 14.397 11.124 10.233 656 HZ3 LYS 78 HZ3 LYS 78 13.693 12.405 9.388 657 H ARG 79 HN ARG 79 11.951 12.538 6.425 658 HA ARG 79 HA ARG 79 11.428 11.657 3.693 659 HB2 ARG 79 HB2 ARG 79 13.071 13.339 2.818 660 HB3 ARG 79 HB1 ARG 79 11.534 13.991 3.351 661 HG2 ARG 79 HG2 ARG 79 13.074 15.518 4.151 662 HG3 ARG 79 HG1 ARG 79 12.750 14.507 5.556 663 HD2 ARG 79 HD2 ARG 79 14.795 13.271 5.183 664 HD3 ARG 79 HD1 ARG 79 15.097 14.163 3.692 665 HE ARG 79 HE ARG 79 14.977 16.138 5.492 666 HH11 ARG 79 HH11 ARG 79 16.691 13.091 5.546 667 HH12 ARG 79 HH12 ARG 79 18.013 13.704 6.487 668 HH21 ARG 79 HH21 ARG 79 16.719 16.957 6.716 669 HH22 ARG 79 HH22 ARG 79 18.032 15.910 7.148 670 H LYS 80 HN LYS 80 12.899 10.348 2.812 671 HA LYS 80 HA LYS 80 14.504 8.753 2.775 672 HB2 LYS 80 HB2 LYS 80 15.917 11.271 3.471 673 HB3 LYS 80 HB1 LYS 80 16.827 9.775 3.613 674 HG2 LYS 80 HG2 LYS 80 17.199 10.766 1.446 675 HG3 LYS 80 HG1 LYS 80 16.316 9.251 1.271 676 HD2 LYS 80 HD2 LYS 80 14.214 10.549 1.076 677 HD3 LYS 80 HD1 LYS 80 15.162 12.036 1.143 678 HE2 LYS 80 HE2 LYS 80 16.356 11.375 -0.881 679 HE3 LYS 80 HE1 LYS 80 15.444 9.868 -0.938 680 HZ1 LYS 80 HZ1 LYS 80 13.409 11.195 -1.184 681 HZ2 LYS 80 HZ2 LYS 80 14.496 11.456 -2.451 682 HZ3 LYS 80 HZ3 LYS 80 14.337 12.607 -1.224 683 HA PRO 81 HA PRO 81 14.226 7.744 7.288 684 HB2 PRO 81 HB2 PRO 81 12.713 5.544 7.080 685 HB3 PRO 81 HB1 PRO 81 11.992 7.158 7.012 686 HG2 PRO 81 HG2 PRO 81 12.683 5.296 4.767 687 HG3 PRO 81 HG1 PRO 81 11.214 6.260 5.005 688 HD2 PRO 81 HD2 PRO 81 13.275 7.014 3.372 689 HD3 PRO 81 HD1 PRO 81 12.184 8.163 4.171 690 H GLN 82 HN GLN 82 16.372 7.211 5.453 691 HA GLN 82 HA GLN 82 16.920 4.388 5.446 692 HB2 GLN 82 HB2 GLN 82 19.114 5.078 4.499 693 HB3 GLN 82 HB1 GLN 82 17.739 5.712 3.609 694 HG2 GLN 82 HG2 GLN 82 18.023 7.871 4.772 695 HG3 GLN 82 HG1 GLN 82 19.457 7.221 5.567 696 HE21 GLN 82 HE21 GLN 82 19.225 9.498 3.778 697 HE22 GLN 82 HE22 GLN 82 20.271 9.168 2.437 698 H ALA 83 HN ALA 83 18.028 3.246 6.880 699 HA ALA 83 HA ALA 83 19.111 4.681 9.203 700 HB1 ALA 83 HB1 ALA 83 17.232 3.210 9.719 701 HB2 ALA 83 HB2 ALA 83 18.717 2.631 10.473 702 HB3 ALA 83 HB3 ALA 83 18.100 1.844 9.021 703 H1 VAL 201 HT1 VAL 201 -6.337 0.163 -14.090 704 H2 VAL 201 HT2 VAL 201 -6.771 0.313 -15.714 705 H3 VAL 201 HT3 VAL 201 -5.942 1.568 -14.945 706 HA VAL 201 HA VAL 201 -4.896 -1.135 -15.530 707 HB VAL 201 HB VAL 201 -4.038 1.554 -16.623 708 HG11 VAL 201 HG11 VAL 201 -2.610 0.236 -18.121 709 HG12 VAL 201 HG12 VAL 201 -3.119 -1.240 -17.299 710 HG13 VAL 201 HG13 VAL 201 -2.190 -0.021 -16.426 711 HG21 VAL 201 HG21 VAL 201 -5.504 -0.694 -17.998 712 HG22 VAL 201 HG22 VAL 201 -4.930 0.789 -18.760 713 HG23 VAL 201 HG23 VAL 201 -6.199 0.859 -17.538 714 H VAL 202 HN VAL 202 -4.232 -1.509 -13.389 715 HA VAL 202 HA VAL 202 -1.949 0.170 -12.580 716 HB VAL 202 HB VAL 202 -3.866 -1.272 -10.733 717 HG11 VAL 202 HG11 VAL 202 -2.526 -0.226 -8.930 718 HG12 VAL 202 HG12 VAL 202 -1.369 0.316 -10.140 719 HG13 VAL 202 HG13 VAL 202 -1.615 -1.409 -9.866 720 HG21 VAL 202 HG21 VAL 202 -3.308 1.681 -10.979 721 HG22 VAL 202 HG22 VAL 202 -4.523 0.904 -9.962 722 HG23 VAL 202 HG23 VAL 202 -4.691 0.870 -11.717 723 HA PRO 203 HA PRO 203 0.249 -3.698 -13.372 724 HB2 PRO 203 HB2 PRO 203 2.368 -1.997 -12.161 725 HB3 PRO 203 HB1 PRO 203 2.408 -2.959 -13.641 726 HG2 PRO 203 HG2 PRO 203 2.203 -0.310 -13.749 727 HG3 PRO 203 HG1 PRO 203 1.306 -1.340 -14.880 728 HD2 PRO 203 HD2 PRO 203 0.333 0.131 -12.471 729 HD3 PRO 203 HD1 PRO 203 -0.475 -0.153 -14.026 730 H LYS 204 HN LYS 204 0.606 -5.361 -12.047 731 HA LYS 204 HA LYS 204 -0.104 -5.342 -9.341 732 HB2 LYS 204 HB2 LYS 204 1.732 -7.312 -10.718 733 HB3 LYS 204 HB1 LYS 204 0.797 -7.597 -9.259 734 HG2 LYS 204 HG2 LYS 204 -0.372 -7.060 -11.979 735 HG3 LYS 204 HG1 LYS 204 -0.181 -8.653 -11.249 736 HD2 LYS 204 HD2 LYS 204 -1.654 -7.993 -9.417 737 HD3 LYS 204 HD1 LYS 204 -1.826 -6.388 -10.132 738 HE2 LYS 204 HE2 LYS 204 -2.604 -8.944 -11.521 739 HE3 LYS 204 HE1 LYS 204 -3.724 -7.944 -10.599 740 HZ1 LYS 204 HZ1 LYS 204 -2.168 -7.026 -12.955 741 HZ2 LYS 204 HZ2 LYS 204 -3.318 -6.125 -12.104 742 HZ3 LYS 204 HZ3 LYS 204 -3.792 -7.485 -12.987 743 H LYS 205 HN LYS 205 1.029 -4.972 -7.483 744 HA LYS 205 HA LYS 205 3.736 -3.958 -7.890 745 HB2 LYS 205 HB2 LYS 205 2.099 -2.491 -6.762 746 HB3 LYS 205 HB1 LYS 205 1.956 -3.673 -5.468 747 HG2 LYS 205 HG2 LYS 205 3.430 -1.817 -4.860 748 HG3 LYS 205 HG1 LYS 205 4.291 -3.358 -4.886 749 HD2 LYS 205 HD2 LYS 205 5.111 -2.816 -7.155 750 HD3 LYS 205 HD1 LYS 205 4.318 -1.245 -7.041 751 HE2 LYS 205 HE2 LYS 205 5.723 -0.637 -5.169 752 HE3 LYS 205 HE1 LYS 205 6.457 -2.241 -5.165 753 HZ1 LYS 205 HZ1 LYS 205 6.640 -0.272 -7.379 754 HZ2 LYS 205 HZ2 LYS 205 7.356 -1.801 -7.362 755 HZ3 LYS 205 HZ3 LYS 205 7.871 -0.618 -6.270 756 H LYS 206 HN LYS 206 5.021 -5.687 -7.934 757 HA LYS 206 HA LYS 206 4.910 -7.871 -6.137 758 HB2 LYS 206 HB2 LYS 206 7.277 -6.826 -7.703 759 HB3 LYS 206 HB1 LYS 206 7.135 -8.425 -6.989 760 HG2 LYS 206 HG2 LYS 206 5.331 -8.981 -8.503 761 HG3 LYS 206 HG1 LYS 206 5.368 -7.351 -9.178 762 HD2 LYS 206 HD2 LYS 206 7.642 -9.337 -9.285 763 HD3 LYS 206 HD1 LYS 206 6.544 -8.968 -10.617 764 HE2 LYS 206 HE2 LYS 206 7.307 -6.630 -10.572 765 HE3 LYS 206 HE1 LYS 206 8.420 -7.025 -9.268 766 HZ1 LYS 206 HZ1 LYS 206 9.501 -6.972 -11.440 767 HZ2 LYS 206 HZ2 LYS 206 8.495 -8.219 -11.982 768 HZ3 LYS 206 HZ3 LYS 206 9.597 -8.506 -10.731 769 H ILE 207 HN ILE 207 5.626 -8.037 -4.112 770 HA ILE 207 HA ILE 207 7.362 -5.900 -3.068 771 HB ILE 207 HB ILE 207 5.196 -7.427 -1.619 772 HG12 ILE 207 HG12 ILE 207 4.413 -5.687 -3.226 773 HG13 ILE 207 HG11 ILE 207 3.989 -5.350 -1.553 774 HG21 ILE 207 HG21 ILE 207 6.912 -5.184 -0.580 775 HG22 ILE 207 HG22 ILE 207 7.146 -6.886 -0.193 776 HG23 ILE 207 HG23 ILE 207 5.668 -6.061 0.306 777 HD11 ILE 207 HD11 ILE 207 5.769 -3.718 -1.408 778 HD12 ILE 207 HD12 ILE 207 4.710 -3.352 -2.768 779 HD13 ILE 207 HD13 ILE 207 6.280 -4.102 -3.050 780 H LYS 208 HN LYS 208 9.163 -6.504 -2.047 781 HA LYS 208 HA LYS 208 9.586 -9.221 -1.149 782 HB2 LYS 208 HB2 LYS 208 9.957 -9.276 -3.632 783 HB3 LYS 208 HB1 LYS 208 11.229 -8.087 -3.426 784 HG2 LYS 208 HG2 LYS 208 12.296 -10.171 -3.621 785 HG3 LYS 208 HG1 LYS 208 12.369 -9.753 -1.910 786 HD2 LYS 208 HD2 LYS 208 10.467 -11.206 -1.458 787 HD3 LYS 208 HD1 LYS 208 10.338 -11.590 -3.175 788 HE2 LYS 208 HE2 LYS 208 12.695 -12.214 -1.397 789 HE3 LYS 208 HE1 LYS 208 11.476 -13.369 -1.934 790 HZ1 LYS 208 HZ1 LYS 208 13.459 -13.517 -3.285 791 HZ2 LYS 208 HZ2 LYS 208 13.357 -11.880 -3.686 792 HZ3 LYS 208 HZ3 LYS 208 12.170 -12.955 -4.222 793 H LYS 209 HN LYS 209 11.512 -9.386 0.130 794 HA LYS 209 HA LYS 209 12.058 -6.996 1.554 795 HB2 LYS 209 HB2 LYS 209 12.037 -9.298 2.537 796 HB3 LYS 209 HB1 LYS 209 13.563 -9.609 1.722 797 HG2 LYS 209 HG2 LYS 209 14.650 -7.879 3.011 798 HG3 LYS 209 HG1 LYS 209 13.116 -7.443 3.767 799 HD2 LYS 209 HD2 LYS 209 12.981 -9.653 4.791 800 HD3 LYS 209 HD1 LYS 209 14.494 -10.115 4.011 801 HE2 LYS 209 HE2 LYS 209 14.182 -7.861 5.992 802 HE3 LYS 209 HE1 LYS 209 14.782 -9.471 6.382 803 HZ1 LYS 209 HZ1 LYS 209 16.615 -9.104 4.832 804 HZ2 LYS 209 HZ2 LYS 209 16.599 -7.937 6.055 805 HZ3 LYS 209 HZ3 LYS 209 16.047 -7.545 4.510 806 H GLU 210 HN GLU 210 13.274 -7.990 -1.368 807 HA GLU 210 HA GLU 210 15.957 -7.062 -1.174 808 HB2 GLU 210 HB2 GLU 210 15.930 -6.984 -3.607 809 HB3 GLU 210 HB1 GLU 210 15.152 -8.463 -3.058 810 HG2 GLU 210 HG2 GLU 210 12.996 -7.596 -3.520 811 HG3 GLU 210 HG1 GLU 210 13.634 -5.981 -3.803 812 H GLN 211 HN GLN 211 12.906 -5.547 -1.255 813 HA GLN 211 HA GLN 211 13.803 -3.039 -2.372 814 HB2 GLN 211 HB2 GLN 211 11.181 -3.811 -1.076 815 HB3 GLN 211 HB1 GLN 211 11.488 -2.313 -1.948 816 HG2 GLN 211 HG2 GLN 211 11.682 -3.416 -4.005 817 HG3 GLN 211 HG1 GLN 211 11.857 -4.992 -3.237 818 HE21 GLN 211 HE21 GLN 211 9.996 -4.140 -5.286 819 HE22 GLN 211 HE22 GLN 211 8.414 -4.439 -4.650 820 H VAL 212 HN VAL 212 14.607 -4.340 0.375 821 HA VAL 212 HA VAL 212 13.938 -2.336 2.299 822 HB VAL 212 HB VAL 212 14.549 -4.676 2.907 823 HG11 VAL 212 HG11 VAL 212 16.358 -5.038 1.338 824 HG12 VAL 212 HG12 VAL 212 16.916 -5.308 2.990 825 HG13 VAL 212 HG13 VAL 212 17.336 -3.815 2.150 826 HG21 VAL 212 HG21 VAL 212 16.262 -2.522 4.135 827 HG22 VAL 212 HG22 VAL 212 15.937 -4.099 4.855 828 HG23 VAL 212 HG23 VAL 212 14.618 -2.953 4.604 829 H GLU 213 HN GLU 213 16.254 -2.624 -0.192 830 HA GLU 213 HA GLU 213 18.179 -0.812 0.940 831 HB2 GLU 213 HB2 GLU 213 17.916 -1.990 -1.830 832 HB3 GLU 213 HB1 GLU 213 19.273 -1.013 -1.285 833 HG2 GLU 213 HG2 GLU 213 19.838 -2.675 0.384 834 HG3 GLU 213 HG1 GLU 213 18.436 -3.638 -0.075 Start of MODEL 18 1 H1 SER 1 HT1 SER 1 -20.699 0.891 9.765 2 H2 SER 1 HT2 SER 1 -22.350 0.609 9.537 3 H3 SER 1 HT3 SER 1 -21.786 2.190 9.774 4 HA SER 1 HA SER 1 -21.056 0.489 7.473 5 HB2 SER 1 HB2 SER 1 -23.494 1.142 7.564 6 HB3 SER 1 HB1 SER 1 -22.974 2.827 7.529 7 HG SER 1 HG SER 1 -23.502 1.472 5.466 8 H GLU 2 HN GLU 2 -19.768 2.511 9.502 9 HA GLU 2 HA GLU 2 -19.210 4.739 7.764 10 HB2 GLU 2 HB2 GLU 2 -18.297 4.121 10.566 11 HB3 GLU 2 HB1 GLU 2 -17.898 5.582 9.681 12 HG2 GLU 2 HG2 GLU 2 -19.678 6.193 11.060 13 HG3 GLU 2 HG1 GLU 2 -20.397 5.965 9.467 14 H GLU 3 HN GLU 3 -17.684 1.765 8.616 15 HA GLU 3 HA GLU 3 -15.005 2.487 8.132 16 HB2 GLU 3 HB2 GLU 3 -16.386 -0.171 7.743 17 HB3 GLU 3 HB1 GLU 3 -14.646 0.064 7.682 18 HG2 GLU 3 HG2 GLU 3 -16.413 0.572 10.061 19 HG3 GLU 3 HG1 GLU 3 -15.348 -0.813 9.834 20 H GLU 4 HN GLU 4 -17.651 1.704 5.997 21 HA GLU 4 HA GLU 4 -15.842 1.675 3.709 22 HB2 GLU 4 HB2 GLU 4 -17.498 -0.146 3.974 23 HB3 GLU 4 HB1 GLU 4 -18.791 1.033 3.833 24 HG2 GLU 4 HG2 GLU 4 -18.178 1.526 1.573 25 HG3 GLU 4 HG1 GLU 4 -16.741 0.511 1.698 26 H ASP 5 HN ASP 5 -18.327 3.671 5.192 27 HA ASP 5 HA ASP 5 -18.623 5.255 2.791 28 HB2 ASP 5 HB2 ASP 5 -20.562 4.818 4.306 29 HB3 ASP 5 HB1 ASP 5 -19.796 5.866 5.491 30 H LYS 6 HN LYS 6 -17.098 5.597 5.935 31 HA LYS 6 HA LYS 6 -16.342 8.303 5.694 32 HB2 LYS 6 HB2 LYS 6 -16.220 7.070 7.824 33 HB3 LYS 6 HB1 LYS 6 -14.928 6.070 7.180 34 HG2 LYS 6 HG2 LYS 6 -14.042 7.764 8.654 35 HG3 LYS 6 HG1 LYS 6 -13.490 8.034 7.000 36 HD2 LYS 6 HD2 LYS 6 -15.161 9.772 6.705 37 HD3 LYS 6 HD1 LYS 6 -15.786 9.470 8.327 38 HE2 LYS 6 HE2 LYS 6 -12.989 10.388 7.681 39 HE3 LYS 6 HE1 LYS 6 -14.299 11.433 8.224 40 HZ1 LYS 6 HZ1 LYS 6 -13.166 9.161 9.761 41 HZ2 LYS 6 HZ2 LYS 6 -14.401 10.189 10.286 42 HZ3 LYS 6 HZ3 LYS 6 -12.840 10.794 10.044 43 H CYS 7 HN CYS 7 -15.131 5.432 4.243 44 HA CYS 7 HA CYS 7 -12.619 6.660 3.475 45 HB2 CYS 7 HB2 CYS 7 -13.747 3.927 2.850 46 HB3 CYS 7 HB1 CYS 7 -12.105 4.466 2.494 47 HG CYS 7 HG CYS 7 -13.419 3.380 5.384 48 H LYS 8 HN LYS 8 -12.436 7.822 1.682 49 HA LYS 8 HA LYS 8 -14.543 7.710 -0.338 50 HB2 LYS 8 HB2 LYS 8 -12.326 9.634 0.285 51 HB3 LYS 8 HB1 LYS 8 -13.026 9.617 -1.324 52 HG2 LYS 8 HG2 LYS 8 -14.078 11.308 0.017 53 HG3 LYS 8 HG1 LYS 8 -15.226 10.037 -0.389 54 HD2 LYS 8 HD2 LYS 8 -14.695 9.040 1.897 55 HD3 LYS 8 HD1 LYS 8 -13.867 10.556 2.245 56 HE2 LYS 8 HE2 LYS 8 -16.760 10.284 1.452 57 HE3 LYS 8 HE1 LYS 8 -16.171 10.536 3.092 58 HZ1 LYS 8 HZ1 LYS 8 -16.887 12.607 2.123 59 HZ2 LYS 8 HZ2 LYS 8 -15.842 12.404 0.811 60 HZ3 LYS 8 HZ3 LYS 8 -15.212 12.644 2.360 61 HA PRO 9 HA PRO 9 -12.707 5.003 -3.087 62 HB2 PRO 9 HB2 PRO 9 -13.444 6.140 -5.484 63 HB3 PRO 9 HB1 PRO 9 -14.507 5.174 -4.460 64 HG2 PRO 9 HG2 PRO 9 -14.304 8.136 -4.722 65 HG3 PRO 9 HG1 PRO 9 -15.743 7.123 -4.514 66 HD2 PRO 9 HD2 PRO 9 -14.653 8.531 -2.479 67 HD3 PRO 9 HD1 PRO 9 -15.448 6.968 -2.215 68 H MET 10 HN MET 10 -10.831 4.638 -4.098 69 HA MET 10 HA MET 10 -9.091 6.927 -4.644 70 HB2 MET 10 HB2 MET 10 -8.287 5.101 -3.122 71 HB3 MET 10 HB1 MET 10 -8.364 3.997 -4.490 72 HG2 MET 10 HG2 MET 10 -6.162 4.557 -4.533 73 HG3 MET 10 HG1 MET 10 -6.826 5.779 -5.619 74 HE1 MET 10 HE1 MET 10 -5.665 4.870 -2.163 75 HE2 MET 10 HE2 MET 10 -7.000 5.839 -1.544 76 HE3 MET 10 HE3 MET 10 -5.337 6.394 -1.345 77 H SER 11 HN SER 11 -8.780 7.520 -6.743 78 HA SER 11 HA SER 11 -9.955 5.923 -8.828 79 HB2 SER 11 HB2 SER 11 -9.199 7.783 -10.330 80 HB3 SER 11 HB1 SER 11 -10.212 8.307 -8.989 81 HG SER 11 HG SER 11 -8.284 8.910 -7.879 82 H TYR 12 HN TYR 12 -8.553 5.864 -11.025 83 HA TYR 12 HA TYR 12 -6.735 3.799 -10.535 84 HB2 TYR 12 HB2 TYR 12 -6.766 3.430 -12.761 85 HB3 TYR 12 HB1 TYR 12 -8.159 4.503 -12.669 86 HD1 TYR 12 HD1 TYR 12 -4.652 4.221 -13.595 87 HD2 TYR 12 HD2 TYR 12 -8.095 6.687 -13.686 88 HE1 TYR 12 HE1 TYR 12 -3.550 5.664 -15.288 89 HE2 TYR 12 HE2 TYR 12 -7.017 8.156 -15.333 90 HH TYR 12 HH TYR 12 -4.687 8.752 -16.007 91 H GLU 13 HN GLU 13 -6.060 7.099 -11.708 92 HA GLU 13 HA GLU 13 -3.285 7.032 -11.663 93 HB2 GLU 13 HB2 GLU 13 -3.493 9.560 -11.293 94 HB3 GLU 13 HB1 GLU 13 -4.455 8.970 -12.652 95 HG2 GLU 13 HG2 GLU 13 -6.433 8.986 -11.295 96 HG3 GLU 13 HG1 GLU 13 -5.502 9.526 -9.894 97 H GLU 14 HN GLU 14 -5.518 7.432 -9.023 98 HA GLU 14 HA GLU 14 -3.565 8.307 -7.159 99 HB2 GLU 14 HB2 GLU 14 -6.357 7.264 -6.968 100 HB3 GLU 14 HB1 GLU 14 -5.412 7.588 -5.524 101 HG2 GLU 14 HG2 GLU 14 -5.143 9.923 -6.268 102 HG3 GLU 14 HG1 GLU 14 -6.148 9.567 -7.670 103 H LYS 15 HN LYS 15 -5.156 5.206 -7.817 104 HA LYS 15 HA LYS 15 -3.755 3.643 -5.981 105 HB2 LYS 15 HB2 LYS 15 -4.867 2.919 -8.680 106 HB3 LYS 15 HB1 LYS 15 -4.185 1.736 -7.571 107 HG2 LYS 15 HG2 LYS 15 -5.909 1.904 -6.083 108 HG3 LYS 15 HG1 LYS 15 -6.351 3.522 -6.641 109 HD2 LYS 15 HD2 LYS 15 -7.528 2.766 -8.410 110 HD3 LYS 15 HD1 LYS 15 -6.532 1.324 -8.611 111 HE2 LYS 15 HE2 LYS 15 -7.562 0.364 -6.621 112 HE3 LYS 15 HE1 LYS 15 -8.596 1.783 -6.460 113 HZ1 LYS 15 HZ1 LYS 15 -9.738 -0.059 -7.543 114 HZ2 LYS 15 HZ2 LYS 15 -8.573 -0.091 -8.768 115 HZ3 LYS 15 HZ3 LYS 15 -9.584 1.253 -8.598 116 H ARG 16 HN ARG 16 -2.921 4.649 -9.252 117 HA ARG 16 HA ARG 16 -0.488 3.246 -9.514 118 HB2 ARG 16 HB2 ARG 16 -1.697 4.377 -11.372 119 HB3 ARG 16 HB1 ARG 16 -1.197 5.920 -10.701 120 HG2 ARG 16 HG2 ARG 16 1.142 5.289 -10.994 121 HG3 ARG 16 HG1 ARG 16 0.614 3.770 -11.702 122 HD2 ARG 16 HD2 ARG 16 -0.200 6.423 -12.817 123 HD3 ARG 16 HD1 ARG 16 1.254 5.582 -13.342 124 HE ARG 16 HE ARG 16 -0.795 3.760 -13.599 125 HH11 ARG 16 HH11 ARG 16 -0.083 6.939 -14.871 126 HH12 ARG 16 HH12 ARG 16 -0.909 6.665 -16.371 127 HH21 ARG 16 HH21 ARG 16 -1.874 3.389 -15.571 128 HH22 ARG 16 HH22 ARG 16 -1.932 4.639 -16.772 129 H GLN 17 HN GLN 17 -1.093 6.605 -8.502 130 HA GLN 17 HA GLN 17 1.509 7.272 -7.791 131 HB2 GLN 17 HB2 GLN 17 -0.525 8.787 -7.969 132 HB3 GLN 17 HB1 GLN 17 -0.953 8.242 -6.353 133 HG2 GLN 17 HG2 GLN 17 0.162 10.311 -6.118 134 HG3 GLN 17 HG1 GLN 17 1.280 9.057 -5.585 135 HE21 GLN 17 HE21 GLN 17 1.809 11.759 -6.524 136 HE22 GLN 17 HE22 GLN 17 2.885 11.596 -7.864 137 H LEU 18 HN LEU 18 -1.041 5.740 -5.976 138 HA LEU 18 HA LEU 18 0.090 5.527 -3.443 139 HB2 LEU 18 HB2 LEU 18 -2.237 4.826 -4.568 140 HB3 LEU 18 HB1 LEU 18 -1.462 3.264 -4.549 141 HG LEU 18 HG LEU 18 -2.225 4.964 -2.207 142 HD11 LEU 18 HD11 LEU 18 -3.298 2.644 -1.710 143 HD12 LEU 18 HD12 LEU 18 -3.140 2.430 -3.448 144 HD13 LEU 18 HD13 LEU 18 -4.075 3.779 -2.805 145 HD21 LEU 18 HD21 LEU 18 -0.393 4.147 -1.230 146 HD22 LEU 18 HD22 LEU 18 -0.190 2.853 -2.404 147 HD23 LEU 18 HD23 LEU 18 -1.352 2.680 -1.089 148 H SER 19 HN SER 19 0.136 3.175 -6.089 149 HA SER 19 HA SER 19 1.769 1.282 -4.873 150 HB2 SER 19 HB2 SER 19 1.819 0.215 -6.930 151 HB3 SER 19 HB1 SER 19 0.390 1.229 -7.095 152 HG SER 19 HG SER 19 1.841 2.808 -8.109 153 H LEU 20 HN LEU 20 2.536 4.319 -6.260 154 HA LEU 20 HA LEU 20 5.349 3.751 -6.597 155 HB2 LEU 20 HB2 LEU 20 3.746 