NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
583674 | 2mhc | 19625 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLY 1 H1 GLY 1 10.762 1.394 23.243 2 H2 GLY 1 H2 GLY 1 10.796 -0.202 23.802 3 H3 GLY 1 H3 GLY 1 11.370 0.162 22.255 4 HA2 GLY 1 HA2 GLY 1 12.659 1.645 24.368 5 HA3 GLY 1 HA3 GLY 1 12.910 -0.091 24.451 6 H SER 2 H SER 2 13.963 -1.157 22.701 7 HA SER 2 HA SER 2 15.482 0.648 20.929 8 HB2 SER 2 HB2 SER 2 16.703 -0.576 22.898 9 HB3 SER 2 HB3 SER 2 16.602 -1.983 21.841 10 HG SER 2 HG SER 2 17.645 -0.663 20.223 11 H ARG 3 H ARG 3 14.737 -2.833 21.275 12 HA ARG 3 HA ARG 3 14.251 -2.944 18.370 13 HB2 ARG 3 HB2 ARG 3 16.164 -4.311 19.335 14 HB3 ARG 3 HB3 ARG 3 14.942 -5.278 20.149 15 HG2 ARG 3 HG2 ARG 3 15.420 -6.490 18.230 16 HG3 ARG 3 HG3 ARG 3 13.940 -5.626 17.816 17 HD2 ARG 3 HD2 ARG 3 15.092 -5.071 15.962 18 HD3 ARG 3 HD3 ARG 3 15.784 -3.835 17.009 19 HE ARG 3 HE ARG 3 17.776 -5.014 17.070 20 HH11 ARG 3 HH11 ARG 3 15.345 -6.867 15.359 21 HH12 ARG 3 HH12 ARG 3 16.487 -7.992 14.710 22 HH21 ARG 3 HH21 ARG 3 19.272 -6.500 16.211 23 HH22 ARG 3 HH22 ARG 3 18.715 -7.786 15.193 24 H THR 4 H THR 4 12.350 -3.789 17.618 25 HA THR 4 HA THR 4 10.568 -5.263 19.312 26 HB THR 4 HB THR 4 10.199 -2.905 20.037 27 HG1 THR 4 HG1 THR 4 8.503 -4.377 20.245 28 HG21 THR 4 HG21 THR 4 9.980 -2.481 17.214 29 HG22 THR 4 HG22 THR 4 10.083 -1.309 18.526 30 HG23 THR 4 HG23 THR 4 8.516 -1.959 18.045 31 H SER 5 H SER 5 8.226 -5.168 18.049 32 HA SER 5 HA SER 5 8.863 -6.184 15.377 33 HB2 SER 5 HB2 SER 5 6.474 -7.055 15.518 34 HB3 SER 5 HB3 SER 5 7.634 -7.759 16.643 35 HG SER 5 HG SER 5 6.501 -6.996 18.235 36 H ARG 6 H ARG 6 8.684 -4.807 13.745 37 HA ARG 6 HA ARG 6 6.916 -2.510 13.887 38 HB2 ARG 6 HB2 ARG 6 7.833 -2.153 11.496 39 HB3 ARG 6 HB3 ARG 6 8.905 -1.917 12.849 40 HG2 ARG 6 HG2 ARG 6 10.126 -3.056 11.198 41 HG3 ARG 6 HG3 ARG 6 9.752 -4.236 12.445 42 HD2 ARG 6 HD2 ARG 6 7.833 -3.988 10.208 43 HD3 ARG 6 HD3 ARG 6 9.399 -4.707 9.842 44 HE ARG 6 HE ARG 6 7.313 -5.815 11.528 45 HH11 ARG 6 HH11 ARG 6 10.640 -6.027 10.457 46 HH12 ARG 6 HH12 ARG 6 10.798 -7.696 10.885 47 HH21 ARG 6 HH21 ARG 6 7.529 -8.015 12.081 48 HH22 ARG 6 HH22 ARG 6 9.034 -8.824 11.805 49 H ILE 7 H ILE 7 6.256 -2.641 10.885 50 HA ILE 7 HA ILE 7 4.529 -4.975 10.877 51 HB ILE 7 HB ILE 7 2.498 -3.846 10.610 52 HG12 ILE 7 HG12 ILE 7 3.123 -1.108 11.141 53 HG13 ILE 7 HG13 ILE 7 4.068 -1.650 9.758 54 HG21 ILE 7 HG21 ILE 7 3.274 -4.154 12.914 55 HG22 ILE 7 HG22 ILE 7 2.187 -2.776 12.746 56 HG23 ILE 7 HG23 ILE 7 3.925 -2.515 12.889 57 HD11 ILE 7 HD11 ILE 7 1.502 -2.633 9.301 58 HD12 ILE 7 HD12 ILE 7 2.277 -1.264 8.507 59 HD13 ILE 7 HD13 ILE 7 1.262 -1.002 9.927 60 H THR 8 H THR 8 3.017 -4.990 8.952 61 HA THR 8 HA THR 8 4.496 -4.263 6.502 62 HB THR 8 HB THR 8 2.729 -6.572 7.268 63 HG1 THR 8 HG1 THR 8 5.169 -6.272 5.870 64 HG21 THR 8 HG21 THR 8 1.553 -5.994 5.329 65 HG22 THR 8 HG22 THR 8 2.697 -7.244 4.834 66 HG23 THR 8 HG23 THR 8 3.024 -5.548 4.466 67 H ALA 9 H ALA 9 3.308 -3.138 4.808 68 HA ALA 9 HA ALA 9 0.745 -2.113 5.827 69 HB1 ALA 9 HB1 ALA 9 1.140 -0.211 4.203 70 HB2 ALA 9 HB2 ALA 9 2.784 -0.831 4.052 71 HB3 ALA 9 HB3 ALA 9 2.185 -0.291 5.621 72 H LEU 10 H LEU 10 -0.968 -2.878 4.988 73 HA LEU 10 HA LEU 10 -0.997 -3.644 2.142 74 HB2 LEU 10 HB2 LEU 10 -1.488 -5.315 4.066 75 HB3 LEU 10 HB3 LEU 10 -3.018 -4.485 4.201 76 HG LEU 10 HG LEU 10 -2.323 -5.414 1.492 77 HD11 LEU 10 HD11 LEU 10 -2.710 -7.275 3.817 78 HD12 LEU 10 HD12 LEU 10 -1.499 -7.343 2.539 79 HD13 LEU 10 HD13 LEU 10 -3.181 -7.734 2.181 80 HD21 LEU 10 HD21 LEU 10 -4.703 -5.198 3.275 81 HD22 LEU 10 HD22 LEU 10 -4.760 -6.260 1.867 82 HD23 LEU 10 HD23 LEU 10 -4.449 -4.532 1.667 83 H TYR 11 H TYR 11 -1.657 -1.787 1.135 84 HA TYR 11 HA TYR 11 -4.033 -0.451 2.234 85 HB2 TYR 11 HB2 TYR 11 -2.190 1.048 2.321 86 HB3 TYR 11 HB3 TYR 11 -1.716 0.683 0.679 87 HD1 TYR 11 HD1 TYR 11 -4.816 1.857 2.419 88 HD2 TYR 11 HD2 TYR 11 -2.109 2.386 -0.821 89 HE1 TYR 11 HE1 TYR 11 -6.127 3.787 1.647 90 HE2 TYR 11 HE2 TYR 11 -3.411 4.320 -1.600 91 HH TYR 11 HH TYR 11 -6.109 5.003 -1.212 92 H GLU 12 H GLU 12 -5.881 -0.593 1.107 93 HA GLU 12 HA GLU 12 -5.651 -1.179 -1.776 94 HB2 GLU 12 HB2 GLU 12 -6.235 -3.131 -0.227 95 HB3 GLU 12 HB3 GLU 12 -7.788 -2.341 -0.010 96 HG2 GLU 12 HG2 GLU 12 -8.046 -4.004 -1.659 97 HG3 GLU 12 HG3 GLU 12 -8.110 -2.447 -2.474 98 H ARG 13 H ARG 13 -7.575 -0.737 -3.060 99 HA ARG 13 HA ARG 13 -9.567 1.047 -2.025 100 HB2 ARG 13 HB2 ARG 13 -7.835 2.668 -2.432 101 HB3 ARG 13 HB3 ARG 13 -7.565 2.038 -4.045 102 HG2 ARG 13 HG2 ARG 13 -9.898 2.720 -4.619 103 HG3 ARG 13 HG3 ARG 13 -9.978 3.521 -3.050 104 HD2 ARG 13 HD2 ARG 13 -9.015 5.310 -3.940 105 HD3 ARG 13 HD3 ARG 13 -7.576 4.352 -4.266 106 HE ARG 13 HE ARG 13 -9.757 4.902 -6.150 107 HH11 ARG 13 HH11 ARG 13 -6.544 3.617 -5.558 108 HH12 ARG 13 HH12 ARG 13 -6.132 3.548 -7.235 109 HH21 ARG 13 HH21 ARG 13 -9.207 4.805 -8.350 110 HH22 ARG 13 HH22 ARG 13 -7.647 4.224 -8.822 111 H LEU 14 H LEU 14 -11.423 0.379 -2.879 112 HA LEU 14 HA LEU 14 -11.436 -0.836 -5.546 113 HB2 LEU 14 HB2 LEU 14 -12.617 -2.507 -4.589 114 HB3 LEU 14 HB3 LEU 14 -12.522 -1.682 -3.052 115 HG LEU 14 HG LEU 14 -14.831 -2.288 -3.586 116 HD11 LEU 14 HD11 LEU 14 -15.649 -0.438 -2.640 117 HD12 LEU 14 HD12 LEU 14 -15.059 0.608 -3.925 118 HD13 LEU 14 HD13 LEU 14 -13.975 0.114 -2.627 119 HD21 LEU 14 HD21 LEU 14 -14.146 -1.479 -6.195 120 HD22 LEU 14 HD22 LEU 14 -15.392 -0.364 -5.638 121 HD23 LEU 14 HD23 LEU 14 -15.692 -2.099 -5.620 122 H SER 15 H SER 15 -12.908 -0.113 -7.081 123 HA SER 15 HA SER 15 -14.227 2.445 -6.462 124 HB2 SER 15 HB2 SER 15 -12.675 3.047 -8.059 125 HB3 SER 15 HB3 SER 15 -12.764 1.498 -8.887 126 HG SER 15 HG SER 15 -14.313 3.770 -9.194 127 H ARG 16 H ARG 16 -16.313 2.727 -6.829 128 HA ARG 16 HA ARG 16 -17.976 0.460 -7.445 129 HB2 ARG 16 HB2 ARG 16 -18.281 3.070 -6.209 130 HB3 ARG 16 HB3 ARG 16 -19.626 2.670 -7.264 131 HG2 ARG 16 HG2 ARG 16 -19.085 0.373 -5.727 132 HG3 ARG 16 HG3 ARG 16 -19.070 1.752 -4.626 133 HD2 ARG 16 HD2 ARG 16 -21.247 2.166 -6.339 134 HD3 ARG 16 HD3 ARG 16 -21.295 0.458 -5.911 135 HE ARG 16 HE ARG 16 -20.890 1.854 -3.554 136 HH11 ARG 16 HH11 ARG 16 -23.364 1.668 -6.023 137 HH12 ARG 16 HH12 ARG 16 -24.655 2.040 -4.932 138 HH21 ARG 16 HH21 ARG 16 -22.596 2.341 -2.119 139 HH22 ARG 16 HH22 ARG 16 -24.219 2.423 -2.716 140 H ASP 17 H ASP 17 -16.517 2.820 -9.364 141 HA ASP 17 HA ASP 17 -18.689 2.931 -11.312 142 HB2 ASP 17 HB2 ASP 17 -16.067 4.244 -11.835 143 HB3 ASP 17 HB3 ASP 17 -17.693 4.792 -12.219 144 H ASP 18 H ASP 18 -16.139 0.875 -10.712 145 HA ASP 18 HA ASP 18 -15.180 0.453 -13.367 146 HB2 ASP 18 HB2 ASP 18 -15.108 -1.472 -11.056 147 HB3 ASP 18 HB3 ASP 18 -14.079 -1.501 -12.480 148 H ASP 19 H ASP 19 -15.423 -1.576 -14.562 149 HA ASP 19 HA ASP 19 -18.177 -2.538 -14.465 150 HB2 ASP 19 HB2 ASP 19 -16.715 -1.605 -16.595 151 HB3 ASP 19 HB3 ASP 19 -16.567 -3.351 -16.772 152 H LEU 20 H LEU 20 -15.651 -3.412 -12.917 153 HA LEU 20 HA LEU 20 -14.858 -5.972 -13.650 154 HB2 LEU 20 HB2 LEU 20 -14.889 -5.999 -10.850 155 HB3 LEU 20 HB3 LEU 20 -13.534 -5.646 -11.896 156 HG LEU 20 HG LEU 20 -14.239 -3.218 -11.824 157 HD11 LEU 20 HD11 LEU 20 -16.520 -3.397 -11.117 158 HD12 LEU 20 HD12 LEU 20 -15.624 -2.578 -9.840 159 HD13 LEU 20 HD13 LEU 20 -16.054 -4.277 -9.662 160 HD21 LEU 20 HD21 LEU 20 -12.378 -4.123 -10.518 161 HD22 LEU 20 HD22 LEU 20 -13.495 -4.507 -9.209 162 HD23 LEU 20 HD23 LEU 20 -13.216 -2.826 -9.664 163 H THR 21 H THR 21 -17.069 -5.327 -10.942 164 HA THR 21 HA THR 21 -18.835 -6.409 -10.094 165 HB THR 21 HB THR 21 -20.523 -7.077 -11.550 166 HG1 THR 21 HG1 THR 21 -18.580 -7.721 -13.514 167 HG21 THR 21 HG21 THR 21 -19.738 -5.725 -13.827 168 HG22 THR 21 HG22 THR 21 -18.832 -4.940 -12.529 169 HG23 THR 21 HG23 THR 21 -20.592 -5.052 -12.439 170 H GLY 22 H GLY 22 -17.878 -7.760 -8.669 171 HA2 GLY 22 HA2 GLY 22 -18.267 -10.441 -8.695 172 HA3 GLY 22 HA3 GLY 22 -16.719 -10.268 -9.501 173 H GLU 23 H GLU 23 -14.902 -9.719 -8.325 174 HA GLU 23 HA GLU 23 -15.117 -10.159 -5.455 175 HB2 GLU 23 HB2 GLU 23 -13.432 -11.481 -6.329 176 HB3 GLU 23 HB3 GLU 23 -12.905 -10.249 -7.461 177 HG2 GLU 23 HG2 GLU 23 -12.549 -9.712 -4.566 178 HG3 GLU 23 HG3 GLU 23 -11.501 -10.908 -5.319 179 H SER 24 H SER 24 -13.262 -7.845 -7.445 180 HA SER 24 HA SER 24 -12.675 -6.159 -5.276 181 HB2 SER 24 HB2 SER 24 -12.036 -6.300 -8.054 182 HB3 SER 24 HB3 SER 24 -12.476 -4.643 -7.649 183 HG SER 24 HG SER 24 -10.678 -4.460 -6.599 184 H ASN 25 H ASN 25 -15.730 -6.498 -6.438 185 HA ASN 25 HA ASN 25 -16.337 -3.661 -6.476 186 HB2 ASN 25 HB2 ASN 25 -18.347 -4.167 -7.480 187 HB3 ASN 25 HB3 ASN 25 -17.356 -5.509 -8.026 188 HD21 ASN 25 HD21 ASN 25 -17.448 -7.452 -6.462 189 HD22 ASN 25 HD22 ASN 25 -19.025 -7.886 -5.915 190 H SER 26 H SER 26 -15.378 -4.326 -3.994 191 HA SER 26 HA SER 26 -17.602 -3.549 -2.368 192 HB2 SER 26 HB2 SER 26 -16.511 -6.309 -2.207 193 HB3 SER 26 HB3 SER 26 -16.899 -5.507 -0.687 194 HG SER 26 HG SER 26 -18.932 -5.790 -1.098 195 H ILE 27 H ILE 27 -14.964 -5.209 -0.851 196 HA ILE 27 HA ILE 27 -13.143 -3.075 -0.650 197 HB ILE 27 HB ILE 27 -15.239 -3.194 1.472 198 HG12 ILE 27 HG12 ILE 27 -15.385 -1.241 0.194 199 HG13 ILE 27 HG13 ILE 27 -14.489 -0.718 1.610 200 HG21 ILE 27 HG21 ILE 27 -13.420 -1.951 2.932 201 HG22 ILE 27 HG22 ILE 27 -12.326 -2.993 2.025 202 HG23 ILE 27 HG23 ILE 27 -13.617 -3.702 2.995 203 HD11 ILE 27 HD11 ILE 27 -13.313 0.258 -0.101 204 HD12 ILE 27 HD12 ILE 27 -13.533 -1.116 -1.185 205 HD13 ILE 27 HD13 ILE 27 -12.399 -1.229 0.159 206 H THR 28 H THR 28 -14.390 -5.406 1.742 207 HA THR 28 HA THR 28 -11.919 -6.326 2.623 208 HB THR 28 HB THR 28 -14.583 -6.813 3.230 209 HG1 THR 28 HG1 THR 28 -13.713 -7.464 5.060 210 HG21 THR 28 HG21 THR 28 -13.265 -9.426 2.558 211 HG22 THR 28 HG22 THR 28 -14.682 -8.743 1.761 212 HG23 THR 28 HG23 THR 28 -14.768 -9.223 3.456 213 H ASN 29 H ASN 29 -13.699 -7.209 -0.261 214 HA ASN 29 HA ASN 29 -12.512 -9.703 -0.749 215 HB2 ASN 29 HB2 ASN 29 -13.437 -7.742 -2.858 216 HB3 ASN 29 HB3 ASN 29 -13.273 -9.481 -3.020 217 HD21 ASN 29 HD21 ASN 29 -15.168 -10.432 -3.093 218 HD22 ASN 29 HD22 ASN 29 -16.555 -10.010 -2.155 219 H GLN 30 H GLN 30 -11.603 -6.510 -2.210 220 HA GLN 30 HA GLN 30 -9.223 -7.559 -3.343 221 HB2 GLN 30 HB2 GLN 30 -9.088 -4.723 -2.598 222 HB3 GLN 30 HB3 GLN 30 -8.826 -5.486 -4.150 223 HG2 GLN 30 HG2 GLN 30 -10.673 -4.237 -4.604 224 HG3 GLN 30 HG3 GLN 30 -11.430 -5.749 -4.110 225 HE21 GLN 30 HE21 GLN 30 -9.944 -3.220 -2.121 226 HE22 GLN 30 HE22 GLN 30 -11.351 -2.885 -1.196 227 H LYS 31 H LYS 31 -9.993 -6.318 -0.141 228 HA LYS 31 HA LYS 31 -7.408 -5.904 0.851 229 HB2 LYS 31 HB2 LYS 31 -9.776 -7.022 2.372 230 HB3 LYS 31 HB3 LYS 31 -8.357 -6.260 3.071 231 HG2 LYS 31 HG2 LYS 31 -9.244 -4.309 1.401 232 HG3 LYS 31 HG3 LYS 31 -10.752 -5.066 1.915 233 HD2 LYS 31 HD2 LYS 31 -8.777 -4.577 4.035 234 HD3 LYS 31 HD3 LYS 31 -9.496 -3.139 3.311 235 HE2 LYS 31 HE2 LYS 31 -11.619 -4.905 3.733 236 HE3 LYS 31 HE3 LYS 31 -10.618 -5.030 5.179 237 HZ1 LYS 31 HZ1 LYS 31 -12.454 -3.223 5.008 238 HZ2 LYS 31 HZ2 LYS 31 -11.290 -2.370 4.129 239 HZ3 LYS 31 HZ3 LYS 31 -10.967 -2.848 5.719 240 H LYS 32 H LYS 32 -9.481 -8.797 0.958 241 HA LYS 32 HA LYS 32 -7.638 -10.565 2.101 242 HB2 LYS 32 HB2 LYS 32 -10.170 -10.798 0.605 243 HB3 LYS 32 HB3 LYS 32 -9.133 -12.217 0.559 244 HG2 LYS 32 HG2 LYS 32 -9.831 -12.805 2.568 245 HG3 LYS 32 HG3 LYS 32 -9.215 -11.296 3.236 246 HD2 LYS 32 HD2 LYS 32 -11.590 -10.603 1.943 247 HD3 LYS 32 HD3 LYS 32 -11.942 -12.121 2.768 248 HE2 LYS 32 HE2 LYS 32 -12.450 -10.303 4.251 249 HE3 LYS 32 HE3 LYS 32 -11.025 -11.144 4.854 250 HZ1 LYS 32 HZ1 LYS 32 -11.309 -8.426 4.124 251 HZ2 LYS 32 HZ2 LYS 32 -10.097 -9.138 3.185 252 HZ3 LYS 32 HZ3 LYS 32 -10.002 -9.195 4.872 253 H TYR 33 H TYR 33 -8.019 -9.437 -1.200 254 HA TYR 33 HA TYR 33 -6.560 -11.363 -2.601 255 HB2 TYR 33 HB2 TYR 33 -7.798 -9.436 -3.643 256 HB3 TYR 33 HB3 TYR 33 -6.518 -8.376 -3.091 257 HD1 TYR 33 HD1 TYR 33 -7.202 -11.262 -5.323 258 HD2 TYR 33 HD2 TYR 33 -4.541 -8.118 -4.283 259 HE1 TYR 33 HE1 TYR 33 -5.878 -11.715 -7.347 260 HE2 TYR 33 HE2 TYR 33 -3.214 -8.552 -6.285 261 HH TYR 33 HH TYR 33 -2.822 -10.632 -7.824 262 H LEU 34 H LEU 34 -5.365 -8.204 -1.460 263 HA LEU 34 HA LEU 34 -2.645 -8.626 -1.822 264 HB2 LEU 34 HB2 LEU 34 -4.205 -6.995 0.168 265 HB3 LEU 34 HB3 LEU 34 -2.461 -7.029 0.204 266 HG LEU 34 HG LEU 34 -2.271 -5.604 -1.523 267 HD11 LEU 34 HD11 LEU 34 -4.702 -6.792 -2.843 268 HD12 LEU 34 HD12 LEU 34 -3.040 -7.307 -3.136 269 HD13 LEU 34 HD13 LEU 34 -3.545 -5.673 -3.563 270 HD21 LEU 34 HD21 LEU 34 -3.875 -4.532 -0.036 271 HD22 LEU 34 HD22 LEU 34 -5.205 -5.234 -0.972 272 HD23 LEU 34 HD23 LEU 34 -4.124 -4.053 -1.718 273 H GLU 35 H GLU 35 -4.797 -9.647 0.790 274 HA GLU 35 HA GLU 35 -2.853 -10.451 2.617 275 HB2 GLU 35 HB2 GLU 35 -5.646 -10.554 2.487 276 HB3 GLU 35 HB3 GLU 35 -5.126 -12.223 2.684 277 HG2 GLU 35 HG2 GLU 35 -3.604 -10.657 4.467 278 HG3 GLU 35 HG3 GLU 35 -5.277 -10.151 4.626 279 H ASP 36 H ASP 36 -4.550 -12.283 0.108 280 HA ASP 36 HA ASP 36 -3.340 -14.757 0.402 281 HB2 ASP 36 HB2 ASP 36 -5.181 -13.793 -1.279 282 HB3 ASP 36 HB3 ASP 36 -3.798 -13.762 -2.362 283 H TYR 37 H TYR 37 -2.117 -11.803 -0.988 284 HA TYR 37 HA TYR 37 0.175 -13.008 -2.232 285 HB2 TYR 37 HB2 TYR 37 -0.571 -10.975 -3.206 286 HB3 TYR 37 HB3 TYR 37 -0.622 -10.154 -1.658 287 HD1 TYR 37 HD1 TYR 37 1.505 -9.532 -0.533 288 HD2 TYR 37 HD2 TYR 37 1.417 -11.045 -4.492 289 HE1 TYR 37 HE1 TYR 37 3.801 -8.716 -0.883 290 HE2 TYR 37 HE2 TYR 37 3.705 -10.220 -4.873 291 HH TYR 37 HH TYR 37 5.211 -8.014 -2.921 292 H ALA 38 H ALA 38 -0.116 -10.691 0.474 293 HA ALA 38 HA ALA 38 2.454 -10.774 1.389 294 HB1 ALA 38 HB1 ALA 38 0.523 -9.337 2.190 295 HB2 ALA 38 HB2 ALA 38 1.690 -9.858 3.406 296 HB3 ALA 38 HB3 ALA 38 0.130 -10.670 3.273 297 H ARG 39 H ARG 39 -0.068 -13.196 1.922 298 HA ARG 39 HA ARG 39 1.499 -14.622 3.885 299 HB2 ARG 39 HB2 ARG 39 -0.206 -16.400 3.668 300 HB3 ARG 39 HB3 ARG 39 -0.890 -14.829 4.044 301 HG2 ARG 39 HG2 ARG 39 -1.076 -14.751 1.380 302 HG3 ARG 39 HG3 ARG 39 -1.172 -16.498 1.636 303 HD2 ARG 39 HD2 ARG 39 -2.832 -15.558 3.590 304 HD3 ARG 39 HD3 ARG 39 -3.110 -14.401 2.293 305 HE ARG 39 HE ARG 39 -3.239 -17.232 1.613 306 HH11 ARG 39 HH11 ARG 39 -4.979 -14.275 2.316 307 HH12 ARG 39 HH12 ARG 39 -6.445 -14.824 1.581 308 HH21 ARG 39 HH21 ARG 39 -5.175 -17.942 0.648 309 HH22 ARG 39 HH22 ARG 39 -6.557 -16.900 0.634 310 H ARG 40 H ARG 40 0.699 -15.040 0.449 311 HA ARG 40 HA ARG 40 2.213 -17.409 0.103 312 HB2 ARG 40 HB2 ARG 40 1.754 -17.206 -2.177 313 HB3 ARG 40 HB3 ARG 40 0.397 -16.389 -1.432 314 HG2 ARG 40 HG2 ARG 40 1.431 -14.239 -1.901 315 HG3 ARG 40 HG3 ARG 40 2.816 -15.053 -2.624 316 HD2 ARG 40 HD2 ARG 40 1.365 -16.027 -4.322 317 HD3 ARG 40 HD3 ARG 40 -0.036 -15.259 -3.580 318 HE ARG 40 HE ARG 40 0.506 -13.333 -4.668 319 HH11 ARG 40 HH11 ARG 40 3.370 -15.338 -4.550 320 HH12 ARG 40 HH12 ARG 40 4.284 -14.306 -5.593 321 HH21 ARG 40 HH21 ARG 40 1.711 -11.989 -6.062 322 HH22 ARG 40 HH22 ARG 40 3.343 -12.407 -6.454 323 H ASN 41 H ASN 41 3.104 -14.161 0.579 324 HA ASN 41 HA ASN 41 5.728 -14.462 -0.645 325 HB2 ASN 41 HB2 ASN 41 4.037 -12.183 0.246 326 HB3 ASN 41 HB3 ASN 41 5.776 -11.959 0.283 327 HD21 ASN 41 HD21 ASN 41 3.150 -13.028 -1.816 328 HD22 ASN 41 HD22 ASN 41 3.846 -12.447 -3.282 329 H GLY 42 H GLY 42 4.200 -13.914 2.495 330 HA2 GLY 42 HA2 GLY 42 5.102 -14.907 4.487 331 HA3 GLY 42 HA3 GLY 42 6.703 -14.767 3.787 332 H PHE 43 H PHE 43 4.065 -12.398 4.304 333 HA PHE 43 HA PHE 43 6.034 -10.660 5.637 334 HB2 PHE 43 HB2 PHE 43 3.490 -10.005 4.152 335 HB3 PHE 43 HB3 PHE 43 4.432 -8.818 5.037 336 HD1 PHE 43 HD1 PHE 43 7.105 -9.048 4.380 337 HD2 PHE 43 HD2 PHE 43 3.769 -9.948 1.921 338 HE1 PHE 43 HE1 PHE 43 8.489 -8.690 2.376 339 HE2 PHE 43 HE2 PHE 43 5.127 -9.611 -0.082 340 HZ PHE 43 HZ PHE 43 7.501 -8.972 0.136 341 H GLU 44 H GLU 44 5.656 -9.859 7.657 342 HA GLU 44 HA GLU 44 3.431 -11.008 9.140 343 HB2 GLU 44 HB2 GLU 44 6.084 -9.856 9.877 344 HB3 GLU 44 HB3 GLU 44 4.816 -10.021 11.083 345 HG2 GLU 44 HG2 GLU 44 6.535 -11.846 10.876 346 HG3 GLU 44 HG3 GLU 44 4.846 -12.311 10.988 347 H ASN 45 H ASN 45 2.615 -9.737 10.966 348 HA ASN 45 HA ASN 45 1.280 -8.048 11.670 349 HB2 ASN 45 HB2 ASN 45 3.661 -6.472 10.729 350 HB3 ASN 45 HB3 ASN 45 2.429 -5.863 11.827 351 HD21 ASN 45 HD21 ASN 45 5.410 -7.248 11.587 352 HD22 ASN 45 HD22 ASN 45 5.600 -7.804 13.216 353 H ILE 46 H ILE 46 0.945 -8.784 8.810 354 HA ILE 46 HA ILE 46 0.715 -6.665 7.089 355 HB ILE 46 HB ILE 46 -1.173 -9.001 7.256 356 HG12 ILE 46 HG12 ILE 46 1.175 -8.837 5.411 357 HG13 ILE 46 HG13 ILE 46 1.426 -9.365 7.074 358 HG21 ILE 46 HG21 ILE 46 -2.139 -8.220 5.417 359 HG22 ILE 46 HG22 ILE 46 -0.581 -7.962 4.632 360 HG23 ILE 46 HG23 ILE 46 -1.257 -6.716 5.678 361 HD11 ILE 46 HD11 ILE 46 -0.789 -10.708 5.688 362 HD12 ILE 46 HD12 ILE 46 0.493 -11.367 6.710 363 HD13 ILE 46 HD13 ILE 46 0.814 -11.014 5.014 364 H ARG 47 H ARG 47 -0.062 -4.847 7.757 365 HA ARG 47 HA ARG 47 -2.610 -4.702 9.156 366 HB2 ARG 47 HB2 ARG 47 -0.356 -3.211 9.405 367 HB3 ARG 47 HB3 ARG 47 -1.309 -2.194 8.330 368 HG2 ARG 47 HG2 ARG 47 -2.851 -3.246 10.552 369 HG3 ARG 47 HG3 ARG 47 -1.485 -2.264 11.061 370 HD2 ARG 47 HD2 ARG 47 -2.523 -0.402 10.469 371 HD3 ARG 47 HD3 ARG 47 -2.819 -1.029 8.849 372 HE ARG 47 HE ARG 47 -4.704 -2.283 10.308 373 HH11 ARG 47 HH11 ARG 47 -3.827 1.089 10.017 374 HH12 ARG 47 HH12 ARG 47 -5.415 1.659 10.391 375 HH21 ARG 47 HH21 ARG 47 -6.795 -1.525 10.797 376 HH22 ARG 47 HH22 ARG 47 -7.101 0.179 10.832 377 H HIS 48 H HIS 48 -4.477 -4.037 8.310 378 HA HIS 48 HA HIS 48 -4.457 -3.609 5.420 379 HB2 HIS 48 HB2 HIS 48 -6.540 -4.683 7.294 380 HB3 HIS 48 HB3 HIS 48 -7.000 -4.072 5.705 381 HD1 HIS 48 HD1 HIS 48 -6.831 -5.660 3.833 382 HD2 HIS 48 HD2 HIS 48 -4.567 -6.856 7.095 383 HE1 HIS 48 HE1 HIS 48 -5.951 -7.930 3.230 384 HE2 HIS 48 HE2 HIS 48 -4.414 -8.537 5.136 385 H PHE 49 H PHE 49 -4.675 -1.672 4.655 386 HA PHE 49 HA PHE 49 -6.017 0.384 6.265 387 HB2 PHE 49 HB2 PHE 49 -4.088 0.767 3.947 388 HB3 PHE 49 HB3 PHE 49 -4.744 2.032 4.978 389 HD1 PHE 49 HD1 PHE 49 -4.076 2.163 7.331 390 HD2 PHE 49 HD2 PHE 49 -2.225 -0.567 4.651 391 HE1 PHE 49 HE1 PHE 49 -2.217 1.892 8.910 392 HE2 PHE 49 HE2 PHE 49 -0.361 -0.845 6.237 393 HZ PHE 49 HZ PHE 49 -0.356 0.382 8.362 394 H THR 50 H THR 50 -8.028 0.271 5.816 395 HA THR 50 HA THR 50 -9.136 -0.444 3.315 396 HB THR 50 HB THR 50 -10.076 -0.859 5.618 397 HG1 THR 50 HG1 THR 50 -11.939 0.378 3.881 398 HG21 THR 50 HG21 THR 50 -10.210 1.028 6.850 399 HG22 THR 50 HG22 THR 50 -11.823 1.056 6.141 400 HG23 THR 50 HG23 THR 50 -10.542 2.057 5.459 401 H ASP 51 H ASP 51 -10.615 0.657 2.057 402 HA ASP 51 HA ASP 51 -10.135 3.548 1.863 403 HB2 ASP 51 HB2 ASP 51 -10.395 3.342 -0.535 404 HB3 ASP 51 HB3 ASP 51 -9.169 2.205 0.013 405 H ASP 52 H ASP 52 -11.806 4.896 1.343 406 HA ASP 52 HA ASP 52 -14.427 3.969 0.739 407 HB2 ASP 52 HB2 ASP 52 -14.447 3.468 3.129 408 HB3 ASP 52 HB3 ASP 52 -13.931 5.109 3.498 409 H GLY 53 H GLY 53 -14.829 5.433 -0.807 410 HA2 GLY 53 HA2 GLY 53 -15.050 7.447 -1.895 411 HA3 GLY 53 HA3 GLY 53 -15.371 8.122 -0.305 412 H PHE 54 H PHE 54 -12.573 6.913 -2.171 413 HA PHE 54 HA PHE 54 -10.817 8.793 -0.873 414 HB2 PHE 54 HB2 PHE 54 -10.466 6.500 -2.758 415 HB3 PHE 54 HB3 PHE 54 -9.199 7.716 -2.684 416 HD1 PHE 54 HD1 PHE 54 -9.755 8.210 0.394 417 HD2 PHE 54 HD2 PHE 54 -8.946 4.759 -1.981 418 HE1 PHE 54 HE1 PHE 54 -8.822 7.072 2.346 419 HE2 PHE 54 HE2 PHE 54 -8.008 3.637 -0.002 420 HZ PHE 54 HZ PHE 54 -7.961 4.803 2.171 421 H SER 55 H SER 55 -9.702 10.427 -1.831 422 HA SER 55 HA SER 55 -11.021 11.798 -3.980 423 HB2 SER 55 HB2 SER 55 -8.677 12.388 -2.202 424 HB3 SER 55 HB3 SER 55 -8.912 13.343 -3.665 425 HG SER 55 HG SER 55 -11.051 13.793 -2.878 426 H GLY 56 H GLY 56 -9.611 12.722 -5.829 427 HA2 GLY 56 HA2 GLY 56 -7.894 10.538 -6.838 428 HA3 GLY 56 HA3 GLY 56 -8.988 11.450 -7.859 429 H VAL 57 H VAL 57 -6.834 12.812 -5.372 430 HA VAL 57 HA VAL 57 -5.600 14.383 -7.509 431 HB VAL 57 HB VAL 57 -4.877 15.956 -5.881 432 HG11 VAL 57 HG11 VAL 57 -7.679 15.053 -5.230 433 HG12 VAL 57 HG12 VAL 57 -7.205 16.147 -6.530 434 HG13 VAL 57 HG13 VAL 57 -6.997 16.634 -4.848 435 HG21 VAL 57 HG21 VAL 57 -5.313 15.630 -3.453 436 HG22 VAL 57 HG22 VAL 57 -4.113 14.523 -4.117 437 HG23 VAL 57 HG23 VAL 57 -5.754 13.958 -3.800 438 H ASN 58 H ASN 58 -4.599 12.420 -4.677 439 HA ASN 58 HA ASN 58 -2.411 11.203 -5.942 440 HB2 ASN 58 HB2 ASN 58 -1.797 13.771 -4.510 441 HB3 ASN 58 HB3 ASN 58 -0.633 12.459 -4.459 442 HD21 ASN 58 HD21 ASN 58 -1.173 15.229 -5.895 443 HD22 ASN 58 HD22 ASN 58 -0.538 14.931 -7.468 444 H PHE 59 H PHE 59 -1.621 12.434 -2.797 445 HA PHE 59 HA PHE 59 -2.421 9.864 -1.603 446 HB2 PHE 59 HB2 PHE 59 -0.144 11.551 -0.579 447 HB3 PHE 59 HB3 PHE 59 -0.457 9.844 -0.297 448 HD1 PHE 59 HD1 PHE 59 0.362 12.204 -3.078 449 HD2 PHE 59 HD2 PHE 59 0.771 8.277 -1.486 450 HE1 PHE 59 HE1 PHE 