6.266 -6.915 156 HB3 LEU 20 HB1 LEU 20 5.445 6.138 -7.296 157 HG LEU 20 HG LEU 20 3.168 4.742 -8.658 158 HD11 LEU 20 HD11 LEU 20 3.638 7.102 -9.200 159 HD12 LEU 20 HD12 LEU 20 3.798 6.005 -10.567 160 HD13 LEU 20 HD13 LEU 20 5.238 6.620 -9.751 161 HD21 LEU 20 HD21 LEU 20 4.915 3.153 -8.501 162 HD22 LEU 20 HD22 LEU 20 6.126 4.342 -8.980 163 HD23 LEU 20 HD23 LEU 20 4.916 3.793 -10.144 164 H ASP 21 HN ASP 21 3.270 5.449 -4.293 165 HA ASP 21 HA ASP 21 5.446 6.443 -2.697 166 HB2 ASP 21 HB2 ASP 21 3.783 7.023 -1.056 167 HB3 ASP 21 HB1 ASP 21 3.296 7.545 -2.649 168 H ILE 22 HN ILE 22 3.431 3.555 -2.618 169 HA ILE 22 HA ILE 22 4.476 2.394 -0.307 170 HB ILE 22 HB ILE 22 3.123 1.442 -2.745 171 HG12 ILE 22 HG12 ILE 22 2.746 0.748 0.154 172 HG13 ILE 22 HG11 ILE 22 2.021 2.154 -0.617 173 HG21 ILE 22 HG21 ILE 22 4.580 -0.505 -0.987 174 HG22 ILE 22 HG22 ILE 22 4.948 -0.153 -2.670 175 HG23 ILE 22 HG23 ILE 22 3.419 -0.915 -2.242 176 HD11 ILE 22 HD11 ILE 22 1.552 -0.682 -1.514 177 HD12 ILE 22 HD12 ILE 22 0.702 0.777 -2.035 178 HD13 ILE 22 HD13 ILE 22 0.513 0.192 -0.383 179 H ASN 23 HN ASN 23 5.663 2.527 -3.591 180 HA ASN 23 HA ASN 23 7.840 0.764 -3.272 181 HB2 ASN 23 HB2 ASN 23 6.959 1.398 -5.464 182 HB3 ASN 23 HB1 ASN 23 7.436 3.066 -5.191 183 HD21 ASN 23 HD21 ASN 23 9.583 3.649 -5.405 184 HD22 ASN 23 HD22 ASN 23 10.754 2.608 -6.126 185 H LYS 24 HN LYS 24 7.298 3.964 -2.186 186 HA LYS 24 HA LYS 24 10.079 4.712 -1.972 187 HB2 LYS 24 HB2 LYS 24 7.473 5.945 -1.231 188 HB3 LYS 24 HB1 LYS 24 8.945 6.570 -0.506 189 HG2 LYS 24 HG2 LYS 24 9.811 7.186 -2.648 190 HG3 LYS 24 HG1 LYS 24 8.493 6.350 -3.476 191 HD2 LYS 24 HD2 LYS 24 6.889 7.916 -2.686 192 HD3 LYS 24 HD1 LYS 24 8.038 8.628 -1.558 193 HE2 LYS 24 HE2 LYS 24 8.314 8.726 -4.565 194 HE3 LYS 24 HE1 LYS 24 7.610 10.006 -3.577 195 HZ1 LYS 24 HZ1 LYS 24 9.710 10.259 -2.440 196 HZ2 LYS 24 HZ2 LYS 24 9.937 10.422 -4.106 197 HZ3 LYS 24 HZ3 LYS 24 10.392 8.992 -3.333 198 H LEU 25 HN LEU 25 7.872 2.897 -0.113 199 HA LEU 25 HA LEU 25 8.966 3.503 2.470 200 HB2 LEU 25 HB2 LEU 25 7.186 1.281 1.497 201 HB3 LEU 25 HB1 LEU 25 7.702 1.445 3.164 202 HG LEU 25 HG LEU 25 5.877 3.242 1.600 203 HD11 LEU 25 HD11 LEU 25 5.688 1.874 4.253 204 HD12 LEU 25 HD12 LEU 25 4.944 1.296 2.762 205 HD13 LEU 25 HD13 LEU 25 4.410 2.812 3.493 206 HD21 LEU 25 HD21 LEU 25 7.194 3.812 4.232 207 HD22 LEU 25 HD22 LEU 25 5.902 4.765 3.512 208 HD23 LEU 25 HD23 LEU 25 7.481 4.686 2.733 209 HA PRO 26 HA PRO 26 12.466 0.714 2.329 210 HB2 PRO 26 HB2 PRO 26 12.901 0.591 5.025 211 HB3 PRO 26 HB1 PRO 26 13.454 1.926 4.012 212 HG2 PRO 26 HG2 PRO 26 11.076 1.757 5.802 213 HG3 PRO 26 HG1 PRO 26 12.154 3.128 5.514 214 HD2 PRO 26 HD2 PRO 26 9.685 2.910 4.382 215 HD3 PRO 26 HD1 PRO 26 11.031 3.769 3.606 216 H GLY 27 HN GLY 27 12.963 -1.467 3.062 217 HA2 GLY 27 HA2 GLY 27 10.897 -3.219 2.683 218 HA3 GLY 27 HA1 GLY 27 12.389 -3.652 3.489 219 H GLU 28 HN GLU 28 12.225 -2.277 5.835 220 HA GLU 28 HA GLU 28 10.541 -3.923 7.362 221 HB2 GLU 28 HB2 GLU 28 11.050 -1.933 9.103 222 HB3 GLU 28 HB1 GLU 28 12.166 -3.237 8.749 223 HG2 GLU 28 HG2 GLU 28 12.213 -0.632 7.278 224 HG3 GLU 28 HG1 GLU 28 13.080 -0.887 8.785 225 H LYS 29 HN LYS 29 10.110 -0.568 6.293 226 HA LYS 29 HA LYS 29 7.736 -0.193 7.860 227 HB2 LYS 29 HB2 LYS 29 9.294 1.383 5.910 228 HB3 LYS 29 HB1 LYS 29 7.583 1.769 5.999 229 HG2 LYS 29 HG2 LYS 29 8.926 3.223 7.422 230 HG3 LYS 29 HG1 LYS 29 7.798 2.255 8.368 231 HD2 LYS 29 HD2 LYS 29 9.449 1.022 9.335 232 HD3 LYS 29 HD1 LYS 29 10.538 1.187 7.948 233 HE2 LYS 29 HE2 LYS 29 11.342 2.422 9.913 234 HE3 LYS 29 HE1 LYS 29 10.995 3.489 8.552 235 HZ1 LYS 29 HZ1 LYS 29 10.153 4.385 10.637 236 HZ2 LYS 29 HZ2 LYS 29 9.205 3.010 10.880 237 HZ3 LYS 29 HZ3 LYS 29 8.879 4.044 9.583 238 H LEU 30 HN LEU 30 8.477 -1.337 4.671 239 HA LEU 30 HA LEU 30 5.791 -0.975 3.732 240 HB2 LEU 30 HB2 LEU 30 6.789 -0.988 1.795 241 HB3 LEU 30 HB1 LEU 30 8.311 -1.407 2.534 242 HG LEU 30 HG LEU 30 6.289 -3.373 1.457 243 HD11 LEU 30 HD11 LEU 30 7.833 -1.691 0.043 244 HD12 LEU 30 HD12 LEU 30 7.410 -3.308 -0.511 245 HD13 LEU 30 HD13 LEU 30 8.964 -3.021 0.267 246 HD21 LEU 30 HD21 LEU 30 7.710 -4.270 3.292 247 HD22 LEU 30 HD22 LEU 30 9.134 -3.838 2.349 248 HD23 LEU 30 HD23 LEU 30 8.005 -5.044 1.736 249 H GLY 31 HN GLY 31 7.362 -3.305 5.603 250 HA2 GLY 31 HA2 GLY 31 5.692 -5.540 5.037 251 HA3 GLY 31 HA1 GLY 31 6.518 -5.243 6.554 252 H ARG 32 HN ARG 32 5.153 -2.512 6.652 253 HA ARG 32 HA ARG 32 2.825 -3.313 8.083 254 HB2 ARG 32 HB2 ARG 32 3.918 -1.261 8.717 255 HB3 ARG 32 HB1 ARG 32 3.663 -0.580 7.122 256 HG2 ARG 32 HG2 ARG 32 1.726 0.254 7.795 257 HG3 ARG 32 HG1 ARG 32 1.143 -1.375 8.137 258 HD2 ARG 32 HD2 ARG 32 2.792 0.264 10.049 259 HD3 ARG 32 HD1 ARG 32 1.029 0.194 10.075 260 HE ARG 32 HE ARG 32 2.621 -2.263 10.358 261 HH11 ARG 32 HH11 ARG 32 0.311 0.032 11.665 262 HH12 ARG 32 HH12 ARG 32 -0.116 -0.976 13.009 263 HH21 ARG 32 HH21 ARG 32 2.054 -3.589 12.121 264 HH22 ARG 32 HH22 ARG 32 0.878 -3.033 13.273 265 H VAL 33 HN VAL 33 3.297 -1.899 4.834 266 HA VAL 33 HA VAL 33 0.550 -1.641 4.266 267 HB VAL 33 HB VAL 33 1.669 -2.266 1.800 268 HG11 VAL 33 HG11 VAL 33 1.214 0.327 3.239 269 HG12 VAL 33 HG12 VAL 33 0.147 -0.487 2.094 270 HG13 VAL 33 HG13 VAL 33 1.648 0.238 1.537 271 HG21 VAL 33 HG21 VAL 33 3.586 -0.427 3.175 272 HG22 VAL 33 HG22 VAL 33 3.734 -1.198 1.594 273 HG23 VAL 33 HG23 VAL 33 3.898 -2.160 3.064 274 H VAL 34 HN VAL 34 2.781 -4.276 3.445 275 HA VAL 34 HA VAL 34 0.994 -6.167 2.530 276 HB VAL 34 HB VAL 34 2.636 -7.693 2.785 277 HG11 VAL 34 HG11 VAL 34 3.911 -5.810 2.057 278 HG12 VAL 34 HG12 VAL 34 4.883 -6.820 3.124 279 HG13 VAL 34 HG13 VAL 34 4.187 -5.315 3.724 280 HG21 VAL 34 HG21 VAL 34 2.110 -8.128 5.122 281 HG22 VAL 34 HG22 VAL 34 3.172 -6.799 5.601 282 HG23 VAL 34 HG23 VAL 34 3.846 -8.225 4.810 283 H HIS 35 HN HIS 35 1.589 -5.209 5.886 284 HA HIS 35 HA HIS 35 -0.032 -7.244 7.037 285 HB2 HIS 35 HB2 HIS 35 1.780 -6.136 8.272 286 HB3 HIS 35 HB1 HIS 35 0.900 -4.616 8.207 287 HD1 HIS 35 HD1 HIS 35 0.730 -8.043 9.787 288 HD2 HIS 35 HD2 HIS 35 -0.997 -4.276 10.169 289 HE1 HIS 35 HE1 HIS 35 -0.598 -8.118 11.919 290 HE2 HIS 35 HE2 HIS 35 -1.712 -5.866 12.085 291 H ILE 36 HN ILE 36 -0.554 -3.775 6.434 292 HA ILE 36 HA ILE 36 -3.183 -3.604 7.378 293 HB ILE 36 HB ILE 36 -1.926 -2.098 5.063 294 HG12 ILE 36 HG12 ILE 36 -2.290 -1.199 7.920 295 HG13 ILE 36 HG11 ILE 36 -0.820 -1.968 7.351 296 HG21 ILE 36 HG21 ILE 36 -3.737 -0.656 5.042 297 HG22 ILE 36 HG22 ILE 36 -4.182 -1.050 6.707 298 HG23 ILE 36 HG23 ILE 36 -4.524 -2.194 5.415 299 HD11 ILE 36 HD11 ILE 36 -0.648 -0.127 5.669 300 HD12 ILE 36 HD12 ILE 36 -0.461 0.367 7.347 301 HD13 ILE 36 HD13 ILE 36 -1.977 0.661 6.504 302 H ILE 37 HN ILE 37 -1.884 -4.364 4.220 303 HA ILE 37 HA ILE 37 -4.302 -4.735 2.863 304 HB ILE 37 HB ILE 37 -1.489 -5.608 2.418 305 HG12 ILE 37 HG12 ILE 37 -3.182 -3.895 0.648 306 HG13 ILE 37 HG11 ILE 37 -2.452 -3.233 2.100 307 HG21 ILE 37 HG21 ILE 37 -3.839 -6.774 1.239 308 HG22 ILE 37 HG22 ILE 37 -2.150 -7.271 1.107 309 HG23 ILE 37 HG23 ILE 37 -2.793 -6.040 0.023 310 HD11 ILE 37 HD11 ILE 37 -1.043 -2.739 0.279 311 HD12 ILE 37 HD12 ILE 37 -1.047 -4.428 -0.246 312 HD13 ILE 37 HD13 ILE 37 -0.251 -3.975 1.261 313 H GLN 38 HN GLN 38 -2.065 -7.320 3.996 314 HA GLN 38 HA GLN 38 -3.680 -9.507 3.588 315 HB2 GLN 38 HB2 GLN 38 -1.743 -8.975 5.849 316 HB3 GLN 38 HB1 GLN 38 -2.506 -10.537 5.592 317 HG2 GLN 38 HG2 GLN 38 -1.449 -10.707 3.416 318 HG3 GLN 38 HG1 GLN 38 -0.742 -9.110 3.632 319 HE21 GLN 38 HE21 GLN 38 -1.074 -11.491 6.175 320 HE22 GLN 38 HE22 GLN 38 0.619 -11.785 6.378 321 H SER 39 HN SER 39 -3.863 -7.228 6.295 322 HA SER 39 HA SER 39 -5.664 -8.888 7.804 323 HB2 SER 39 HB2 SER 39 -5.783 -6.963 9.350 324 HB3 SER 39 HB1 SER 39 -4.122 -7.386 8.952 325 HG SER 39 HG SER 39 -3.958 -5.636 7.652 326 H ARG 40 HN ARG 40 -5.981 -5.866 5.954 327 HA ARG 40 HA ARG 40 -8.826 -5.773 6.309 328 HB2 ARG 40 HB2 ARG 40 -6.977 -4.191 4.510 329 HB3 ARG 40 HB1 ARG 40 -8.693 -3.858 4.699 330 HG2 ARG 40 HG2 ARG 40 -8.363 -3.442 7.035 331 HG3 ARG 40 HG1 ARG 40 -6.661 -3.849 6.915 332 HD2 ARG 40 HD2 ARG 40 -6.562 -1.569 6.823 333 HD3 ARG 40 HD1 ARG 40 -6.698 -1.945 5.105 334 HE ARG 40 HE ARG 40 -9.208 -1.592 5.550 335 HH11 ARG 40 HH11 ARG 40 -6.626 0.188 7.120 336 HH12 ARG 40 HH12 ARG 40 -7.628 1.549 7.500 337 HH21 ARG 40 HH21 ARG 40 -10.531 0.169 6.104 338 HH22 ARG 40 HH22 ARG 40 -9.845 1.549 6.907 339 H GLU 41 HN GLU 41 -6.688 -7.293 4.158 340 HA GLU 41 HA GLU 41 -8.923 -8.149 2.431 341 HB2 GLU 41 HB2 GLU 41 -6.007 -8.331 1.699 342 HB3 GLU 41 HB1 GLU 41 -7.411 -8.430 0.641 343 HG2 GLU 41 HG2 GLU 41 -6.548 -5.946 2.086 344 HG3 GLU 41 HG1 GLU 41 -6.090 -6.363 0.434 345 HA PRO 42 HA PRO 42 -7.266 -11.702 4.920 346 HB2 PRO 42 HB2 PRO 42 -9.835 -12.833 5.197 347 HB3 PRO 42 HB1 PRO 42 -8.911 -11.994 6.435 348 HG2 PRO 42 HG2 PRO 42 -11.257 -11.112 5.019 349 HG3 PRO 42 HG1 PRO 42 -10.407 -10.313 6.345 350 HD2 PRO 42 HD2 PRO 42 -10.433 -9.605 3.565 351 HD3 PRO 42 HD1 PRO 42 -9.599 -8.799 4.900 352 H SER 43 HN SER 43 -8.865 -11.284 2.008 353 HA SER 43 HA SER 43 -9.112 -14.008 1.202 354 HB2 SER 43 HB2 SER 43 -9.276 -12.941 -1.104 355 HB3 SER 43 HB1 SER 43 -10.477 -12.417 0.078 356 HG SER 43 HG SER 43 -9.335 -10.736 -1.200 357 H LEU 44 HN LEU 44 -6.488 -11.833 1.506 358 HA LEU 44 HA LEU 44 -4.824 -13.656 -0.094 359 HB2 LEU 44 HB2 LEU 44 -3.281 -11.754 -0.441 360 HB3 LEU 44 HB1 LEU 44 -4.852 -11.508 -1.142 361 HG LEU 44 HG LEU 44 -5.175 -10.242 1.209 362 HD11 LEU 44 HD11 LEU 44 -3.119 -8.867 1.470 363 HD12 LEU 44 HD12 LEU 44 -2.278 -10.025 0.445 364 HD13 LEU 44 HD13 LEU 44 -2.953 -10.540 1.992 365 HD21 LEU 44 HD21 LEU 44 -5.724 -9.367 -0.984 366 HD22 LEU 44 HD22 LEU 44 -4.013 -9.160 -1.355 367 HD23 LEU 44 HD23 LEU 44 -4.764 -8.190 -0.090 368 H LYS 45 HN LYS 45 -5.634 -13.710 2.786 369 HA LYS 45 HA LYS 45 -3.397 -13.044 4.390 370 HB2 LYS 45 HB2 LYS 45 -4.457 -14.270 6.146 371 HB3 LYS 45 HB1 LYS 45 -5.699 -13.403 5.259 372 HG2 LYS 45 HG2 LYS 45 -6.326 -15.458 4.103 373 HG3 LYS 45 HG1 LYS 45 -5.040 -16.325 4.955 374 HD2 LYS 45 HD2 LYS 45 -7.318 -14.920 6.328 375 HD3 LYS 45 HD1 LYS 45 -7.282 -16.650 5.959 376 HE2 LYS 45 HE2 LYS 45 -5.137 -16.784 7.210 377 HE3 LYS 45 HE1 LYS 45 -5.381 -15.116 7.714 378 HZ1 LYS 45 HZ1 LYS 45 -7.220 -17.366 8.313 379 HZ2 LYS 45 HZ2 LYS 45 -7.438 -15.758 8.790 380 HZ3 LYS 45 HZ3 LYS 45 -6.144 -16.654 9.408 381 H ASN 46 HN ASN 46 -3.975 -15.671 2.246 382 HA ASN 46 HA ASN 46 -2.278 -17.595 3.482 383 HB2 ASN 46 HB2 ASN 46 -2.365 -18.767 1.282 384 HB3 ASN 46 HB1 ASN 46 -3.970 -18.222 1.771 385 HD21 ASN 46 HD21 ASN 46 -1.393 -17.888 -0.493 386 HD22 ASN 46 HD22 ASN 46 -2.223 -16.837 -1.598 387 H SER 47 HN SER 47 -1.678 -14.701 1.879 388 HA SER 47 HA SER 47 0.872 -15.438 0.756 389 HB2 SER 47 HB2 SER 47 -0.500 -12.765 1.047 390 HB3 SER 47 HB1 SER 47 1.018 -13.016 0.183 391 HG SER 47 HG SER 47 -1.586 -13.682 -0.533 392 H ASN 48 HN ASN 48 2.821 -15.227 1.715 393 HA ASN 48 HA ASN 48 2.953 -14.545 4.499 394 HB2 ASN 48 HB2 ASN 48 5.089 -15.227 2.476 395 HB3 ASN 48 HB1 ASN 48 5.425 -14.926 4.173 396 HD21 ASN 48 HD21 ASN 48 4.787 -16.434 5.714 397 HD22 ASN 48 HD22 ASN 48 4.308 -18.040 5.286 398 HA PRO 49 HA PRO 49 3.480 -10.277 4.353 399 HB2 PRO 49 HB2 PRO 49 5.379 -9.899 6.311 400 HB3 PRO 49 HB1 PRO 49 3.665 -10.186 6.604 401 HG2 PRO 49 HG2 PRO 49 5.940 -12.108 6.685 402 HG3 PRO 49 HG1 PRO 49 4.555 -11.954 7.779 403 HD2 PRO 49 HD2 PRO 49 4.632 -13.857 5.905 404 HD3 PRO 49 HD1 PRO 49 3.116 -13.030 6.316 405 H ASP 50 HN ASP 50 6.326 -12.210 3.847 406 HA ASP 50 HA ASP 50 7.760 -9.871 2.805 407 HB2 ASP 50 HB2 ASP 50 8.663 -12.653 3.507 408 HB3 ASP 50 HB1 ASP 50 9.664 -11.566 2.557 409 H GLU 51 HN GLU 51 5.511 -11.753 1.607 410 HA GLU 51 HA GLU 51 6.779 -11.899 -1.045 411 HB2 GLU 51 HB2 GLU 51 4.967 -14.042 0.077 412 HB3 GLU 51 HB1 GLU 51 5.788 -14.062 -1.476 413 HG2 GLU 51 HG2 GLU 51 7.955 -14.140 -0.287 414 HG3 GLU 51 HG1 GLU 51 7.076 -14.221 1.239 415 H ILE 52 HN ILE 52 4.859 -10.057 0.321 416 HA ILE 52 HA ILE 52 2.254 -10.713 -0.613 417 HB ILE 52 HB ILE 52 3.062 -9.138 1.394 418 HG12 ILE 52 HG12 ILE 52 0.736 -8.285 1.461 419 HG13 ILE 52 HG11 ILE 52 0.500 -8.859 -0.179 420 HG21 ILE 52 HG21 ILE 52 2.405 -7.256 -0.850 421 HG22 ILE 52 HG22 ILE 52 3.936 -7.366 0.017 422 HG23 ILE 52 HG23 ILE 52 2.488 -6.803 0.849 423 HD11 ILE 52 HD11 ILE 52 1.164 -10.550 2.181 424 HD12 ILE 52 HD12 ILE 52 0.844 -11.124 0.551 425 HD13 ILE 52 HD13 ILE 52 -0.438 -10.354 1.483 426 H GLU 53 HN GLU 53 1.082 -9.899 -2.203 427 HA GLU 53 HA GLU 53 2.419 -8.131 -4.139 428 HB2 GLU 53 HB2 GLU 53 0.294 -10.225 -4.672 429 HB3 GLU 53 HB1 GLU 53 0.992 -9.151 -5.875 430 HG2 GLU 53 HG2 GLU 53 2.590 -11.139 -4.294 431 HG3 GLU 53 HG1 GLU 53 1.881 -11.487 -5.868 432 H ILE 54 HN ILE 54 1.654 -6.201 -3.517 433 HA ILE 54 HA ILE 54 -0.875 -5.759 -2.352 434 HB ILE 54 HB ILE 54 0.985 -3.807 -3.719 435 HG12 ILE 54 HG12 ILE 54 0.818 -4.724 -0.841 436 HG13 ILE 54 HG11 ILE 54 2.151 -4.973 -1.958 437 HG21 ILE 54 HG21 ILE 54 -1.192 -3.317 -1.719 438 HG22 ILE 54 HG22 ILE 54 -1.266 -2.934 -3.432 439 HG23 ILE 54 HG23 ILE 54 -0.109 -2.106 -2.391 440 HD11 ILE 54 HD11 ILE 54 2.717 -3.194 -0.428 441 HD12 ILE 54 HD12 ILE 54 1.223 -2.354 -0.823 442 HD13 ILE 54 HD13 ILE 54 2.482 -2.528 -2.043 443 H ASP 55 HN ASP 55 -2.618 -6.331 -3.539 444 HA ASP 55 HA ASP 55 -2.767 -5.697 -6.366 445 HB2 ASP 55 HB2 ASP 55 -4.376 -7.406 -4.508 446 HB3 ASP 55 HB1 ASP 55 -5.072 -6.875 -6.027 447 H PHE 56 HN PHE 56 -2.930 -3.455 -6.241 448 HA PHE 56 HA PHE 56 -4.686 -2.042 -4.606 449 HB2 PHE 56 HB2 PHE 56 -3.558 -1.280 -7.285 450 HB3 PHE 56 HB1 PHE 56 -4.334 -0.164 -6.167 451 HD1 PHE 56 HD1 PHE 56 -3.315 0.049 -3.856 452 HD2 PHE 56 HD2 PHE 56 -1.266 -1.707 -7.117 453 HE1 PHE 56 HE1 PHE 56 -1.216 0.442 -2.700 454 HE2 PHE 56 HE2 PHE 56 0.874 -1.318 -5.964 455 HZ PHE 56 HZ PHE 56 0.887 -0.226 -3.748 456 H GLU 57 HN GLU 57 -5.324 -3.886 -7.372 457 HA GLU 57 HA GLU 57 -7.670 -2.503 -8.228 458 HB2 GLU 57 HB2 GLU 57 -6.586 -5.257 -8.826 459 HB3 GLU 57 HB1 GLU 57 -7.990 -4.568 -9.634 460 HG2 GLU 57 HG2 GLU 57 -5.215 -3.392 -9.660 461 HG3 GLU 57 HG1 GLU 57 -5.910 -4.380 -10.943 462 H THR 58 HN THR 58 -6.964 -5.076 -5.950 463 HA THR 58 HA THR 58 -9.843 -5.508 -5.585 464 HB THR 58 HB THR 58 -9.181 -7.504 -4.253 465 HG1 THR 58 HG1 THR 58 -7.158 -7.625 -3.693 466 HG21 THR 58 HG21 THR 58 -8.101 -7.417 -7.071 467 HG22 THR 58 HG22 THR 58 -9.779 -7.715 -6.615 468 HG23 THR 58 HG23 THR 58 -8.526 -8.872 -6.170 469 H LEU 59 HN LEU 59 -6.999 -4.246 -4.036 470 HA LEU 59 HA LEU 59 -7.624 -4.303 -1.360 471 HB2 LEU 59 HB2 LEU 59 -6.326 -2.106 -2.924 472 HB3 LEU 59 HB1 LEU 59 -6.370 -2.186 -1.180 473 HG LEU 59 HG LEU 59 -5.045 -4.161 -3.018 474 HD11 LEU 59 HD11 LEU 59 -3.849 -2.328 -0.969 475 HD12 LEU 59 HD12 LEU 59 -3.898 -1.988 -2.696 476 HD13 LEU 59 HD13 LEU 59 -3.001 -3.380 -2.096 477 HD21 LEU 59 HD21 LEU 59 -5.537 -4.177 -0.055 478 HD22 LEU 59 HD22 LEU 59 -4.190 -5.053 -0.793 479 HD23 LEU 59 HD23 LEU 59 -5.846 -5.445 -1.250 480 H LYS 60 HN LYS 60 -9.204 -3.488 -0.157 481 HA LYS 60 HA LYS 60 -11.384 -2.037 -1.143 482 HB2 LYS 60 HB2 LYS 60 -10.301 -2.177 1.680 483 HB3 LYS 60 HB1 LYS 60 -11.889 -1.559 1.253 484 HG2 LYS 60 HG2 LYS 60 -12.559 -3.735 0.489 485 HG3 LYS 60 HG1 LYS 60 -10.939 -4.358 0.741 486 HD2 LYS 60 HD2 LYS 60 -11.189 -3.825 3.144 487 HD3 LYS 60 HD1 LYS 60 -12.871 -3.402 2.833 488 HE2 LYS 60 HE2 LYS 60 -13.334 -5.646 2.073 489 HE3 LYS 60 HE1 LYS 60 -11.633 -6.083 2.219 490 HZ1 LYS 60 HZ1 LYS 60 -11.792 -5.715 4.607 491 HZ2 LYS 60 HZ2 LYS 60 -12.889 -6.893 4.095 492 HZ3 LYS 60 HZ3 LYS 60 -13.435 -5.336 4.457 493 HA PRO 61 HA PRO 61 -9.990 2.209 -1.605 494 HB2 PRO 61 HB2 PRO 61 -12.600 2.677 -0.227 495 HB3 PRO 61 HB1 PRO 61 -11.920 3.480 -1.647 496 HG2 PRO 61 HG2 PRO 61 -13.806 1.620 -1.898 497 HG3 PRO 61 HG1 PRO 61 -12.483 1.775 -3.064 498 HD2 PRO 61 HD2 PRO 61 -12.939 -0.308 -1.000 499 HD3 PRO 61 HD1 PRO 61 -12.041 -0.407 -2.529 500 H SER 62 HN SER 62 -11.405 0.950 1.339 501 HA SER 62 HA SER 62 -10.471 2.864 3.153 502 HB2 SER 62 HB2 SER 62 -10.908 -0.083 3.660 503 HB3 SER 62 HB1 SER 62 -10.989 1.226 4.841 504 HG SER 62 HG SER 62 -12.863 1.935 3.946 505 H THR 63 HN THR 63 -9.054 -0.276 2.166 506 HA THR 63 HA THR 63 -6.726 -0.070 3.736 507 HB THR 63 HB THR 63 -6.684 -1.488 1.086 508 HG1 THR 63 HG1 THR 63 -7.951 -3.143 1.910 509 HG21 THR 63 HG21 THR 63 -4.739 -2.173 2.026 510 HG22 THR 63 HG22 THR 63 -5.769 -3.197 3.036 511 HG23 THR 63 HG23 THR 63 -5.247 -1.623 3.626 512 H LEU 64 HN LEU 64 -7.432 0.802 0.375 513 HA LEU 64 HA LEU 64 -4.852 1.558 -0.373 514 HB2 LEU 64 HB2 LEU 64 -7.515 2.584 -1.330 515 HB3 LEU 64 HB1 LEU 64 -5.995 2.909 -2.125 516 HG LEU 64 HG LEU 64 -7.121 0.144 -1.717 517 HD11 LEU 64 HD11 LEU 64 -7.843 2.192 -3.574 518 HD12 LEU 64 HD12 LEU 64 -8.508 0.570 -3.390 519 HD13 LEU 64 HD13 LEU 64 -7.106 0.839 -4.427 520 HD21 LEU 64 HD21 LEU 64 -4.736 1.274 -3.132 521 HD22 LEU 64 HD22 LEU 64 -5.451 -0.263 -3.622 522 HD23 LEU 64 HD23 LEU 64 -4.819 -0.066 -1.987 523 H ARG 65 HN ARG 65 -7.483 3.564 0.977 524 HA ARG 65 HA ARG 65 -5.988 5.961 0.988 525 HB2 ARG 65 HB2 ARG 65 -8.358 5.074 2.621 526 HB3 ARG 65 HB1 ARG 65 -7.661 6.685 2.726 527 HG2 ARG 65 HG2 ARG 65 -8.748 5.472 0.193 528 HG3 ARG 65 HG1 ARG 65 -9.658 6.533 1.261 529 HD2 ARG 65 HD2 ARG 65 -8.104 8.335 0.877 530 HD3 ARG 65 HD1 ARG 65 -7.070 7.281 -0.081 531 HE ARG 65 HE ARG 65 -9.725 7.436 -1.130 532 HH11 ARG 65 HH11 ARG 65 -6.689 9.173 -0.943 533 HH12 ARG 65 HH12 ARG 65 -6.856 9.892 -2.511 534 HH21 ARG 65 HH21 ARG 65 -9.947 8.422 -3.219 535 HH22 ARG 65 HH22 ARG 65 -8.684 9.471 -3.794 536 H GLU 66 HN GLU 66 -6.235 3.281 3.224 537 HA GLU 66 HA GLU 66 -4.792 4.466 5.357 538 HB2 GLU 66 HB2 GLU 66 -6.129 2.526 5.790 539 HB3 GLU 66 HB1 GLU 66 -5.287 1.596 4.558 540 HG2 GLU 66 HG2 GLU 66 -4.511 0.842 6.646 541 HG3 GLU 66 HG1 GLU 66 -3.218 1.808 5.940 542 H LEU 67 HN LEU 67 -3.748 2.054 2.919 543 HA LEU 67 HA LEU 67 -1.044 1.945 3.337 544 HB2 LEU 67 HB2 LEU 67 -2.231 2.187 0.558 545 HB3 LEU 67 HB1 LEU 67 -0.836 1.241 1.061 546 HG LEU 67 HG LEU 67 -3.676 0.653 1.880 547 HD11 LEU 67 HD11 LEU 67 -2.160 -1.161 0.148 548 HD12 LEU 67 HD12 LEU 67 -2.726 0.332 -0.599 549 HD13 LEU 67 HD13 LEU 67 -3.878 -0.771 0.157 550 HD21 LEU 67 HD21 LEU 67 -1.328 -0.103 3.098 551 HD22 LEU 67 HD22 LEU 67 -1.697 -1.462 2.043 552 HD23 LEU 67 HD23 LEU 67 -2.880 -0.925 3.235 553 H GLU 68 HN GLU 68 -2.637 4.208 1.107 554 HA GLU 68 HA GLU 68 -0.587 5.925 0.451 555 HB2 GLU 68 HB2 GLU 68 -2.793 5.943 -0.524 556 HB3 GLU 68 HB1 GLU 68 -3.467 6.540 0.990 557 HG2 GLU 68 HG2 GLU 68 -3.154 8.230 -0.788 558 HG3 GLU 68 HG1 GLU 68 -2.375 8.623 0.740 559 H ARG 69 HN ARG 69 -2.977 6.629 3.027 560 HA ARG 69 HA ARG 69 -1.645 8.838 4.110 561 HB2 ARG 69 HB2 ARG 69 -3.709 6.944 5.060 562 HB3 ARG 69 HB1 ARG 69 -2.977 8.003 6.251 563 HG2 ARG 69 HG2 ARG 69 -3.976 9.222 3.742 564 HG3 ARG 69 HG1 ARG 69 -5.168 8.660 4.917 565 HD2 ARG 69 HD2 ARG 69 -4.654 10.998 5.297 566 HD3 ARG 69 HD1 ARG 69 -4.080 10.016 6.644 567 HE ARG 69 HE ARG 69 -2.045 10.466 4.689 568 HH11 ARG 69 HH11 ARG 69 -3.697 11.934 7.401 569 HH12 ARG 69 HH12 ARG 69 -2.361 12.950 7.828 570 HH21 ARG 69 HH21 ARG 69 -0.286 11.788 5.249 571 HH22 ARG 69 HH22 ARG 69 -0.418 12.877 6.597 572 H TYR 70 HN TYR 70 -1.109 5.450 4.602 573 HA TYR 70 HA TYR 70 0.376 5.729 7.019 574 HB2 TYR 70 HB2 TYR 70 -0.521 3.570 6.610 575 HB3 TYR 70 HB1 TYR 70 0.155 3.525 4.987 576 HD1 TYR 70 HD2 TYR 70 1.402 4.022 8.481 577 HD2 TYR 70 HD1 TYR 70 1.953 2.227 4.679 578 HE1 TYR 70 HE2 TYR 70 3.469 2.972 9.298 579 HE2 TYR 70 HE1 TYR 70 4.000 1.154 5.469 580 HH TYR 70 HH TYR 70 4.909 1.103 8.791 581 H VAL 71 HN VAL 71 1.282 5.269 3.599 582 HA VAL 71 HA VAL 71 4.054 5.376 4.066 583 HB VAL 71 HB VAL 71 4.381 5.694 1.746 584 HG11 VAL 71 HG11 VAL 71 2.575 4.196 0.706 585 HG12 VAL 71 HG12 VAL 71 2.003 4.012 2.366 586 HG13 VAL 71 HG13 VAL 71 3.644 3.528 1.936 587 HG21 VAL 71 HG21 VAL 71 2.767 6.473 0.212 588 HG22 VAL 71 HG22 VAL 71 2.914 7.647 1.515 589 HG23 VAL 71 HG23 VAL 71 1.528 6.555 1.456 590 H THR 72 HN THR 72 1.598 7.859 3.620 591 HA THR 72 HA THR 72 3.351 9.952 3.042 592 HB THR 72 HB THR 72 1.571 11.511 3.653 593 HG1 THR 72 HG1 THR 72 0.522 9.228 4.901 594 HG21 THR 72 HG21 THR 72 1.037 9.114 1.984 595 HG22 THR 72 HG22 THR 72 1.334 10.784 1.490 596 HG23 THR 72 HG23 THR 72 -0.225 10.329 2.180 597 H SER 73 HN SER 73 2.484 8.443 6.031 598 HA SER 73 HA SER 73 3.405 10.493 7.762 599 HB2 SER 73 HB2 SER 73 3.161 8.918 9.511 600 HB3 SER 73 HB1 SER 73 1.918 8.491 8.332 601 HG SER 73 HG SER 73 3.168 6.789 7.635 602 H CYS 74 HN CYS 74 4.919 8.022 5.890 603 HA CYS 74 HA CYS 74 7.512 8.426 7.206 604 HB2 CYS 74 HB2 CYS 74 6.954 6.108 6.891 605 HB3 CYS 74 HB1 CYS 74 6.571 6.380 5.194 606 HG CYS 74 HG CYS 74 9.501 7.341 5.121 607 H LEU 75 HN LEU 75 5.790 9.216 4.321 608 HA LEU 75 HA LEU 75 8.251 9.877 2.895 609 HB2 LEU 75 HB2 LEU 75 5.413 9.800 1.881 610 HB3 LEU 75 HB1 LEU 75 6.848 9.935 0.911 611 HG LEU 75 HG LEU 75 5.868 7.543 2.416 612 HD11 LEU 75 HD11 LEU 75 5.051 8.119 0.083 613 HD12 LEU 75 HD12 LEU 75 5.755 6.516 0.305 614 HD13 LEU 75 HD13 LEU 75 6.697 7.793 -0.456 615 HD21 LEU 75 HD21 LEU 75 7.908 6.401 1.890 616 HD22 LEU 75 HD22 LEU 75 8.305 7.855 2.797 617 HD23 LEU 75 HD23 LEU 75 8.543 7.815 1.051 618 H ARG 76 HN ARG 76 5.075 11.337 3.598 619 HA ARG 76 HA ARG 76 6.038 13.857 2.543 620 HB2 ARG 76 HB2 ARG 76 3.308 13.015 3.461 621 HB3 ARG 76 HB1 ARG 76 3.696 14.598 2.794 622 HG2 ARG 76 HG2 ARG 76 4.483 13.461 0.731 623 HG3 ARG 76 HG1 ARG 76 3.912 11.944 1.425 624 HD2 ARG 76 HD2 ARG 76 2.250 12.816 -0.074 625 HD3 ARG 76 HD1 ARG 76 1.681 12.873 1.590 626 HE ARG 76 HE ARG 76 2.779 15.342 1.121 627 HH11 ARG 76 HH11 ARG 76 0.250 13.429 -0.356 628 HH12 ARG 76 HH12 ARG 76 -0.698 14.808 -0.815 629 HH21 ARG 76 HH21 ARG 76 1.534 17.158 0.510 630 HH22 ARG 76 HH22 ARG 76 0.026 16.924 -0.312 631 H LYS 77 HN LYS 77 5.143 12.403 5.575 632 HA LYS 77 HA LYS 77 5.127 14.893 7.023 633 HB2 LYS 77 HB2 LYS 77 3.751 12.771 7.520 634 HB3 LYS 77 HB1 LYS 77 5.219 12.124 8.227 635 HG2 LYS 77 HG2 LYS 77 4.105 14.745 9.145 636 HG3 LYS 77 HG1 LYS 77 3.469 13.221 9.756 637 HD2 LYS 77 HD2 LYS 77 5.733 12.598 10.492 638 HD3 LYS 77 HD1 LYS 77 6.331 14.158 9.923 639 HE2 LYS 77 HE2 LYS 77 5.976 14.288 12.290 640 HE3 LYS 77 HE1 LYS 77 4.755 15.268 11.482 641 HZ1 LYS 77 HZ1 LYS 77 3.753 13.985 13.226 642 HZ2 LYS 77 HZ2 LYS 77 4.373 12.545 12.596 643 HZ3 LYS 77 HZ3 LYS 77 3.198 13.403 11.739 644 H LYS 78 HN LYS 78 7.492 12.604 6.051 645 HA LYS 78 HA LYS 78 9.516 14.015 7.606 646 HB2 LYS 78 HB2 LYS 78 8.637 11.804 8.718 647 HB3 LYS 78 HB1 LYS 78 9.669 11.031 7.529 648 HG2 LYS 78 HG2 LYS 78 10.516 12.977 9.669 649 HG3 LYS 78 HG1 LYS 78 10.847 11.246 9.618 650 HD2 LYS 78 HD2 LYS 78 12.189 11.575 7.589 651 HD3 LYS 78 HD1 LYS 78 11.863 13.309 7.664 652 HE2 LYS 78 HE2 LYS 78 12.964 13.386 9.871 653 HE3 LYS 78 HE1 LYS 78 13.337 11.670 9.725 654 HZ1 LYS 78 HZ1 LYS 78 14.342 13.855 7.983 655 HZ2 LYS 78 HZ2 LYS 78 14.612 12.209 7.698 656 HZ3 LYS 78 HZ3 LYS 78 15.243 12.944 9.088 657 H ARG 79 HN ARG 79 10.570 14.849 5.872 658 HA ARG 79 HA ARG 79 11.009 13.400 3.470 659 HB2 ARG 79 HB2 ARG 79 12.476 15.197 2.786 660 HB3 ARG 79 HB1 ARG 79 11.033 15.864 3.523 661 HG2 ARG 79 HG2 ARG 79 13.590 15.540 5.058 662 HG3 ARG 79 HG1 ARG 79 13.270 16.955 4.058 663 HD2 ARG 79 HD2 ARG 79 11.182 17.321 5.382 664 HD3 ARG 79 HD1 ARG 79 11.687 16.006 6.442 665 HE ARG 79 HE ARG 79 13.824 17.707 6.383 666 HH11 ARG 79 HH11 ARG 79 10.448 18.011 7.264 667 HH12 ARG 79 HH12 ARG 79 10.735 19.283 8.405 668 HH21 ARG 79 HH21 ARG 79 14.195 19.378 7.897 669 HH22 ARG 79 HH22 ARG 79 12.861 20.045 8.782 670 H LYS 80 HN LYS 80 12.239 11.712 3.236 671 HA LYS 80 HA LYS 80 13.825 10.143 3.464 672 HB2 LYS 80 HB2 LYS 80 15.436 12.598 4.076 673 HB3 LYS 80 HB1 LYS 80 16.162 10.997 4.109 674 HG2 LYS 80 HG2 LYS 80 14.845 12.335 1.754 675 HG3 LYS 80 HG1 LYS 80 16.566 12.010 1.970 676 HD2 LYS 80 HD2 LYS 80 15.950 9.554 2.100 677 HD3 LYS 80 HD1 LYS 80 14.340 10.022 1.555 678 HE2 LYS 80 HE2 LYS 80 15.636 9.306 -0.342 679 HE3 LYS 80 HE1 LYS 80 15.361 11.044 -0.451 680 HZ1 LYS 80 HZ1 LYS 80 17.850 9.756 0.531 681 HZ2 LYS 80 HZ2 LYS 80 17.585 11.422 0.397 682 HZ3 LYS 80 HZ3 LYS 80 17.644 10.463 -0.991 683 HA PRO 81 HA PRO 81 13.249 9.476 7.914 684 HB2 PRO 81 HB2 PRO 81 12.380 6.951 7.733 685 HB3 PRO 81 HB1 PRO 81 11.323 8.312 7.331 686 HG2 PRO 81 HG2 PRO 81 12.852 6.499 5.507 687 HG3 PRO 81 HG1 PRO 81 11.192 7.098 5.351 688 HD2 PRO 81 HD2 PRO 81 13.351 8.177 4.041 689 HD3 PRO 81 HD1 PRO 81 11.870 9.077 4.420 690 H GLN 82 HN GLN 82 15.793 9.512 6.832 691 HA GLN 82 HA GLN 82 16.980 7.090 8.010 692 HB2 GLN 82 HB2 GLN 82 18.048 8.616 5.624 693 HB3 GLN 82 HB1 GLN 82 18.805 7.222 6.379 694 HG2 GLN 82 HG2 GLN 82 16.853 5.859 5.748 695 HG3 GLN 82 HG1 GLN 82 16.170 7.261 4.927 696 HE21 GLN 82 HE21 GLN 82 16.925 4.677 3.852 697 HE22 GLN 82 HE22 GLN 82 18.098 4.983 2.620 698 H ALA 83 HN ALA 83 19.302 7.516 8.669 699 HA ALA 83 HA ALA 83 19.718 10.316 9.443 700 HB1 ALA 83 HB1 ALA 83 18.790 9.155 11.384 701 HB2 ALA 83 HB2 ALA 83 20.467 9.619 11.666 702 HB3 ALA 83 HB3 ALA 83 20.069 7.946 11.278 703 H1 VAL 201 HT1 VAL 201 -5.614 -3.262 -14.929 704 H2 VAL 201 HT2 VAL 201 -7.251 -2.877 -15.091 705 H3 VAL 201 HT3 VAL 201 -6.496 -2.746 -13.579 706 HA VAL 201 HA VAL 201 -5.908 -1.114 -15.981 707 HB VAL 201 HB VAL 201 -7.195 -0.349 -13.349 708 HG11 VAL 201 HG11 VAL 201 -7.465 1.871 -14.358 709 HG12 VAL 201 HG12 VAL 201 -6.549 1.336 -15.767 710 HG13 VAL 201 HG13 VAL 201 -5.766 1.430 -14.190 711 HG21 VAL 201 HG21 VAL 201 -8.719 -1.559 -14.826 712 HG22 VAL 201 HG22 VAL 201 -8.346 -0.440 -16.136 713 HG23 VAL 201 HG23 VAL 201 -9.178 0.139 -14.693 714 H VAL 202 HN VAL 202 -5.359 -1.402 -12.456 715 HA VAL 202 HA VAL 202 -2.789 -0.031 -12.815 716 HB VAL 202 HB VAL 202 -4.236 -0.746 -10.259 717 HG11 VAL 202 HG11 VAL 202 -2.621 0.768 -9.184 718 HG12 VAL 202 HG12 VAL 202 -1.790 0.962 -10.727 719 HG13 VAL 202 HG13 VAL 202 -1.827 -0.615 -9.937 720 HG21 VAL 202 HG21 VAL 202 -3.931 1.945 -11.587 721 HG22 VAL 202 HG22 VAL 202 -4.826 1.586 -10.111 722 HG23 VAL 202 HG23 VAL 202 -5.387 0.953 -11.658 723 HA PRO 203 HA PRO 203 -0.819 -4.075 -12.758 724 HB2 PRO 203 HB2 PRO 203 1.573 -2.343 -12.467 725 HB3 PRO 203 HB1 PRO 203 1.245 -3.619 -13.645 726 HG2 PRO 203 HG2 PRO 203 1.162 -1.051 -14.355 727 HG3 PRO 203 HG1 PRO 203 0.003 -2.221 -15.013 728 HD2 PRO 203 HD2 PRO 203 -0.380 -0.172 -12.869 729 HD3 PRO 203 HD1 PRO 203 -1.489 -0.679 -14.160 730 H LYS 204 HN LYS 204 -0.548 -5.301 -11.022 731 HA LYS 204 HA LYS 204 -0.572 -4.225 -8.414 732 HB2 LYS 204 HB2 LYS 204 -0.214 -6.590 -7.688 733 HB3 LYS 204 HB1 LYS 204 -1.580 -6.351 -8.767 734 HG2 LYS 204 HG2 LYS 204 -0.192 -7.160 -10.646 735 HG3 LYS 204 HG1 LYS 204 1.117 -7.469 -9.505 736 HD2 LYS 204 HD2 LYS 204 -0.144 -9.121 -8.367 737 HD3 LYS 204 HD1 LYS 204 -1.629 -8.659 -9.199 738 HE2 LYS 204 HE2 LYS 204 0.801 -9.863 -10.518 739 HE3 LYS 204 HE1 LYS 204 -0.653 -10.751 -10.067 740 HZ1 LYS 204 HZ1 LYS 204 -1.922 -9.327 -11.566 741 HZ2 LYS 204 HZ2 LYS 204 -0.700 -10.155 -12.389 742 HZ3 LYS 204 HZ3 LYS 204 -0.508 -8.518 -12.020 743 H LYS 205 HN LYS 205 0.971 -4.437 -6.754 744 HA LYS 205 HA LYS 205 3.659 -3.904 -7.767 745 HB2 LYS 205 HB2 LYS 205 2.738 -2.125 -6.464 746 HB3 LYS 205 HB1 LYS 205 2.255 -3.226 -5.185 747 HG2 LYS 205 HG2 LYS 205 4.167 -1.980 -4.476 748 HG3 LYS 205 HG1 LYS 205 4.630 -3.665 -4.712 749 HD2 LYS 205 HD2 LYS 205 5.561 -3.081 -6.911 750 HD3 LYS 205 HD1 LYS 205 5.138 -1.389 -6.625 751 HE2 LYS 205 HE2 LYS 205 6.579 -1.359 -4.654 752 HE3 LYS 205 HE1 LYS 205 6.997 -3.052 -4.929 753 HZ1 LYS 205 HZ1 LYS 205 7.931 -2.389 -7.098 754 HZ2 LYS 205 HZ2 LYS 205 8.730 -1.674 -5.787 755 HZ3 LYS 205 HZ3 LYS 205 7.641 -0.766 -6.704 756 H LYS 206 HN LYS 206 5.220 -5.323 -7.532 757 HA LYS 206 HA LYS 206 4.820 -7.748 -6.014 758 HB2 LYS 206 HB2 LYS 206 7.233 -6.835 -7.594 759 HB3 LYS 206 HB1 LYS 206 6.907 -8.471 -7.034 760 HG2 LYS 206 HG2 LYS 206 5.116 -8.737 -8.532 761 HG3 LYS 206 HG1 LYS 206 5.070 -7.014 -8.903 762 HD2 LYS 206 HD2 LYS 206 7.389 -7.278 -9.852 763 HD3 LYS 206 HD1 LYS 206 7.170 -9.022 -9.691 764 HE2 LYS 206 HE2 LYS 206 6.634 -8.218 -11.953 765 HE3 LYS 206 HE1 LYS 206 5.240 -8.944 -11.154 766 HZ1 LYS 206 HZ1 LYS 206 4.390 -6.771 -10.661 767 HZ2 LYS 206 HZ2 LYS 206 4.716 -6.856 -12.318 768 HZ3 LYS 206 HZ3 LYS 206 5.772 -6.026 -11.289 769 H ILE 207 HN ILE 207 5.491 -8.077 -4.006 770 HA ILE 207 HA ILE 207 7.486 -6.219 -2.864 771 HB ILE 207 HB ILE 207 5.121 -7.411 -1.422 772 HG12 ILE 207 HG12 ILE 207 4.525 -5.756 -3.231 773 HG13 ILE 207 HG11 ILE 207 4.001 -5.326 -1.611 774 HG21 ILE 207 HG21 ILE 207 6.957 -5.180 -0.577 775 HG22 ILE 207 HG22 ILE 207 7.083 -6.848 -0.023 776 HG23 ILE 207 HG23 ILE 207 5.653 -5.895 0.369 777 HD11 ILE 207 HD11 ILE 207 5.877 -3.783 -1.422 778 HD12 ILE 207 HD12 ILE 207 4.859 -3.399 -2.801 779 HD13 ILE 207 HD13 ILE 207 6.400 -4.221 -3.043 780 H LYS 208 HN LYS 208 9.010 -7.958 -3.462 781 HA LYS 208 HA LYS 208 8.829 -10.310 -1.722 782 HB2 LYS 208 HB2 LYS 208 10.598 -9.814 -4.121 783 HB3 LYS 208 HB1 LYS 208 10.589 -11.285 -3.161 784 HG2 LYS 208 HG2 LYS 208 8.362 -10.210 -4.871 785 HG3 LYS 208 HG1 LYS 208 9.327 -11.660 -5.153 786 HD2 LYS 208 HD2 LYS 208 8.425 -12.551 -2.977 787 HD3 LYS 208 HD1 LYS 208 7.317 -11.177 -2.960 788 HE2 LYS 208 HE2 LYS 208 7.484 -13.364 -5.023 789 HE3 LYS 208 HE1 LYS 208 6.173 -13.070 -3.881 790 HZ1 LYS 208 HZ1 LYS 208 6.987 -11.231 -6.063 791 HZ2 LYS 208 HZ2 LYS 208 5.690 -10.989 -4.998 792 HZ3 LYS 208 HZ3 LYS 208 5.657 -12.270 -6.104 793 H LYS 209 HN LYS 209 11.735 -8.810 -3.062 794 HA LYS 209 HA LYS 209 12.671 -8.363 -0.302 795 HB2 LYS 209 HB2 LYS 209 14.286 -9.392 -2.641 796 HB3 LYS 209 HB1 LYS 209 14.930 -9.012 -1.050 797 HG2 LYS 209 HG2 LYS 209 13.667 -10.774 -0.047 798 HG3 LYS 209 HG1 LYS 209 12.814 -11.086 -1.560 799 HD2 LYS 209 HD2 LYS 209 14.938 -11.724 -2.606 800 HD3 LYS 209 HD1 LYS 209 15.767 -11.438 -1.075 801 HE2 LYS 209 HE2 LYS 209 14.471 -13.187 -0.013 802 HE3 LYS 209 HE1 LYS 209 13.546 -13.433 -1.493 803 HZ1 LYS 209 HZ1 LYS 209 16.469 -13.858 -1.220 804 HZ2 LYS 209 HZ2 LYS 209 15.549 -14.141 -2.607 805 HZ3 LYS 209 HZ3 LYS 209 15.302 -15.080 -1.224 806 H GLU 210 HN GLU 210 12.081 -7.050 -3.337 807 HA GLU 210 HA GLU 210 13.992 -4.869 -2.937 808 HB2 GLU 210 HB2 GLU 210 12.235 -5.532 -5.306 809 HB3 GLU 210 HB1 GLU 210 13.346 -4.172 -5.225 810 HG2 GLU 210 HG2 GLU 210 15.217 -5.739 -4.974 811 HG3 GLU 210 HG1 GLU 210 14.086 -7.086 -5.116 812 H GLN 211 HN GLN 211 13.334 -3.062 -2.021 813 HA GLN 211 HA GLN 211 10.527 -2.539 -1.606 814 HB2 GLN 211 HB2 GLN 211 11.368 -0.484 -0.442 815 HB3 GLN 211 HB1 GLN 211 11.995 -1.992 0.207 816 HG2 GLN 211 HG2 GLN 211 14.059 -1.626 -1.139 817 HG3 GLN 211 HG1 GLN 211 13.427 -0.040 -1.574 818 HE21 GLN 211 HE21 GLN 211 14.671 -2.026 0.992 819 HE22 GLN 211 HE22 GLN 211 15.007 -0.735 2.096 820 H VAL 212 HN VAL 212 13.078 -1.488 -3.712 821 HA VAL 212 HA VAL 212 11.141 0.188 -5.167 822 HB VAL 212 HB VAL 212 13.053 1.520 -6.020 823 HG11 VAL 212 HG11 VAL 212 13.477 2.800 -3.972 824 HG12 VAL 212 HG12 VAL 212 12.811 1.476 -3.017 825 HG13 VAL 212 HG13 VAL 212 11.776 2.363 -4.136 826 HG21 VAL 212 HG21 VAL 212 14.663 -0.008 -3.978 827 HG22 VAL 212 HG22 VAL 212 15.231 1.372 -4.915 828 HG23 VAL 212 HG23 VAL 212 14.818 -0.136 -5.729 829 H GLU 213 HN GLU 213 11.411 0.189 -7.505 830 HA GLU 213 HA GLU 213 13.142 -1.925 -8.542 831 HB2 GLU 213 HB2 GLU 213 11.297 -2.593 -10.136 832 HB3 GLU 213 HB1 GLU 213 11.069 -3.062 -8.460 833 HG2 GLU 213 HG2 GLU 213 9.546 -1.159 -8.153 834 HG3 GLU 213 HG1 GLU 213 9.752 -0.741 -9.854 Start of MODEL 19 1 H1 SER 1 HT1 SER 1 -21.145 0.357 10.210 2 H2 SER 1 HT2 SER 1 -21.081 2.046 10.260 3 H3 SER 1 HT3 SER 1 -19.827 1.172 9.539 4 HA SER 1 HA SER 1 -21.282 0.401 7.818 5 HB2 SER 1 HB2 SER 1 -23.346 0.414 9.205 6 HB3 SER 1 HB1 SER 1 -23.370 2.171 9.102 7 HG SER 1 HG SER 1 -23.151 0.959 6.656 8 H GLU 2 HN GLU 2 -20.823 3.561 9.268 9 HA GLU 2 HA GLU 2 -21.166 4.943 6.764 10 HB2 GLU 2 HB2 GLU 2 -21.392 5.731 9.341 11 HB3 GLU 2 HB1 GLU 2 -19.763 6.291 8.968 12 HG2 GLU 2 HG2 GLU 2 -20.574 7.574 7.098 13 HG3 GLU 2 HG1 GLU 2 -22.210 6.970 7.367 14 H GLU 3 HN GLU 3 -18.697 3.103 8.035 15 HA GLU 3 HA GLU 3 -16.410 4.599 7.407 16 HB2 GLU 3 HB2 GLU 3 -16.752 1.596 7.332 17 HB3 GLU 3 HB1 GLU 3 -15.214 2.446 7.341 18 HG2 GLU 3 HG2 GLU 3 -17.254 2.300 9.538 19 HG3 GLU 3 HG1 GLU 3 -15.602 1.689 9.543 20 H GLU 4 HN GLU 4 -18.675 2.941 5.420 21 HA GLU 4 HA GLU 4 -17.057 2.665 3.108 22 HB2 GLU 4 HB2 GLU 4 -19.156 1.402 3.487 23 HB3 GLU 4 HB1 GLU 4 -20.070 2.891 3.309 24 HG2 GLU 4 HG2 GLU 4 -19.258 3.099 1.010 25 HG3 GLU 4 HG1 GLU 4 -18.379 1.581 1.194 26 H ASP 5 HN ASP 5 -18.867 5.312 4.499 27 HA ASP 5 HA ASP 5 -18.426 6.909 2.096 28 HB2 ASP 5 HB2 ASP 5 -20.692 6.992 3.025 29 HB3 ASP 5 HB1 ASP 5 -20.043 7.572 4.549 30 H LYS 6 HN LYS 6 -17.326 6.433 5.297 31 HA LYS 6 HA LYS 6 -15.847 8.827 5.600 32 HB2 LYS 6 HB2 LYS 6 -16.323 7.248 7.465 33 HB3 LYS 6 HB1 LYS 6 -15.216 6.093 6.738 34 HG2 LYS 6 HG2 LYS 6 -14.142 7.258 8.554 35 HG3 LYS 6 HG1 LYS 6 -13.376 7.678 7.024 36 HD2 LYS 6 HD2 LYS 6 -14.602 9.777 6.965 37 HD3 LYS 6 HD1 LYS 6 -15.439 9.348 8.458 38 HE2 LYS 6 HE2 LYS 6 -12.457 9.707 8.176 39 HE3 LYS 6 HE1 LYS 6 -13.565 10.918 8.816 40 HZ1 LYS 6 HZ1 LYS 6 -13.100 8.226 9.985 41 HZ2 LYS 6 HZ2 LYS 6 -14.137 9.407 10.603 42 HZ3 LYS 6 HZ3 LYS 6 -12.471 9.679 10.580 43 H CYS 7 HN CYS 7 -15.085 5.665 4.207 44 HA CYS 7 HA CYS 7 -12.447 6.563 3.447 45 HB2 CYS 7 HB2 CYS 7 -13.826 3.984 2.689 46 HB3 CYS 7 HB1 CYS 7 -12.101 4.331 2.583 47 HG CYS 7 HG CYS 7 -13.975 3.549 5.289 48 H LYS 8 HN LYS 8 -12.150 7.760 1.698 49 HA LYS 8 HA LYS 8 -14.224 7.908 -0.344 50 HB2 LYS 8 HB2 LYS 8 -11.738 9.499 0.249 51 HB3 LYS 8 HB1 LYS 8 -12.514 9.624 -1.319 52 HG2 LYS 8 HG2 LYS 8 -13.210 11.418 0.145 53 HG3 LYS 8 HG1 LYS 8 -14.565 10.378 -0.286 54 HD2 LYS 8 HD2 LYS 8 -14.351 9.246 1.902 55 HD3 LYS 8 HD1 LYS 8 -13.020 10.327 2.312 56 HE2 LYS 8 HE2 LYS 8 -14.509 12.242 2.170 57 HE3 LYS 8 HE1 LYS 8 -15.841 11.192 1.690 58 HZ1 LYS 8 HZ1 LYS 8 -15.906 11.772 4.052 59 HZ2 LYS 8 HZ2 LYS 8 -14.402 11.034 4.284 60 HZ3 LYS 8 HZ3 LYS 8 -15.740 10.106 3.819 61 HA PRO 9 HA PRO 9 -12.608 4.957 -3.053 62 HB2 PRO 9 HB2 PRO 9 -13.446 6.069 -5.429 63 HB3 PRO 9 HB1 PRO 9 -14.463 5.118 -4.347 64 HG2 PRO 9 HG2 PRO 9 -14.277 8.068 -4.670 65 HG3 PRO 9 HG1 PRO 9 -15.698 7.061 -4.343 66 HD2 PRO 9 HD2 PRO 9 -14.461 8.527 -2.424 67 HD3 PRO 9 HD1 PRO 9 -15.269 6.992 -2.066 68 H MET 10 HN MET 10 -10.681 4.580 -3.979 69 HA MET 10 HA MET 10 -9.026 6.886 -4.670 70 HB2 MET 10 HB2 MET 10 -8.150 5.088 -3.137 71 HB3 MET 10 HB1 MET 10 -8.208 3.984 -4.507 72 HG2 MET 10 HG2 MET 10 -6.034 4.617 -4.626 73 HG3 MET 10 HG1 MET 10 -6.762 5.858 -5.648 74 HE1 MET 10 HE1 MET 10 -5.864 4.849 -2.169 75 HE2 MET 10 HE2 MET 10 -5.292 6.309 -1.361 76 HE3 MET 10 HE3 MET 10 -4.273 5.504 -2.554 77 H SER 11 HN SER 11 -8.751 7.452 -6.746 78 HA SER 11 HA SER 11 -9.864 5.770 -8.811 79 HB2 SER 11 HB2 SER 11 -9.096 7.832 -10.225 80 HB3 SER 11 HB1 SER 11 -10.473 7.977 -9.134 81 HG SER 11 HG SER 11 -7.885 9.033 -8.923 82 H TYR 12 HN TYR 12 -8.420 6.163 -11.038 83 HA TYR 12 HA TYR 12 -6.569 4.078 -10.710 84 HB2 TYR 12 HB2 TYR 12 -6.882 3.816 -12.895 85 HB3 TYR 12 HB1 TYR 12 -7.973 5.192 -12.823 86 HD1 TYR 12 HD1 TYR 12 -4.486 4.198 -13.530 87 HD2 TYR 12 HD2 TYR 12 -7.470 7.184 -13.994 88 HE1 TYR 12 HE1 TYR 12 -3.056 5.355 -15.173 89 HE2 TYR 12 HE2 TYR 12 -6.050 8.362 -15.621 90 HH TYR 12 HH TYR 12 -3.812 8.539 -16.337 91 H GLU 13 HN GLU 13 -5.846 7.467 -11.730 92 HA GLU 13 HA GLU 13 -3.083 7.124 -11.552 93 HB2 GLU 13 HB2 GLU 13 -3.162 9.747 -11.329 94 HB3 GLU 13 HB1 GLU 13 -3.669 8.989 -12.831 95 HG2 GLU 13 HG2 GLU 13 -5.093 10.839 -12.141 96 HG3 GLU 13 HG1 GLU 13 -5.952 9.319 -12.336 97 H GLU 14 HN GLU 14 -5.403 7.589 -9.059 98 HA GLU 14 HA GLU 14 -3.505 8.474 -7.123 99 HB2 GLU 14 HB2 GLU 14 -6.315 7.463 -7.004 100 HB3 GLU 14 HB1 GLU 14 -5.387 7.670 -5.525 101 HG2 GLU 14 HG2 GLU 14 -4.975 10.060 -6.355 102 HG3 GLU 14 HG1 GLU 14 -6.270 9.747 -7.505 103 H LYS 15 HN LYS 15 -5.088 5.370 -7.850 104 HA LYS 15 HA LYS 15 -3.699 3.776 -6.029 105 HB2 LYS 15 HB2 LYS 15 -4.755 3.091 -8.769 106 HB3 LYS 15 HB1 LYS 15 -4.090 1.898 -7.659 107 HG2 LYS 15 HG2 LYS 15 -5.847 2.013 -6.227 108 HG3 LYS 15 HG1 LYS 15 -6.269 3.651 -6.719 109 HD2 LYS 15 HD2 LYS 15 -7.422 2.976 -8.537 110 HD3 LYS 15 HD1 LYS 15 -6.442 1.529 -8.769 111 HE2 LYS 15 HE2 LYS 15 -7.494 0.539 -6.795 112 HE3 LYS 15 HE1 LYS 15 -8.529 1.956 -6.632 113 HZ1 LYS 15 HZ1 LYS 15 -9.400 1.444 -8.871 114 HZ2 LYS 15 HZ2 LYS 15 -9.717 0.222 -7.749 115 HZ3 LYS 15 HZ3 LYS 15 -8.480 0.019 -8.890 116 H ARG 16 HN ARG 16 -2.774 4.907 -9.252 117 HA ARG 16 HA ARG 16 -0.356 3.470 -9.454 118 HB2 ARG 16 HB2 ARG 16 -1.388 4.689 -11.360 119 HB3 ARG 16 HB1 ARG 16 -0.928 6.201 -10.594 120 HG2 ARG 16 HG2 ARG 16 1.442 5.378 -10.656 121 HG3 ARG 16 HG1 ARG 16 0.869 4.083 -11.691 122 HD2 ARG 16 HD2 ARG 16 1.788 5.924 -12.995 123 HD3 ARG 16 HD1 ARG 16 0.073 5.708 -13.285 124 HE ARG 16 HE ARG 16 0.791 7.684 -11.293 125 HH11 ARG 16 HH11 ARG 16 -0.085 7.056 -14.622 126 HH12 ARG 16 HH12 ARG 16 -0.624 8.676 -14.921 127 HH21 ARG 16 HH21 ARG 16 0.059 9.811 -11.672 128 HH22 ARG 16 HH22 ARG 16 -0.536 10.247 -13.243 129 H GLN 17 HN GLN 17 -0.979 6.791 -8.349 130 HA GLN 17 HA GLN 17 1.593 7.447 -7.541 131 HB2 GLN 17 HB2 GLN 17 -0.392 8.987 -7.672 132 HB3 GLN 17 HB1 GLN 17 -0.949 8.299 -6.155 133 HG2 GLN 17 HG2 GLN 17 0.145 10.327 -5.637 134 HG3 GLN 17 HG1 GLN 17 1.218 9.019 -5.140 135 HE21 GLN 17 HE21 GLN 17 0.688 11.575 -7.426 136 HE22 GLN 17 HE22 GLN 17 2.297 11.615 -8.055 137 H LEU 18 HN LEU 18 -0.988 5.836 -5.830 138 HA LEU 18 HA LEU 18 0.148 5.484 -3.316 139 HB2 LEU 18 HB2 LEU 18 -2.198 4.916 -4.379 140 HB3 LEU 18 HB1 LEU 18 -1.470 3.355 -4.628 141 HG LEU 18 HG LEU 18 -2.122 4.699 -2.031 142 HD11 LEU 18 HD11 LEU 18 -3.300 2.479 -1.773 143 HD12 LEU 18 HD12 LEU 18 -2.996 2.232 -3.484 144 HD13 LEU 18 HD13 LEU 18 -3.971 3.598 -2.948 145 HD21 LEU 18 HD21 LEU 18 -0.163 3.747 -1.339 146 HD22 LEU 18 HD22 LEU 18 -0.201 2.499 -2.579 147 HD23 LEU 18 HD23 LEU 18 -1.247 2.368 -1.166 148 H SER 19 HN SER 19 0.229 3.310 -6.138 149 HA SER 19 HA SER 19 1.803 1.330 -4.918 150 HB2 SER 19 HB2 SER 19 1.807 0.284 -6.985 151 HB3 SER 19 HB1 SER 19 0.406 1.343 -7.142 152 HG SER 19 HG SER 19 1.830 2.883 -8.168 153 H LEU 20 HN LEU 20 2.572 4.386 -6.220 154 HA LEU 20 HA LEU 20 5.392 3.840 -6.563 155 HB2 LEU 20 HB2 LEU 20 3.791 6.365 -6.840 156 HB3 LEU 20 HB1 LEU 20 5.484 6.221 -7.244 157 HG LEU 20 HG LEU 20 3.179 4.856 -8.591 158 HD11 LEU 20 HD11 LEU 20 3.646 7.233 -9.095 159 HD12 LEU 20 HD12 LEU 20 3.752 6.155 -10.481 160 HD13 LEU 20 HD13 LEU 20 5.222 6.745 -9.702 161 HD21 LEU 20 HD21 LEU 20 5.005 3.302 -8.442 162 HD22 LEU 20 HD22 LEU 20 6.129 4.514 -9.056 163 HD23 LEU 20 HD23 LEU 20 4.850 3.885 -10.097 164 H ASP 21 HN ASP 21 3.248 5.446 -4.274 165 HA ASP 21 HA ASP 21 5.412 6.429 -2.655 166 HB2 ASP 21 HB2 ASP 21 3.716 7.130 -1.071 167 HB3 ASP 21 HB1 ASP 21 3.336 7.654 -2.685 168 H ILE 22 HN ILE 22 3.369 3.575 -2.659 169 HA ILE 22 HA ILE 22 4.352 2.416 -0.298 170 HB ILE 22 HB ILE 22 3.034 1.452 -2.755 171 HG12 ILE 22 HG12 ILE 22 2.581 0.856 0.155 172 HG13 ILE 22 HG11 ILE 22 1.852 2.208 -0.704 173 HG21 ILE 22 HG21 ILE 22 4.401 -0.477 -0.914 174 HG22 ILE 22 HG22 ILE 22 4.853 -0.154 -2.582 175 HG23 ILE 22 HG23 ILE 22 3.296 -0.892 -2.216 176 HD11 ILE 22 HD11 ILE 22 1.455 -0.689 -1.430 177 HD12 ILE 22 HD12 ILE 22 0.632 0.709 -2.118 178 HD13 ILE 22 HD13 ILE 22 0.352 0.263 -0.437 179 H ASN 23 HN ASN 23 5.600 2.479 -3.590 180 HA ASN 23 HA ASN 23 7.686 0.617 -3.150 181 HB2 ASN 23 HB2 ASN 23 6.786 1.231 -5.381 182 HB3 ASN 23 HB1 ASN 23 7.512 2.820 -5.204 183 HD21 ASN 23 HD21 ASN 23 9.728 3.054 -5.468 184 HD22 ASN 23 HD22 ASN 23 10.728 1.789 -6.093 185 H LYS 24 HN LYS 24 7.255 3.891 -2.292 186 HA LYS 24 HA LYS 24 10.022 4.618 -2.090 187 HB2 LYS 24 HB2 LYS 24 7.431 5.824 -1.242 188 HB3 LYS 24 HB1 LYS 24 8.936 6.475 -0.614 189 HG2 LYS 24 HG2 LYS 24 9.678 7.003 -2.851 190 HG3 LYS 24 HG1 LYS 24 8.252 6.226 -3.539 191 HD2 LYS 24 HD2 LYS 24 6.812 7.887 -2.719 192 HD3 LYS 24 HD1 LYS 24 8.014 8.494 -1.585 193 HE2 LYS 24 HE2 LYS 24 8.199 8.703 -4.595 194 HE3 LYS 24 HE1 LYS 24 7.684 9.990 -3.502 195 HZ1 LYS 24 HZ1 LYS 24 10.000 10.235 -4.101 196 HZ2 LYS 24 HZ2 LYS 24 10.352 8.688 -3.520 197 HZ3 LYS 24 HZ3 LYS 24 9.865 9.900 -2.448 198 H LEU 25 HN LEU 25 7.756 2.946 -0.116 199 HA LEU 25 HA LEU 25 8.970 3.466 2.410 200 HB2 LEU 25 HB2 LEU 25 7.111 1.291 1.478 201 HB3 LEU 25 HB1 LEU 25 7.662 1.451 3.135 202 HG LEU 25 HG LEU 25 5.849 3.281 1.594 203 HD11 LEU 25 HD11 LEU 25 5.684 1.915 4.250 204 HD12 LEU 25 HD12 LEU 25 4.883 1.372 2.775 205 HD13 LEU 25 HD13 LEU 25 4.417 2.900 3.529 206 HD21 LEU 25 HD21 LEU 25 7.223 3.836 4.198 207 HD22 LEU 25 HD22 LEU 25 5.943 4.816 3.491 208 HD23 LEU 25 HD23 LEU 25 7.508 4.691 2.688 209 HA PRO 26 HA PRO 26 12.358 0.551 2.140 210 HB2 PRO 26 HB2 PRO 26 12.946 0.458 4.797 211 HB3 PRO 26 HB1 PRO 26 13.454 1.786 3.749 212 HG2 PRO 26 HG2 PRO 26 11.163 1.633 5.658 213 HG3 PRO 26 HG1 PRO 26 12.254 2.989 5.339 214 HD2 PRO 26 HD2 PRO 26 9.734 2.829 4.312 215 HD3 PRO 26 HD1 PRO 26 11.061 3.669 3.484 216 H GLY 27 HN GLY 27 12.854 -1.602 2.992 217 HA2 GLY 27 HA2 GLY 27 10.790 -3.360 2.690 218 HA3 GLY 27 HA1 GLY 27 12.271 -3.757 3.536 219 H GLU 28 HN GLU 28 12.105 -2.354 5.836 220 HA GLU 28 HA GLU 28 10.344 -3.970 7.326 221 HB2 GLU 28 HB2 GLU 28 10.996 -2.098 9.140 222 HB3 GLU 28 HB1 GLU 28 12.028 -3.453 8.717 223 HG2 GLU 28 HG2 GLU 28 12.220 -0.770 7.400 224 HG3 GLU 28 HG1 GLU 28 13.105 -1.194 8.857 225 H LYS 29 HN LYS 29 10.096 -0.599 6.281 226 HA LYS 29 HA LYS 29 7.744 -0.100 7.852 227 HB2 LYS 29 HB2 LYS 29 9.349 1.401 5.873 228 HB3 LYS 29 HB1 LYS 29 7.659 1.856 5.995 229 HG2 LYS 29 HG2 LYS 29 9.097 3.258 7.379 230 HG3 LYS 29 HG1 LYS 29 7.937 2.355 8.350 231 HD2 LYS 29 HD2 LYS 29 9.533 1.100 9.344 232 HD3 LYS 29 HD1 LYS 29 10.589 1.111 7.924 233 HE2 LYS 29 HE2 LYS 29 11.560 2.377 9.779 234 HE3 LYS 29 HE1 LYS 29 11.212 3.420 8.401 235 HZ1 LYS 29 HZ1 LYS 29 9.550 3.144 10.851 236 HZ2 LYS 29 HZ2 LYS 29 9.178 4.127 9.527 237 HZ3 LYS 29 HZ3 LYS 29 10.543 4.459 10.467 238 H LEU 30 HN LEU 30 8.436 -1.282 4.655 239 HA LEU 30 HA LEU 30 5.710 -0.917 3.797 240 HB2 LEU 30 HB2 LEU 30 6.710 -0.789 1.854 241 HB3 LEU 30 HB1 LEU 30 8.224 -1.352 2.520 242 HG LEU 30 HG LEU 30 6.091 -3.251 1.601 243 HD11 LEU 30 HD11 LEU 30 8.093 -1.723 0.076 244 HD12 LEU 30 HD12 LEU 30 6.426 -2.078 -0.340 245 HD13 LEU 30 HD13 LEU 30 7.660 -3.335 -0.451 246 HD21 LEU 30 HD21 LEU 30 7.959 -4.082 3.041 247 HD22 LEU 30 HD22 LEU 30 9.078 -3.552 1.786 248 HD23 LEU 30 HD23 LEU 30 7.902 -4.816 1.440 249 H GLY 31 HN GLY 31 7.439 -3.298 5.500 250 HA2 GLY 31 HA2 GLY 31 5.753 -5.521 5.037 251 HA3 GLY 31 HA1 GLY 31 6.616 -5.198 6.528 252 H ARG 32 HN ARG 32 5.183 -2.476 6.576 253 HA ARG 32 HA ARG 32 2.892 -3.218 8.098 254 HB2 ARG 32 HB2 ARG 32 3.992 -1.024 8.419 255 HB3 ARG 32 HB1 ARG 32 3.514 -0.575 6.793 256 HG2 ARG 32 HG2 ARG 32 1.759 0.396 7.845 257 HG3 ARG 32 HG1 ARG 32 1.091 -1.227 7.698 258 HD2 ARG 32 HD2 ARG 32 1.330 -1.695 9.945 259 HD3 ARG 32 HD1 ARG 32 2.657 -0.525 10.141 260 HE ARG 32 HE ARG 32 -0.200 0.162 9.851 261 HH11 ARG 32 HH11 ARG 32 3.006 0.877 11.080 262 HH12 ARG 32 HH12 ARG 32 2.484 2.269 11.970 263 HH21 ARG 32 HH21 ARG 32 -0.883 1.982 11.013 264 HH22 ARG 32 HH22 ARG 32 0.268 2.904 11.928 265 H VAL 33 HN VAL 33 3.259 -1.852 4.808 266 HA VAL 33 HA VAL 33 0.516 -1.666 4.269 267 HB VAL 33 HB VAL 33 1.643 -2.304 1.797 268 HG11 VAL 33 HG11 VAL 33 1.121 0.291 3.207 269 HG12 VAL 33 HG12 VAL 33 0.070 -0.567 2.079 270 HG13 VAL 33 HG13 VAL 33 1.548 0.190 1.505 271 HG21 VAL 33 HG21 VAL 33 3.498 -0.407 3.182 272 HG22 VAL 33 HG22 VAL 33 3.672 -1.152 1.589 273 HG23 VAL 33 HG23 VAL 33 3.865 -2.128 3.046 274 H VAL 34 HN VAL 34 2.775 -4.282 3.511 275 HA VAL 34 HA VAL 34 1.021 -6.207 2.588 276 HB VAL 34 HB VAL 34 2.677 -7.709 2.888 277 HG11 VAL 34 HG11 VAL 34 3.917 -5.803 2.127 278 HG12 VAL 34 HG12 VAL 34 4.907 -6.794 3.194 279 HG13 VAL 34 HG13 VAL 34 4.198 -5.295 3.790 280 HG21 VAL 34 HG21 VAL 34 2.149 -8.080 5.241 281 HG22 VAL 34 HG22 VAL 34 3.215 -6.740 5.677 282 HG23 VAL 34 HG23 VAL 34 3.883 -8.187 4.920 283 H HIS 35 HN HIS 35 1.594 -5.252 5.969 284 HA HIS 35 HA HIS 35 -0.069 -7.287 7.061 285 HB2 HIS 35 HB2 HIS 35 1.708 -6.298 8.400 286 HB3 HIS 35 HB1 HIS 35 0.947 -4.713 8.290 287 HD1 HIS 35 HD1 HIS 35 0.448 -8.110 9.879 288 HD2 HIS 35 HD2 HIS 35 -1.023 -4.227 10.159 289 HE1 HIS 35 HE1 HIS 35 -1.018 -8.085 11.920 290 HE2 HIS 35 HE2 HIS 35 -2.055 -5.791 11.944 291 H ILE 36 HN ILE 36 -0.546 -3.797 6.494 292 HA ILE 36 HA ILE 36 -3.184 -3.602 7.390 293 HB ILE 36 HB ILE 36 -1.892 -2.140 5.068 294 HG12 ILE 36 HG12 ILE 36 -2.278 -1.217 7.913 295 HG13 ILE 36 HG11 ILE 36 -0.800 -1.974 7.347 296 HG21 ILE 36 HG21 ILE 36 -3.707 -0.734 4.950 297 HG22 ILE 36 HG22 ILE 36 -4.121 -0.978 6.650 298 HG23 ILE 36 HG23 ILE 36 -4.516 -2.218 5.464 299 HD11 ILE 36 HD11 ILE 36 -0.660 -0.134 5.652 300 HD12 ILE 36 HD12 ILE 36 -0.452 0.358 7.329 301 HD13 ILE 36 HD13 ILE 36 -1.980 0.644 6.507 302 H ILE 37 HN ILE 37 -1.882 -4.353 4.221 303 HA ILE 37 HA ILE 37 -4.292 -4.766 2.875 304 HB ILE 37 HB ILE 37 -1.472 -5.610 2.434 305 HG12 ILE 37 HG12 ILE 37 -3.232 -3.963 0.660 306 HG13 ILE 37 HG11 ILE 37 -2.436 -3.268 2.058 307 HG21 ILE 37 HG21 ILE 37 -3.815 -6.827 1.269 308 HG22 ILE 37 HG22 ILE 37 -2.122 -7.330 1.195 309 HG23 ILE 37 HG23 ILE 37 -2.737 -6.136 0.055 310 HD11 ILE 37 HD11 ILE 37 -1.090 -2.813 0.196 311 HD12 ILE 37 HD12 ILE 37 -1.158 -4.497 -0.338 312 HD13 ILE 37 HD13 ILE 37 -0.277 -4.072 1.128 313 H GLN 38 HN GLN 38 -2.044 -7.317 4.051 314 HA GLN 38 HA GLN 38 -3.669 -9.509 3.650 315 HB2 GLN 38 HB2 GLN 38 -1.686 -9.017 5.879 316 HB3 GLN 38 HB1 GLN 38 -2.429 -10.578 5.568 317 HG2 GLN 38 HG2 GLN 38 -1.402 -10.616 3.349 318 HG3 GLN 38 HG1 GLN 38 -0.685 -9.042 3.670 319 HE21 GLN 38 HE21 GLN 38 -1.004 -11.532 6.090 320 HE22 GLN 38 HE22 GLN 38 0.682 -11.873 6.234 321 H SER 39 HN SER 39 -3.847 -7.209 6.328 322 HA SER 39 HA SER 39 -5.612 -8.886 7.877 323 HB2 SER 39 HB2 SER 39 -5.759 -6.921 9.391 324 HB3 SER 39 HB1 SER 39 -4.098 -7.369 9.032 325 HG SER 39 HG SER 39 -3.906 -5.649 7.683 326 H ARG 40 HN ARG 40 -5.958 -5.882 6.010 327 HA ARG 40 HA ARG 40 -8.790 -5.756 6.402 328 HB2 ARG 40 HB2 ARG 40 -6.961 -4.297 4.481 329 HB3 ARG 40 HB1 ARG 40 -8.666 -3.923 4.696 330 HG2 ARG 40 HG2 ARG 40 -8.273 -3.382 6.993 331 HG3 ARG 40 HG1 ARG 40 -6.583 -3.841 6.863 332 HD2 ARG 40 HD2 