59 1.914 11.628 -4.892 451 HE2 PHE 59 HE2 PHE 59 2.322 7.703 -3.299 452 HZ PHE 59 HZ PHE 59 2.895 9.377 -5.007 453 H ASN 60 H ASN 60 -1.802 10.541 1.063 454 HA ASN 60 HA ASN 60 -2.645 11.492 2.933 455 HB2 ASN 60 HB2 ASN 60 -3.472 13.774 1.125 456 HB3 ASN 60 HB3 ASN 60 -3.450 13.812 2.883 457 HD21 ASN 60 HD21 ASN 60 -0.957 12.277 3.073 458 HD22 ASN 60 HD22 ASN 60 0.301 13.356 2.602 459 H ARG 61 H ARG 61 -4.071 9.675 2.815 460 HA ARG 61 HA ARG 61 -6.909 10.448 2.497 461 HB2 ARG 61 HB2 ARG 61 -6.365 7.585 2.251 462 HB3 ARG 61 HB3 ARG 61 -7.366 8.621 1.257 463 HG2 ARG 61 HG2 ARG 61 -4.499 9.031 0.814 464 HG3 ARG 61 HG3 ARG 61 -5.044 7.390 0.481 465 HD2 ARG 61 HD2 ARG 61 -5.435 8.342 -1.550 466 HD3 ARG 61 HD3 ARG 61 -6.990 8.635 -0.778 467 HE ARG 61 HE ARG 61 -4.913 10.608 -1.345 468 HH11 ARG 61 HH11 ARG 61 -8.081 9.912 -0.016 469 HH12 ARG 61 HH12 ARG 61 -8.567 11.570 0.001 470 HH21 ARG 61 HH21 ARG 61 -5.565 12.784 -1.316 471 HH22 ARG 61 HH22 ARG 61 -7.139 13.202 -0.732 472 HA PRO 62 HA PRO 62 -7.751 9.059 6.633 473 HB2 PRO 62 HB2 PRO 62 -9.671 7.100 6.277 474 HB3 PRO 62 HB3 PRO 62 -10.006 8.835 6.248 475 HG2 PRO 62 HG2 PRO 62 -9.491 6.976 3.950 476 HG3 PRO 62 HG3 PRO 62 -10.760 8.189 4.117 477 HD2 PRO 62 HD2 PRO 62 -8.642 8.760 2.667 478 HD3 PRO 62 HD3 PRO 62 -9.269 9.972 3.803 479 H GLY 63 H GLY 63 -8.311 5.981 4.908 480 HA2 GLY 63 HA2 GLY 63 -6.926 4.363 6.724 481 HA3 GLY 63 HA3 GLY 63 -7.304 3.929 5.061 482 H PHE 64 H PHE 64 -5.889 6.097 3.857 483 HA PHE 64 HA PHE 64 -3.321 4.981 3.559 484 HB2 PHE 64 HB2 PHE 64 -4.490 6.310 1.837 485 HB3 PHE 64 HB3 PHE 64 -4.340 7.740 2.847 486 HD1 PHE 64 HD1 PHE 64 -1.825 8.226 3.598 487 HD2 PHE 64 HD2 PHE 64 -3.007 6.065 0.144 488 HE1 PHE 64 HE1 PHE 64 0.338 8.726 2.558 489 HE2 PHE 64 HE2 PHE 64 -0.855 6.563 -0.910 490 HZ PHE 64 HZ PHE 64 0.837 7.888 0.297 491 H GLN 65 H GLN 65 -4.546 7.764 5.381 492 HA GLN 65 HA GLN 65 -2.106 8.801 6.256 493 HB2 GLN 65 HB2 GLN 65 -4.919 8.973 7.225 494 HB3 GLN 65 HB3 GLN 65 -3.640 9.515 8.301 495 HG2 GLN 65 HG2 GLN 65 -3.183 10.611 5.712 496 HG3 GLN 65 HG3 GLN 65 -4.856 10.912 6.174 497 HE21 GLN 65 HE21 GLN 65 -5.267 12.540 7.521 498 HE22 GLN 65 HE22 GLN 65 -4.082 13.425 8.409 499 H SER 66 H SER 66 -4.034 6.117 7.385 500 HA SER 66 HA SER 66 -2.556 5.733 9.821 501 HB2 SER 66 HB2 SER 66 -4.910 4.825 9.250 502 HB3 SER 66 HB3 SER 66 -4.060 3.566 8.365 503 HG SER 66 HG SER 66 -4.574 3.607 10.921 504 H LEU 67 H LEU 67 -2.493 4.451 6.529 505 HA LEU 67 HA LEU 67 -0.446 2.571 6.758 506 HB2 LEU 67 HB2 LEU 67 -1.236 2.339 4.655 507 HB3 LEU 67 HB3 LEU 67 -1.905 3.957 4.672 508 HG LEU 67 HG LEU 67 0.371 4.816 4.036 509 HD11 LEU 67 HD11 LEU 67 1.741 3.016 4.806 510 HD12 LEU 67 HD12 LEU 67 1.901 3.112 3.054 511 HD13 LEU 67 HD13 LEU 67 0.887 1.862 3.784 512 HD21 LEU 67 HD21 LEU 67 0.136 4.228 1.716 513 HD22 LEU 67 HD22 LEU 67 -1.468 4.429 2.422 514 HD23 LEU 67 HD23 LEU 67 -0.828 2.812 2.134 515 H ILE 68 H ILE 68 -0.287 5.997 5.781 516 HA ILE 68 HA ILE 68 2.528 6.171 5.692 517 HB ILE 68 HB ILE 68 0.442 7.851 5.016 518 HG12 ILE 68 HG12 ILE 68 2.177 9.365 4.189 519 HG13 ILE 68 HG13 ILE 68 3.369 8.589 5.225 520 HG21 ILE 68 HG21 ILE 68 1.903 9.048 7.362 521 HG22 ILE 68 HG22 ILE 68 0.167 8.795 7.176 522 HG23 ILE 68 HG23 ILE 68 0.991 9.998 6.187 523 HD11 ILE 68 HD11 ILE 68 1.897 7.256 2.963 524 HD12 ILE 68 HD12 ILE 68 3.162 6.536 3.960 525 HD13 ILE 68 HD13 ILE 68 3.544 7.887 2.891 526 H LYS 69 H LYS 69 0.167 6.681 8.268 527 HA LYS 69 HA LYS 69 1.766 7.879 10.200 528 HB2 LYS 69 HB2 LYS 69 -0.313 7.825 11.061 529 HB3 LYS 69 HB3 LYS 69 -0.750 6.396 10.144 530 HG2 LYS 69 HG2 LYS 69 -0.902 5.499 12.192 531 HG3 LYS 69 HG3 LYS 69 0.823 5.251 11.974 532 HD2 LYS 69 HD2 LYS 69 -0.548 7.449 13.507 533 HD3 LYS 69 HD3 LYS 69 0.497 6.176 14.139 534 HE2 LYS 69 HE2 LYS 69 2.423 7.144 13.207 535 HE3 LYS 69 HE3 LYS 69 1.486 8.193 12.146 536 HZ1 LYS 69 HZ1 LYS 69 0.644 9.266 14.250 537 HZ2 LYS 69 HZ2 LYS 69 2.267 9.547 13.871 538 HZ3 LYS 69 HZ3 LYS 69 1.863 8.427 15.070 539 H GLU 70 H GLU 70 1.503 4.506 9.239 540 HA GLU 70 HA GLU 70 3.178 3.518 11.345 541 HB2 GLU 70 HB2 GLU 70 2.409 2.265 8.692 542 HB3 GLU 70 HB3 GLU 70 3.248 1.432 9.993 543 HG2 GLU 70 HG2 GLU 70 0.412 2.363 9.870 544 HG3 GLU 70 HG3 GLU 70 1.047 0.763 10.241 545 H VAL 71 H VAL 71 3.604 4.606 8.018 546 HA VAL 71 HA VAL 71 6.282 3.803 7.675 547 HB VAL 71 HB VAL 71 4.999 6.272 6.472 548 HG11 VAL 71 HG11 VAL 71 6.711 5.178 4.625 549 HG12 VAL 71 HG12 VAL 71 7.562 4.947 6.154 550 HG13 VAL 71 HG13 VAL 71 7.048 6.561 5.664 551 HG21 VAL 71 HG21 VAL 71 3.878 3.880 6.168 552 HG22 VAL 71 HG22 VAL 71 5.134 3.735 4.939 553 HG23 VAL 71 HG23 VAL 71 3.966 5.051 4.853 554 H GLU 72 H GLU 72 4.903 6.907 8.771 555 HA GLU 72 HA GLU 72 7.335 8.251 9.149 556 HB2 GLU 72 HB2 GLU 72 5.859 9.588 10.885 557 HB3 GLU 72 HB3 GLU 72 5.614 9.749 9.155 558 HG2 GLU 72 HG2 GLU 72 3.661 8.518 9.184 559 HG3 GLU 72 HG3 GLU 72 4.041 7.742 10.718 560 H ALA 73 H ALA 73 5.358 6.391 11.428 561 HA ALA 73 HA ALA 73 6.999 6.803 13.695 562 HB1 ALA 73 HB1 ALA 73 4.644 5.337 13.032 563 HB2 ALA 73 HB2 ALA 73 5.245 5.801 14.625 564 HB3 ALA 73 HB3 ALA 73 5.753 4.272 13.899 565 H GLY 74 H GLY 74 7.371 4.851 10.891 566 HA2 GLY 74 HA2 GLY 74 9.206 3.659 10.202 567 HA3 GLY 74 HA3 GLY 74 9.931 3.851 11.785 568 H ASN 75 H ASN 75 6.972 2.373 10.475 569 HA ASN 75 HA ASN 75 7.585 -0.125 11.924 570 HB2 ASN 75 HB2 ASN 75 5.108 1.515 11.706 571 HB3 ASN 75 HB3 ASN 75 4.907 -0.221 11.731 572 HD21 ASN 75 HD21 ASN 75 3.750 1.054 13.681 573 HD22 ASN 75 HD22 ASN 75 4.610 0.913 15.163 574 H VAL 76 H VAL 76 5.666 1.215 9.215 575 HA VAL 76 HA VAL 76 5.126 -1.195 7.935 576 HB VAL 76 HB VAL 76 4.003 0.903 7.349 577 HG11 VAL 76 HG11 VAL 76 5.038 2.743 6.809 578 HG12 VAL 76 HG12 VAL 76 5.913 1.953 5.502 579 HG13 VAL 76 HG13 VAL 76 6.562 1.931 7.141 580 HG21 VAL 76 HG21 VAL 76 5.434 -0.268 4.969 581 HG22 VAL 76 HG22 VAL 76 3.879 0.565 4.965 582 HG23 VAL 76 HG23 VAL 76 4.040 -1.000 5.764 583 H GLU 77 H GLU 77 6.956 -2.531 7.887 584 HA GLU 77 HA GLU 77 9.384 -1.679 6.587 585 HB2 GLU 77 HB2 GLU 77 10.267 -3.800 7.120 586 HB3 GLU 77 HB3 GLU 77 9.249 -3.355 8.481 587 HG2 GLU 77 HG2 GLU 77 7.580 -4.876 7.881 588 HG3 GLU 77 HG3 GLU 77 8.228 -5.073 6.257 589 H THR 78 H THR 78 6.402 -2.715 5.440 590 HA THR 78 HA THR 78 7.469 -3.091 2.769 591 HB THR 78 HB THR 78 5.568 -5.197 3.667 592 HG1 THR 78 HG1 THR 78 6.969 -6.154 4.889 593 HG21 THR 78 HG21 THR 78 5.956 -5.515 1.471 594 HG22 THR 78 HG22 THR 78 7.285 -6.471 2.133 595 HG23 THR 78 HG23 THR 78 7.579 -4.832 1.551 596 H LEU 79 H LEU 79 5.874 -2.933 1.123 597 HA LEU 79 HA LEU 79 3.247 -2.028 2.066 598 HB2 LEU 79 HB2 LEU 79 4.893 -0.199 1.255 599 HB3 LEU 79 HB3 LEU 79 4.536 -0.819 -0.322 600 HG LEU 79 HG LEU 79 2.975 0.818 -0.298 601 HD11 LEU 79 HD11 LEU 79 0.794 0.059 0.293 602 HD12 LEU 79 HD12 LEU 79 1.460 -1.139 1.397 603 HD13 LEU 79 HD13 LEU 79 1.713 -1.306 -0.338 604 HD21 LEU 79 HD21 LEU 79 1.776 1.352 1.977 605 HD22 LEU 79 HD22 LEU 79 3.347 2.044 1.568 606 HD23 LEU 79 HD23 LEU 79 3.251 0.648 2.643 607 H ILE 80 H ILE 80 1.722 -3.221 1.278 608 HA ILE 80 HA ILE 80 2.087 -4.551 -1.318 609 HB ILE 80 HB ILE 80 0.758 -5.414 1.205 610 HG12 ILE 80 HG12 ILE 80 1.755 -7.615 0.412 611 HG13 ILE 80 HG13 ILE 80 2.507 -6.695 -0.887 612 HG21 ILE 80 HG21 ILE 80 -0.213 -6.046 -1.541 613 HG22 ILE 80 HG22 ILE 80 -1.130 -5.706 -0.075 614 HG23 ILE 80 HG23 ILE 80 -0.321 -7.260 -0.267 615 HD11 ILE 80 HD11 ILE 80 2.909 -5.995 1.996 616 HD12 ILE 80 HD12 ILE 80 3.864 -5.503 0.598 617 HD13 ILE 80 HD13 ILE 80 3.915 -7.175 1.156 618 H VAL 81 H VAL 81 1.000 -3.617 -2.889 619 HA VAL 81 HA VAL 81 -1.712 -2.587 -2.382 620 HB VAL 81 HB VAL 81 0.250 -1.243 -4.246 621 HG11 VAL 81 HG11 VAL 81 -2.579 -0.918 -3.616 622 HG12 VAL 81 HG12 VAL 81 -1.652 -0.356 -5.004 623 HG13 VAL 81 HG13 VAL 81 -1.666 0.586 -3.516 624 HG21 VAL 81 HG21 VAL 81 1.221 -0.718 -2.183 625 HG22 VAL 81 HG22 VAL 81 -0.339 -0.660 -1.346 626 HG23 VAL 81 HG23 VAL 81 0.122 0.640 -2.454 627 H LYS 82 H LYS 82 -3.140 -2.707 -4.174 628 HA LYS 82 HA LYS 82 -2.886 -4.942 -5.844 629 HB2 LYS 82 HB2 LYS 82 -4.862 -3.048 -5.253 630 HB3 LYS 82 HB3 LYS 82 -4.609 -2.909 -6.983 631 HG2 LYS 82 HG2 LYS 82 -5.026 -5.565 -5.671 632 HG3 LYS 82 HG3 LYS 82 -6.378 -4.544 -6.169 633 HD2 LYS 82 HD2 LYS 82 -6.040 -4.948 -8.351 634 HD3 LYS 82 HD3 LYS 82 -4.283 -4.878 -8.190 635 HE2 LYS 82 HE2 LYS 82 -4.243 -7.094 -8.372 636 HE3 LYS 82 HE3 LYS 82 -5.077 -7.184 -6.824 637 HZ1 LYS 82 HZ1 LYS 82 -6.307 -8.428 -8.415 638 HZ2 LYS 82 HZ2 LYS 82 -6.320 -7.146 -9.516 639 HZ3 LYS 82 HZ3 LYS 82 -7.194 -7.029 -8.073 640 H ASP 83 H ASP 83 -2.019 -1.576 -6.308 641 HA ASP 83 HA ASP 83 -0.130 -2.073 -8.313 642 HB2 ASP 83 HB2 ASP 83 -1.366 -0.767 -10.160 643 HB3 ASP 83 HB3 ASP 83 -1.785 -2.458 -9.922 644 H MET 84 H MET 84 0.816 -0.077 -9.200 645 HA MET 84 HA MET 84 1.197 1.874 -7.223 646 HB2 MET 84 HB2 MET 84 2.013 1.534 -10.058 647 HB3 MET 84 HB3 MET 84 2.134 3.151 -9.383 648 HG2 MET 84 HG2 MET 84 3.283 0.880 -7.850 649 HG3 MET 84 HG3 MET 84 4.136 1.463 -9.276 650 HE1 MET 84 HE1 MET 84 3.537 1.430 -5.925 651 HE2 MET 84 HE2 MET 84 3.529 3.053 -5.233 652 HE3 MET 84 HE3 MET 84 5.060 2.221 -5.511 653 H SER 85 H SER 85 -1.424 1.577 -9.381 654 HA SER 85 HA SER 85 -1.937 4.284 -9.964 655 HB2 SER 85 HB2 SER 85 -4.088 2.199 -9.649 656 HB3 SER 85 HB3 SER 85 -4.061 3.589 -10.732 657 HG SER 85 HG SER 85 -2.310 2.543 -11.835 658 H ARG 86 H ARG 86 -2.634 2.314 -7.141 659 HA ARG 86 HA ARG 86 -4.616 3.792 -5.903 660 HB2 ARG 86 HB2 ARG 86 -2.261 2.431 -4.581 661 HB3 ARG 86 HB3 ARG 86 -3.731 2.934 -3.763 662 HG2 ARG 86 HG2 ARG 86 -3.434 0.783 -5.839 663 HG3 ARG 86 HG3 ARG 86 -3.881 0.592 -4.143 664 HD2 ARG 86 HD2 ARG 86 -5.896 2.038 -4.698 665 HD3 ARG 86 HD3 ARG 86 -5.496 1.743 -6.390 666 HE ARG 86 HE ARG 86 -6.381 -0.242 -4.435 667 HH11 ARG 86 HH11 ARG 86 -5.516 0.528 -7.736 668 HH12 ARG 86 HH12 ARG 86 -6.136 -0.957 -8.368 669 HH21 ARG 86 HH21 ARG 86 -7.171 -2.196 -5.270 670 HH22 ARG 86 HH22 ARG 86 -7.074 -2.503 -6.970 671 H LEU 87 H LEU 87 -1.088 4.213 -5.522 672 HA LEU 87 HA LEU 87 -1.453 6.723 -4.123 673 HB2 LEU 87 HB2 LEU 87 0.994 5.229 -5.053 674 HB3 LEU 87 HB3 LEU 87 1.072 6.778 -4.239 675 HG LEU 87 HG LEU 87 -0.351 5.519 -2.401 676 HD11 LEU 87 HD11 LEU 87 0.520 3.161 -2.229 677 HD12 LEU 87 HD12 LEU 87 0.992 3.308 -3.921 678 HD13 LEU 87 HD13 LEU 87 -0.705 3.451 -3.462 679 HD21 LEU 87 HD21 LEU 87 1.669 6.417 -1.718 680 HD22 