ARG 40 -6.415 -1.581 6.621 333 HD3 ARG 40 HD1 ARG 40 -6.620 -2.056 4.938 334 HE ARG 40 HE ARG 40 -9.064 -1.543 5.336 335 HH11 ARG 40 HH11 ARG 40 -6.497 0.057 7.101 336 HH12 ARG 40 HH12 ARG 40 -7.443 1.464 7.453 337 HH21 ARG 40 HH21 ARG 40 -10.327 0.293 5.867 338 HH22 ARG 40 HH22 ARG 40 -9.606 1.609 6.737 339 H GLU 41 HN GLU 41 -6.658 -7.212 4.161 340 HA GLU 41 HA GLU 41 -8.913 -8.198 2.545 341 HB2 GLU 41 HB2 GLU 41 -6.012 -8.358 1.773 342 HB3 GLU 41 HB1 GLU 41 -7.430 -8.478 0.739 343 HG2 GLU 41 HG2 GLU 41 -6.580 -5.973 2.153 344 HG3 GLU 41 HG1 GLU 41 -6.115 -6.396 0.505 345 HA PRO 42 HA PRO 42 -7.133 -11.586 5.191 346 HB2 PRO 42 HB2 PRO 42 -9.420 -12.839 5.840 347 HB3 PRO 42 HB1 PRO 42 -8.902 -11.371 6.658 348 HG2 PRO 42 HG2 PRO 42 -10.892 -11.674 4.447 349 HG3 PRO 42 HG1 PRO 42 -11.026 -10.733 5.944 350 HD2 PRO 42 HD2 PRO 42 -10.356 -9.622 3.575 351 HD3 PRO 42 HD1 PRO 42 -9.740 -9.007 5.123 352 H SER 43 HN SER 43 -9.076 -11.484 2.441 353 HA SER 43 HA SER 43 -9.124 -14.151 1.614 354 HB2 SER 43 HB2 SER 43 -8.804 -11.738 -0.181 355 HB3 SER 43 HB1 SER 43 -9.559 -13.282 -0.582 356 HG SER 43 HG SER 43 -11.205 -12.812 0.891 357 H LEU 44 HN LEU 44 -6.534 -11.791 1.657 358 HA LEU 44 HA LEU 44 -4.847 -13.709 0.205 359 HB2 LEU 44 HB2 LEU 44 -3.358 -11.816 -0.320 360 HB3 LEU 44 HB1 LEU 44 -4.957 -11.623 -0.970 361 HG LEU 44 HG LEU 44 -5.212 -10.220 1.307 362 HD11 LEU 44 HD11 LEU 44 -3.159 -8.814 1.427 363 HD12 LEU 44 HD12 LEU 44 -2.335 -10.036 0.462 364 HD13 LEU 44 HD13 LEU 44 -2.972 -10.450 2.054 365 HD21 LEU 44 HD21 LEU 44 -5.838 -9.443 -0.880 366 HD22 LEU 44 HD22 LEU 44 -4.148 -9.307 -1.360 367 HD23 LEU 44 HD23 LEU 44 -4.802 -8.236 -0.122 368 H LYS 45 HN LYS 45 -5.561 -13.597 3.133 369 HA LYS 45 HA LYS 45 -3.133 -13.029 4.527 370 HB2 LYS 45 HB2 LYS 45 -4.103 -14.109 6.417 371 HB3 LYS 45 HB1 LYS 45 -5.384 -13.214 5.617 372 HG2 LYS 45 HG2 LYS 45 -6.213 -15.269 4.611 373 HG3 LYS 45 HG1 LYS 45 -4.902 -16.174 5.373 374 HD2 LYS 45 HD2 LYS 45 -6.866 -14.565 6.979 375 HD3 LYS 45 HD1 LYS 45 -7.178 -16.240 6.520 376 HE2 LYS 45 HE2 LYS 45 -6.207 -16.522 8.585 377 HE3 LYS 45 HE1 LYS 45 -4.811 -16.653 7.516 378 HZ1 LYS 45 HZ1 LYS 45 -5.598 -14.142 8.886 379 HZ2 LYS 45 HZ2 LYS 45 -4.165 -14.442 8.039 380 HZ3 LYS 45 HZ3 LYS 45 -4.462 -15.231 9.499 381 H ASN 46 HN ASN 46 -4.041 -15.482 2.384 382 HA ASN 46 HA ASN 46 -2.375 -17.586 3.320 383 HB2 ASN 46 HB2 ASN 46 -2.572 -18.393 0.896 384 HB3 ASN 46 HB1 ASN 46 -4.098 -18.158 1.745 385 HD21 ASN 46 HD21 ASN 46 -5.259 -17.907 -0.125 386 HD22 ASN 46 HD22 ASN 46 -5.130 -16.503 -1.136 387 H SER 47 HN SER 47 -1.764 -14.588 1.901 388 HA SER 47 HA SER 47 0.685 -15.341 0.572 389 HB2 SER 47 HB2 SER 47 -0.593 -12.644 1.047 390 HB3 SER 47 HB1 SER 47 0.824 -12.922 0.030 391 HG SER 47 HG SER 47 -1.610 -14.310 -0.397 392 H ASN 48 HN ASN 48 2.739 -14.834 1.223 393 HA ASN 48 HA ASN 48 3.111 -14.513 4.074 394 HB2 ASN 48 HB2 ASN 48 5.120 -14.826 1.837 395 HB3 ASN 48 HB1 ASN 48 5.516 -14.828 3.548 396 HD21 ASN 48 HD21 ASN 48 3.198 -16.340 4.357 397 HD22 ASN 48 HD22 ASN 48 3.458 -17.967 3.833 398 HA PRO 49 HA PRO 49 3.451 -10.175 4.092 399 HB2 PRO 49 HB2 PRO 49 5.138 -9.869 6.238 400 HB3 PRO 49 HB1 PRO 49 3.413 -10.216 6.357 401 HG2 PRO 49 HG2 PRO 49 5.726 -12.086 6.554 402 HG3 PRO 49 HG1 PRO 49 4.241 -12.021 7.521 403 HD2 PRO 49 HD2 PRO 49 4.561 -13.816 5.550 404 HD3 PRO 49 HD1 PRO 49 2.982 -13.081 5.899 405 H ASP 50 HN ASP 50 6.367 -12.089 3.889 406 HA ASP 50 HA ASP 50 7.934 -9.745 3.146 407 HB2 ASP 50 HB2 ASP 50 8.677 -12.640 3.540 408 HB3 ASP 50 HB1 ASP 50 9.798 -11.456 2.878 409 H GLU 51 HN GLU 51 5.769 -11.600 1.590 410 HA GLU 51 HA GLU 51 7.091 -11.163 -0.990 411 HB2 GLU 51 HB2 GLU 51 5.746 -13.772 -0.247 412 HB3 GLU 51 HB1 GLU 51 6.403 -13.366 -1.823 413 HG2 GLU 51 HG2 GLU 51 8.658 -13.184 -0.727 414 HG3 GLU 51 HG1 GLU 51 7.915 -13.842 0.729 415 H ILE 52 HN ILE 52 4.977 -9.821 0.475 416 HA ILE 52 HA ILE 52 2.445 -10.683 -0.397 417 HB ILE 52 HB ILE 52 3.126 -9.002 1.514 418 HG12 ILE 52 HG12 ILE 52 0.793 -8.253 1.574 419 HG13 ILE 52 HG11 ILE 52 0.583 -8.736 -0.099 420 HG21 ILE 52 HG21 ILE 52 2.466 -7.194 -0.791 421 HG22 ILE 52 HG22 ILE 52 3.993 -7.259 0.086 422 HG23 ILE 52 HG23 ILE 52 2.532 -6.692 0.895 423 HD11 ILE 52 HD11 ILE 52 1.288 -10.578 2.131 424 HD12 ILE 52 HD12 ILE 52 0.867 -11.024 0.480 425 HD13 ILE 52 HD13 ILE 52 -0.346 -10.308 1.540 426 H GLU 53 HN GLU 53 1.049 -9.827 -1.859 427 HA GLU 53 HA GLU 53 2.328 -8.405 -4.110 428 HB2 GLU 53 HB2 GLU 53 1.637 -10.878 -4.468 429 HB3 GLU 53 HB1 GLU 53 -0.019 -10.308 -4.347 430 HG2 GLU 53 HG2 GLU 53 0.544 -10.549 -6.636 431 HG3 GLU 53 HG1 GLU 53 0.427 -8.826 -6.300 432 H ILE 54 HN ILE 54 1.687 -6.345 -3.458 433 HA ILE 54 HA ILE 54 -0.908 -5.767 -2.465 434 HB ILE 54 HB ILE 54 1.084 -3.890 -3.744 435 HG12 ILE 54 HG12 ILE 54 0.786 -4.756 -0.866 436 HG13 ILE 54 HG11 ILE 54 2.178 -5.001 -1.912 437 HG21 ILE 54 HG21 ILE 54 -1.161 -3.343 -1.832 438 HG22 ILE 54 HG22 ILE 54 -1.180 -3.002 -3.558 439 HG23 ILE 54 HG23 ILE 54 -0.049 -2.154 -2.502 440 HD11 ILE 54 HD11 ILE 54 2.654 -3.184 -0.413 441 HD12 ILE 54 HD12 ILE 54 1.150 -2.393 -0.850 442 HD13 ILE 54 HD13 ILE 54 2.444 -2.541 -2.037 443 H ASP 55 HN ASP 55 -2.560 -6.271 -3.800 444 HA ASP 55 HA ASP 55 -2.442 -5.384 -6.597 445 HB2 ASP 55 HB2 ASP 55 -3.000 -7.772 -6.231 446 HB3 ASP 55 HB1 ASP 55 -4.386 -7.286 -5.257 447 H PHE 56 HN PHE 56 -3.102 -3.341 -6.707 448 HA PHE 56 HA PHE 56 -4.725 -2.160 -4.711 449 HB2 PHE 56 HB2 PHE 56 -3.787 -1.068 -7.349 450 HB3 PHE 56 HB1 PHE 56 -4.521 -0.113 -6.065 451 HD1 PHE 56 HD1 PHE 56 -3.344 0.087 -3.893 452 HD2 PHE 56 HD2 PHE 56 -1.495 -1.664 -7.274 453 HE1 PHE 56 HE1 PHE 56 -1.190 0.378 -2.817 454 HE2 PHE 56 HE2 PHE 56 0.693 -1.373 -6.203 455 HZ PHE 56 HZ PHE 56 0.846 -0.347 -3.961 456 H GLU 57 HN GLU 57 -5.625 -3.962 -7.374 457 HA GLU 57 HA GLU 57 -8.077 -2.500 -7.892 458 HB2 GLU 57 HB2 GLU 57 -6.909 -5.052 -8.993 459 HB3 GLU 57 HB1 GLU 57 -8.510 -4.473 -9.446 460 HG2 GLU 57 HG2 GLU 57 -5.926 -2.974 -9.841 461 HG3 GLU 57 HG1 GLU 57 -6.792 -3.874 -11.084 462 H THR 58 HN THR 58 -6.974 -5.375 -6.221 463 HA THR 58 HA THR 58 -9.703 -6.045 -5.467 464 HB THR 58 HB THR 58 -8.606 -7.971 -4.266 465 HG1 THR 58 HG1 THR 58 -6.309 -7.132 -5.740 466 HG21 THR 58 HG21 THR 58 -8.093 -7.675 -7.227 467 HG22 THR 58 HG22 THR 58 -9.580 -8.259 -6.475 468 HG23 THR 58 HG23 THR 58 -8.095 -9.202 -6.342 469 H LEU 59 HN LEU 59 -6.900 -4.453 -4.168 470 HA LEU 59 HA LEU 59 -7.574 -4.468 -1.441 471 HB2 LEU 59 HB2 LEU 59 -6.213 -2.326 -3.035 472 HB3 LEU 59 HB1 LEU 59 -6.313 -2.377 -1.295 473 HG LEU 59 HG LEU 59 -4.927 -4.386 -3.045 474 HD11 LEU 59 HD11 LEU 59 -3.848 -2.412 -1.058 475 HD12 LEU 59 HD12 LEU 59 -3.745 -2.266 -2.812 476 HD13 LEU 59 HD13 LEU 59 -2.921 -3.584 -1.984 477 HD21 LEU 59 HD21 LEU 59 -5.500 -4.317 -0.096 478 HD22 LEU 59 HD22 LEU 59 -4.143 -5.222 -0.777 479 HD23 LEU 59 HD23 LEU 59 -5.788 -5.618 -1.261 480 H LYS 60 HN LYS 60 -9.192 -3.593 -0.387 481 HA LYS 60 HA LYS 60 -11.227 -2.164 -1.750 482 HB2 LYS 60 HB2 LYS 60 -10.725 -2.760 1.158 483 HB3 LYS 60 HB1 LYS 60 -12.126 -1.844 0.615 484 HG2 LYS 60 HG2 LYS 60 -12.878 -3.732 -0.707 485 HG3 LYS 60 HG1 LYS 60 -11.424 -4.630 -0.274 486 HD2 LYS 60 HD2 LYS 60 -13.112 -3.597 1.934 487 HD3 LYS 60 HD1 LYS 60 -13.728 -4.962 1.004 488 HE2 LYS 60 HE2 LYS 60 -12.485 -5.704 2.974 489 HE3 LYS 60 HE1 LYS 60 -11.705 -6.225 1.483 490 HZ1 LYS 60 HZ1 LYS 60 -10.196 -5.334 3.234 491 HZ2 LYS 60 HZ2 LYS 60 -10.877 -3.807 2.985 492 HZ3 LYS 60 HZ3 LYS 60 -10.043 -4.580 1.726 493 HA PRO 61 HA PRO 61 -9.946 2.064 -1.782 494 HB2 PRO 61 HB2 PRO 61 -12.553 2.467 -0.368 495 HB3 PRO 61 HB1 PRO 61 -11.853 3.373 -1.713 496 HG2 PRO 61 HG2 PRO 61 -13.745 1.540 -2.122 497 HG3 PRO 61 HG1 PRO 61 -12.421 1.796 -3.266 498 HD2 PRO 61 HD2 PRO 61 -12.906 -0.465 -1.430 499 HD3 PRO 61 HD1 PRO 61 -11.937 -0.408 -2.914 500 H SER 62 HN SER 62 -11.458 0.855 1.166 501 HA SER 62 HA SER 62 -10.490 2.786 2.948 502 HB2 SER 62 HB2 SER 62 -11.064 1.136 4.693 503 HB3 SER 62 HB1 SER 62 -12.333 1.144 3.465 504 HG SER 62 HG SER 62 -11.968 -0.921 3.441 505 H THR 63 HN THR 63 -9.099 -0.397 2.027 506 HA THR 63 HA THR 63 -6.802 -0.171 3.653 507 HB THR 63 HB THR 63 -6.697 -1.592 1.001 508 HG1 THR 63 HG1 THR 63 -7.928 -3.272 1.839 509 HG21 THR 63 HG21 THR 63 -4.748 -2.246 1.955 510 HG22 THR 63 HG22 THR 63 -5.762 -3.268 2.980 511 HG23 THR 63 HG23 THR 63 -5.264 -1.677 3.547 512 H LEU 64 HN LEU 64 -7.428 0.702 0.275 513 HA LEU 64 HA LEU 64 -4.847 1.464 -0.442 514 HB2 LEU 64 HB2 LEU 64 -7.491 2.536 -1.399 515 HB3 LEU 64 HB1 LEU 64 -5.962 2.825 -2.190 516 HG LEU 64 HG LEU 64 -7.141 0.085 -1.782 517 HD11 LEU 64 HD11 LEU 64 -7.708 2.174 -3.726 518 HD12 LEU 64 HD12 LEU 64 -8.622 0.719 -3.328 519 HD13 LEU 64 HD13 LEU 64 -7.264 0.631 -4.453 520 HD21 LEU 64 HD21 LEU 64 -4.763 1.189 -3.237 521 HD22 LEU 64 HD22 LEU 64 -5.512 -0.334 -3.724 522 HD23 LEU 64 HD23 LEU 64 -4.847 -0.158 -2.100 523 H ARG 65 HN ARG 65 -7.468 3.451 0.915 524 HA ARG 65 HA ARG 65 -5.978 5.851 0.932 525 HB2 ARG 65 HB2 ARG 65 -8.371 4.968 2.528 526 HB3 ARG 65 HB1 ARG 65 -7.683 6.583 2.630 527 HG2 ARG 65 HG2 ARG 65 -8.780 5.316 0.128 528 HG3 ARG 65 HG1 ARG 65 -9.620 6.486 1.135 529 HD2 ARG 65 HD2 ARG 65 -7.878 8.139 0.699 530 HD3 ARG 65 HD1 ARG 65 -7.024 6.976 -0.311 531 HE ARG 65 HE ARG 65 -9.699 7.367 -1.204 532 HH11 ARG 65 HH11 ARG 65 -6.521 8.854 -1.198 533 HH12 ARG 65 HH12 ARG 65 -6.751 9.647 -2.727 534 HH21 ARG 65 HH21 ARG 65 -10.004 8.464 -3.209 535 HH22 ARG 65 HH22 ARG 65 -8.713 9.435 -3.855 536 H GLU 66 HN GLU 66 -6.218 3.179 3.183 537 HA GLU 66 HA GLU 66 -4.796 4.441 5.300 538 HB2 GLU 66 HB2 GLU 66 -6.164 2.510 5.766 539 HB3 GLU 66 HB1 GLU 66 -5.265 1.534 4.614 540 HG2 GLU 66 HG2 GLU 66 -4.614 0.937 6.832 541 HG3 GLU 66 HG1 GLU 66 -3.269 1.750 6.032 542 H LEU 67 HN LEU 67 -3.803 2.013 2.865 543 HA LEU 67 HA LEU 67 -1.091 1.905 3.293 544 HB2 LEU 67 HB2 LEU 67 -2.240 2.080 0.492 545 HB3 LEU 67 HB1 LEU 67 -0.870 1.131 1.061 546 HG LEU 67 HG LEU 67 -3.724 0.585 1.849 547 HD11 LEU 67 HD11 LEU 67 -2.181 -1.207 0.094 548 HD12 LEU 67 HD12 LEU 67 -2.842 0.260 -0.629 549 HD13 LEU 67 HD13 LEU 67 -3.915 -0.901 0.155 550 HD21 LEU 67 HD21 LEU 67 -1.400 -0.185 3.082 551 HD22 LEU 67 HD22 LEU 67 -1.740 -1.534 2.007 552 HD23 LEU 67 HD23 LEU 67 -2.946 -1.023 3.186 553 H GLU 68 HN GLU 68 -2.786 4.240 1.188 554 HA GLU 68 HA GLU 68 -0.582 5.786 0.446 555 HB2 GLU 68 HB2 GLU 68 -2.817 5.955 -0.595 556 HB3 GLU 68 HB1 GLU 68 -3.439 6.685 0.876 557 HG2 GLU 68 HG2 GLU 68 -1.725 8.503 0.542 558 HG3 GLU 68 HG1 GLU 68 -1.473 7.833 -1.070 559 H ARG 69 HN ARG 69 -3.002 6.595 2.957 560 HA ARG 69 HA ARG 69 -1.686 8.822 4.007 561 HB2 ARG 69 HB2 ARG 69 -3.734 6.919 4.990 562 HB3 ARG 69 HB1 ARG 69 -3.050 8.058 6.136 563 HG2 ARG 69 HG2 ARG 69 -3.998 9.146 3.560 564 HG3 ARG 69 HG1 ARG 69 -5.224 8.577 4.693 565 HD2 ARG 69 HD2 ARG 69 -4.734 10.972 4.958 566 HD3 ARG 69 HD1 ARG 69 -4.364 10.040 6.408 567 HE ARG 69 HE ARG 69 -2.149 10.516 4.593 568 HH11 ARG 69 HH11 ARG 69 -3.888 11.583 7.434 569 HH12 ARG 69 HH12 ARG 69 -2.520 12.402 8.119 570 HH21 ARG 69 HH21 ARG 69 -0.344 11.582 5.490 571 HH22 ARG 69 HH22 ARG 69 -0.504 12.414 7.006 572 H TYR 70 HN TYR 70 -1.157 5.444 4.568 573 HA TYR 70 HA TYR 70 0.334 5.743 6.970 574 HB2 TYR 70 HB2 TYR 70 -0.546 3.573 6.548 575 HB3 TYR 70 HB1 TYR 70 0.144 3.540 4.929 576 HD1 TYR 70 HD2 TYR 70 1.359 4.053 8.428 577 HD2 TYR 70 HD1 TYR 70 1.947 2.240 4.634 578 HE1 TYR 70 HE2 TYR 70 3.424 3.020 9.264 579 HE2 TYR 70 HE1 TYR 70 4.006 1.198 5.448 580 HH TYR 70 HH TYR 70 5.625 1.369 7.138 581 H VAL 71 HN VAL 71 1.265 5.251 3.556 582 HA VAL 71 HA VAL 71 4.033 5.382 4.020 583 HB VAL 71 HB VAL 71 4.360 5.706 1.696 584 HG11 VAL 71 HG11 VAL 71 2.624 4.188 0.632 585 HG12 VAL 71 HG12 VAL 71 1.960 4.023 2.262 586 HG13 VAL 71 HG13 VAL 71 3.621 3.527 1.927 587 HG21 VAL 71 HG21 VAL 71 2.715 6.449 0.164 588 HG22 VAL 71 HG22 VAL 71 2.902 7.643 1.441 589 HG23 VAL 71 HG23 VAL 71 1.504 6.564 1.431 590 H THR 72 HN THR 72 1.576 7.852 3.583 591 HA THR 72 HA THR 72 3.327 9.947 2.963 592 HB THR 72 HB THR 72 1.524 11.496 3.493 593 HG1 THR 72 HG1 THR 72 0.457 9.231 4.797 594 HG21 THR 72 HG21 THR 72 1.044 9.026 1.930 595 HG22 THR 72 HG22 THR 72 1.254 10.687 1.368 596 HG23 THR 72 HG23 THR 72 -0.275 10.186 2.095 597 H SER 73 HN SER 73 2.451 8.477 5.970 598 HA SER 73 HA SER 73 3.366 10.558 7.673 599 HB2 SER 73 HB2 SER 73 3.096 9.011 9.448 600 HB3 SER 73 HB1 SER 73 1.856 8.574 8.267 601 HG SER 73 HG SER 73 3.162 6.877 7.572 602 H CYS 74 HN CYS 74 4.883 8.089 5.819 603 HA CYS 74 HA CYS 74 7.473 8.477 7.147 604 HB2 CYS 74 HB2 CYS 74 6.875 6.165 6.866 605 HB3 CYS 74 HB1 CYS 74 6.534 6.415 5.156 606 HG CYS 74 HG CYS 74 9.537 7.366 5.349 607 H LEU 75 HN LEU 75 5.781 9.244 4.245 608 HA LEU 75 HA LEU 75 8.253 9.831 2.800 609 HB2 LEU 75 HB2 LEU 75 5.416 9.725 1.807 610 HB3 LEU 75 HB1 LEU 75 6.843 9.861 0.821 611 HG LEU 75 HG LEU 75 5.925 7.486 2.394 612 HD11 LEU 75 HD11 LEU 75 5.044 8.049 0.074 613 HD12 LEU 75 HD12 LEU 75 5.727 6.439 0.312 614 HD13 LEU 75 HD13 LEU 75 6.670 7.685 -0.499 615 HD21 LEU 75 HD21 LEU 75 7.965 6.370 1.834 616 HD22 LEU 75 HD22 LEU 75 8.376 7.856 2.679 617 HD23 LEU 75 HD23 LEU 75 8.544 7.763 0.927 618 H ARG 76 HN ARG 76 5.089 11.319 3.421 619 HA ARG 76 HA ARG 76 6.066 13.806 2.306 620 HB2 ARG 76 HB2 ARG 76 3.311 13.040 3.239 621 HB3 ARG 76 HB1 ARG 76 3.735 14.528 2.388 622 HG2 ARG 76 HG2 ARG 76 4.573 13.160 0.513 623 HG3 ARG 76 HG1 ARG 76 4.027 11.727 1.374 624 HD2 ARG 76 HD2 ARG 76 1.752 12.635 1.331 625 HD3 ARG 76 HD1 ARG 76 2.320 13.944 0.296 626 HE ARG 76 HE ARG 76 3.183 11.796 -1.038 627 HH11 ARG 76 HH11 ARG 76 0.012 12.576 0.240 628 HH12 ARG 76 HH12 ARG 76 -0.814 11.521 -0.862 629 HH21 ARG 76 HH21 ARG 76 2.104 10.386 -2.438 630 HH22 ARG 76 HH22 ARG 76 0.376 10.257 -2.374 631 H LYS 77 HN LYS 77 5.758 12.282 5.237 632 HA LYS 77 HA LYS 77 6.635 14.743 6.589 633 HB2 LYS 77 HB2 LYS 77 4.444 13.887 7.487 634 HB3 LYS 77 HB1 LYS 77 5.236 12.360 7.845 635 HG2 LYS 77 HG2 LYS 77 6.679 13.424 9.451 636 HG3 LYS 77 HG1 LYS 77 6.025 15.008 9.032 637 HD2 LYS 77 HD2 LYS 77 3.813 14.293 9.812 638 HD3 LYS 77 HD1 LYS 77 4.479 12.717 10.243 639 HE2 LYS 77 HE2 LYS 77 5.400 15.346 11.397 640 HE3 LYS 77 HE1 LYS 77 4.241 14.267 12.170 641 HZ1 LYS 77 HZ1 LYS 77 6.477 13.957 13.034 642 HZ2 LYS 77 HZ2 LYS 77 7.045 13.572 11.491 643 HZ3 LYS 77 HZ3 LYS 77 5.934 12.558 12.258 644 H LYS 78 HN LYS 78 8.716 14.615 7.149 645 HA LYS 78 HA LYS 78 10.833 13.804 7.510 646 HB2 LYS 78 HB2 LYS 78 9.794 12.166 9.069 647 HB3 LYS 78 HB1 LYS 78 9.535 11.073 7.723 648 HG2 LYS 78 HG2 LYS 78 11.442 10.271 8.808 649 HG3 LYS 78 HG1 LYS 78 12.052 11.126 7.392 650 HD2 LYS 78 HD2 LYS 78 13.465 11.854 9.083 651 HD3 LYS 78 HD1 LYS 78 12.268 13.144 8.994 652 HE2 LYS 78 HE2 LYS 78 12.214 10.860 10.967 653 HE3 LYS 78 HE1 LYS 78 12.817 12.478 11.314 654 HZ1 LYS 78 HZ1 LYS 78 10.568 13.322 10.774 655 HZ2 LYS 78 HZ2 LYS 78 10.600 12.302 12.120 656 HZ3 LYS 78 HZ3 LYS 78 10.026 11.723 10.641 657 H ARG 79 HN ARG 79 12.521 12.727 6.271 658 HA ARG 79 HA ARG 79 11.642 11.414 3.826 659 HB2 ARG 79 HB2 ARG 79 13.277 12.735 2.481 660 HB3 ARG 79 HB1 ARG 79 11.907 13.660 3.064 661 HG2 ARG 79 HG2 ARG 79 13.648 15.108 3.427 662 HG3 ARG 79 HG1 ARG 79 13.504 14.324 4.999 663 HD2 ARG 79 HD2 ARG 79 15.833 14.489 4.341 664 HD3 ARG 79 HD1 ARG 79 15.328 12.802 4.399 665 HE ARG 79 HE ARG 79 14.961 13.481 1.797 666 HH11 ARG 79 HH11 ARG 79 17.663 13.684 4.004 667 HH12 ARG 79 HH12 ARG 79 18.863 13.536 2.761 668 HH21 ARG 79 HH21 ARG 79 16.528 13.270 0.151 669 HH22 