LEU 87 HD22 LEU 87 2.599 5.479 -2.887 681 HD23 LEU 87 HD23 LEU 87 1.919 4.690 -1.463 682 H GLY 88 H GLY 88 -1.106 5.786 -7.418 683 HA2 GLY 88 HA2 GLY 88 -1.741 7.629 -8.955 684 HA3 GLY 88 HA3 GLY 88 -0.553 8.605 -8.115 685 H ARG 89 H ARG 89 -0.749 7.994 -10.948 686 HA ARG 89 HA ARG 89 1.308 6.114 -11.598 687 HB2 ARG 89 HB2 ARG 89 -0.144 8.202 -13.218 688 HB3 ARG 89 HB3 ARG 89 1.111 7.178 -13.900 689 HG2 ARG 89 HG2 ARG 89 -0.746 5.513 -12.543 690 HG3 ARG 89 HG3 ARG 89 -1.647 6.623 -13.573 691 HD2 ARG 89 HD2 ARG 89 0.508 5.777 -15.126 692 HD3 ARG 89 HD3 ARG 89 -0.048 4.329 -14.290 693 HE ARG 89 HE ARG 89 -2.284 5.648 -15.319 694 HH11 ARG 89 HH11 ARG 89 0.539 3.948 -16.499 695 HH12 ARG 89 HH12 ARG 89 -0.232 3.433 -17.960 696 HH21 ARG 89 HH21 ARG 89 -3.291 4.971 -17.247 697 HH22 ARG 89 HH22 ARG 89 -2.406 4.012 -18.385 698 H ASN 90 H ASN 90 1.283 9.375 -10.568 699 HA ASN 90 HA ASN 90 3.600 10.375 -11.819 700 HB2 ASN 90 HB2 ASN 90 3.649 11.860 -9.657 701 HB3 ASN 90 HB3 ASN 90 2.346 12.054 -10.821 702 HD21 ASN 90 HD21 ASN 90 3.226 10.849 -7.673 703 HD22 ASN 90 HD22 ASN 90 1.616 10.658 -7.076 704 H TYR 91 H TYR 91 4.995 8.540 -11.730 705 HA TYR 91 HA TYR 91 5.961 7.263 -9.476 706 HB2 TYR 91 HB2 TYR 91 6.300 6.472 -11.731 707 HB3 TYR 91 HB3 TYR 91 7.343 7.837 -12.097 708 HD1 TYR 91 HD1 TYR 91 9.622 7.924 -11.204 709 HD2 TYR 91 HD2 TYR 91 7.113 4.565 -10.488 710 HE1 TYR 91 HE1 TYR 91 11.590 6.601 -10.574 711 HE2 TYR 91 HE2 TYR 91 9.084 3.219 -9.858 712 HH TYR 91 HH TYR 91 11.900 3.639 -10.600 713 H LEU 92 H LEU 92 6.524 10.531 -10.346 714 HA LEU 92 HA LEU 92 9.129 10.860 -9.276 715 HB2 LEU 92 HB2 LEU 92 6.877 12.843 -9.604 716 HB3 LEU 92 HB3 LEU 92 8.511 13.273 -9.136 717 HG LEU 92 HG LEU 92 9.238 12.187 -11.347 718 HD11 LEU 92 HD11 LEU 92 6.287 12.135 -11.562 719 HD12 LEU 92 HD12 LEU 92 7.498 11.041 -12.228 720 HD13 LEU 92 HD13 LEU 92 7.199 12.598 -13.001 721 HD21 LEU 92 HD21 LEU 92 8.782 14.732 -10.662 722 HD22 LEU 92 HD22 LEU 92 7.595 14.571 -11.956 723 HD23 LEU 92 HD23 LEU 92 9.299 14.253 -12.278 724 H GLN 93 H GLN 93 5.923 11.675 -7.956 725 HA GLN 93 HA GLN 93 6.912 12.129 -5.304 726 HB2 GLN 93 HB2 GLN 93 4.220 12.036 -6.603 727 HB3 GLN 93 HB3 GLN 93 4.321 11.976 -4.848 728 HG2 GLN 93 HG2 GLN 93 5.392 14.149 -6.628 729 HG3 GLN 93 HG3 GLN 93 3.947 14.234 -5.626 730 HE21 GLN 93 HE21 GLN 93 4.136 14.951 -3.607 731 HE22 GLN 93 HE22 GLN 93 5.628 15.224 -2.783 732 H VAL 94 H VAL 94 5.055 9.508 -6.870 733 HA VAL 94 HA VAL 94 4.680 7.909 -4.607 734 HB VAL 94 HB VAL 94 5.277 6.596 -7.249 735 HG11 VAL 94 HG11 VAL 94 3.379 6.083 -4.969 736 HG12 VAL 94 HG12 VAL 94 4.747 5.099 -5.492 737 HG13 VAL 94 HG13 VAL 94 3.306 5.213 -6.502 738 HG21 VAL 94 HG21 VAL 94 3.370 8.704 -6.935 739 HG22 VAL 94 HG22 VAL 94 2.510 7.184 -7.174 740 HG23 VAL 94 HG23 VAL 94 3.710 7.713 -8.357 741 H GLY 95 H GLY 95 7.405 8.110 -6.867 742 HA2 GLY 95 HA2 GLY 95 8.961 6.034 -5.757 743 HA3 GLY 95 HA3 GLY 95 9.580 7.382 -6.695 744 H PHE 96 H PHE 96 8.987 9.553 -5.184 745 HA PHE 96 HA PHE 96 10.998 9.817 -3.359 746 HB2 PHE 96 HB2 PHE 96 9.974 11.839 -3.819 747 HB3 PHE 96 HB3 PHE 96 8.354 11.167 -3.708 748 HD1 PHE 96 HD1 PHE 96 7.414 10.667 -1.393 749 HD2 PHE 96 HD2 PHE 96 10.936 12.977 -2.027 750 HE1 PHE 96 HE1 PHE 96 7.194 11.616 0.858 751 HE2 PHE 96 HE2 PHE 96 10.717 13.928 0.229 752 HZ PHE 96 HZ PHE 96 8.845 13.248 1.673 753 H TYR 97 H TYR 97 7.695 8.686 -2.764 754 HA TYR 97 HA TYR 97 7.892 8.361 0.013 755 HB2 TYR 97 HB2 TYR 97 6.146 7.128 -2.097 756 HB3 TYR 97 HB3 TYR 97 6.037 6.593 -0.422 757 HD1 TYR 97 HD1 TYR 97 5.701 8.468 1.347 758 HD2 TYR 97 HD2 TYR 97 4.911 8.953 -2.800 759 HE1 TYR 97 HE1 TYR 97 4.255 10.382 1.853 760 HE2 TYR 97 HE2 TYR 97 3.460 10.869 -2.307 761 HH TYR 97 HH TYR 97 2.093 11.679 -0.323 762 H THR 98 H THR 98 8.358 5.987 -2.623 763 HA THR 98 HA THR 98 9.170 3.942 -0.779 764 HB THR 98 HB THR 98 9.719 2.669 -2.875 765 HG1 THR 98 HG1 THR 98 10.190 4.389 -4.255 766 HG21 THR 98 HG21 THR 98 7.490 2.303 -3.543 767 HG22 THR 98 HG22 THR 98 6.990 3.904 -2.996 768 HG23 THR 98 HG23 THR 98 7.453 2.675 -1.820 769 H GLU 99 H GLU 99 10.953 6.427 -2.512 770 HA GLU 99 HA GLU 99 13.456 4.965 -2.150 771 HB2 GLU 99 HB2 GLU 99 14.493 6.806 -3.446 772 HB3 GLU 99 HB3 GLU 99 13.240 5.927 -4.303 773 HG2 GLU 99 HG2 GLU 99 12.192 7.807 -4.716 774 HG3 GLU 99 HG3 GLU 99 12.012 8.120 -2.997 775 H VAL 100 H VAL 100 12.072 8.080 -1.054 776 HA VAL 100 HA VAL 100 14.389 8.291 0.748 777 HB VAL 100 HB VAL 100 14.137 10.207 -0.736 778 HG11 VAL 100 HG11 VAL 100 11.404 10.387 0.478 779 HG12 VAL 100 HG12 VAL 100 11.866 10.382 -1.223 780 HG13 VAL 100 HG13 VAL 100 12.203 11.792 -0.222 781 HG21 VAL 100 HG21 VAL 100 15.126 10.546 1.455 782 HG22 VAL 100 HG22 VAL 100 13.530 10.849 2.142 783 HG23 VAL 100 HG23 VAL 100 14.208 11.968 0.960 784 H LEU 101 H LEU 101 10.872 8.479 0.710 785 HA LEU 101 HA LEU 101 10.547 9.107 3.451 786 HB2 LEU 101 HB2 LEU 101 8.923 9.131 1.320 787 HB3 LEU 101 HB3 LEU 101 8.415 7.614 2.038 788 HG LEU 101 HG LEU 101 6.947 9.360 2.784 789 HD11 LEU 101 HD11 LEU 101 6.955 8.880 5.043 790 HD12 LEU 101 HD12 LEU 101 8.712 8.958 5.167 791 HD13 LEU 101 HD13 LEU 101 7.943 7.564 4.407 792 HD21 LEU 101 HD21 LEU 101 8.812 11.133 2.432 793 HD22 LEU 101 HD22 LEU 101 9.201 10.805 4.119 794 HD23 LEU 101 HD23 LEU 101 7.597 11.389 3.682 795 H PHE 102 H PHE 102 9.851 6.043 1.772 796 HA PHE 102 HA PHE 102 9.327 4.542 4.068 797 HB2 PHE 102 HB2 PHE 102 10.057 3.764 1.262 798 HB3 PHE 102 HB3 PHE 102 9.661 2.587 2.497 799 HD1 PHE 102 HD1 PHE 102 7.927 5.748 2.623 800 HD2 PHE 102 HD2 PHE 102 7.807 1.803 1.016 801 HE1 PHE 102 HE1 PHE 102 5.552 6.032 2.102 802 HE2 PHE 102 HE2 PHE 102 5.418 2.085 0.504 803 HZ PHE 102 HZ PHE 102 4.285 4.203 1.048 804 HA PRO 103 HA PRO 103 14.115 2.983 3.200 805 HB2 PRO 103 HB2 PRO 103 14.866 5.800 3.882 806 HB3 PRO 103 HB3 PRO 103 15.757 4.598 2.954 807 HG2 PRO 103 HG2 PRO 103 14.384 6.526 1.736 808 HG3 PRO 103 HG3 PRO 103 14.458 4.889 1.062 809 HD2 PRO 103 HD2 PRO 103 12.200 6.288 2.341 810 HD3 PRO 103 HD3 PRO 103 12.196 4.926 1.218 811 H GLN 104 H GLN 104 12.843 5.357 5.507 812 HA GLN 104 HA GLN 104 14.443 4.991 7.690 813 HB2 GLN 104 HB2 GLN 104 11.620 4.979 8.468 814 HB3 GLN 104 HB3 GLN 104 12.900 6.098 8.889 815 HG2 GLN 104 HG2 GLN 104 12.632 7.233 6.750 816 HG3 GLN 104 HG3 GLN 104 11.357 6.099 6.324 817 HE21 GLN 104 HE21 GLN 104 12.245 8.761 8.406 818 HE22 GLN 104 HE22 GLN 104 10.636 9.194 8.858 819 H LYS 105 H LYS 105 11.911 2.800 6.584 820 HA LYS 105 HA LYS 105 12.698 0.937 8.724 821 HB2 LYS 105 HB2 LYS 105 10.091 0.491 7.412 822 HB3 LYS 105 HB3 LYS 105 10.546 0.348 9.098 823 HG2 LYS 105 HG2 LYS 105 9.553 2.265 9.536 824 HG3 LYS 105 HG3 LYS 105 10.610 3.106 8.412 825 HD2 LYS 105 HD2 LYS 105 8.184 1.605 7.498 826 HD3 LYS 105 HD3 LYS 105 8.076 3.269 8.071 827 HE2 LYS 105 HE2 LYS 105 9.141 4.108 6.254 828 HE3 LYS 105 HE3 LYS 105 10.165 2.689 6.092 829 HZ1 LYS 105 HZ1 LYS 105 7.891 1.592 5.419 830 HZ2 LYS 105 HZ2 LYS 105 8.845 2.405 4.290 831 HZ3 LYS 105 HZ3 LYS 105 7.512 3.180 4.979 832 H ASN 106 H ASN 106 13.371 1.340 5.586 833 HA ASN 106 HA ASN 106 13.984 -0.019 3.865 834 HB2 ASN 106 HB2 ASN 106 15.373 -1.101 5.530 835 HB3 ASN 106 HB3 ASN 106 14.022 -2.094 6.069 836 HD21 ASN 106 HD21 ASN 106 16.394 -1.557 3.602 837 HD22 ASN 106 HD22 ASN 106 16.188 -3.066 2.794 838 H VAL 107 H VAL 107 12.062 0.268 2.789 839 HA VAL 107 HA VAL 107 9.888 -1.617 3.231 840 HB VAL 107 HB VAL 107 9.674 0.945 2.984 841 HG11 VAL 107 HG11 VAL 107 9.608 1.846 0.870 842 HG12 VAL 107 HG12 VAL 107 9.141 0.324 0.122 843 HG13 VAL 107 HG13 VAL 107 10.812 0.594 0.606 844 HG21 VAL 107 HG21 VAL 107 7.872 -0.690 3.333 845 HG22 VAL 107 HG22 VAL 107 7.809 -0.974 1.594 846 HG23 VAL 107 HG23 VAL 107 7.380 0.607 2.248 847 H ARG 108 H ARG 108 8.854 -2.741 1.719 848 HA ARG 108 HA ARG 108 10.155 -3.143 -0.859 849 HB2 ARG 108 HB2 ARG 108 10.242 -5.053 1.046 850 HB3 ARG 108 HB3 ARG 108 8.690 -5.434 0.321 851 HG2 ARG 108 HG2 ARG 108 11.201 -5.141 -1.290 852 HG3 ARG 108 HG3 ARG 108 10.667 -6.675 -0.600 853 HD2 ARG 108 HD2 ARG 108 8.759 -5.071 -2.236 854 HD3 ARG 108 HD3 ARG 108 10.012 -6.001 -3.051 855 HE ARG 108 HE ARG 108 7.850 -7.091 -1.390 856 HH11 ARG 108 HH11 ARG 108 10.460 -7.610 -3.674 857 HH12 ARG 108 HH12 ARG 108 10.013 -9.249 -3.989 858 HH21 ARG 108 HH21 ARG 108 7.277 -9.250 -1.815 859 HH22 ARG 108 HH22 ARG 108 8.215 -10.181 -2.932 860 H PHE 109 H PHE 109 8.768 -1.821 -1.928 861 HA PHE 109 HA PHE 109 5.953 -1.909 -1.429 862 HB2 PHE 109 HB2 PHE 109 7.520 0.035 -2.320 863 HB3 PHE 109 HB3 PHE 109 7.041 -0.616 -3.877 864 HD1 PHE 109 HD1 PHE 109 4.508 -0.898 -4.286 865 HD2 PHE 109 HD2 PHE 109 6.174 1.519 -1.216 866 HE1 PHE 109 HE1 PHE 109 2.409 0.374 -4.170 867 HE2 PHE 109 HE2 PHE 109 4.084 2.808 -1.079 868 HZ PHE 109 HZ PHE 109 2.192 2.235 -2.560 869 H LEU 110 H LEU 110 4.350 -2.803 -2.679 870 HA LEU 110 HA LEU 110 5.188 -4.389 -5.003 871 HB2 LEU 110 HB2 LEU 110 4.950 -5.988 -3.318 872 HB3 LEU 110 HB3 LEU 110 3.516 -5.236 -2.659 873 HG LEU 110 HG LEU 110 3.222 -7.441 -3.893 874 HD11 LEU 110 HD11 LEU 110 1.514 -5.449 -3.468 875 HD12 LEU 110 HD12 LEU 110 1.075 -6.923 -4.328 876 HD13 LEU 110 HD13 LEU 110 1.487 -5.466 -5.231 877 HD21 LEU 110 HD21 LEU 110 3.805 -7.671 -6.019 878 HD22 LEU 110 HD22 LEU 110 4.610 -6.107 -5.903 879 HD23 LEU 110 HD23 LEU 110 2.947 -6.201 -6.479 880 H ALA 111 H ALA 111 4.065 -4.113 -6.739 881 HA ALA 111 HA ALA 111 1.378 -2.926 -6.586 882 HB1 ALA 111 HB1 ALA 111 2.711 -1.152 -7.392 883 HB2 ALA 111 HB2 ALA 111 1.960 -1.851 -8.829 884 HB3 ALA 111 HB3 ALA 111 3.641 -2.221 -8.445 885 H ILE 112 H ILE 112 0.226 -4.745 -6.900 886 HA ILE 112 HA ILE 112 1.049 -6.941 -8.383 887 HB ILE 112 HB ILE 112 -1.667 -6.085 -7.452 888 HG12 ILE 112 HG12 ILE 112 -0.387 -8.602 -6.601 889 HG13 ILE 112 HG13 ILE 112 0.463 -7.137 -6.138 890 HG21 ILE 112 HG21 ILE 112 -0.950 -8.432 -9.162 891 HG22 ILE 112 HG22 ILE 112 -2.322 -7.332 -9.294 892 HG23 ILE 112 HG23 ILE 112 -2.276 -8.533 -8.004 893 HD11 ILE 112 HD11 ILE 112 -1.559 -8.322 -4.744 894 HD12 ILE 112 HD12 ILE 112 -2.393 -7.022 -5.601 895 HD13 ILE 112 HD13 ILE 112 -1.020 -6.653 -4.558 896 H ASN 113 H ASN 113 -1.188 -4.361 -9.515 897 HA ASN 113 HA ASN 113 -1.228 -5.626 -12.146 898 HB2 ASN 113 HB2 ASN 113 -2.816 -3.372 -10.940 899 HB3 ASN 113 HB3 ASN 113 -2.919 -3.790 -12.645 900 HD21 ASN 113 HD21 ASN 113 -4.871 -3.915 -10.402 901 HD22 ASN 113 HD22 ASN 113 -5.471 -5.532 -10.433 902 H ASN 114 H ASN 114 1.281 -4.399 -11.401 903 HA ASN 114 HA ASN 114 1.957 -3.108 -13.749 904 HB2 ASN 114 HB2 ASN 114 0.545 -1.343 -12.055 905 HB3 ASN 114 HB3 ASN 114 2.232 -0.857 -12.003 906 HD21 ASN 114 HD21 ASN 114 -0.626 -1.033 -13.908 907 HD22 ASN 114 HD22 ASN 114 -0.013 -0.196 -15.289 908 H SER 115 H SER 115 4.167 -2.661 -13.903 909 HA SER 115 HA SER 115 5.831 -3.957 -12.021 910 HB2 SER 115 HB2 SER 115 6.223 -2.457 -14.531 911 HB3 SER 115 HB3 SER 115 7.589 -2.413 -13.418 912 HG SER 115 HG SER 115 7.692 -4.628 -13.472 913 H ILE 116 H ILE 116 6.090 -3.228 -10.024 914 HA ILE 116 HA ILE 116 5.758 -0.582 -9.184 915 HB ILE 116 HB ILE 116 5.921 -2.957 -7.907 916 HG12 ILE 116 HG12 ILE 116 4.820 -0.822 -7.194 917 HG13 ILE 116 HG13 ILE 116 5.557 -1.730 -5.880 918 HG21 ILE 116 HG21 ILE 116 8.474 -1.516 -7.218 919 HG22 ILE 116 HG22 ILE 116 8.339 -3.090 -8.003 920 HG23 ILE 116 HG23 ILE 116 7.801 -2.885 -6.334 921 HD11 ILE 116 HD11 ILE 116 7.593 -0.148 -6.354 922 HD12 ILE 116 HD12 ILE 116 6.227 0.395 -5.381 923 HD13 ILE 116 HD13 ILE 116 6.349 0.873 -7.073 924 H ASP 117 H ASP 117 8.787 -2.405 -9.692 925 HA ASP 117 HA ASP 117 10.181 -0.085 -10.577 926 HB2 ASP 117 HB2 ASP 117 10.021 -0.344 -7.793 927 HB3 ASP 117 HB3 ASP 117 11.633 -0.914 -8.206 928 H SER 118 H SER 118 9.734 -2.918 -11.329 929 HA SER 118 HA SER 118 12.335 -4.149 -11.008 930 HB2 SER 118 HB2 SER 118 9.913 -5.271 -11.097 931 HB3 SER 118 HB3 SER 118 10.298 -5.351 -12.816 932 HG SER 118 HG SER 118 11.643 -6.534 -10.637 933 H ASN 119 H ASN 119 12.514 -5.481 -13.524 934 HA ASN 119 HA ASN 119 13.111 -3.217 -15.312 935 HB2 ASN 119 HB2 ASN 119 14.900 -5.064 -14.243 936 HB3 ASN 119 HB3 ASN 119 14.645 -5.601 -15.904 937 HD21 ASN 119 HD21 ASN 119 15.308 -2.716 -13.981 938 HD22 ASN 119 HD22 ASN 119 16.357 -1.985 -15.132 939 H ASN 120 H ASN 120 12.673 -6.738 -15.460 940 HA ASN 120 HA ASN 120 11.784 -6.697 -18.155 941 HB2 ASN 120 HB2 ASN 120 12.851 -8.679 -17.295 942 HB3 ASN 120 HB3 ASN 120 11.619 -8.848 -16.053 943 HD21 ASN 120 HD21 ASN 120 12.190 -8.958 -19.523 944 HD22 ASN 120 HD22 ASN 120 10.870 -10.009 -19.890 Start of MODEL 2 1 H1 GLY 1 H1 GLY 1 4.017 -4.665 22.820 2 H2 GLY 1 H2 GLY 1 4.080 -3.709 24.214 3 H3 GLY 1 H3 GLY 1 5.353 -3.668 23.104 4 HA2 GLY 1 HA2 GLY 1 3.560 -2.910 21.432 5 HA3 GLY 1 HA3 GLY 1 2.653 -2.508 22.881 6 H SER 2 H SER 2 6.022 -2.146 21.744 7 HA SER 2 HA SER 2 5.869 0.719 21.877 8 HB2 SER 2 HB2 SER 2 7.080 -0.839 24.093 9 HB3 SER 2 HB3 SER 2 8.002 0.550 23.520 10 HG SER 2 HG SER 2 5.390 0.490 24.592 11 H ARG 3 H ARG 3 8.682 -1.377 22.443 12 HA ARG 3 HA ARG 3 9.839 -0.403 19.924 13 HB2 ARG 3 HB2 ARG 3 10.880 -0.866 22.575 14 HB3 ARG 3 HB3 ARG 3 11.787 -1.807 21.400 15 HG2 ARG 3 HG2 ARG 3 12.063 0.318 20.080 16 HG3 ARG 3 HG3 ARG 3 11.396 1.170 21.472 17 HD2 ARG 3 HD2 ARG 3 13.251 0.834 22.741 18 HD3 ARG 3 HD3 ARG 3 13.610 -0.721 21.994 19 HE ARG 3 HE ARG 3 14.031 1.686 20.397 20 HH11 ARG 3 HH11 ARG 3 15.432 -0.918 22.279 21 HH12 ARG 3 HH12 ARG 3 17.018 -0.699 21.624 22 HH21 ARG 3 HH21 ARG 3 16.126 1.967 19.543 23 HH22 ARG 3 HH22 ARG 3 17.413 0.937 20.074 24 H THR 4 H THR 4 11.577 -2.106 19.103 25 HA THR 4 HA THR 4 12.042 -4.064 18.082 26 HB THR 4 HB THR 4 11.698 -6.053 19.174 27 HG1 THR 4 HG1 THR 4 9.658 -6.567 19.212 28 HG21 THR 4 HG21 THR 4 10.839 -4.444 21.527 29 HG22 THR 4 HG22 THR 4 12.434 -4.191 20.820 30 HG23 THR 4 HG23 THR 4 11.982 -5.783 21.430 31 H SER 5 H SER 5 11.420 -5.037 16.251 32 HA SER 5 HA SER 5 10.197 -5.638 14.448 33 HB2 SER 5 HB2 SER 5 7.778 -5.565 16.244 34 HB3 SER 5 HB3 SER 5 7.946 -6.414 14.707 35 HG SER 5 HG SER 5 8.769 -8.015 15.773 36 H ARG 6 H ARG 6 9.187 -4.732 12.768 37 HA ARG 6 HA ARG 6 8.197 -1.981 13.097 38 HB2 ARG 6 HB2 ARG 6 8.870 -2.870 10.373 39 HB3 ARG 6 HB3 ARG 6 9.249 -1.365 11.195 40 HG2 ARG 6 HG2 ARG 6 11.314 -2.104 11.091 41 HG3 ARG 6 HG3 ARG 6 10.874 -3.094 12.476 42 HD2 ARG 6 HD2 ARG 6 11.020 -3.879 9.574 43 HD3 ARG 6 HD3 ARG 6 11.910 -4.558 10.930 44 HE ARG 6 HE ARG 6 8.988 -4.905 10.784 45 HH11 ARG 6 HH11 ARG 6 12.206 -6.310 10.749 46 HH12 ARG 6 HH12 ARG 6 11.626 -7.926 10.949 47 HH21 ARG 6 HH21 ARG 6 8.249 -7.038 11.035 48 HH22 ARG 6 HH22 ARG 6 9.386 -8.342 11.105 49 H ILE 7 H ILE 7 7.245 -2.337 10.128 50 HA ILE 7 HA ILE 7 5.088 -4.206 10.529 51 HB ILE 7 HB ILE 7 3.339 -2.837 10.711 52 HG12 ILE 7 HG12 ILE 7 4.099 -0.211 9.927 53 HG13 ILE 7 HG13 ILE 7 4.618 -1.318 8.666 54 HG21 ILE 7 HG21 ILE 7 3.880 -0.786 12.078 55 HG22 ILE 7 HG22 ILE 7 5.576 -1.199 11.841 56 HG23 ILE 7 HG23 ILE 7 4.507 -2.318 12.682 57 HD11 ILE 7 HD11 ILE 7 2.546 -1.032 7.892 58 HD12 ILE 7 HD12 ILE 7 1.930 -0.479 9.451 59 HD13 ILE 7 HD13 ILE 7 2.099 -2.206 9.131 60 H THR 8 H THR 8 3.672 -4.486 8.694 61 HA THR 8 HA THR 8 5.019 -3.928 6.127 62 HB THR 8 HB THR 8 3.337 -6.191 7.140 63 HG1 THR 8 HG1 THR 8 5.202 -7.067 6.861 64 HG21 THR 8 HG21 THR 8 2.006 -5.738 5.267 65 HG22 THR 8 HG22 THR 8 3.125 -7.003 4.756 66 HG23 THR 8 HG23 THR 8 3.402 -5.329 4.270 67 H ALA 9 H ALA 9 3.838 -2.766 4.523 68 HA ALA 9 HA ALA 9 1.268 -1.782 5.555 69 HB1 ALA 9 HB1 ALA 9 2.741 0.030 5.290 70 HB2 ALA 9 HB2 ALA 9 1.588 0.120 3.958 71 HB3 ALA 9 HB3 ALA 9 3.217 -0.500 3.676 72 H LEU 10 H LEU 10 -0.433 -2.630 4.779 73 HA LEU 10 HA LEU 10 -0.528 -3.452 1.952 74 HB2 LEU 10 HB2 LEU 10 -0.955 -5.059 3.954 75 HB3 LEU 10 HB3 LEU 10 -2.494 -4.243 4.081 76 HG LEU 10 HG LEU 10 -1.872 -5.235 1.391 77 HD11 LEU 10 HD11 LEU 10 -1.802 -7.002 3.773 78 HD12 LEU 10 HD12 LEU 10 -1.001 -7.176 2.213 79 HD13 LEU 10 HD13 LEU 10 -2.713 -7.567 2.373 80 HD21 LEU 10 HD21 LEU 10 -4.172 -5.110 3.288 81 HD22 LEU 10 HD22 LEU 10 -4.240 -6.189 1.895 82 HD23 LEU 10 HD23 LEU 10 -4.026 -4.452 1.661 83 H TYR 11 H TYR 11 -1.223 -1.628 0.907 84 HA TYR 11 HA TYR 11 -3.594 -0.270 2.006 85 HB2 TYR 11 HB2 TYR 11 -1.906 1.323 2.097 86 HB3 TYR 11 HB3 TYR 11 -1.165 0.786 0.612 87 HD1 TYR 11 HD1 TYR 11 -4.331 2.346 1.833 88 HD2 TYR 11 HD2 TYR 11 -1.450 2.089 -1.286 89 HE1 TYR 11 HE1 TYR 11 -5.458 4.182 0.648 90 HE2 TYR 11 HE2 TYR 11 -2.569 3.922 -2.479 91 HH TYR 11 HH TYR 11 -4.637 5.999 -1.141 92 H GLU 12 H GLU 12 -5.417 -0.095 0.755 93 HA GLU 12 HA GLU 12 -5.205 -0.558 -2.114 94 HB2 GLU 12 HB2 GLU 12 -7.290 -2.282 -1.286 95 HB3 GLU 12 HB3 GLU 12 -5.788 -2.708 -2.089 96 HG2 GLU 12 HG2 GLU 12 -6.187 -3.987 -0.033 97 HG3 GLU 12 HG3 GLU 12 -4.698 -3.049 0.024 98 H ARG 13 H ARG 13 -7.594 -0.873 -2.999 99 HA ARG 13 HA ARG 13 -9.589 0.671 -1.667 100 HB2 ARG 13 HB2 ARG 13 -9.266 2.681 -2.580 101 HB3 ARG 13 HB3 ARG 13 -7.815 2.089 -3.366 102 HG2 ARG 13 HG2 ARG 13 -8.864 1.786 -5.383 103 HG3 ARG 13 HG3 ARG 13 -10.447 1.551 -4.651 104 HD2 ARG 13 HD2 ARG 13 -10.025 3.726 -5.935 105 HD3 ARG 13 HD3 ARG 13 -10.791 3.828 -4.351 106 HE ARG 13 HE ARG 13 -9.019 5.055 -3.649 107 HH11 ARG 13 HH11 ARG 13 -7.975 3.183 -6.421 108 HH12 ARG 13 HH12 ARG 13 -6.412 3.905 -6.472 109 HH21 ARG 13 HH21 ARG 13 -6.951 5.966 -3.689 110 HH22 ARG 13 HH22 ARG 13 -5.818 5.483 -4.904 111 H LEU 14 H LEU 14 -11.647 0.625 -2.704 112 HA LEU 14 HA LEU 14 -12.014 -0.805 -5.168 113 HB2 LEU 14 HB2 LEU 14 -11.912 -2.792 -3.899 114 HB3 LEU 14 HB3 LEU 14 -12.747 -2.081 -2.538 115 HG LEU 14 HG LEU 14 -13.990 -3.794 -4.007 116 HD11 LEU 14 HD11 LEU 14 -15.801 -1.542 -3.864 117 HD12 LEU 14 HD12 LEU 14 -14.839 -1.728 -2.398 118 HD13 LEU 14 HD13 LEU 14 -15.820 -3.070 -2.985 119 HD21 LEU 14 HD21 LEU 14 -14.970 -1.605 -5.683 120 HD22 LEU 14 HD22 LEU 14 -14.640 -3.283 -6.085 121 HD23 LEU 14 HD23 LEU 14 -13.323 -2.120 -6.039 122 H SER 15 H SER 15 -13.695 0.105 -6.203 123 HA SER 15 HA SER 15 -15.641 1.627 -4.603 124 HB2 SER 15 HB2 SER 15 -14.057 2.403 -6.831 125 HB3 SER 15 HB3 SER 15 -15.743 2.401 -7.347 126 HG SER 15 HG SER 15 -16.232 3.850 -5.765 127 H ARG 16 H ARG 16 -17.740 1.217 -4.752 128 HA ARG 16 HA ARG 16 -18.634 -1.130 -6.161 129 HB2 ARG 16 HB2 ARG 16 -19.346 -0.378 -3.829 130 HB3 ARG 16 HB3 ARG 16 -20.363 0.805 -4.638 131 HG2 ARG 16 HG2 ARG 16 -21.910 -0.711 -5.140 132 HG3 ARG 16 HG3 ARG 16 -20.710 -1.883 -5.688 133 HD2 ARG 16 HD2 ARG 16 -20.278 -2.569 -3.423 134 HD3 ARG 16 HD3 ARG 16 -21.340 -1.310 -2.801 135 HE ARG 16 HE ARG 16 -22.343 -3.517 -4.477 136 HH11 ARG 16 HH11 ARG 16 -22.576 -1.548 -1.578 137 HH12 ARG 16 HH12 ARG 16 -24.054 -2.281 -1.063 138 HH21 ARG 16 HH21 ARG 16 -24.286 -4.465 -3.782 139 HH22 ARG 16 HH22 ARG 16 -25.025 -3.932 -2.309 140 H ASP 17 H ASP 17 -18.391 2.129 -7.026 141 HA ASP 17 HA ASP 17 -20.798 2.275 -8.618 142 HB2 ASP 17 HB2 ASP 17 -19.493 4.379 -9.504 143 HB3 ASP 17 HB3 ASP 17 -20.250 4.397 -7.916 144 H ASP 18 H ASP 18 -17.535 1.272 -9.125 145 HA ASP 18 HA ASP 18 -17.352 1.706 -11.912 146 HB2 ASP 18 HB2 ASP 18 -15.975 -0.464 -10.354 147 HB3 ASP 18 HB3 ASP 18 -15.434 0.266 -11.859 148 H ASP 19 H ASP 19 -17.259 0.046 -13.593 149 HA ASP 19 HA ASP 19 -19.599 -1.558 -13.637 150 HB2 ASP 19 HB2 ASP 19 -17.992 -0.476 -15.558 151 HB3 ASP 19 HB3 ASP 19 -17.522 -2.170 -15.630 152 H LEU 20 H LEU 20 -16.414 -2.094 -12.573 153 HA LEU 20 HA LEU 20 -16.227 -4.902 -12.926 154 HB2 LEU 20 HB2 LEU 20 -14.494 -4.654 -11.024 155 HB3 LEU 20 HB3 LEU 20 -14.166 -3.910 -12.574 156 HG LEU 20 HG LEU 20 -14.942 -1.728 -11.633 157 HD11 LEU 20 HD11 LEU 20 -16.339 -2.194 -9.848 158 HD12 LEU 20 HD12 LEU 20 -14.854 -1.692 -9.045 159 HD13 LEU 20 HD13 LEU 20 -15.251 -3.403 -9.176 160 HD21 LEU 20 HD21 LEU 20 -12.745 -2.774 -9.903 161 HD22 LEU 20 HD22 LEU 20 -12.892 -1.215 -10.713 162 HD23 LEU 20 HD23 LEU 20 -12.528 -2.665 -11.649 163 H THR 21 H THR 21 -16.728 -6.589 -11.551 164 HA THR 21 HA THR 21 -17.696 -6.102 -8.886 165 HB THR 21 HB THR 21 -19.926 -7.238 -9.378 166 HG1 THR 21 HG1 THR 21 -19.596 -7.974 -11.443 167 HG21 THR 21 HG21 THR 21 -19.626 -4.561 -10.710 168 HG22 THR 21 HG22 THR 21 -19.667 -4.781 -8.961 169 HG23 THR 21 HG23 THR 21 -21.061 -5.239 -9.940 170 H GLY 22 H GLY 22 -16.925 -7.692 -7.694 171 HA2 GLY 22 HA2 GLY 22 -17.380 -10.358 -7.828 172 HA3 GLY 22 HA3 GLY 22 -15.998 -10.153 -8.888 173 H GLU 23 H GLU 23 -14.714 -11.447 -7.463 174 HA GLU 23 HA GLU 23 -14.340 -10.948 -4.730 175 HB2 GLU 23 HB2 GLU 23 -13.472 -12.994 -5.432 176 HB3 GLU 23 HB3 GLU 23 -12.667 -12.289 -6.827 177 HG2 GLU 23 HG2 GLU 23 -11.063 -11.186 -5.293 178 HG3 GLU 23 HG3 GLU 23 -11.833 -12.017 -3.945 179 H SER 24 H SER 24 -12.603 -9.691 -7.557 180 HA SER 24 HA SER 24 -10.752 -8.155 -6.026 181 HB2 SER 24 HB2 SER 24 -11.479 -8.265 -8.937 182 HB3 SER 24 HB3 SER 24 -10.382 -7.026 -8.326 183 HG SER 24 HG SER 24 -9.021 -8.622 -8.770 184 H