ARG 79 HH22 ARG 79 18.216 13.308 0.560 670 H LYS 80 HN LYS 80 13.021 9.894 3.040 671 HA LYS 80 HA LYS 80 14.564 8.247 3.118 672 HB2 LYS 80 HB2 LYS 80 16.258 10.516 4.156 673 HB3 LYS 80 HB1 LYS 80 16.904 8.921 3.801 674 HG2 LYS 80 HG2 LYS 80 15.546 10.735 1.821 675 HG3 LYS 80 HG1 LYS 80 17.288 10.495 1.977 676 HD2 LYS 80 HD2 LYS 80 16.940 8.082 1.500 677 HD3 LYS 80 HD1 LYS 80 15.233 8.423 1.213 678 HE2 LYS 80 HE2 LYS 80 15.851 9.966 -0.582 679 HE3 LYS 80 HE1 LYS 80 17.554 9.604 -0.303 680 HZ1 LYS 80 HZ1 LYS 80 16.724 8.324 -2.142 681 HZ2 LYS 80 HZ2 LYS 80 15.478 7.682 -1.199 682 HZ3 LYS 80 HZ3 LYS 80 17.083 7.282 -0.859 683 HA PRO 81 HA PRO 81 13.915 7.320 7.596 684 HB2 PRO 81 HB2 PRO 81 12.422 5.113 7.240 685 HB3 PRO 81 HB1 PRO 81 11.709 6.730 7.174 686 HG2 PRO 81 HG2 PRO 81 12.530 4.932 4.926 687 HG3 PRO 81 HG1 PRO 81 11.057 5.902 5.097 688 HD2 PRO 81 HD2 PRO 81 13.207 6.681 3.613 689 HD3 PRO 81 HD1 PRO 81 12.099 7.825 4.395 690 H GLN 82 HN GLN 82 16.299 6.945 6.461 691 HA GLN 82 HA GLN 82 16.896 4.147 6.015 692 HB2 GLN 82 HB2 GLN 82 17.984 5.969 4.723 693 HB3 GLN 82 HB1 GLN 82 18.752 6.532 6.199 694 HG2 GLN 82 HG2 GLN 82 20.291 5.239 4.843 695 HG3 GLN 82 HG1 GLN 82 19.971 4.435 6.379 696 HE21 GLN 82 HE21 GLN 82 19.456 4.357 2.941 697 HE22 GLN 82 HE22 GLN 82 18.924 2.714 2.860 698 H ALA 83 HN ALA 83 16.768 6.282 8.647 699 HA ALA 83 HA ALA 83 17.237 6.105 10.852 700 HB1 ALA 83 HB1 ALA 83 17.776 3.197 10.257 701 HB2 ALA 83 HB2 ALA 83 16.209 3.889 10.678 702 HB3 ALA 83 HB3 ALA 83 17.527 3.906 11.853 703 H1 VAL 201 HT1 VAL 201 -4.522 1.309 -16.463 704 H2 VAL 201 HT2 VAL 201 -5.140 0.156 -17.531 705 H3 VAL 201 HT3 VAL 201 -3.468 0.344 -17.364 706 HA VAL 201 HA VAL 201 -5.328 -0.615 -15.275 707 HB VAL 201 HB VAL 201 -4.077 -2.751 -15.463 708 HG11 VAL 201 HG11 VAL 201 -5.142 -3.524 -17.522 709 HG12 VAL 201 HG12 VAL 201 -5.408 -1.852 -18.013 710 HG13 VAL 201 HG13 VAL 201 -6.220 -2.492 -16.585 711 HG21 VAL 201 HG21 VAL 201 -2.706 -3.187 -17.444 712 HG22 VAL 201 HG22 VAL 201 -2.014 -1.901 -16.454 713 HG23 VAL 201 HG23 VAL 201 -2.880 -1.503 -17.936 714 H VAL 202 HN VAL 202 -4.425 -1.026 -13.263 715 HA VAL 202 HA VAL 202 -1.949 0.419 -12.728 716 HB VAL 202 HB VAL 202 -3.900 -0.834 -10.782 717 HG11 VAL 202 HG11 VAL 202 -2.735 0.534 -9.095 718 HG12 VAL 202 HG12 VAL 202 -1.573 1.032 -10.322 719 HG13 VAL 202 HG13 VAL 202 -1.671 -0.660 -9.835 720 HG21 VAL 202 HG21 VAL 202 -3.541 2.067 -11.515 721 HG22 VAL 202 HG22 VAL 202 -4.708 1.405 -10.372 722 HG23 VAL 202 HG23 VAL 202 -4.851 1.039 -12.092 723 HA PRO 203 HA PRO 203 0.294 -3.482 -12.667 724 HB2 PRO 203 HB2 PRO 203 2.649 -2.381 -11.830 725 HB3 PRO 203 HB1 PRO 203 2.110 -2.370 -13.513 726 HG2 PRO 203 HG2 PRO 203 1.921 -0.212 -11.448 727 HG3 PRO 203 HG1 PRO 203 2.380 -0.089 -13.157 728 HD2 PRO 203 HD2 PRO 203 -0.076 0.579 -12.300 729 HD3 PRO 203 HD1 PRO 203 0.187 -0.184 -13.885 730 H LYS 204 HN LYS 204 0.422 -4.914 -11.064 731 HA LYS 204 HA LYS 204 -0.048 -4.149 -8.344 732 HB2 LYS 204 HB2 LYS 204 0.165 -6.567 -7.879 733 HB3 LYS 204 HB1 LYS 204 -0.955 -6.240 -9.195 734 HG2 LYS 204 HG2 LYS 204 0.752 -6.845 -10.818 735 HG3 LYS 204 HG1 LYS 204 1.900 -7.140 -9.512 736 HD2 LYS 204 HD2 LYS 204 0.316 -8.860 -8.625 737 HD3 LYS 204 HD1 LYS 204 -0.648 -8.641 -10.086 738 HE2 LYS 204 HE2 LYS 204 0.884 -10.569 -10.235 739 HE3 LYS 204 HE1 LYS 204 1.205 -9.346 -11.462 740 HZ1 LYS 204 HZ1 LYS 204 3.110 -8.632 -10.350 741 HZ2 LYS 204 HZ2 LYS 204 3.188 -10.317 -10.234 742 HZ3 LYS 204 HZ3 LYS 204 2.687 -9.394 -8.901 743 H LYS 205 HN LYS 205 1.404 -4.482 -6.572 744 HA LYS 205 HA LYS 205 4.155 -3.958 -7.403 745 HB2 LYS 205 HB2 LYS 205 2.695 -3.463 -4.819 746 HB3 LYS 205 HB1 LYS 205 4.435 -3.272 -4.973 747 HG2 LYS 205 HG2 LYS 205 2.371 -1.793 -6.581 748 HG3 LYS 205 HG1 LYS 205 3.239 -1.145 -5.189 749 HD2 LYS 205 HD2 LYS 205 4.486 -2.079 -7.777 750 HD3 LYS 205 HD1 LYS 205 4.200 -0.400 -7.325 751 HE2 LYS 205 HE2 LYS 205 5.727 -0.573 -5.486 752 HE3 LYS 205 HE1 LYS 205 5.911 -2.305 -5.746 753 HZ1 LYS 205 HZ1 LYS 205 6.992 -1.900 -7.818 754 HZ2 LYS 205 HZ2 LYS 205 7.768 -0.971 -6.635 755 HZ3 LYS 205 HZ3 LYS 205 6.697 -0.237 -7.720 756 H LYS 206 HN LYS 206 5.507 -5.562 -7.460 757 HA LYS 206 HA LYS 206 5.130 -7.969 -5.928 758 HB2 LYS 206 HB2 LYS 206 7.455 -7.085 -7.651 759 HB3 LYS 206 HB1 LYS 206 7.225 -8.699 -6.993 760 HG2 LYS 206 HG2 LYS 206 5.173 -8.943 -8.298 761 HG3 LYS 206 HG1 LYS 206 5.406 -7.323 -8.958 762 HD2 LYS 206 HD2 LYS 206 6.181 -8.950 -10.559 763 HD3 LYS 206 HD1 LYS 206 7.564 -8.065 -9.915 764 HE2 LYS 206 HE2 LYS 206 8.010 -9.925 -8.369 765 HE3 LYS 206 HE1 LYS 206 6.649 -10.807 -9.058 766 HZ1 LYS 206 HZ1 LYS 206 7.778 -10.784 -11.199 767 HZ2 LYS 206 HZ2 LYS 206 8.730 -11.532 -10.019 768 HZ3 LYS 206 HZ3 LYS 206 9.087 -9.960 -10.517 769 H ILE 207 HN ILE 207 5.473 -7.862 -3.839 770 HA ILE 207 HA ILE 207 7.509 -6.023 -2.805 771 HB ILE 207 HB ILE 207 5.175 -7.322 -1.410 772 HG12 ILE 207 HG12 ILE 207 4.552 -5.705 -3.191 773 HG13 ILE 207 HG11 ILE 207 4.068 -5.194 -1.583 774 HG21 ILE 207 HG21 ILE 207 6.935 -5.072 -0.467 775 HG22 ILE 207 HG22 ILE 207 7.057 -6.741 0.081 776 HG23 ILE 207 HG23 ILE 207 5.599 -5.807 0.416 777 HD11 ILE 207 HD11 ILE 207 6.006 -3.683 -1.506 778 HD12 ILE 207 HD12 ILE 207 4.917 -3.323 -2.845 779 HD13 ILE 207 HD13 ILE 207 6.428 -4.181 -3.147 780 H LYS 208 HN LYS 208 9.280 -7.412 -3.103 781 HA LYS 208 HA LYS 208 9.430 -9.559 -1.103 782 HB2 LYS 208 HB2 LYS 208 10.577 -9.658 -3.904 783 HB3 LYS 208 HB1 LYS 208 10.808 -10.882 -2.663 784 HG2 LYS 208 HG2 LYS 208 8.416 -11.350 -2.660 785 HG3 LYS 208 HG1 LYS 208 8.165 -10.103 -3.883 786 HD2 LYS 208 HD2 LYS 208 8.197 -12.272 -4.939 787 HD3 LYS 208 HD1 LYS 208 9.633 -11.368 -5.418 788 HE2 LYS 208 HE2 LYS 208 10.941 -12.587 -3.732 789 HE3 LYS 208 HE1 LYS 208 9.502 -13.508 -3.295 790 HZ1 LYS 208 HZ1 LYS 208 10.793 -13.499 -5.968 791 HZ2 LYS 208 HZ2 LYS 208 9.433 -14.404 -5.527 792 HZ3 LYS 208 HZ3 LYS 208 10.932 -14.728 -4.814 793 H LYS 209 HN LYS 209 12.079 -10.230 -1.377 794 HA LYS 209 HA LYS 209 13.438 -8.289 0.058 795 HB2 LYS 209 HB2 LYS 209 14.461 -10.536 -1.671 796 HB3 LYS 209 HB1 LYS 209 15.528 -9.522 -0.710 797 HG2 LYS 209 HG2 LYS 209 14.491 -10.235 1.319 798 HG3 LYS 209 HG1 LYS 209 13.235 -11.096 0.433 799 HD2 LYS 209 HD2 LYS 209 14.894 -12.639 -0.451 800 HD3 LYS 209 HD1 LYS 209 16.177 -11.752 0.373 801 HE2 LYS 209 HE2 LYS 209 15.494 -13.798 1.580 802 HE3 LYS 209 HE1 LYS 209 15.258 -12.330 2.527 803 HZ1 LYS 209 HZ1 LYS 209 13.378 -13.895 2.655 804 HZ2 LYS 209 HZ2 LYS 209 13.114 -13.702 0.999 805 HZ3 LYS 209 HZ3 LYS 209 12.926 -12.387 2.044 806 H GLU 210 HN GLU 210 13.431 -8.861 -3.434 807 HA GLU 210 HA GLU 210 14.793 -6.296 -3.824 808 HB2 GLU 210 HB2 GLU 210 14.067 -8.475 -5.792 809 HB3 GLU 210 HB1 GLU 210 14.849 -6.962 -6.229 810 HG2 GLU 210 HG2 GLU 210 16.759 -7.550 -4.810 811 HG3 GLU 210 HG1 GLU 210 15.975 -9.076 -4.403 812 H GLN 211 HN GLN 211 13.021 -5.030 -3.096 813 HA GLN 211 HA GLN 211 10.524 -5.173 -4.570 814 HB2 GLN 211 HB2 GLN 211 9.787 -3.351 -3.076 815 HB3 GLN 211 HB1 GLN 211 10.395 -4.737 -2.180 816 HG2 GLN 211 HG2 GLN 211 12.486 -3.594 -1.771 817 HG3 GLN 211 HG1 GLN 211 11.962 -2.230 -2.754 818 HE21 GLN 211 HE21 GLN 211 10.450 -0.802 -1.935 819 HE22 GLN 211 HE22 GLN 211 10.031 -0.756 -0.256 820 H VAL 212 HN VAL 212 13.440 -3.311 -4.503 821 HA VAL 212 HA VAL 212 12.429 -1.093 -6.000 822 HB VAL 212 HB VAL 212 14.809 -0.457 -6.273 823 HG11 VAL 212 HG11 VAL 212 13.570 0.255 -4.302 824 HG12 VAL 212 HG12 VAL 212 15.257 -0.057 -3.896 825 HG13 VAL 212 HG13 VAL 212 14.015 -1.234 -3.468 826 HG21 VAL 212 HG21 VAL 212 16.551 -1.757 -5.155 827 HG22 VAL 212 HG22 VAL 212 15.772 -2.704 -6.422 828 HG23 VAL 212 HG23 VAL 212 15.368 -2.991 -4.730 829 H GLU 213 HN GLU 213 12.884 -0.576 -8.165 830 HA GLU 213 HA GLU 213 13.094 -2.958 -9.858 831 HB2 GLU 213 HB2 GLU 213 11.077 -1.514 -10.042 832 HB3 GLU 213 HB1 GLU 213 12.107 -0.185 -10.546 833 HG2 GLU 213 HG2 GLU 213 12.742 -1.393 -12.543 834 HG3 GLU 213 HG1 GLU 213 11.794 -2.786 -12.025 Start of MODEL 20 1 H1 SER 1 HT1 SER 1 -21.767 -0.348 5.925 2 H2 SER 1 HT2 SER 1 -23.388 -0.465 5.463 3 H3 SER 1 HT3 SER 1 -22.841 0.912 6.288 4 HA SER 1 HA SER 1 -21.891 0.092 3.609 5 HB2 SER 1 HB2 SER 1 -24.321 0.745 3.664 6 HB3 SER 1 HB1 SER 1 -23.832 2.306 4.325 7 HG SER 1 HG SER 1 -22.360 2.117 2.244 8 H GLU 2 HN GLU 2 -20.727 1.136 6.270 9 HA GLU 2 HA GLU 2 -19.907 3.809 5.468 10 HB2 GLU 2 HB2 GLU 2 -19.590 2.314 8.067 11 HB3 GLU 2 HB1 GLU 2 -19.020 3.948 7.786 12 HG2 GLU 2 HG2 GLU 2 -21.033 4.289 8.863 13 HG3 GLU 2 HG1 GLU 2 -21.470 4.459 7.165 14 H GLU 3 HN GLU 3 -18.704 0.610 5.601 15 HA GLU 3 HA GLU 3 -15.984 1.019 6.023 16 HB2 GLU 3 HB2 GLU 3 -17.317 -1.022 4.233 17 HB3 GLU 3 HB1 GLU 3 -15.659 -1.106 4.811 18 HG2 GLU 3 HG2 GLU 3 -18.121 -1.146 6.543 19 HG3 GLU 3 HG1 GLU 3 -17.158 -2.550 6.089 20 H GLU 4 HN GLU 4 -17.870 1.176 3.040 21 HA GLU 4 HA GLU 4 -15.499 1.924 1.516 22 HB2 GLU 4 HB2 GLU 4 -17.027 0.242 0.581 23 HB3 GLU 4 HB1 GLU 4 -18.341 1.405 0.618 24 HG2 GLU 4 HG2 GLU 4 -17.097 2.813 -0.981 25 HG3 GLU 4 HG1 GLU 4 -15.846 1.572 -1.057 26 H ASP 5 HN ASP 5 -18.257 3.413 3.001 27 HA ASP 5 HA ASP 5 -18.149 5.693 1.204 28 HB2 ASP 5 HB2 ASP 5 -20.337 4.727 2.019 29 HB3 ASP 5 HB1 ASP 5 -19.952 5.424 3.588 30 H LYS 6 HN LYS 6 -17.480 4.967 4.592 31 HA LYS 6 HA LYS 6 -16.876 7.612 5.401 32 HB2 LYS 6 HB2 LYS 6 -17.158 5.329 6.750 33 HB3 LYS 6 HB1 LYS 6 -15.413 5.270 6.564 34 HG2 LYS 6 HG2 LYS 6 -17.001 7.440 7.918 35 HG3 LYS 6 HG1 LYS 6 -16.001 6.219 8.700 36 HD2 LYS 6 HD2 LYS 6 -14.037 7.157 7.485 37 HD3 LYS 6 HD1 LYS 6 -15.086 8.450 6.898 38 HE2 LYS 6 HE2 LYS 6 -13.873 9.232 8.826 39 HE3 LYS 6 HE1 LYS 6 -15.575 9.057 9.246 40 HZ1 LYS 6 HZ1 LYS 6 -14.170 8.178 10.984 41 HZ2 LYS 6 HZ2 LYS 6 -13.416 7.126 9.897 42 HZ3 LYS 6 HZ3 LYS 6 -15.052 6.924 10.273 43 H CYS 7 HN CYS 7 -15.000 4.986 4.058 44 HA CYS 7 HA CYS 7 -12.528 6.427 3.979 45 HB2 CYS 7 HB2 CYS 7 -13.402 3.886 2.581 46 HB3 CYS 7 HB1 CYS 7 -11.737 4.460 2.731 47 HG CYS 7 HG CYS 7 -13.683 2.886 4.973 48 H LYS 8 HN LYS 8 -11.625 7.493 2.244 49 HA LYS 8 HA LYS 8 -13.515 8.394 0.237 50 HB2 LYS 8 HB2 LYS 8 -10.734 9.209 1.013 51 HB3 LYS 8 HB1 LYS 8 -11.364 9.669 -0.559 52 HG2 LYS 8 HG2 LYS 8 -11.670 11.456 1.017 53 HG3 LYS 8 HG1 LYS 8 -13.225 10.815 0.496 54 HD2 LYS 8 HD2 LYS 8 -13.339 9.502 2.596 55 HD3 LYS 8 HD1 LYS 8 -11.812 10.224 3.100 56 HE2 LYS 8 HE2 LYS 8 -14.360 11.726 2.517 57 HE3 LYS 8 HE1 LYS 8 -13.745 11.339 4.122 58 HZ1 LYS 8 HZ1 LYS 8 -13.160 13.574 3.576 59 HZ2 LYS 8 HZ2 LYS 8 -12.466 13.106 2.110 60 HZ3 LYS 8 HZ3 LYS 8 -11.744 12.650 3.571 61 HA PRO 9 HA PRO 9 -12.515 5.426 -2.767 62 HB2 PRO 9 HB2 PRO 9 -13.399 6.743 -4.978 63 HB3 PRO 9 HB1 PRO 9 -14.483 6.008 -3.793 64 HG2 PRO 9 HG2 PRO 9 -13.670 8.865 -4.105 65 HG3 PRO 9 HG1 PRO 9 -15.262 8.188 -3.722 66 HD2 PRO 9 HD2 PRO 9 -13.608 9.254 -1.838 67 HD3 PRO 9 HD1 PRO 9 -14.751 7.949 -1.477 68 H MET 10 HN MET 10 -10.703 4.915 -3.856 69 HA MET 10 HA MET 10 -8.881 7.094 -4.530 70 HB2 MET 10 HB2 MET 10 -8.092 5.228 -3.052 71 HB3 MET 10 HB1 MET 10 -8.282 4.135 -4.419 72 HG2 MET 10 HG2 MET 10 -6.066 4.615 -4.599 73 HG3 MET 10 HG1 MET 10 -6.741 5.899 -5.607 74 HE1 MET 10 HE1 MET 10 -5.452 4.847 -2.234 75 HE2 MET 10 HE2 MET 10 -6.730 5.844 -1.550 76 HE3 MET 10 HE3 MET 10 -5.042 6.334 -1.387 77 H SER 11 HN SER 11 -8.461 7.597 -6.628 78 HA SER 11 HA SER 11 -9.825 6.050 -8.675 79 HB2 SER 11 HB2 SER 11 -9.142 8.006 -10.142 80 HB3 SER 11 HB1 SER 11 -10.219 8.392 -8.803 81 HG SER 11 HG SER 11 -8.642 9.433 -7.798 82 H TYR 12 HN TYR 12 -8.488 6.208 -10.937 83 HA TYR 12 HA TYR 12 -6.543 4.193 -10.678 84 HB2 TYR 12 HB2 TYR 12 -7.241 3.952 -12.789 85 HB3 TYR 12 HB1 TYR 12 -7.922 5.574 -12.805 86 HD1 TYR 12 HD1 TYR 12 -4.678 3.774 -13.240 87 HD2 TYR 12 HD2 TYR 12 -7.038 7.163 -14.233 88 HE1 TYR 12 HE1 TYR 12 -2.984 4.460 -14.883 89 HE2 TYR 12 HE2 TYR 12 -5.351 7.863 -15.872 90 HH TYR 12 HH TYR 12 -2.967 7.549 -16.302 91 H GLU 13 HN GLU 13 -6.141 7.616 -11.569 92 HA GLU 13 HA GLU 13 -3.374 7.772 -11.755 93 HB2 GLU 13 HB2 GLU 13 -5.459 9.707 -10.733 94 HB3 GLU 13 HB1 GLU 13 -3.776 10.172 -10.877 95 HG2 GLU 13 HG2 GLU 13 -5.366 9.095 -13.191 96 HG3 GLU 13 HG1 GLU 13 -5.327 10.813 -12.784 97 H GLU 14 HN GLU 14 -5.433 7.649 -8.972 98 HA GLU 14 HA GLU 14 -3.478 8.515 -7.093 99 HB2 GLU 14 HB2 GLU 14 -6.244 7.429 -6.919 100 HB3 GLU 14 HB1 GLU 14 -5.302 7.811 -5.482 101 HG2 GLU 14 HG2 GLU 14 -5.794 9.788 -7.680 102 HG3 GLU 14 HG1 GLU 14 -6.882 9.588 -6.351 103 H LYS 15 HN LYS 15 -5.126 5.433 -7.768 104 HA LYS 15 HA LYS 15 -3.742 3.803 -5.990 105 HB2 LYS 15 HB2 LYS 15 -4.878 3.176 -8.705 106 HB3 LYS 15 HB1 LYS 15 -4.172 1.951 -7.657 107 HG2 LYS 15 HG2 LYS 15 -5.883 2.011 -6.175 108 HG3 LYS 15 HG1 LYS 15 -6.317 3.670 -6.570 109 HD2 LYS 15 HD2 LYS 15 -7.556 3.078 -8.359 110 HD3 LYS 15 HD1 LYS 15 -6.564 1.669 -8.728 111 HE2 LYS 15 HE2 LYS 15 -7.512 0.555 -6.746 112 HE3 LYS 15 HE1 LYS 15 -8.591 1.926 -6.508 113 HZ1 LYS 15 HZ1 LYS 15 -9.675 0.106 -7.686 114 HZ2 LYS 15 HZ2 LYS 15 -8.511 0.168 -8.914 115 HZ3 LYS 15 HZ3 LYS 15 -9.566 1.473 -8.673 116 H ARG 16 HN ARG 16 -2.854 4.897 -9.233 117 HA ARG 16 HA ARG 16 -0.458 3.427 -9.486 118 HB2 ARG 16 HB2 ARG 16 -1.471 4.590 -11.392 119 HB3 ARG 16 HB1 ARG 16 -1.132 6.137 -10.630 120 HG2 ARG 16 HG2 ARG 16 1.281 5.459 -10.638 121 HG3 ARG 16 HG1 ARG 16 0.820 4.150 -11.709 122 HD2 ARG 16 HD2 ARG 16 1.621 6.004 -13.005 123 HD3 ARG 16 HD1 ARG 16 -0.106 5.820 -13.242 124 HE ARG 16 HE ARG 16 1.034 7.827 -11.419 125 HH11 ARG 16 HH11 ARG 16 -1.142 6.929 -13.999 126 HH12 ARG 16 HH12 ARG 16 -1.985 8.452 -13.995 127 HH21 ARG 16 HH21 ARG 16 -0.038 9.831 -11.417 128 HH22 ARG 16 HH22 ARG 16 -1.358 10.107 -12.521 129 H GLN 17 HN GLN 17 -0.995 6.781 -8.411 130 HA GLN 17 HA GLN 17 1.611 7.366 -7.649 131 HB2 GLN 17 HB2 GLN 17 -0.265 8.996 -7.815 132 HB3 GLN 17 HB1 GLN 17 -0.904 8.349 -6.310 133 HG2 GLN 17 HG2 GLN 17 0.283 10.328 -5.782 134 HG3 GLN 17 HG1 GLN 17 1.248 8.963 -5.226 135 HE21 GLN 17 HE21 GLN 17 2.030 11.701 -5.893 136 HE22 GLN 17 HE22 GLN 17 3.261 11.555 -7.097 137 H LEU 18 HN LEU 18 -0.962 5.774 -5.934 138 HA LEU 18 HA LEU 18 0.179 5.496 -3.394 139 HB2 LEU 18 HB2 LEU 18 -2.183 4.931 -4.430 140 HB3 LEU 18 HB1 LEU 18 -1.475 3.351 -4.624 141 HG LEU 18 HG LEU 18 -2.048 4.807 -2.065 142 HD11 LEU 18 HD11 LEU 18 -3.251 2.551 -1.755 143 HD12 LEU 18 HD12 LEU 18 -3.115 2.430 -3.503 144 HD13 LEU 18 HD13 LEU 18 -3.975 3.784 -2.775 145 HD21 LEU 18 HD21 LEU 18 -0.141 3.792 -1.358 146 HD22 LEU 18 HD22 LEU 18 -0.216 2.536 -2.590 147 HD23 LEU 18 HD23 LEU 18 -1.257 2.444 -1.170 148 H SER 19 HN SER 19 0.208 3.266 -6.165 149 HA SER 19 HA SER 19 1.787 1.305 -4.939 150 HB2 SER 19 HB2 SER 19 1.822 0.256 -7.017 151 HB3 SER 19 HB1 SER 19 0.368 1.243 -7.111 152 HG SER 19 HG SER 19 1.756 2.867 -8.152 153 H LEU 20 HN LEU 20 2.562 4.328 -6.334 154 HA LEU 20 HA LEU 20 5.374 3.770 -6.658 155 HB2 LEU 20 HB2 LEU 20 3.778 6.293 -6.948 156 HB3 LEU 20 HB1 LEU 20 5.475 6.160 -7.330 157 HG LEU 20 HG LEU 20 3.187 4.808 -8.713 158 HD11 LEU 20 HD11 LEU 20 3.704 7.171 -9.227 159 HD12 LEU 20 HD12 LEU 20 3.839 6.083 -10.604 160 HD13 LEU 20 HD13 LEU 20 5.291 6.659 -9.784 161 HD21 LEU 20 HD21 LEU 20 4.940 3.199 -8.549 162 HD22 LEU 20 HD22 LEU 20 6.141 4.379 -9.074 163 HD23 LEU 20 HD23 LEU 20 4.899 3.822 -10.197 164 H ASP 21 HN ASP 21 3.268 5.433 -4.362 165 HA ASP 21 HA ASP 21 5.446 6.410 -2.758 166 HB2 ASP 21 HB2 ASP 21 3.775 7.112 -1.164 167 HB3 ASP 21 HB1 ASP 21 3.361 7.618 -2.774 168 H ILE 22 HN ILE 22 3.406 3.551 -2.713 169 HA ILE 