ASN 25 H ASN 25 -13.967 -7.683 -6.120 185 HA ASN 25 HA ASN 25 -13.649 -4.797 -5.834 186 HB2 ASN 25 HB2 ASN 25 -15.964 -5.945 -7.377 187 HB3 ASN 25 HB3 ASN 25 -15.432 -4.270 -7.303 188 HD21 ASN 25 HD21 ASN 25 -14.890 -7.386 -8.695 189 HD22 ASN 25 HD22 ASN 25 -13.774 -6.882 -9.910 190 H SER 26 H SER 26 -13.809 -5.531 -3.496 191 HA SER 26 HA SER 26 -16.488 -5.115 -2.571 192 HB2 SER 26 HB2 SER 26 -15.234 -7.830 -2.248 193 HB3 SER 26 HB3 SER 26 -16.532 -7.255 -1.214 194 HG SER 26 HG SER 26 -16.585 -8.019 -3.883 195 H ILE 27 H ILE 27 -13.627 -4.133 -2.133 196 HA ILE 27 HA ILE 27 -12.357 -3.250 -0.467 197 HB ILE 27 HB ILE 27 -14.895 -3.647 1.123 198 HG12 ILE 27 HG12 ILE 27 -15.157 -1.871 -0.456 199 HG13 ILE 27 HG13 ILE 27 -14.872 -1.118 1.107 200 HG21 ILE 27 HG21 ILE 27 -12.404 -2.223 2.051 201 HG22 ILE 27 HG22 ILE 27 -12.943 -3.799 2.628 202 HG23 ILE 27 HG23 ILE 27 -13.923 -2.368 2.932 203 HD11 ILE 27 HD11 ILE 27 -13.373 0.124 0.090 204 HD12 ILE 27 HD12 ILE 27 -13.379 -0.901 -1.346 205 HD13 ILE 27 HD13 ILE 27 -12.352 -1.318 0.026 206 H THR 28 H THR 28 -14.177 -5.425 1.667 207 HA THR 28 HA THR 28 -11.978 -6.468 2.998 208 HB THR 28 HB THR 28 -14.792 -6.845 2.999 209 HG1 THR 28 HG1 THR 28 -14.387 -6.944 5.056 210 HG21 THR 28 HG21 THR 28 -13.276 -9.435 3.113 211 HG22 THR 28 HG22 THR 28 -14.568 -9.009 1.992 212 HG23 THR 28 HG23 THR 28 -14.917 -9.202 3.710 213 H ASN 29 H ASN 29 -13.573 -7.614 0.057 214 HA ASN 29 HA ASN 29 -12.223 -10.076 -0.111 215 HB2 ASN 29 HB2 ASN 29 -13.563 -8.344 -2.175 216 HB3 ASN 29 HB3 ASN 29 -12.774 -9.859 -2.598 217 HD21 ASN 29 HD21 ASN 29 -14.013 -11.584 -2.612 218 HD22 ASN 29 HD22 ASN 29 -15.484 -11.787 -1.730 219 H GLN 30 H GLN 30 -11.455 -6.876 -1.606 220 HA GLN 30 HA GLN 30 -9.105 -7.781 -2.880 221 HB2 GLN 30 HB2 GLN 30 -9.291 -5.723 -3.721 222 HB3 GLN 30 HB3 GLN 30 -10.450 -5.280 -2.482 223 HG2 GLN 30 HG2 GLN 30 -7.581 -5.245 -1.744 224 HG3 GLN 30 HG3 GLN 30 -8.168 -3.992 -2.835 225 HE21 GLN 30 HE21 GLN 30 -10.364 -3.056 -2.065 226 HE22 GLN 30 HE22 GLN 30 -10.426 -2.629 -0.394 227 H LYS 31 H LYS 31 -9.777 -6.729 0.407 228 HA LYS 31 HA LYS 31 -7.207 -6.371 1.399 229 HB2 LYS 31 HB2 LYS 31 -9.547 -7.635 2.837 230 HB3 LYS 31 HB3 LYS 31 -8.136 -6.925 3.593 231 HG2 LYS 31 HG2 LYS 31 -9.029 -4.863 2.065 232 HG3 LYS 31 HG3 LYS 31 -10.531 -5.643 2.538 233 HD2 LYS 31 HD2 LYS 31 -8.682 -5.445 4.744 234 HD3 LYS 31 HD3 LYS 31 -9.028 -3.867 4.044 235 HE2 LYS 31 HE2 LYS 31 -11.394 -5.533 4.395 236 HE3 LYS 31 HE3 LYS 31 -10.548 -5.182 5.898 237 HZ1 LYS 31 HZ1 LYS 31 -10.771 -2.873 5.540 238 HZ2 LYS 31 HZ2 LYS 31 -12.295 -3.543 5.252 239 HZ3 LYS 31 HZ3 LYS 31 -11.316 -3.086 3.954 240 H LYS 32 H LYS 32 -9.190 -9.311 1.411 241 HA LYS 32 HA LYS 32 -7.334 -11.139 2.346 242 HB2 LYS 32 HB2 LYS 32 -9.841 -11.250 0.832 243 HB3 LYS 32 HB3 LYS 32 -8.758 -12.586 0.471 244 HG2 LYS 32 HG2 LYS 32 -9.208 -13.588 2.398 245 HG3 LYS 32 HG3 LYS 32 -8.946 -12.105 3.317 246 HD2 LYS 32 HD2 LYS 32 -11.462 -12.552 1.741 247 HD3 LYS 32 HD3 LYS 32 -11.280 -13.173 3.383 248 HE2 LYS 32 HE2 LYS 32 -10.419 -10.517 3.494 249 HE3 LYS 32 HE3 LYS 32 -11.860 -10.497 2.481 250 HZ1 LYS 32 HZ1 LYS 32 -13.184 -11.163 4.187 251 HZ2 LYS 32 HZ2 LYS 32 -12.021 -10.317 5.072 252 HZ3 LYS 32 HZ3 LYS 32 -11.957 -12.004 4.990 253 H TYR 33 H TYR 33 -7.759 -9.823 -0.906 254 HA TYR 33 HA TYR 33 -6.174 -11.561 -2.389 255 HB2 TYR 33 HB2 TYR 33 -7.558 -9.606 -3.259 256 HB3 TYR 33 HB3 TYR 33 -6.234 -8.565 -2.776 257 HD1 TYR 33 HD1 TYR 33 -7.199 -11.269 -5.101 258 HD2 TYR 33 HD2 TYR 33 -4.253 -8.406 -4.033 259 HE1 TYR 33 HE1 TYR 33 -6.037 -11.669 -7.232 260 HE2 TYR 33 HE2 TYR 33 -3.082 -8.790 -6.131 261 HH TYR 33 HH TYR 33 -3.972 -9.726 -8.593 262 H LEU 34 H LEU 34 -5.057 -8.361 -1.190 263 HA LEU 34 HA LEU 34 -2.339 -8.850 -1.639 264 HB2 LEU 34 HB2 LEU 34 -3.808 -7.012 0.222 265 HB3 LEU 34 HB3 LEU 34 -2.069 -7.116 0.271 266 HG LEU 34 HG LEU 34 -1.805 -5.900 -1.606 267 HD11 LEU 34 HD11 LEU 34 -4.362 -6.994 -2.737 268 HD12 LEU 34 HD12 LEU 34 -2.752 -7.649 -3.043 269 HD13 LEU 34 HD13 LEU 34 -3.160 -6.023 -3.588 270 HD21 LEU 34 HD21 LEU 34 -3.275 -4.119 -1.679 271 HD22 LEU 34 HD22 LEU 34 -3.514 -4.774 -0.056 272 HD23 LEU 34 HD23 LEU 34 -4.673 -5.143 -1.341 273 H GLU 35 H GLU 35 -4.445 -9.638 1.070 274 HA GLU 35 HA GLU 35 -2.532 -10.339 2.980 275 HB2 GLU 35 HB2 GLU 35 -5.303 -10.400 2.821 276 HB3 GLU 35 HB3 GLU 35 -4.869 -12.096 2.969 277 HG2 GLU 35 HG2 GLU 35 -3.422 -11.336 4.941 278 HG3 GLU 35 HG3 GLU 35 -4.360 -9.857 4.883 279 H ASP 36 H ASP 36 -4.105 -12.244 0.452 280 HA ASP 36 HA ASP 36 -2.914 -14.723 0.932 281 HB2 ASP 36 HB2 ASP 36 -4.768 -13.800 -0.807 282 HB3 ASP 36 HB3 ASP 36 -3.397 -13.973 -1.891 283 H TYR 37 H TYR 37 -1.752 -11.863 -0.707 284 HA TYR 37 HA TYR 37 0.548 -13.120 -1.876 285 HB2 TYR 37 HB2 TYR 37 -0.195 -11.172 -2.997 286 HB3 TYR 37 HB3 TYR 37 -0.299 -10.251 -1.509 287 HD1 TYR 37 HD1 TYR 37 1.751 -9.412 -0.427 288 HD2 TYR 37 HD2 TYR 37 1.878 -11.360 -4.198 289 HE1 TYR 37 HE1 TYR 37 4.020 -8.546 -0.787 290 HE2 TYR 37 HE2 TYR 37 4.145 -10.486 -4.581 291 HH TYR 37 HH TYR 37 6.122 -9.502 -2.434 292 H ALA 38 H ALA 38 0.199 -10.656 0.672 293 HA ALA 38 HA ALA 38 2.728 -10.524 1.601 294 HB1 ALA 38 HB1 ALA 38 0.429 -10.558 3.519 295 HB2 ALA 38 HB2 ALA 38 0.644 -9.255 2.352 296 HB3 ALA 38 HB3 ALA 38 1.890 -9.571 3.558 297 H ARG 39 H ARG 39 0.424 -13.127 2.236 298 HA ARG 39 HA ARG 39 2.151 -14.349 4.217 299 HB2 ARG 39 HB2 ARG 39 0.566 -16.287 4.056 300 HB3 ARG 39 HB3 ARG 39 -0.157 -14.768 4.546 301 HG2 ARG 39 HG2 ARG 39 -0.556 -14.636 1.894 302 HG3 ARG 39 HG3 ARG 39 -0.590 -16.388 2.139 303 HD2 ARG 39 HD2 ARG 39 -2.210 -14.402 3.720 304 HD3 ARG 39 HD3 ARG 39 -2.826 -15.367 2.382 305 HE ARG 39 HE ARG 39 -1.709 -16.658 4.775 306 HH11 ARG 39 HH11 ARG 39 -4.401 -16.168 2.583 307 HH12 ARG 39 HH12 ARG 39 -5.349 -17.433 3.280 308 HH21 ARG 39 HH21 ARG 39 -2.972 -18.318 5.680 309 HH22 ARG 39 HH22 ARG 39 -4.545 -18.648 5.037 310 H ARG 40 H ARG 40 1.228 -15.030 0.844 311 HA ARG 40 HA ARG 40 2.856 -17.295 0.499 312 HB2 ARG 40 HB2 ARG 40 2.235 -17.196 -1.698 313 HB3 ARG 40 HB3 ARG 40 1.044 -16.086 -1.053 314 HG2 ARG 40 HG2 ARG 40 2.350 -14.197 -1.751 315 HG3 ARG 40 HG3 ARG 40 3.670 -15.250 -2.259 316 HD2 ARG 40 HD2 ARG 40 1.217 -16.074 -3.496 317 HD3 ARG 40 HD3 ARG 40 1.489 -14.359 -3.784 318 HE ARG 40 HE ARG 40 3.886 -15.622 -4.318 319 HH11 ARG 40 HH11 ARG 40 0.616 -15.717 -5.563 320 HH12 ARG 40 HH12 ARG 40 1.105 -16.184 -7.157 321 HH21 ARG 40 HH21 ARG 40 4.524 -16.234 -6.423 322 HH22 ARG 40 HH22 ARG 40 3.323 -16.477 -7.645 323 H ASN 41 H ASN 41 3.587 -13.950 0.764 324 HA ASN 41 HA ASN 41 6.265 -14.226 -0.350 325 HB2 ASN 41 HB2 ASN 41 4.409 -12.033 0.139 326 HB3 ASN 41 HB3 ASN 41 6.040 -11.652 0.673 327 HD21 ASN 41 HD21 ASN 41 4.281 -13.014 -2.082 328 HD22 ASN 41 HD22 ASN 41 5.302 -12.324 -3.290 329 H GLY 42 H GLY 42 4.652 -13.914 2.740 330 HA2 GLY 42 HA2 GLY 42 5.547 -14.628 4.787 331 HA3 GLY 42 HA3 GLY 42 7.153 -14.571 4.086 332 H PHE 43 H PHE 43 4.574 -12.120 4.466 333 HA PHE 43 HA PHE 43 6.586 -10.315 5.624 334 HB2 PHE 43 HB2 PHE 43 3.940 -9.778 4.267 335 HB3 PHE 43 HB3 PHE 43 4.896 -8.530 5.057 336 HD1 PHE 43 HD1 PHE 43 7.542 -8.753 4.276 337 HD2 PHE 43 HD2 PHE 43 4.098 -9.769 2.028 338 HE1 PHE 43 HE1 PHE 43 8.817 -8.462 2.193 339 HE2 PHE 43 HE2 PHE 43 5.345 -9.493 -0.051 340 HZ PHE 43 HZ PHE 43 7.717 -8.831 0.021 341 H GLU 44 H GLU 44 6.295 -9.328 7.586 342 HA GLU 44 HA GLU 44 4.218 -10.431 9.303 343 HB2 GLU 44 HB2 GLU 44 6.870 -9.145 9.755 344 HB3 GLU 44 HB3 GLU 44 5.681 -9.190 11.047 345 HG2 GLU 44 HG2 GLU 44 7.428 -10.997 10.930 346 HG3 GLU 44 HG3 GLU 44 5.764 -11.467 11.218 347 H ASN 45 H ASN 45 3.400 -9.030 11.016 348 HA ASN 45 HA ASN 45 2.065 -7.292 11.611 349 HB2 ASN 45 HB2 ASN 45 4.385 -5.769 10.442 350 HB3 ASN 45 HB3 ASN 45 3.217 -5.116 11.588 351 HD21 ASN 45 HD21 ASN 45 6.212 -6.364 11.242 352 HD22 ASN 45 HD22 ASN 45 6.519 -6.880 12.863 353 H ILE 46 H ILE 46 1.618 -8.279 8.849 354 HA ILE 46 HA ILE 46 1.321 -6.271 6.981 355 HB ILE 46 HB ILE 46 -0.435 -8.706 7.259 356 HG12 ILE 46 HG12 ILE 46 1.979 -8.495 5.497 357 HG13 ILE 46 HG13 ILE 46 2.168 -8.954 7.186 358 HG21 ILE 46 HG21 ILE 46 -0.141 -8.223 4.608 359 HG22 ILE 46 HG22 ILE 46 -0.140 -6.582 5.256 360 HG23 ILE 46 HG23 ILE 46 -1.498 -7.659 5.584 361 HD11 ILE 46 HD11 ILE 46 0.135 -10.436 5.628 362 HD12 ILE 46 HD12 ILE 46 1.250 -10.994 6.878 363 HD13 ILE 46 HD13 ILE 46 1.829 -10.732 5.234 364 H ARG 47 H ARG 47 0.452 -4.456 7.578 365 HA ARG 47 HA ARG 47 -2.133 -4.385 8.922 366 HB2 ARG 47 HB2 ARG 47 0.049 -2.777 9.180 367 HB3 ARG 47 HB3 ARG 47 -0.973 -1.826 8.109 368 HG2 ARG 47 HG2 ARG 47 -2.651 -2.823 10.128 369 HG3 ARG 47 HG3 ARG 47 -1.200 -2.227 10.924 370 HD2 ARG 47 HD2 ARG 47 -1.455 -0.075 9.983 371 HD3 ARG 47 HD3 ARG 47 -2.686 -0.645 8.860 372 HE ARG 47 HE ARG 47 -3.072 -0.358 11.769 373 HH11 ARG 47 HH11 ARG 47 -4.377 -0.401 8.511 374 HH12 ARG 47 HH12 ARG 47 -5.969 0.038 9.022 375 HH21 ARG 47 HH21 ARG 47 -5.169 0.217 12.420 376 HH22 ARG 47 HH22 ARG 47 -6.420 0.390 11.234 377 H HIS 48 H HIS 48 -3.995 -3.984 7.982 378 HA HIS 48 HA HIS 48 -3.954 -3.508 5.105 379 HB2 HIS 48 HB2 HIS 48 -6.004 -4.701 6.955 380 HB3 HIS 48 HB3 HIS 48 -6.451 -4.186 5.331 381 HD1 HIS 48 HD1 HIS 48 -6.631 -6.255 3.997 382 HD2 HIS 48 HD2 HIS 48 -3.366 -6.307 6.520 383 HE1 HIS 48 HE1 HIS 48 -5.412 -8.371 3.426 384 HE2 HIS 48 HE2 HIS 48 -3.322 -8.279 4.841 385 H PHE 49 H PHE 49 -4.194 -1.538 4.403 386 HA PHE 49 HA PHE 49 -5.724 0.397 5.987 387 HB2 PHE 49 HB2 PHE 49 -3.813 0.959 3.698 388 HB3 PHE 49 HB3 PHE 49 -4.496 2.128 4.821 389 HD1 PHE 49 HD1 PHE 49 -3.811 2.080 7.193 390 HD2 PHE 49 HD2 PHE 49 -1.863 -0.294 4.255 391 HE1 PHE 49 HE1 PHE 49 -1.899 1.788 8.705 392 HE2 PHE 49 HE2 PHE 49 0.046 -0.587 5.766 393 HZ PHE 49 HZ PHE 49 0.034 0.449 7.989 394 H THR 50 H THR 50 -7.706 0.079 5.483 395 HA THR 50 HA THR 50 -8.709 -0.472 2.878 396 HB THR 50 HB THR 50 -9.601 -1.294 5.070 397 HG1 THR 50 HG1 THR 50 -11.508 0.062 3.464 398 HG21 THR 50 HG21 THR 50 -9.882 1.480 5.622 399 HG22 THR 50 HG22 THR 50 -10.206 0.094 6.663 400 HG23 THR 50 HG23 THR 50 -11.479 0.726 5.621 401 H ASP 51 H ASP 51 -10.315 0.698 1.732 402 HA ASP 51 HA ASP 51 -10.006 3.607 2.024 403 HB2 ASP 51 HB2 ASP 51 -10.010 3.868 -0.287 404 HB3 ASP 51 HB3 ASP 51 -9.087 2.385 -0.077 405 H ASP 52 H ASP 52 -11.751 4.942 1.736 406 HA ASP 52 HA ASP 52 -14.344 3.910 1.096 407 HB2 ASP 52 HB2 ASP 52 -14.291 3.216 3.417 408 HB3 ASP 52 HB3 ASP 52 -13.745 4.809 3.926 409 H GLY 53 H GLY 53 -14.848 5.462 -0.323 410 HA2 GLY 53 HA2 GLY 53 -15.281 7.544 -1.209 411 HA3 GLY 53 HA3 GLY 53 -15.415 8.114 0.449 412 H PHE 54 H PHE 54 -12.840 7.045 -1.791 413 HA PHE 54 HA PHE 54 -11.003 8.985 -0.629 414 HB2 PHE 54 HB2 PHE 54 -10.701 6.636 -2.472 415 HB3 PHE 54 HB3 PHE 54 -9.456 7.871 -2.450 416 HD1 PHE 54 HD1 PHE 54 -10.576 7.925 0.788 417 HD2 PHE 54 HD2 PHE 54 -8.447 5.372 -1.885 418 HE1 PHE 54 HE1 PHE 54 -9.566 6.767 2.685 419 HE2 PHE 54 HE2 PHE 54 -7.409 4.243 0.035 420 HZ PHE 54 HZ PHE 54 -7.972 4.942 2.328 421 H SER 55 H SER 55 -10.559 10.897 -1.570 422 HA SER 55 HA SER 55 -11.933 11.783 -3.889 423 HB2 SER 55 HB2 SER 55 -10.269 12.966 -1.880 424 HB3 SER 55 HB3 SER 55 -9.664 13.451 -3.462 425 HG SER 55 HG SER 55 -11.338 14.823 -2.575 426 H GLY 56 H GLY 56 -10.665 12.773 -5.822 427 HA2 GLY 56 HA2 GLY 56 -8.760 10.710 -6.716 428 HA3 GLY 56 HA3 GLY 56 -9.781 11.662 -7.775 429 H VAL 57 H VAL 57 -7.627 12.770 -5.131 430 HA VAL 57 HA VAL 57 -6.351 14.524 -7.102 431 HB VAL 57 HB VAL 57 -5.416 15.754 -5.163 432 HG11 VAL 57 HG11 VAL 57 -8.153 15.967 -4.384 433 HG12 VAL 57 HG12 VAL 57 -8.061 15.709 -6.126 434 HG13 VAL 57 HG13 VAL 57 -7.192 17.053 -5.388 435 HG21 VAL 57 HG21 VAL 57 -7.044 13.770 -3.589 436 HG22 VAL 57 HG22 VAL 57 -6.508 15.318 -2.935 437 HG23 VAL 57 HG23 VAL 57 -5.321 14.121 -3.450 438 H ASN 58 H ASN 58 -5.381 12.262 -4.489 439 HA ASN 58 HA ASN 58 -3.293 11.020 -5.774 440 HB2 ASN 58 HB2 ASN 58 -1.294 12.255 -4.767 441 HB3 ASN 58 HB3 ASN 58 -2.083 13.016 -6.139 442 HD21 ASN 58 HD21 ASN 58 -2.981 15.011 -5.895 443 HD22 ASN 58 HD22 ASN 58 -2.955 15.906 -4.421 444 H PHE 59 H PHE 59 -1.881 12.174 -2.918 445 HA PHE 59 HA PHE 59 -2.699 9.733 -1.537 446 HB2 PHE 59 HB2 PHE 59 -0.425 11.504 -0.679 447 HB3 PHE 59 HB3 PHE 59 -0.665 9.791 -0.367 448 HD1 PHE 59 HD1 PHE 59 -0.117 12.128 -3.263 449 HD2 PHE 59 HD2 PHE 59 0.590 8.282 -1.578 450 HE1 PHE 59 HE1 PHE 59 1.361 11.579 -5.136 451 HE2 PHE 59 HE2 PHE 59 2.073 7.739 -3.458 452 HZ PHE 59 HZ PHE 59 2.458 9.385 -5.239 453 H ASN 60 H ASN 60 -2.316 10.195 1.037 454 HA ASN 60 HA ASN 60 -2.971 11.274 2.943 455 HB2 ASN 60 HB2 ASN 60 -4.067 13.495 1.202 456 HB3 ASN 60 HB3 ASN 60 -3.834 13.541 2.944 457 HD21 ASN 60 HD21 ASN 60 -1.346 12.425 3.209 458 HD22 ASN 60 HD22 ASN 60 -0.171 13.439 2.455 459 H ARG 61 H ARG 61 -4.280 9.419 2.973 460 HA ARG 61 HA ARG 61 -7.185 9.968 2.749 461 HB2 ARG 61 HB2 ARG 61 -6.491 7.151 2.534 462 HB3 ARG 61 HB3 ARG 61 -7.529 8.126 1.513 463 HG2 ARG 61 HG2 ARG 61 -4.653 8.588 1.109 464 HG3 ARG 61 HG3 ARG 61 -5.209 6.963 0.725 465 HD2 ARG 61 HD2 ARG 61 -5.267 8.540 -1.195 466 HD3 ARG 61 HD3 ARG 61 -6.819 7.793 -0.822 467 HE ARG 61 HE ARG 61 -6.427 10.358 0.419 468 HH11 ARG 61 HH11 ARG 61 -7.539 8.698 -2.441 469 HH12 ARG 61 HH12 ARG 61 -8.550 10.002 -2.954 470 HH21 ARG 61 HH21 ARG 61 -7.763 12.071 -0.244 471 HH22 ARG 61 HH22 ARG 61 -8.674 11.923 -1.707 472 HA PRO 62 HA PRO 62 -7.602 8.653 6.976 473 HB2 PRO 62 HB2 PRO 62 -9.468 6.606 6.780 474 HB3 PRO 62 HB3 PRO 62 -9.863 8.327 6.835 475 HG2 PRO 62 HG2 PRO 62 -9.596 6.521 4.462 476 HG3 PRO 62 HG3 PRO 62 -10.810 7.767 4.782 477 HD2 PRO 62 HD2 PRO 62 -8.798 8.252 3.107 478 HD3 PRO 62 HD3 PRO 62 -9.353 9.503 4.241 479 H GLY 63 H GLY 63 -8.166 5.552 5.284 480 HA2 GLY 63 HA2 GLY 63 -6.629 3.958 6.980 481 HA3 GLY 63 HA3 GLY 63 -7.028 3.561 5.316 482 H PHE 64 H PHE 64 -5.780 5.742 4.068 483 HA PHE 64 HA PHE 64 -3.161 4.808 3.692 484 HB2 PHE 64 HB2 PHE 64 -4.460 6.053 2.018 485 HB3 PHE 64 HB3 PHE 64 -4.389 7.488 3.027 486 HD1 PHE 64 HD1 PHE 64 -1.886 8.168 3.696 487 HD2 PHE 64 HD2 PHE 64 -3.023 5.930 0.277 488 HE1 PHE 64 HE1 PHE 64 0.193 8.836 2.578 489 HE2 PHE 64 HE2 PHE 64 -0.957 6.589 -0.851 490 HZ PHE 64 HZ PHE 64 0.669 8.039 0.301 491 H GLN 65 H GLN 65 -4.460 7.527 5.559 492 HA GLN 65 HA GLN 65 -2.059 8.718 6.317 493 HB2 GLN 65 HB2 GLN 65 -4.807 8.667 7.496 494 HB3 GLN 65 HB3 GLN 65 -3.491 9.373 8.423 495 HG2 GLN 65 HG2 GLN 65 -3.483 10.349 5.708 496 HG3 GLN 65 HG3 GLN 65 -5.045 10.616 6.480 497 HE21 GLN 65 HE21 GLN 65 -1.568 10.951 7.138 498 HE22 GLN 65 HE22 GLN 65 -1.705 12.442 8.000 499 H SER 66 H SER 66 -3.707 5.885 7.502 500 HA SER 66 HA SER 66 -2.111 5.579 9.872 501 HB2 SER 66 HB2 SER 66 -4.346 4.454 9.462 502 HB3 SER 66 HB3 SER 66 -3.529 3.406 8.312 503 HG SER 66 HG SER 66 -3.427 2.286 10.158 504 H LEU 67 H LEU 67 -2.077 4.304 6.576 505 HA LEU 67 HA LEU 67 0.177 2.681 6.664 506 HB2 LEU 67 HB2 LEU 67 -0.719 2.354 4.623 507 HB3 LEU 67 HB3 LEU 67 -1.564 3.885 4.692 508 HG LEU 67 HG LEU 67 0.653 4.947 3.966 509 HD11 LEU 67 HD11 LEU 67 2.155 3.164 4.406 510 HD12 LEU 67 HD12 LEU 67 2.067 3.344 2.653 511 HD13 LEU 67 HD13 LEU 67 1.193 2.036 3.453 512 HD21 LEU 67 HD21 LEU 67 -1.239 4.800 2.494 513 HD22 LEU 67 HD22 LEU 67 -0.898 3.104 2.160 514 HD23 LEU 67 HD23 LEU 67 0.213 4.353 1.599 515 H ILE 68 H ILE 68 -0.116 6.127 5.803 516 HA ILE 68 HA ILE 68 2.653 6.570 5.435 517 HB ILE 68 HB ILE 68 0.458 8.007 4.809 518 HG12 ILE 68 HG12 ILE 68 1.950 9.811 4.124 519 HG13 ILE 68 HG13 ILE 68 3.202 9.222 5.212 520 HG21 ILE 68 HG21 ILE 68 -0.106 8.822 6.945 521 HG22 ILE 68 HG22 ILE 68 0.640 10.173 6.096 522 HG23 ILE 68 HG23 ILE 68 1.561 9.274 7.303 523 HD11 ILE 68 HD11 ILE 68 3.332 7.156 3.871 524 HD12 ILE 68 HD12 ILE 68 3.715 8.610 2.948 525 HD13 ILE 68 HD13 ILE 68 2.140 7.836 2.762 526 H LYS 69 H LYS 69 0.511 6.923 8.245 527 HA LYS 69 HA LYS 69 2.189 8.294 9.982 528 HB2 LYS 69 HB2 LYS 69 -0.184 7.685 10.455 529 HB3 LYS 69 HB3 LYS 69 0.338 6.032 10.752 530 HG2 LYS 69 HG2 LYS 69 1.885 7.928 12.278 531 HG3 LYS 69 HG3 LYS 69 0.158 8.081 12.609 532 HD2 LYS 69 HD2 LYS 69 0.486 6.396 14.054 533 HD3 LYS 69 HD3 LYS 69 0.520 5.367 12.622 534 HE2 LYS 69 HE2 LYS 69 2.839 5.248 12.606 535 HE3 LYS 69 HE3 LYS 69 3.018 6.707 13.578 536 HZ1 LYS 69 HZ1 LYS 69 2.091 4.048 14.511 537 HZ2 LYS 69 HZ2 LYS 69 2.068 5.444 15.463 538 HZ3 LYS 69 HZ3 LYS 69 3.541 4.819 14.915 539 H GLU 70 H GLU 70 2.134 4.902 9.115 540 HA GLU 70 HA GLU 70 4.140 4.119 11.016 541 HB2 GLU 70 HB2 GLU 70 2.504 2.814 8.979 542 HB3 GLU 70 HB3 GLU 70 4.155 2.212 8.994 543 HG2 GLU 70 HG2 GLU 70 2.413 1.027 10.440 544 HG3 GLU 70 HG3 GLU 70 3.979 1.396 11.153 545 H VAL 71 H VAL 71 4.051 5.040 7.598 546 HA VAL 71 HA VAL 71 6.737 4.474 6.984 547 HB VAL 71 HB VAL 71 5.119 6.709 5.760 548 HG11 VAL 71 HG11 VAL 71 7.447 5.066 4.791 549 HG12 VAL 71 HG12 VAL 71 7.447 6.787 5.179 550 HG13 VAL 71 HG13 VAL 71 6.538 6.196 3.788 551 HG21 VAL 71 HG21 VAL 71 5.185 4.297 4.190 552 HG22 VAL 71 HG22 VAL 71 3.797 5.247 4.722 553 HG23 VAL 71 HG23 VAL 71 4.452 3.987 5.766 554 H GLU 72 H GLU 72 5.210 7.388 8.321 555 HA GLU 72 HA GLU 72 7.564 8.980 8.255 556 HB2 GLU 72 HB2 GLU 72 6.196 10.235 10.166 557 HB3 GLU 72 HB3 GLU 72 5.791 10.385 8.465 558 HG2 GLU 72 HG2 GLU 72 3.899 9.108 8.661 559 HG3 GLU 72 HG3 GLU 72 4.492 8.254 10.074 560 H ALA 73 H ALA 73 6.071 6.940 10.726 561 HA ALA 73 HA ALA 73 7.950 7.558 12.783 562 HB1 ALA 73 HB1 ALA 73 6.755 6.117 14.085 563 HB2 ALA 73 HB2 ALA 73 6.517 4.956 12.778 564 HB3 ALA 73 HB3 ALA 73 5.551 6.431 12.834 565 H GLY 74 H GLY 74 8.276 5.790 9.931 566 HA2 GLY 74 HA2 GLY 74 10.006 4.565 9.102 567 HA3 GLY 74 HA3 GLY 74 10.886 4.833 10.589 568 H ASN 75 H ASN 75 7.700 3.382 10.297 569 HA ASN 75 HA ASN 75 8.649 0.921 11.576 570 HB2 ASN 75 HB2 ASN 75 5.983 2.264 11.196 571 HB3 ASN 75 HB3 ASN 75 6.047 0.546 11.546 572 HD21 ASN 75 HD21 ASN 75 4.719 1.770 13.309 573 HD22 ASN 75 HD22 ASN 75 5.603 2.102 14.754 574 H VAL 76 H VAL 76 6.419 1.847 8.922 575 HA VAL 76 HA VAL 76 6.047 -0.619 7.810 576 HB VAL 76 HB VAL 76 4.922 1.501 7.072 577 HG11 VAL 76 HG11 VAL 76 7.476 2.341 6.444 578 HG12 VAL 76 HG12 VAL 76 5.974 3.123 5.974 579 HG13 VAL 76 HG13 VAL 76 6.754 1.989 4.878 580 HG21 VAL 76 HG21 VAL 76 4.546 0.723 4.809 581 HG22 VAL 76 HG22 VAL 76 4.654 -0.649 5.912 582 HG23 VAL 76 HG23 VAL 76 6.021 -0.243 4.872 583 H GLU 77 H GLU 77 7.390 -2.095 7.167 584 HA GLU 77 HA GLU 77 9.988 -1.311 6.029 585 HB2 GLU 77 HB2 GLU 77 10.809 -3.475 6.665 586 HB3 GLU 77 HB3 GLU 77 9.995 -2.761 8.049 587 HG2 GLU 77 HG2 GLU 77 8.596 -4.459 8.197 588 HG3 GLU 77 HG3 GLU 77 8.156 -4.320 6.497 589 H THR 78 H THR 78 6.981 -2.198 5.018 590 HA THR 78 HA THR 78 7.897 -2.894 2.378 591 HB THR 78 HB THR 78 5.947 -4.867 3.370 592 HG1 THR 78 HG1 THR 78 7.158 -5.444 4.983 593 HG21 THR 78 HG21 THR 78 6.551 -5.360 1.253 594 HG22 THR 78 HG22 THR 78 7.730 -6.330 2.138 595 HG23 THR 78 HG23 THR 78 8.199 -4.767 1.465 596 H LEU 79 H LEU 79 6.237 -2.819 0.798 597 HA LEU 79 HA LEU 79 3.654 -1.825 1.757 598 HB2 LEU 79 HB2 LEU 79 5.302 -0.037 0.803 599 HB3 LEU 79 HB3 LEU 79 4.849 -0.714 -0.728 600 HG LEU 79 HG LEU 79 3.383 1.047 -0.594 601 HD11 LEU 79 HD11 LEU 79 1.212 0.236 -0.261 602 HD12 LEU 79 HD12 LEU 79 1.745 -0.942 0.932 603 HD13 LEU 79 HD13 LEU 79 2.166 -1.156 -0.766 604 HD21 LEU 79 HD21 LEU 79 3.688 0.696 2.302 605 HD22 LEU 79 HD22 LEU 79 2.111 1.275 1.761 606 HD23 LEU 79 HD23 LEU 79 3.574 2.165 1.334 607 H ILE 80 H ILE 80 2.073 -2.982 1.006 608 HA ILE 80 HA ILE 80 2.397 -4.447 -1.525 609 HB ILE 80 HB ILE 80 1.181 -5.260 1.078 610 HG12 ILE 80 HG12 ILE 80 2.275 -7.450 0.330 611 HG13 ILE 80 HG13 ILE 80 2.996 -6.510 -0.972 612 HG21 ILE 80 HG21 ILE 80 0.184 -6.026 -1.616 613 HG22 ILE 80 HG22 ILE 80 -0.706 -5.747 -0.120 614 HG23 ILE 80 HG23 ILE 80 0.211 -7.237 -0.334 615 HD11 ILE 80 HD11 ILE 80 4.367 -6.906 1.140 616 HD12 ILE 80 HD12 ILE 80 3.320 -5.698 1.886 617 HD13 ILE 80 HD13 ILE 80 4.306 -5.269 0.488 618 H VAL 81 H VAL 81 1.219 -3.559 -3.067 619 HA VAL 81 HA VAL 81 -1.503 -2.611 -2.447 620 HB VAL 81 HB VAL 81 0.305 -1.285 -4.465 621 HG11 VAL 81 HG11 VAL 81 -2.067 -0.019 -3.162 622 HG12 VAL 81 HG12 VAL 81 -2.291 -1.155 -4.490 623 HG13 VAL 81 HG13 VAL 81 -1.336 0.305 -4.732 624 HG21 VAL 81 HG21 VAL 81 1.441 -0.633 -2.562 625 HG22 VAL 81 HG22 VAL 81 0.001 -0.718 -1.536 626 HG23 VAL 81 HG23 VAL 81 0.213 0.634 -2.653 627 H LYS 82 H LYS 82 -3.054 -2.991 -4.041 628 HA LYS 82 HA LYS 82 -2.732 -5.185 -5.749 629 HB2 LYS 82 HB2 LYS 82 -4.855 -3.631 -4.928 630 HB3 LYS 82 HB3 LYS 82 -4.741 -3.233 -6.635 631 HG2 LYS 82 HG2 LYS 82 -4.778 -6.074 -5.693 632 HG3 LYS 82 HG3 LYS 82 -6.264 -5.159 -5.954 633 HD2 LYS 82 HD2 LYS 82 -6.021 -5.147 -8.206 634 HD3 LYS 82 HD3 LYS 82 -4.261 -5.073 -8.126 635 HE2 LYS 82 HE2 LYS 82 -4.034 -7.321 -8.117 636 HE3 LYS 82 HE3 LYS 82 -5.484 -7.569 -7.149 637 HZ1 LYS 82 HZ1 LYS 