22 HA ILE 22 4.406 2.423 -0.350 170 HB ILE 22 HB ILE 22 3.080 1.432 -2.789 171 HG12 ILE 22 HG12 ILE 22 2.644 0.825 0.125 172 HG13 ILE 22 HG11 ILE 22 1.929 2.198 -0.713 173 HG21 ILE 22 HG21 ILE 22 4.483 -0.485 -0.951 174 HG22 ILE 22 HG22 ILE 22 4.904 -0.167 -2.629 175 HG23 ILE 22 HG23 ILE 22 3.358 -0.912 -2.235 176 HD11 ILE 22 HD11 ILE 22 1.481 -0.679 -1.472 177 HD12 ILE 22 HD12 ILE 22 0.671 0.740 -2.133 178 HD13 ILE 22 HD13 ILE 22 0.402 0.275 -0.456 179 H ASN 23 HN ASN 23 5.635 2.504 -3.637 180 HA ASN 23 HA ASN 23 7.744 0.666 -3.254 181 HB2 ASN 23 HB2 ASN 23 6.822 1.362 -5.461 182 HB3 ASN 23 HB1 ASN 23 7.551 2.941 -5.231 183 HD21 ASN 23 HD21 ASN 23 9.752 3.188 -5.530 184 HD22 ASN 23 HD22 ASN 23 10.751 1.941 -6.192 185 H LYS 24 HN LYS 24 7.288 3.941 -2.370 186 HA LYS 24 HA LYS 24 10.045 4.673 -2.146 187 HB2 LYS 24 HB2 LYS 24 7.441 5.887 -1.359 188 HB3 LYS 24 HB1 LYS 24 8.931 6.547 -0.702 189 HG2 LYS 24 HG2 LYS 24 9.727 7.073 -2.902 190 HG3 LYS 24 HG1 LYS 24 8.356 6.246 -3.644 191 HD2 LYS 24 HD2 LYS 24 6.829 7.874 -2.856 192 HD3 LYS 24 HD1 LYS 24 8.024 8.575 -1.767 193 HE2 LYS 24 HE2 LYS 24 8.205 8.618 -4.784 194 HE3 LYS 24 HE1 LYS 24 7.615 9.944 -3.781 195 HZ1 LYS 24 HZ1 LYS 24 9.799 9.997 -2.695 196 HZ2 LYS 24 HZ2 LYS 24 9.905 10.298 -4.355 197 HZ3 LYS 24 HZ3 LYS 24 10.348 8.786 -3.743 198 H LEU 25 HN LEU 25 7.823 2.948 -0.193 199 HA LEU 25 HA LEU 25 8.933 3.573 2.350 200 HB2 LEU 25 HB2 LEU 25 7.236 1.267 1.421 201 HB3 LEU 25 HB1 LEU 25 7.727 1.499 3.087 202 HG LEU 25 HG LEU 25 5.844 3.164 1.453 203 HD11 LEU 25 HD11 LEU 25 5.709 1.897 4.160 204 HD12 LEU 25 HD12 LEU 25 4.987 1.235 2.693 205 HD13 LEU 25 HD13 LEU 25 4.395 2.756 3.367 206 HD21 LEU 25 HD21 LEU 25 7.123 3.903 4.060 207 HD22 LEU 25 HD22 LEU 25 5.807 4.776 3.282 208 HD23 LEU 25 HD23 LEU 25 7.397 4.712 2.522 209 HA PRO 26 HA PRO 26 12.460 0.789 2.356 210 HB2 PRO 26 HB2 PRO 26 12.859 0.850 5.065 211 HB3 PRO 26 HB1 PRO 26 13.465 2.082 3.958 212 HG2 PRO 26 HG2 PRO 26 11.092 2.144 5.753 213 HG3 PRO 26 HG1 PRO 26 12.197 3.452 5.310 214 HD2 PRO 26 HD2 PRO 26 9.697 3.145 4.241 215 HD3 PRO 26 HD1 PRO 26 11.035 3.950 3.398 216 H GLY 27 HN GLY 27 12.971 -1.287 3.436 217 HA2 GLY 27 HA2 GLY 27 10.943 -3.082 2.949 218 HA3 GLY 27 HA1 GLY 27 12.385 -3.457 3.866 219 H GLU 28 HN GLU 28 12.099 -2.185 6.206 220 HA GLU 28 HA GLU 28 10.283 -3.924 7.486 221 HB2 GLU 28 HB2 GLU 28 11.072 -2.935 9.545 222 HB3 GLU 28 HB1 GLU 28 12.381 -3.185 8.426 223 HG2 GLU 28 HG2 GLU 28 13.032 -1.185 8.965 224 HG3 GLU 28 HG1 GLU 28 11.773 -0.660 7.869 225 H LYS 29 HN LYS 29 10.123 -0.579 6.611 226 HA LYS 29 HA LYS 29 7.670 -0.002 7.982 227 HB2 LYS 29 HB2 LYS 29 9.401 1.371 6.038 228 HB3 LYS 29 HB1 LYS 29 7.704 1.771 5.897 229 HG2 LYS 29 HG2 LYS 29 8.873 3.374 7.283 230 HG3 LYS 29 HG1 LYS 29 7.675 2.500 8.230 231 HD2 LYS 29 HD2 LYS 29 9.209 1.596 9.564 232 HD3 LYS 29 HD1 LYS 29 10.342 1.303 8.237 233 HE2 LYS 29 HE2 LYS 29 11.238 2.906 9.848 234 HE3 LYS 29 HE1 LYS 29 10.993 3.655 8.272 235 HZ1 LYS 29 HZ1 LYS 29 9.262 3.929 10.667 236 HZ2 LYS 29 HZ2 LYS 29 8.876 4.550 9.144 237 HZ3 LYS 29 HZ3 LYS 29 10.231 5.127 9.971 238 H LEU 30 HN LEU 30 8.502 -1.443 4.923 239 HA LEU 30 HA LEU 30 5.833 -1.052 3.893 240 HB2 LEU 30 HB2 LEU 30 6.890 -1.068 1.992 241 HB3 LEU 30 HB1 LEU 30 8.379 -1.578 2.742 242 HG LEU 30 HG LEU 30 6.255 -3.446 1.675 243 HD11 LEU 30 HD11 LEU 30 7.842 -1.803 0.242 244 HD12 LEU 30 HD12 LEU 30 7.276 -3.372 -0.323 245 HD13 LEU 30 HD13 LEU 30 8.881 -3.217 0.387 246 HD21 LEU 30 HD21 LEU 30 7.698 -4.406 3.459 247 HD22 LEU 30 HD22 LEU 30 9.113 -4.000 2.488 248 HD23 LEU 30 HD23 LEU 30 7.937 -5.171 1.888 249 H GLY 31 HN GLY 31 7.390 -3.398 5.799 250 HA2 GLY 31 HA2 GLY 31 5.702 -5.609 5.221 251 HA3 GLY 31 HA1 GLY 31 6.510 -5.321 6.746 252 H ARG 32 HN ARG 32 5.135 -2.577 6.785 253 HA ARG 32 HA ARG 32 2.786 -3.369 8.189 254 HB2 ARG 32 HB2 ARG 32 3.891 -1.333 8.840 255 HB3 ARG 32 HB1 ARG 32 3.643 -0.641 7.250 256 HG2 ARG 32 HG2 ARG 32 1.584 0.023 7.757 257 HG3 ARG 32 HG1 ARG 32 1.174 -1.523 8.501 258 HD2 ARG 32 HD2 ARG 32 2.891 0.543 9.829 259 HD3 ARG 32 HD1 ARG 32 1.137 0.490 10.027 260 HE ARG 32 HE ARG 32 2.511 -1.980 10.630 261 HH11 ARG 32 HH11 ARG 32 1.344 1.070 11.885 262 HH12 ARG 32 HH12 ARG 32 1.291 0.520 13.529 263 HH21 ARG 32 HH21 ARG 32 2.447 -2.713 12.785 264 HH22 ARG 32 HH22 ARG 32 1.914 -1.641 14.041 265 H VAL 33 HN VAL 33 3.316 -1.939 4.946 266 HA VAL 33 HA VAL 33 0.579 -1.669 4.331 267 HB VAL 33 HB VAL 33 1.743 -2.325 1.890 268 HG11 VAL 33 HG11 VAL 33 1.244 0.274 3.299 269 HG12 VAL 33 HG12 VAL 33 0.228 -0.540 2.107 270 HG13 VAL 33 HG13 VAL 33 1.751 0.189 1.617 271 HG21 VAL 33 HG21 VAL 33 3.635 -0.467 3.267 272 HG22 VAL 33 HG22 VAL 33 3.817 -1.286 1.713 273 HG23 VAL 33 HG23 VAL 33 3.943 -2.203 3.215 274 H VAL 34 HN VAL 34 2.809 -4.324 3.592 275 HA VAL 34 HA VAL 34 1.024 -6.205 2.625 276 HB VAL 34 HB VAL 34 2.679 -7.720 2.872 277 HG11 VAL 34 HG11 VAL 34 3.954 -5.799 2.217 278 HG12 VAL 34 HG12 VAL 34 4.913 -6.855 3.253 279 HG13 VAL 34 HG13 VAL 34 4.215 -5.374 3.906 280 HG21 VAL 34 HG21 VAL 34 2.120 -8.225 5.181 281 HG22 VAL 34 HG22 VAL 34 3.144 -6.890 5.718 282 HG23 VAL 34 HG23 VAL 34 3.865 -8.283 4.909 283 H HIS 35 HN HIS 35 1.594 -5.293 6.009 284 HA HIS 35 HA HIS 35 -0.089 -7.302 7.104 285 HB2 HIS 35 HB2 HIS 35 1.653 -6.289 8.462 286 HB3 HIS 35 HB1 HIS 35 0.915 -4.704 8.285 287 HD1 HIS 35 HD1 HIS 35 0.334 -8.032 9.980 288 HD2 HIS 35 HD2 HIS 35 -1.041 -4.113 10.122 289 HE1 HIS 35 HE1 HIS 35 -1.132 -7.905 12.016 290 HE2 HIS 35 HE2 HIS 35 -1.803 -5.480 12.177 291 H ILE 36 HN ILE 36 -0.565 -3.829 6.471 292 HA ILE 36 HA ILE 36 -3.212 -3.626 7.352 293 HB ILE 36 HB ILE 36 -1.885 -2.152 5.056 294 HG12 ILE 36 HG12 ILE 36 -2.277 -1.246 7.905 295 HG13 ILE 36 HG11 ILE 36 -0.809 -2.032 7.354 296 HG21 ILE 36 HG21 ILE 36 -3.670 -0.688 4.985 297 HG22 ILE 36 HG22 ILE 36 -4.142 -1.038 6.652 298 HG23 ILE 36 HG23 ILE 36 -4.494 -2.199 5.378 299 HD11 ILE 36 HD11 ILE 36 -0.621 -0.179 5.661 300 HD12 ILE 36 HD12 ILE 36 -0.398 0.282 7.344 301 HD13 ILE 36 HD13 ILE 36 -1.918 0.620 6.533 302 H ILE 37 HN ILE 37 -1.864 -4.429 4.221 303 HA ILE 37 HA ILE 37 -4.283 -4.741 2.835 304 HB ILE 37 HB ILE 37 -1.477 -5.627 2.380 305 HG12 ILE 37 HG12 ILE 37 -3.170 -3.855 0.668 306 HG13 ILE 37 HG11 ILE 37 -2.389 -3.238 2.114 307 HG21 ILE 37 HG21 ILE 37 -3.845 -6.724 1.155 308 HG22 ILE 37 HG22 ILE 37 -2.164 -7.259 1.044 309 HG23 ILE 37 HG23 ILE 37 -2.759 -5.993 -0.028 310 HD11 ILE 37 HD11 ILE 37 -1.019 -2.744 0.265 311 HD12 ILE 37 HD12 ILE 37 -1.071 -4.421 -0.288 312 HD13 ILE 37 HD13 ILE 37 -0.229 -4.010 1.205 313 H GLN 38 HN GLN 38 -2.059 -7.356 3.919 314 HA GLN 38 HA GLN 38 -3.701 -9.520 3.491 315 HB2 GLN 38 HB2 GLN 38 -1.711 -9.047 5.711 316 HB3 GLN 38 HB1 GLN 38 -2.530 -10.582 5.492 317 HG2 GLN 38 HG2 GLN 38 -1.523 -10.716 3.204 318 HG3 GLN 38 HG1 GLN 38 -0.672 -9.234 3.579 319 HE21 GLN 38 HE21 GLN 38 -1.111 -12.562 4.861 320 HE22 GLN 38 HE22 GLN 38 0.495 -12.669 5.481 321 H SER 39 HN SER 39 -3.847 -7.275 6.238 322 HA SER 39 HA SER 39 -5.654 -8.935 7.739 323 HB2 SER 39 HB2 SER 39 -5.811 -6.984 9.271 324 HB3 SER 39 HB1 SER 39 -4.146 -7.431 8.920 325 HG SER 39 HG SER 39 -3.909 -5.691 7.643 326 H ARG 40 HN ARG 40 -5.976 -5.878 5.946 327 HA ARG 40 HA ARG 40 -8.819 -5.799 6.287 328 HB2 ARG 40 HB2 ARG 40 -6.917 -4.170 4.589 329 HB3 ARG 40 HB1 ARG 40 -8.652 -3.877 4.638 330 HG2 ARG 40 HG2 ARG 40 -8.529 -3.466 6.990 331 HG3 ARG 40 HG1 ARG 40 -6.820 -3.865 7.019 332 HD2 ARG 40 HD2 ARG 40 -6.516 -1.968 5.379 333 HD3 ARG 40 HD1 ARG 40 -8.170 -1.491 5.776 334 HE ARG 40 HE ARG 40 -6.347 -1.886 8.013 335 HH11 ARG 40 HH11 ARG 40 -7.961 0.408 5.914 336 HH12 ARG 40 HH12 ARG 40 -7.682 1.754 6.969 337 HH21 ARG 40 HH21 ARG 40 -5.996 -0.132 9.396 338 HH22 ARG 40 HH22 ARG 40 -6.524 1.456 8.932 339 H GLU 41 HN GLU 41 -6.705 -7.339 4.151 340 HA GLU 41 HA GLU 41 -8.966 -8.130 2.429 341 HB2 GLU 41 HB2 GLU 41 -6.063 -8.250 1.641 342 HB3 GLU 41 HB1 GLU 41 -7.478 -8.371 0.605 343 HG2 GLU 41 HG2 GLU 41 -6.743 -5.878 2.095 344 HG3 GLU 41 HG1 GLU 41 -6.156 -6.252 0.475 345 HA PRO 42 HA PRO 42 -7.285 -11.791 4.728 346 HB2 PRO 42 HB2 PRO 42 -9.838 -12.920 5.053 347 HB3 PRO 42 HB1 PRO 42 -8.905 -12.082 6.286 348 HG2 PRO 42 HG2 PRO 42 -11.282 -11.213 4.892 349 HG3 PRO 42 HG1 PRO 42 -10.450 -10.439 6.246 350 HD2 PRO 42 HD2 PRO 42 -10.477 -9.645 3.488 351 HD3 PRO 42 HD1 PRO 42 -9.654 -8.870 4.850 352 H SER 43 HN SER 43 -8.889 -11.171 1.902 353 HA SER 43 HA SER 43 -9.194 -13.832 0.905 354 HB2 SER 43 HB2 SER 43 -9.233 -12.398 -1.320 355 HB3 SER 43 HB1 SER 43 -10.586 -12.337 -0.186 356 HG SER 43 HG SER 43 -8.915 -10.360 -0.951 357 H LEU 44 HN LEU 44 -6.541 -11.715 1.365 358 HA LEU 44 HA LEU 44 -4.906 -13.465 -0.339 359 HB2 LEU 44 HB2 LEU 44 -3.363 -11.557 -0.654 360 HB3 LEU 44 HB1 LEU 44 -4.940 -11.294 -1.334 361 HG LEU 44 HG LEU 44 -5.264 -10.087 1.038 362 HD11 LEU 44 HD11 LEU 44 -3.224 -8.733 1.391 363 HD12 LEU 44 HD12 LEU 44 -2.366 -9.804 0.285 364 HD13 LEU 44 HD13 LEU 44 -3.021 -10.437 1.795 365 HD21 LEU 44 HD21 LEU 44 -4.986 -8.027 -0.193 366 HD22 LEU 44 HD22 LEU 44 -5.736 -9.232 -1.237 367 HD23 LEU 44 HD23 LEU 44 -4.025 -8.850 -1.418 368 H LYS 45 HN LYS 45 -5.686 -13.677 2.485 369 HA LYS 45 HA LYS 45 -3.496 -13.034 4.160 370 HB2 LYS 45 HB2 LYS 45 -4.500 -14.575 5.768 371 HB3 LYS 45 HB1 LYS 45 -5.716 -13.523 5.062 372 HG2 LYS 45 HG2 LYS 45 -6.537 -15.292 3.672 373 HG3 LYS 45 HG1 LYS 45 -5.184 -16.332 4.140 374 HD2 LYS 45 HD2 LYS 45 -6.901 -15.267 6.301 375 HD3 LYS 45 HD1 LYS 45 -7.552 -16.558 5.281 376 HE2 LYS 45 HE2 LYS 45 -5.882 -18.045 5.875 377 HE3 LYS 45 HE1 LYS 45 -4.798 -16.762 6.400 378 HZ1 LYS 45 HZ1 LYS 45 -5.657 -17.951 8.294 379 HZ2 LYS 45 HZ2 LYS 45 -7.252 -17.694 7.795 380 HZ3 LYS 45 HZ3 LYS 45 -6.305 -16.386 8.297 381 H ASN 46 HN ASN 46 -4.091 -15.616 1.935 382 HA ASN 46 HA ASN 46 -2.275 -17.527 2.981 383 HB2 ASN 46 HB2 ASN 46 -4.078 -18.045 1.358 384 HB3 ASN 46 HB1 ASN 46 -3.209 -17.139 0.128 385 HD21 ASN 46 HD21 ASN 46 -2.977 -18.867 -1.227 386 HD22 ASN 46 HD22 ASN 46 -1.925 -20.203 -0.877 387 H SER 47 HN SER 47 -1.910 -14.653 1.137 388 HA SER 47 HA SER 47 0.582 -15.164 -0.080 389 HB2 SER 47 HB2 SER 47 -0.711 -12.556 0.738 390 HB3 SER 47 HB1 SER 47 0.705 -12.683 -0.309 391 HG SER 47 HG SER 47 -1.445 -12.504 -1.351 392 H ASN 48 HN ASN 48 2.662 -14.474 0.517 393 HA ASN 48 HA ASN 48 3.149 -14.688 3.373 394 HB2 ASN 48 HB2 ASN 48 5.102 -14.471 1.073 395 HB3 ASN 48 HB1 ASN 48 5.513 -14.864 2.735 396 HD21 ASN 48 HD21 ASN 48 3.255 -16.594 3.181 397 HD22 ASN 48 HD22 ASN 48 3.549 -18.036 2.276 398 HA PRO 49 HA PRO 49 3.512 -10.339 4.039 399 HB2 PRO 49 HB2 PRO 49 5.149 -10.416 6.230 400 HB3 PRO 49 HB1 PRO 49 3.412 -10.730 6.280 401 HG2 PRO 49 HG2 PRO 49 5.683 -12.663 6.229 402 HG3 PRO 49 HG1 PRO 49 4.181 -12.712 7.170 403 HD2 PRO 49 HD2 PRO 49 4.525 -14.193 4.946 404 HD3 PRO 49 HD1 PRO 49 2.945 -13.521 5.398 405 H ASP 50 HN ASP 50 6.292 -12.364 3.571 406 HA ASP 50 HA ASP 50 8.106 -10.110 3.257 407 HB2 ASP 50 HB2 ASP 50 8.516 -13.080 2.841 408 HB3 ASP 50 HB1 ASP 50 9.777 -11.873 2.652 409 H GLU 51 HN GLU 51 5.795 -11.598 1.382 410 HA GLU 51 HA GLU 51 7.179 -10.960 -1.123 411 HB2 GLU 51 HB2 GLU 51 5.828 -13.621 -0.617 412 HB3 GLU 51 HB1 GLU 51 6.603 -13.113 -2.108 413 HG2 GLU 51 HG2 GLU 51 8.759 -13.040 -0.951 414 HG3 GLU 51 HG1 GLU 51 7.972 -13.576 0.530 415 H ILE 52 HN ILE 52 5.029 -9.733 0.365 416 HA ILE 52 HA ILE 52 2.508 -10.594 -0.500 417 HB ILE 52 HB ILE 52 3.184 -8.950 1.433 418 HG12 ILE 52 HG12 ILE 52 0.866 -8.164 1.513 419 HG13 ILE 52 HG11 ILE 52 0.648 -8.593 -0.174 420 HG21 ILE 52 HG21 ILE 52 2.472 -7.064 -0.788 421 HG22 ILE 52 HG22 ILE 52 4.069 -7.215 -0.057 422 HG23 ILE 52 HG23 ILE 52 2.708 -6.627 0.900 423 HD11 ILE 52 HD11 ILE 52 1.313 -10.527 1.985 424 HD12 ILE 52 HD12 ILE 52 0.851 -10.900 0.331 425 HD13 ILE 52 HD13 ILE 52 -0.319 -10.185 1.436 426 H GLU 53 HN GLU 53 1.091 -9.763 -1.934 427 HA GLU 53 HA GLU 53 2.289 -8.314 -4.210 428 HB2 GLU 53 HB2 GLU 53 1.718 -10.746 -4.624 429 HB3 GLU 53 HB1 GLU 53 0.053 -10.390 -4.212 430 HG2 GLU 53 HG2 GLU 53 0.368 -8.671 -6.251 431 HG3 GLU 53 HG1 GLU 53 1.561 -9.902 -6.713 432 H ILE 54 HN ILE 54 1.646 -6.258 -3.291 433 HA ILE 54 HA ILE 54 -0.954 -5.697 -2.427 434 HB ILE 54 HB ILE 54 1.022 -3.819 -3.718 435 HG12 ILE 54 HG12 ILE 54 0.770 -4.704 -0.841 436 HG13 ILE 54 HG11 ILE 54 2.138 -4.958 -1.914 437 HG21 ILE 54 HG21 ILE 54 -1.215 -3.298 -1.791 438 HG22 ILE 54 HG22 ILE 54 -1.213 -2.906 -3.508 439 HG23 ILE 54 HG23 ILE 54 -0.090 -2.097 -2.416 440 HD11 ILE 54 HD11 ILE 54 2.672 -3.165 -0.411 441 HD12 ILE 54 HD12 ILE 54 1.168 -2.349 -0.804 442 HD13 ILE 54 HD13 ILE 54 2.430 -2.500 -2.023 443 H ASP 55 HN ASP 55 -2.606 -6.241 -3.757 444 HA ASP 55 HA ASP 55 -2.506 -5.400 -6.567 445 HB2 ASP 55 HB2 ASP 55 -3.125 -7.767 -6.131 446 HB3 ASP 55 HB1 ASP 55 -4.500 -7.213 -5.178 447 H PHE 56 HN PHE 56 -3.124 -3.355 -6.737 448 HA PHE 56 HA PHE 56 -4.703 -2.092 -4.750 449 HB2 PHE 56 HB2 PHE 56 -3.701 -1.085 -7.398 450 HB3 PHE 56 HB1 PHE 56 -4.442 -0.077 -6.163 451 HD1 PHE 56 HD1 PHE 56 -3.317 0.111 -3.939 452 HD2 PHE 56 HD2 PHE 56 -1.415 -1.673 -7.280 453 HE1 PHE 56 HE1 PHE 56 -1.183 0.398 -2.830 454 HE2 PHE 56 HE2 PHE 56 0.763 -1.385 -6.172 455 HZ PHE 56 HZ PHE 56 0.872 -0.343 -3.935 456 H GLU 57 HN GLU 57 -5.623 -3.906 -7.401 457 HA GLU 57 HA GLU 57 -8.043 -2.405 -7.953 458 HB2 GLU 57 HB2 GLU 57 -6.858 -4.932 -9.047 459 HB3 GLU 57 HB1 GLU 57 -8.519 -4.480 -9.409 460 HG2 GLU 57 HG2 GLU 57 -6.061 -2.857 -10.019 461 HG3 GLU 57 HG1 GLU 57 -7.026 -3.785 -11.169 462 H THR 58 HN THR 58 -7.020 -5.131 -6.064 463 HA THR 58 HA THR 58 -9.795 -5.782 -5.427 464 HB THR 58 HB THR 58 -8.756 -7.676 -4.112 465 HG1 THR 58 HG1 THR 58 -6.415 -6.918 -5.560 466 HG21 THR 58 HG21 THR 58 -8.205 -7.480 -7.073 467 HG22 THR 58 HG22 THR 58 -9.687 -8.062 -6.309 468 HG23 THR 58 HG23 THR 58 -8.191 -8.981 -6.143 469 H LEU 59 HN LEU 59 -6.966 -4.273 -4.065 470 HA LEU 59 HA LEU 59 -7.664 -4.199 -1.362 471 HB2 LEU 59 HB2 LEU 59 -6.226 -2.135 -2.995 472 HB3 LEU 59 HB1 LEU 59 -6.308 -2.164 -1.251 473 HG LEU 59 HG LEU 59 -5.021 -4.233 -3.008 474 HD11 LEU 59 HD11 LEU 59 -3.864 -2.291 -1.035 475 HD12 LEU 59 HD12 LEU 59 -3.750 -2.174 -2.790 476 HD13 LEU 59 HD13 LEU 59 -2.980 -3.512 -1.941 477 HD21 LEU 59 HD21 LEU 59 -5.577 -4.152 -0.057 478 HD22 LEU 59 HD22 LEU 59 -4.248 -5.096 -0.741 479 HD23 LEU 59 HD23 LEU 59 -5.907 -5.439 -1.225 480 H LYS 60 HN LYS 60 -9.329 -3.336 -0.388 481 HA LYS 60 HA LYS 60 -11.276 -1.777 -1.730 482 HB2 LYS 60 HB2 LYS 60 -10.825 -2.484 1.162 483 HB3 LYS 60 HB1 LYS 60 -12.186 -1.498 0.646 484 HG2 LYS 60 HG2 LYS 60 -13.019 -3.306 -0.716 485 HG3 LYS 60 HG1 LYS 60 -11.588 -4.270 -0.354 486 HD2 LYS 60 HD2 LYS 60 -13.210 -3.284 1.927 487 HD3 LYS 60 HD1 LYS 60 -13.877 -4.594 0.954 488 HE2 LYS 60 HE2 LYS 60 -12.598 -5.380 2.920 489 HE3 LYS 60 HE1 LYS 60 -11.966 -5.972 1.389 490 HZ1 LYS 60 HZ1 LYS 60 -10.289 -5.176 3.045 491 HZ2 LYS 60 HZ2 LYS 60 -10.847 -3.605 2.768 492 HZ3 LYS 60 HZ3 LYS 60 -10.155 -4.495 1.503 493 HA PRO 61 HA PRO 61 -9.942 2.455 -1.426 494 HB2 PRO 61 HB2 PRO 61 -12.495 2.874 0.075 495 HB3 PRO 61 HB1 PRO 61 -11.806 3.813 -1.257 496 HG2 PRO 61 HG2 PRO 61 -13.792 2.097 -1.684 497 HG3 PRO 61 HG1 PRO 61 -12.478 2.316 -2.852 498 HD2 PRO 61 HD2 PRO 61 -13.014 0.048 -1.013 499 HD3 PRO 61 HD1 PRO 61 -12.184 0.054 -2.580 500 H SER 62 HN SER 62 -11.457 1.025 1.413 501 HA SER 62 HA SER 62 -10.470 2.636 3.428 502 HB2 SER 62 HB2 SER 62 -10.685 -0.345 3.742 503 HB3 SER 62 HB1 SER 62 -11.150 0.926 4.874 504 HG SER 62 HG SER 62 -12.975 1.295 3.743 505 H THR 63 HN THR 63 -9.026 -0.357 2.095 506 HA THR 63 HA THR 63 -6.684 -0.226 3.688 507 HB THR 63 HB THR 63 -6.636 -1.538 1.000 508 HG1 THR 63 HG1 THR 63 -7.928 -3.230 1.756 509 HG21 THR 63 HG21 THR 63 -4.703 -2.201 2.008 510 HG22 THR 63 HG22 THR 63 -5.775 -3.375 2.782 511 HG23 THR 63 HG23 THR 63 -5.349 -1.891 3.625 512 H LEU 64 HN LEU 64 -7.380 0.732 0.337 513 HA LEU 64 HA LEU 64 -4.805 1.484 -0.397 514 HB2 LEU 64 HB2 LEU 64 -7.449 2.584 -1.311 515 HB3 LEU 64 HB1 LEU 64 -5.927 2.916 -2.097 516 HG LEU 64 HG LEU 64 -7.125 0.165 -1.800 517 HD11 LEU 64 HD11 LEU 64 -7.810 2.289 -3.558 518 HD12 LEU 64 HD12 LEU 64 -8.435 0.642 -3.520 519 HD13 LEU 64 HD13 LEU 64 -7.012 1.022 -4.487 520 HD21 LEU 64 HD21 LEU 64 -4.703 1.266 -3.190 521 HD22 LEU 64 HD22 LEU 64 -5.439 -0.269 -3.655 522 HD23 LEU 64 HD23 LEU 64 -4.800 -0.057 -2.024 523 H ARG 65 HN ARG 65 -7.375 3.487 1.057 524 HA ARG 65 HA ARG 65 -5.816 5.850 1.066 525 HB2 ARG 65 HB2 ARG 65 -8.240 5.034 2.640 526 HB3 ARG 65 HB1 ARG 65 -7.464 6.600 2.832 527 HG2 ARG 65 HG2 ARG 65 -8.583 5.541 0.248 528 HG3 ARG 65 HG1 ARG 65 -9.403 6.666 1.329 529 HD2 ARG 65 HD2 ARG 65 -7.632 8.300 1.008 530 HD3 ARG 65 HD1 ARG 65 -6.757 7.175 -0.023 531 HE ARG 65 HE ARG 65 -9.408 7.696 -0.962 532 HH11 ARG 65 HH11 ARG 65 -6.108 8.896 -0.917 533 HH12 ARG 65 HH12 ARG 65 -6.273 9.762 -2.417 534 HH21 ARG 65 HH21 ARG 65 -9.623 8.847 -2.942 535 HH22 ARG 65 HH22 ARG 65 -8.268 9.744 -3.549 536 H GLU 66 HN GLU 66 -6.116 3.172 3.303 537 HA GLU 66 HA GLU 66 -4.655 4.405 5.407 538 HB2 GLU 66 HB2 GLU 66 -6.026 2.441 5.831 539 HB3 GLU 66 HB1 GLU 66 -5.078 1.491 4.692 540 HG2 GLU 66 HG2 GLU 66 -4.410 0.891 6.883 541 HG3 GLU 66 HG1 GLU 66 -3.106 1.829 6.152 542 H LEU 67 HN LEU 67 -3.707 2.029 2.898 543 HA LEU 67 HA LEU 67 -0.981 1.926 3.287 544 HB2 LEU 67 HB2 LEU 67 -2.188 2.112 0.517 545 HB3 LEU 67 HB1 LEU 67 -0.803 1.166 1.055 546 HG LEU 67 HG LEU 67 -3.631 0.603 1.916 547 HD11 LEU 67 HD11 LEU 67 -2.155 -1.164 0.077 548 HD12 LEU 67 HD12 LEU 67 -2.841 0.312 -0.597 549 HD13 LEU 67 HD13 LEU 67 -3.884 -0.860 0.210 550 HD21 LEU 67 HD21 LEU 67 -1.296 -0.163 3.090 551 HD22 LEU 67 HD22 LEU 67 -1.599 -1.493 1.978 552 HD23 LEU 67 HD23 LEU 67 -2.814 -1.052 3.178 553 H GLU 68 HN GLU 68 -2.725 4.222 1.175 554 HA GLU 68 HA GLU 68 -0.591 5.829 0.399 555 HB2 GLU 68 HB2 GLU 68 -2.827 6.004 -0.591 556 HB3 GLU 68 HB1 GLU 68 -3.469 6.614 0.926 557 HG2 GLU 68 HG2 GLU 68 -1.686 8.469 0.608 558 HG3 GLU 68 HG1 GLU 68 -1.758 7.978 -1.084 559 H ARG 69 HN ARG 69 -2.924 6.541 2.995 560 HA ARG 69 HA ARG 69 -1.599 8.812 4.007 561 HB2 ARG 69 HB2 ARG 69 -3.657 6.926 5.044 562 HB3 ARG 69 HB1 ARG 69 -3.077 8.230 6.056 563 HG2 ARG 69 HG2 ARG 69 -3.946 8.944 3.327 564 HG3 ARG 69 HG1 ARG 69 -5.210 8.441 4.453 565 HD2 ARG 69 HD2 ARG 69 -4.946 10.842 4.514 566 HD3 ARG 69 HD1 ARG 69 -4.426 10.133 6.042 567 HE ARG 69 HE ARG 69 -2.157 10.546 5.411 568 HH11 ARG 69 HH11 ARG 69 -4.518 11.940 3.237 569 HH12 ARG 69 HH12 ARG 69 -3.447 13.173 2.655 570 HH21 ARG 69 HH21 ARG 69 -0.742 12.162 4.657 571 HH22 ARG 69 HH22 ARG 69 -1.292 13.304 3.474 572 H TYR 70 HN TYR 70 -1.044 5.463 4.475 573 HA TYR 70 HA TYR 70 0.404 5.731 6.929 574 HB2 TYR 70 HB2 TYR 70 -0.513 3.585 6.515 575 HB3 TYR 70 HB1 TYR 70 0.170 3.534 4.895 576 HD1 TYR 70 HD2 TYR 70 1.361 3.980 8.403 577 HD2 TYR 70 HD1 TYR 70 1.981 2.233 4.588 578 HE1 TYR 70 HE2 TYR 70 3.383 2.880 9.255 579 HE2 TYR 70 HE1 TYR 70 3.996 1.118 5.409 580 HH TYR 70 HH TYR 70 5.525 1.086 7.127 581 H VAL 71 HN VAL 71 1.288 5.282 3.502 582 HA VAL 71 HA VAL 71 4.066 5.399 3.965 583 HB VAL 71 HB VAL 71 4.399 5.707 1.649 584 HG11 VAL 71 HG11 VAL 71 2.627 4.202 0.591 585 HG12 VAL 71 HG12 VAL 71 2.015 4.020 2.237 586 HG13 VAL 71 HG13 VAL 71 3.667 3.539 1.847 587 HG21 VAL 71 HG21 VAL 71 2.794 6.474 0.102 588 HG22 VAL 71 HG22 VAL 71 2.930 7.653 1.402 589 HG23 VAL 71 HG23 VAL 71 1.545 6.557 1.338 590 H THR 72 HN THR 72 1.590 7.860 3.553 591 HA THR 72 HA THR 72 3.325 9.967 2.922 592 HB THR 72 HB THR 72 1.508 11.493 3.586 593 HG1 THR 72 HG1 THR 72 0.490 10.519 5.272 594 HG21 THR 72 HG21 THR 72 1.041 9.124 1.849 595 HG22 THR 72 HG22 THR 72 1.325 10.807 1.390 596 HG23 THR 72 HG23 THR 72 -0.240 10.323 2.049 597 H SER 73 HN SER 73 2.346 8.545 5.947 598 HA SER 73 HA SER 73 3.363 10.553 7.652 599 HB2 SER 73 HB2 SER 73 3.039 9.003 9.409 600 HB3 SER 73 HB1 SER 73 1.803 8.601 8.211 601 HG SER 73 HG SER 73 3.149 6.906 7.486 602 H CYS 74 HN CYS 74 4.829 8.120 5.733 603 HA CYS 74 HA CYS 74 7.433 8.406 7.058 604 HB2 CYS 74 HB2 CYS 74 6.834 6.120 6.685 605 HB3 CYS 74 HB1 CYS 74 6.399 6.448 5.010 606 HG CYS 74 HG CYS 74 9.367 7.334 4.897 607 H LEU 75 HN LEU 75 5.742 9.263 4.155 608 HA LEU 75 HA LEU 75 8.225 9.916 2.761 609 HB2 LEU 75 HB2 LEU 75 5.398 9.817 1.721 610 HB3 LEU 75 HB1 LEU 75 6.841 9.973 0.759 611 HG LEU 75 HG LEU 75 5.896 7.565 2.270 612 HD11 LEU 75 HD11 LEU 75 5.061 8.148 -0.061 613 HD12 LEU 75 HD12 LEU 75 5.759 6.544 0.165 614 HD13 LEU 75 HD13 LEU 75 6.704 7.815 -0.605 615 HD21 LEU 75 HD21 LEU 75 7.946 6.454 1.725 616 HD22 LEU 75 HD22 LEU 75 8.337 7.919 2.617 617 HD23 LEU 75 HD23 LEU 75 8.547 7.871 0.867 618 H ARG 76 HN ARG 76 5.024 11.371 3.347 619 HA ARG 76 HA ARG 76 5.968 13.934 2.425 620 HB2 ARG 76 HB2 ARG 76 3.305 13.072 3.511 621 HB3 ARG 76 HB1 ARG 76 3.659 14.690 2.913 622 HG2 ARG 76 HG2 ARG 76 4.271 13.666 0.731 623 HG3 ARG 76 HG1 ARG 76 3.709 12.124 1.376 624 HD2 ARG 76 HD2 ARG 76 1.947 13.084 0.086 625 HD3 ARG 76 HD1 ARG 76 1.529 13.143 1.794 626 HE ARG 76 HE ARG 76 2.690 15.567 1.272 627 HH11 ARG 76 HH11 ARG 76 -0.042 13.784 0.004 628 HH12 ARG 76 HH12 ARG 76 -0.943 15.205 -0.408 629 HH21 ARG 76 HH21 ARG 76 1.510 17.451 0.722 630 HH22 ARG 76 HH22 ARG 76 -0.054 17.296 -0.010 631 H LYS 77 HN LYS 77 5.405 12.280 5.376 632 HA LYS 77 HA LYS 77 6.181 14.665 6.922 633 HB2 LYS 77 HB2 LYS 77 3.975 13.629 7.522 634 HB3 LYS 77 HB1 LYS 77 4.815 12.126 7.867 635 HG2 LYS 77 HG2 LYS 77 6.088 13.271 9.638 636 HG3 LYS 77 HG1 LYS 77 5.153 14.735 9.323 637 HD2 LYS 77 HD2 LYS 77 3.096 13.558 9.893 638 HD3 LYS 77 HD1 LYS 77 4.010 12.075 10.169 639 HE2 LYS 77 HE2 LYS 77 3.534 13.121 12.282 640 HE3 LYS 77 HE1 LYS 77 5.262 13.222 11.961 641 HZ1 LYS 77 HZ1 LYS 77 4.982 15.506 11.273 642 HZ2 LYS 77 HZ2 LYS 77 4.360 15.300 12.831 643 HZ3 LYS 77 HZ3 LYS 77 3.311 15.412 11.513 644 H LYS 78 HN LYS 78 7.841 14.403 8.475 645 HA LYS 78 HA LYS 78 9.762 13.581 9.402 646 HB2 LYS 78 HB2 LYS 78 8.555 11.553 9.967 647 HB3 LYS 78 HB1 LYS 78 8.778 10.927 8.341 648 HG2 LYS 78 HG2 LYS 78 10.351 9.819 9.708 649 HG3 LYS 78 HG1 LYS 78 11.247 11.012 8.765 650 HD2 LYS 78 HD2 LYS 78 11.190 12.545 10.689 651 HD3 LYS 78 HD1 LYS 78 10.371 11.300 11.633 652 HE2 LYS 78 HE2 LYS 78 13.105 11.037 10.386 653 HE3 LYS 78 HE1 LYS 78 12.792 11.390 12.082 654 HZ1 LYS 78 HZ1 LYS 78 12.033 8.908 10.641 655 HZ2 LYS 78 HZ2 LYS 78 11.648 9.248 12.252 656 HZ3 LYS 78 HZ3 LYS 78 13.265 9.066 11.789 657 H ARG 79 HN ARG 79 11.864 13.392 8.815 658 HA ARG 79 HA ARG 79 12.425 12.817 5.995 659 HB2 ARG 79 HB2 ARG 79 14.267 14.389 6.029 660 HB3 ARG 79 HB1 ARG 79 12.794 15.211 6.500 661 HG2 ARG 79 HG2 ARG 79 14.856 14.223 8.456 662 HG3 ARG 79 HG1 ARG 79 14.835 15.852 7.785 663 HD2 ARG 79 HD2 ARG 79 12.735 14.559 9.517 664 HD3 ARG 79 HD1 ARG 79 13.802 15.887 9.952 665 HE ARG 79 HE ARG 79 12.412 16.789 7.770 666 HH11 ARG 79 HH11 ARG 79 11.570 15.592 10.957 667 HH12 ARG 79 HH12 ARG 79 10.102 16.513 11.047 668 HH21 ARG 79 HH21 ARG 79 10.481 17.995 7.895 669 HH22 ARG 79 HH22 ARG 79 9.480 17.880 9.309 670 H LYS 80 HN LYS 80 14.051 11.399 5.573 671 HA LYS 80 HA LYS 80 15.400 9.611 5.898 672 HB2 LYS 80 HB2 LYS 80 16.121 10.984 8.494 673 HB3 LYS 80 HB1 LYS 80 16.989 9.629 7.785 674 HG2 LYS 80 HG2 LYS 80 16.684 12.364 6.554 675 HG3 LYS 80 HG1 LYS 80 18.121 11.747 7.372 676 HD2 LYS 80 HD2 LYS 80 18.335 9.993 5.682 677 HD3 LYS 80 HD1 LYS 80 16.886 10.591 4.872 678 HE2 LYS 80 HE2 LYS 80 17.999 12.728 4.458 679 HE3 LYS 80 HE1 LYS 80 19.444 12.135 5.274 680 HZ1 LYS 80 HZ1 LYS 80 18.267 11.017 2.790 681 HZ2 LYS 80 HZ2 LYS 80 19.633 10.413 3.581 682 HZ3 LYS 80 HZ3 LYS 80 19.670 11.956 2.890 683 HA PRO 81 HA PRO 81 12.165 7.641 8.530 684 HB2 PRO 81 HB2 PRO 81 11.419 5.770 6.739 685 HB3 PRO 81 HB1 PRO 81 10.796 7.424 6.687 686 HG2 PRO 81 HG2 PRO 81 12.981 6.170 5.070 687 HG3 PRO 81 HG1 PRO 81 11.678 7.251 4.542 688 HD2 PRO 81 HD2 PRO 81 14.218 8.103 5.013 689 HD3 PRO 81 HD1 PRO 81 12.792 9.136 5.240 690 H GLN 82 HN GLN 82 14.978 6.460 6.915 691 HA GLN 82 HA GLN 82 15.066 4.210 8.804 692 HB2 GLN 82 HB2 GLN 82 14.639 3.379 6.534 693 HB3 GLN 82 HB1 GLN 82 16.064 4.225 5.949 694 HG2 GLN 82 HG2 GLN 82 17.496 2.819 7.288 695 HG3 GLN 82 HG1 GLN 82 16.093 2.022 7.997 696 HE21 GLN 82 HE21 GLN 82 16.775 0.009 7.270 697 HE22 GLN 82 HE22 GLN 82 16.672 -0.452 5.604 698 H ALA 83 HN ALA 83 16.431 4.951 10.293 699 HA ALA 83 HA ALA 83 18.792 6.463 9.524 700 HB1 ALA 83 HB1 ALA 83 17.461 7.236 11.423 701 HB2 ALA 83 HB2 ALA 83 19.098 6.810 11.922 702 HB3 ALA 83 HB3 ALA 83 17.760 5.712 12.258 703 H1 VAL 201 HT1 VAL 201 -4.798 0.791 -16.007 704 H2 VAL 201 HT2 VAL 201 -5.864 -0.320 -16.702 705 H3 VAL 201 HT3 VAL 201 -4.198 -0.598 -16.759 706 HA VAL 201 HA VAL 201 -5.828 -0.506 -14.292 707 HB VAL 201 HB VAL 201 -4.544 -2.901 -15.625 708 HG11 VAL 201 HG11 VAL 201 -5.799 -4.190 -13.946 709 HG12 VAL 201 HG12 VAL 201 -6.343 -2.680 -13.213 710 HG13 VAL 201 HG13 VAL 201 -4.628 -3.093 -13.212 711 HG21 VAL 201 HG21 VAL 201 -6.855 -3.658 -16.058 712 HG22 VAL 201 HG22 VAL 201 -6.436 -2.194 -16.946 713 HG23 VAL 201 HG23 VAL 201 -7.446 -2.092 -15.504 714 H VAL 202 HN VAL 202 -4.655 -0.115 -12.537 715 HA VAL 202 HA VAL 202 -1.883 0.359 -12.598 716 HB VAL 202 HB VAL 202 -3.725 -0.130 -10.250 717 HG11 VAL 202 HG11 VAL 202 -1.414 -0.599 -9.608 718 HG12 VAL 202 HG12 VAL 202 -1.986 0.893 -8.861 719 HG13 VAL 202 HG13 VAL 202 -0.909 0.962 -10.257 720 HG21 VAL 202 HG21 VAL 202 -2.604 2.425 -11.391 721 HG22 VAL 202 HG22 VAL 202 -3.702 2.284 -10.020 722 HG23 VAL 202 HG23 VAL 202 -4.247 1.836 -11.634 723 HA PRO 203 HA PRO 203 -0.471 -3.866 -12.486 724 HB2 PRO 203 HB2 PRO 203 2.168 -3.272 -12.081 725 HB3 PRO 203 HB1 PRO 203 1.378 -3.192 -13.658 726 HG2 PRO 203 HG2 PRO 203 2.004 -0.989 -11.739 727 HG3 PRO 203 HG1 PRO 203 2.148 -1.013 -13.506 728 HD2 PRO 203 HD2 PRO 203 0.085 0.181 -12.238 729 HD3 PRO 203 HD1 PRO 203 -0.097 -0.600 -13.821 730 H LYS 204 HN LYS 204 -0.384 -5.263 -10.875 731 HA LYS 204 HA LYS 204 -0.516 -4.602 -8.174 732 HB2 LYS 204 HB2 LYS 204 0.055 -7.025 -7.793 733 HB3 LYS 204 HB1 LYS 204 -1.292 -6.748 -8.889 734 HG2 LYS 204 HG2 LYS 204 0.278 -7.046 -10.791 735 HG3 LYS 204 HG1 LYS 204 1.530 -7.480 -9.629 736 HD2 LYS 204 HD2 LYS 204 0.342 -9.417 -8.943 737 HD3 LYS 204 HD1 LYS 204 -1.111 -8.908 -9.803 738 HE2 LYS 204 HE2 LYS 204 1.516 -9.666 -11.076 739 HE3 LYS 204 HE1 LYS 204 0.076 -10.682 -11.003 740 HZ1 LYS 204 HZ1 LYS 204 0.299 -8.069 -12.399 741 HZ2 LYS 204 HZ2 LYS 204 -1.107 -9.002 -12.298 742 HZ3 LYS 204 HZ3 LYS 204 0.238 -9.589 -13.134 743 H LYS 205 HN LYS 205 0.970 -4.467 -6.543 744 HA LYS 205 HA LYS 205 3.656 -3.856 -7.432 745 HB2 LYS 205 HB2 LYS 205 2.228 -2.548 -5.686 746 HB3 LYS 205 HB1 LYS 205 2.780 -3.786 -4.566 747 HG2 LYS 205 HG2 LYS 205 4.235 -1.912 -4.377 748 HG3 LYS 205 HG1 LYS 205 5.119 -3.210 -5.183 749 HD2 LYS 205 HD2 LYS 205 4.621 -2.159 -7.359 750 HD3 LYS 205 HD1 LYS 205 3.810 -0.840 -6.515 751 HE2 LYS 205 HE2 LYS 205 5.992 -0.081 -7.030 752 HE3 LYS 205 HE1 LYS 205 5.965 -0.432 -5.301 753 HZ1 LYS 205 HZ1 LYS 205 7.979 -1.261 -6.336 754 HZ2 LYS 205 HZ2 LYS 205 7.078 -2.198 -7.416 755 HZ3 LYS 205 HZ3 LYS 205 7.048 -2.555 -5.764 756 H LYS 206 HN LYS 206 5.023 -5.461 -7.673 757 HA LYS 206 HA LYS 206 4.778 -7.911 -6.175 758 HB2 LYS 206 HB2 LYS 206 6.901 -7.026 -8.144 759 HB3 LYS 206 HB1 LYS 206 6.695 -8.659 -7.519 760 HG2 LYS 206 HG2 LYS 206 4.465 -8.750 -8.552 761 HG3 LYS 206 HG1 LYS 206 4.731 -7.143 -9.225 762 HD2 LYS 206 HD2 LYS 206 6.647 -7.985 -10.484 763 HD3 LYS 206 HD1 LYS 206 6.398 -9.589 -9.794 764 HE2 LYS 206 HE2 LYS 206 4.170 -9.669 -10.831 765 HE3 LYS 206 HE1 LYS 206 4.459 -8.086 -11.548 766 HZ1 LYS 206 HZ1 LYS 206 6.004 -10.560 -12.094 767 HZ2 LYS 206 HZ2 LYS 206 6.339 -9.039 -12.751 768 HZ3 LYS 206 HZ3 LYS 206 4.894 -9.824 -13.138 769 H ILE 207 HN ILE 207 5.201 -7.536 -4.079 770 HA ILE 207 HA ILE 207 7.442 -5.873 -3.299 771 HB ILE 207 HB ILE 207 5.422 -7.333 -1.597 772 HG12 ILE 207 HG12 ILE 207 4.530 -5.578 -3.193 773 HG13 ILE 207 HG11 ILE 207 4.181 -5.305 -1.488 774 HG21 ILE 207 HG21 ILE 207 6.153 -5.546 0.087 775 HG22 ILE 207 HG22 ILE 207 7.566 -5.339 -0.952 776 HG23 ILE 207 HG23 ILE 207 7.245 -6.903 -0.203 777 HD11 ILE 207 HD11 ILE 207 5.783 -3.579 -1.355 778 HD12 ILE 207 HD12 ILE 207 4.861 -3.294 -2.829 779 HD13 ILE 207 HD13 ILE 207 6.475 -3.999 -2.919 780 H LYS 208 HN LYS 208 9.367 -6.650 -3.003 781 HA LYS 208 HA LYS 208 9.871 -9.077 -1.567 782 HB2 LYS 208 HB2 LYS 208 9.444 -9.707 -4.053 783 HB3 LYS 208 HB1 LYS 208 10.981 -8.926 -4.375 784 HG2 LYS 208 HG2 LYS 208 11.080 -11.407 -4.151 785 HG3 LYS 208 HG1 LYS 208 12.161 -10.533 -3.073 786 HD2 LYS 208 HD2 LYS 208 10.629 -10.845 -1.225 787 HD3 LYS 208 HD1 LYS 208 9.458 -11.616 -2.295 788 HE2 LYS 208 HE2 LYS 208 12.238 -12.666 -1.788 789 HE3 LYS 208 HE1 LYS 208 10.808 -13.202 -0.908 790 HZ1 LYS 208 HZ1 LYS 208 9.849 -13.971 -2.978 791 HZ2 LYS 208 HZ2 LYS 208 11.360 -14.689 -2.735 792 HZ3 LYS 208 HZ3 LYS 208 11.197 -13.425 -3.842 793 H LYS 209 HN LYS 209 12.653 -9.246 -2.363 794 HA LYS 209 HA LYS 209 13.728 -7.170 -0.823 795 HB2 LYS 209 HB2 LYS 209 15.154 -8.905 -2.843 796 HB3 LYS 209 HB1 LYS 209 15.927 -7.936 -1.599 797 HG2 LYS 209 HG2 LYS 209 14.650 -9.304 0.092 798 HG3 LYS 209 HG1 LYS 209 14.211 -10.377 -1.239 799 HD2 LYS 209 HD2 LYS 209 17.022 -9.688 -0.381 800 HD3 LYS 209 HD1 LYS 209 16.178 -11.191 -0.013 801 HE2 LYS 209 HE2 LYS 209 16.773 -10.204 -2.799 802 HE3 LYS 209 HE1 LYS 209 17.775 -11.351 -1.917 803 HZ1 LYS 209 HZ1 LYS 209 14.966 -11.741 -2.786 804 HZ2 LYS 209 HZ2 LYS 209 15.796 -12.807 -1.769 805 HZ3 LYS 209 HZ3 LYS 209 16.335 -12.557 -3.353 806 H GLU 210 HN GLU 210 13.095 -7.423 -4.234 807 HA GLU 210 HA GLU 210 14.576 -5.021 -4.875 808 HB2 GLU 210 HB2 GLU 210 12.682 -6.681 -6.542 809 HB3 GLU 210 HB1 GLU 210 13.643 -5.339 -7.140 810 HG2 GLU 210 HG2 GLU 210 15.687 -6.577 -6.548 811 HG3 GLU 210 HG1 GLU 210 14.683 -7.940 -6.048 812 H GLN 211 HN GLN 211 13.577 -3.443 -3.602 813 HA GLN 211 HA GLN 211 10.942 -2.638 -4.614 814 HB2 GLN 211 HB2 GLN 211 10.389 -1.811 -2.315 815 HB3 GLN 211 HB1 GLN 211 10.485 -3.559 -2.462 816 HG2 GLN 211 HG2 GLN 211 12.753 -3.483 -1.506 817 HG3 GLN 211 HG1 GLN 211 12.579 -1.743 -1.297 818 HE21 GLN 211 HE21 GLN 211 11.097 -0.958 0.228 819 HE22 GLN 211 HE22 GLN 211 10.517 -1.955 1.511 820 H VAL 212 HN VAL 212 13.724 -1.464 -2.705 821 HA VAL 212 HA VAL 212 13.264 1.259 -3.479 822 HB VAL 212 HB VAL 212 15.682 -0.012 -2.169 823 HG11 VAL 212 HG11 VAL 212 14.942 2.898 -2.441 824 HG12 VAL 212 HG12 VAL 212 16.270 2.082 -3.264 825 HG13 VAL 212 HG13 VAL 212 16.297 2.262 -1.509 826 HG21 VAL 212 HG21 VAL 212 14.783 0.972 -0.099 827 HG22 VAL 212 HG22 VAL 212 13.699 -0.229 -0.798 828 HG23 VAL 212 HG23 VAL 212 13.349 1.488 -0.987 829 H GLU 213 HN GLU 213 15.266 -1.394 -4.537 830 HA GLU 213 HA GLU 213 16.578 0.292 -6.527 831 HB2 GLU 213 HB2 GLU 213 17.778 -1.456 -5.035 832 HB3 GLU 213 HB1 GLU 213 17.079 -2.644 -6.127 833 HG2 GLU 213 HG2 GLU 213 19.333 -2.123 -6.802 834 HG3 GLU 213 HG1 GLU 213 18.193 -1.542 -8.016
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