82 -5.614 -6.760 -9.992 638 HZ2 LYS 82 HZ2 LYS 82 -6.845 -7.411 -9.033 639 HZ3 LYS 82 HZ3 LYS 82 -5.552 -8.384 -9.521 640 H ASP 83 H ASP 83 -2.214 -1.736 -6.244 641 HA ASP 83 HA ASP 83 -0.432 -2.052 -8.354 642 HB2 ASP 83 HB2 ASP 83 -1.872 -0.929 -10.167 643 HB3 ASP 83 HB3 ASP 83 -2.114 -2.645 -9.873 644 H MET 84 H MET 84 0.227 0.010 -9.349 645 HA MET 84 HA MET 84 0.560 2.009 -7.406 646 HB2 MET 84 HB2 MET 84 1.118 1.941 -10.360 647 HB3 MET 84 HB3 MET 84 1.505 3.337 -9.366 648 HG2 MET 84 HG2 MET 84 2.496 0.822 -8.273 649 HG3 MET 84 HG3 MET 84 3.152 1.216 -9.860 650 HE1 MET 84 HE1 MET 84 3.213 2.730 -5.917 651 HE2 MET 84 HE2 MET 84 4.898 2.263 -6.148 652 HE3 MET 84 HE3 MET 84 3.607 1.123 -6.527 653 H SER 85 H SER 85 -2.218 1.493 -9.225 654 HA SER 85 HA SER 85 -2.884 4.174 -9.889 655 HB2 SER 85 HB2 SER 85 -4.871 1.961 -9.377 656 HB3 SER 85 HB3 SER 85 -5.055 3.363 -10.428 657 HG SER 85 HG SER 85 -3.611 1.001 -10.838 658 H ARG 86 H ARG 86 -2.945 2.407 -6.926 659 HA ARG 86 HA ARG 86 -5.002 3.816 -5.604 660 HB2 ARG 86 HB2 ARG 86 -2.632 2.328 -4.484 661 HB3 ARG 86 HB3 ARG 86 -3.991 2.911 -3.532 662 HG2 ARG 86 HG2 ARG 86 -4.346 1.039 -5.848 663 HG3 ARG 86 HG3 ARG 86 -4.038 0.468 -4.205 664 HD2 ARG 86 HD2 ARG 86 -6.073 1.214 -3.432 665 HD3 ARG 86 HD3 ARG 86 -6.235 2.418 -4.705 666 HE ARG 86 HE ARG 86 -7.218 -0.223 -4.761 667 HH11 ARG 86 HH11 ARG 86 -5.667 2.091 -6.879 668 HH12 ARG 86 HH12 ARG 86 -6.419 1.467 -8.302 669 HH21 ARG 86 HH21 ARG 86 -8.189 -1.039 -6.636 670 HH22 ARG 86 HH22 ARG 86 -7.848 -0.310 -8.168 671 H LEU 87 H LEU 87 -1.456 4.205 -5.370 672 HA LEU 87 HA LEU 87 -1.761 6.658 -3.881 673 HB2 LEU 87 HB2 LEU 87 0.607 5.170 -4.986 674 HB3 LEU 87 HB3 LEU 87 0.777 6.747 -4.244 675 HG LEU 87 HG LEU 87 -0.609 5.452 -2.305 676 HD11 LEU 87 HD11 LEU 87 1.049 3.389 -3.722 677 HD12 LEU 87 HD12 LEU 87 -0.667 3.320 -3.319 678 HD13 LEU 87 HD13 LEU 87 0.543 3.244 -2.039 679 HD21 LEU 87 HD21 LEU 87 1.446 6.754 -2.021 680 HD22 LEU 87 HD22 LEU 87 2.384 5.403 -2.651 681 HD23 LEU 87 HD23 LEU 87 1.503 5.236 -1.133 682 H GLY 88 H GLY 88 -1.550 5.866 -7.254 683 HA2 GLY 88 HA2 GLY 88 -2.419 7.840 -8.558 684 HA3 GLY 88 HA3 GLY 88 -1.111 8.734 -7.816 685 H ARG 89 H ARG 89 -1.608 8.508 -10.581 686 HA ARG 89 HA ARG 89 0.192 6.615 -11.754 687 HB2 ARG 89 HB2 ARG 89 -1.129 9.081 -12.904 688 HB3 ARG 89 HB3 ARG 89 -0.201 7.921 -13.839 689 HG2 ARG 89 HG2 ARG 89 -2.179 6.966 -14.229 690 HG3 ARG 89 HG3 ARG 89 -2.001 6.299 -12.606 691 HD2 ARG 89 HD2 ARG 89 -3.227 8.224 -11.698 692 HD3 ARG 89 HD3 ARG 89 -3.428 8.854 -13.331 693 HE ARG 89 HE ARG 89 -4.445 6.260 -13.288 694 HH11 ARG 89 HH11 ARG 89 -5.173 9.377 -11.881 695 HH12 ARG 89 HH12 ARG 89 -6.869 9.061 -11.754 696 HH21 ARG 89 HH21 ARG 89 -6.677 5.847 -13.119 697 HH22 ARG 89 HH22 ARG 89 -7.724 7.056 -12.457 698 H ASN 90 H ASN 90 0.411 9.852 -10.505 699 HA ASN 90 HA ASN 90 2.708 10.783 -11.801 700 HB2 ASN 90 HB2 ASN 90 2.993 12.048 -9.484 701 HB3 ASN 90 HB3 ASN 90 1.719 12.484 -10.614 702 HD21 ASN 90 HD21 ASN 90 2.379 10.435 -7.799 703 HD22 ASN 90 HD22 ASN 90 0.792 10.555 -7.127 704 H TYR 91 H TYR 91 4.218 9.163 -11.994 705 HA TYR 91 HA TYR 91 5.201 7.601 -9.868 706 HB2 TYR 91 HB2 TYR 91 5.357 6.887 -12.147 707 HB3 TYR 91 HB3 TYR 91 6.379 8.254 -12.569 708 HD1 TYR 91 HD1 TYR 91 8.730 8.321 -11.675 709 HD2 TYR 91 HD2 TYR 91 6.253 4.892 -11.265 710 HE1 TYR 91 HE1 TYR 91 10.721 6.943 -11.274 711 HE2 TYR 91 HE2 TYR 91 8.247 3.487 -10.869 712 HH TYR 91 HH TYR 91 10.975 3.928 -11.636 713 H LEU 92 H LEU 92 5.763 10.890 -10.590 714 HA LEU 92 HA LEU 92 8.439 11.101 -9.619 715 HB2 LEU 92 HB2 LEU 92 6.228 13.143 -9.845 716 HB3 LEU 92 HB3 LEU 92 7.865 13.529 -9.350 717 HG LEU 92 HG LEU 92 8.552 12.496 -11.627 718 HD11 LEU 92 HD11 LEU 92 6.526 11.493 -12.296 719 HD12 LEU 92 HD12 LEU 92 6.737 12.902 -13.336 720 HD13 LEU 92 HD13 LEU 92 5.607 12.962 -11.983 721 HD21 LEU 92 HD21 LEU 92 8.963 14.631 -12.078 722 HD22 LEU 92 HD22 LEU 92 7.885 15.091 -10.758 723 HD23 LEU 92 HD23 LEU 92 7.253 14.926 -12.397 724 H GLN 93 H GLN 93 5.265 11.891 -8.268 725 HA GLN 93 HA GLN 93 6.177 12.347 -5.611 726 HB2 GLN 93 HB2 GLN 93 3.522 12.012 -6.957 727 HB3 GLN 93 HB3 GLN 93 3.601 11.966 -5.198 728 HG2 GLN 93 HG2 GLN 93 4.036 14.168 -5.025 729 HG3 GLN 93 HG3 GLN 93 4.993 14.205 -6.510 730 HE21 GLN 93 HE21 GLN 93 3.549 13.691 -8.516 731 HE22 GLN 93 HE22 GLN 93 2.089 14.609 -8.603 732 H VAL 94 H VAL 94 4.515 9.646 -7.218 733 HA VAL 94 HA VAL 94 4.319 7.923 -5.016 734 HB VAL 94 HB VAL 94 4.686 7.165 -7.935 735 HG11 VAL 94 HG11 VAL 94 3.291 5.527 -5.845 736 HG12 VAL 94 HG12 VAL 94 5.026 5.384 -6.125 737 HG13 VAL 94 HG13 VAL 94 3.892 5.035 -7.430 738 HG21 VAL 94 HG21 VAL 94 2.567 7.736 -8.331 739 HG22 VAL 94 HG22 VAL 94 2.603 8.605 -6.795 740 HG23 VAL 94 HG23 VAL 94 1.996 6.951 -6.857 741 H GLY 95 H GLY 95 6.850 8.216 -7.510 742 HA2 GLY 95 HA2 GLY 95 8.569 6.221 -6.523 743 HA3 GLY 95 HA3 GLY 95 9.059 7.582 -7.520 744 H PHE 96 H PHE 96 8.556 9.742 -5.979 745 HA PHE 96 HA PHE 96 10.716 10.083 -4.354 746 HB2 PHE 96 HB2 PHE 96 9.518 12.038 -4.810 747 HB3 PHE 96 HB3 PHE 96 7.979 11.321 -4.356 748 HD1 PHE 96 HD1 PHE 96 7.479 10.964 -1.906 749 HD2 PHE 96 HD2 PHE 96 10.797 13.262 -3.271 750 HE1 PHE 96 HE1 PHE 96 7.642 12.035 0.296 751 HE2 PHE 96 HE2 PHE 96 10.958 14.337 -1.066 752 HZ PHE 96 HZ PHE 96 9.382 13.723 0.720 753 H TYR 97 H TYR 97 7.518 8.889 -3.404 754 HA TYR 97 HA TYR 97 8.044 8.596 -0.663 755 HB2 TYR 97 HB2 TYR 97 6.066 7.303 -2.524 756 HB3 TYR 97 HB3 TYR 97 6.123 6.884 -0.814 757 HD1 TYR 97 HD1 TYR 97 6.351 9.199 0.688 758 HD2 TYR 97 HD2 TYR 97 4.410 8.793 -3.072 759 HE1 TYR 97 HE1 TYR 97 4.971 11.165 1.197 760 HE2 TYR 97 HE2 TYR 97 3.029 10.760 -2.578 761 HH TYR 97 HH TYR 97 3.695 12.958 -0.281 762 H THR 98 H THR 98 8.310 6.261 -3.346 763 HA THR 98 HA THR 98 9.274 4.196 -1.584 764 HB THR 98 HB THR 98 9.594 2.909 -3.695 765 HG1 THR 98 HG1 THR 98 9.287 3.824 -5.597 766 HG21 THR 98 HG21 THR 98 7.343 3.219 -2.450 767 HG22 THR 98 HG22 THR 98 7.372 2.481 -4.051 768 HG23 THR 98 HG23 THR 98 6.906 4.172 -3.867 769 H GLU 99 H GLU 99 10.856 6.690 -3.486 770 HA GLU 99 HA GLU 99 13.408 5.269 -3.339 771 HB2 GLU 99 HB2 GLU 99 14.270 7.221 -4.693 772 HB3 GLU 99 HB3 GLU 99 13.090 6.182 -5.471 773 HG2 GLU 99 HG2 GLU 99 11.740 7.883 -5.828 774 HG3 GLU 99 HG3 GLU 99 11.759 8.334 -4.128 775 H VAL 100 H VAL 100 12.059 8.370 -2.162 776 HA VAL 100 HA VAL 100 14.514 8.645 -0.574 777 HB VAL 100 HB VAL 100 14.103 10.526 -2.066 778 HG11 VAL 100 HG11 VAL 100 12.203 12.101 -1.402 779 HG12 VAL 100 HG12 VAL 100 11.487 10.694 -0.620 780 HG13 VAL 100 HG13 VAL 100 11.801 10.674 -2.355 781 HG21 VAL 100 HG21 VAL 100 14.161 12.345 -0.339 782 HG22 VAL 100 HG22 VAL 100 15.322 11.038 -0.100 783 HG23 VAL 100 HG23 VAL 100 13.852 11.101 0.873 784 H LEU 101 H LEU 101 10.999 8.812 -0.278 785 HA LEU 101 HA LEU 101 10.936 9.469 2.469 786 HB2 LEU 101 HB2 LEU 101 9.096 9.447 0.547 787 HB3 LEU 101 HB3 LEU 101 8.722 7.892 1.267 788 HG LEU 101 HG LEU 101 7.262 9.526 2.219 789 HD11 LEU 101 HD11 LEU 101 8.265 7.791 3.723 790 HD12 LEU 101 HD12 LEU 101 7.697 9.241 4.550 791 HD13 LEU 101 HD13 LEU 101 9.423 9.008 4.263 792 HD21 LEU 101 HD21 LEU 101 8.074 11.628 2.015 793 HD22 LEU 101 HD22 LEU 101 9.733 11.146 2.363 794 HD23 LEU 101 HD23 LEU 101 8.577 11.341 3.680 795 H PHE 102 H PHE 102 10.020 6.355 0.996 796 HA PHE 102 HA PHE 102 9.817 4.891 3.334 797 HB2 PHE 102 HB2 PHE 102 10.363 4.043 0.505 798 HB3 PHE 102 HB3 PHE 102 10.100 2.899 1.805 799 HD1 PHE 102 HD1 PHE 102 8.241 5.946 2.090 800 HD2 PHE 102 HD2 PHE 102 8.191 2.051 0.352 801 HE1 PHE 102 HE1 PHE 102 5.823 6.134 1.727 802 HE2 PHE 102 HE2 PHE 102 5.767 2.245 -0.004 803 HZ PHE 102 HZ PHE 102 4.582 4.287 0.687 804 HA PRO 103 HA PRO 103 14.564 3.474 2.119 805 HB2 PRO 103 HB2 PRO 103 15.295 6.350 2.496 806 HB3 PRO 103 HB3 PRO 103 16.105 5.098 1.555 807 HG2 PRO 103 HG2 PRO 103 14.548 6.903 0.377 808 HG3 PRO 103 HG3 PRO 103 14.581 5.221 -0.181 809 HD2 PRO 103 HD2 PRO 103 12.469 6.676 1.281 810 HD3 PRO 103 HD3 PRO 103 12.353 5.260 0.239 811 H GLN 104 H GLN 104 13.540 6.038 4.379 812 HA GLN 104 HA GLN 104 15.471 5.769 6.313 813 HB2 GLN 104 HB2 GLN 104 12.810 6.048 7.499 814 HB3 GLN 104 HB3 GLN 104 14.228 7.067 7.653 815 HG2 GLN 104 HG2 GLN 104 13.717 7.966 5.372 816 HG3 GLN 104 HG3 GLN 104 12.206 7.079 5.452 817 HE21 GLN 104 HE21 GLN 104 10.541 8.291 6.020 818 HE22 GLN 104 HE22 GLN 104 10.590 9.647 7.086 819 H LYS 105 H LYS 105 12.956 3.476 5.591 820 HA LYS 105 HA LYS 105 13.902 1.838 7.841 821 HB2 LYS 105 HB2 LYS 105 11.182 1.201 7.008 822 HB3 LYS 105 HB3 LYS 105 11.840 1.433 8.619 823 HG2 LYS 105 HG2 LYS 105 10.206 3.083 8.389 824 HG3 LYS 105 HG3 LYS 105 11.732 3.925 8.128 825 HD2 LYS 105 HD2 LYS 105 11.010 3.062 5.608 826 HD3 LYS 105 HD3 LYS 105 9.480 3.544 6.339 827 HE2 LYS 105 HE2 LYS 105 11.120 5.564 7.113 828 HE3 LYS 105 HE3 LYS 105 11.778 5.168 5.530 829 HZ1 LYS 105 HZ1 LYS 105 10.177 6.585 4.873 830 HZ2 LYS 105 HZ2 LYS 105 9.215 6.334 6.239 831 HZ3 LYS 105 HZ3 LYS 105 9.195 5.215 4.974 832 H ASN 106 H ASN 106 14.002 1.995 4.582 833 HA ASN 106 HA ASN 106 14.409 0.502 2.922 834 HB2 ASN 106 HB2 ASN 106 15.992 -0.567 4.367 835 HB3 ASN 106 HB3 ASN 106 14.718 -1.392 5.259 836 HD21 ASN 106 HD21 ASN 106 16.586 -1.292 2.337 837 HD22 ASN 106 HD22 ASN 106 16.145 -2.858 1.767 838 H VAL 107 H VAL 107 12.616 0.421 1.753 839 HA VAL 107 HA VAL 107 10.384 -1.260 2.671 840 HB VAL 107 HB VAL 107 10.106 1.257 2.304 841 HG11 VAL 107 HG11 VAL 107 9.419 0.606 -0.500 842 HG12 VAL 107 HG12 VAL 107 11.134 0.772 -0.135 843 HG13 VAL 107 HG13 VAL 107 10.036 2.104 0.189 844 HG21 VAL 107 HG21 VAL 107 7.789 0.881 1.629 845 HG22 VAL 107 HG22 VAL 107 8.319 -0.344 2.777 846 HG23 VAL 107 HG23 VAL 107 8.212 -0.732 1.060 847 H ARG 108 H ARG 108 9.248 -2.501 1.319 848 HA ARG 108 HA ARG 108 10.408 -3.141 -1.288 849 HB2 ARG 108 HB2 ARG 108 10.186 -4.845 0.951 850 HB3 ARG 108 HB3 ARG 108 8.924 -5.345 -0.162 851 HG2 ARG 108 HG2 ARG 108 10.892 -6.635 -0.583 852 HG3 ARG 108 HG3 ARG 108 10.636 -5.537 -1.941 853 HD2 ARG 108 HD2 ARG 108 12.515 -4.365 -1.515 854 HD3 ARG 108 HD3 ARG 108 12.324 -4.493 0.231 855 HE ARG 108 HE ARG 108 13.841 -6.224 -1.478 856 HH11 ARG 108 HH11 ARG 108 12.152 -6.008 1.575 857 HH12 ARG 108 HH12 ARG 108 13.050 -7.293 2.305 858 HH21 ARG 108 HH21 ARG 108 15.027 -7.916 -0.513 859 HH22 ARG 108 HH22 ARG 108 14.687 -8.374 1.121 860 H PHE 109 H PHE 109 9.013 -1.855 -2.421 861 HA PHE 109 HA PHE 109 6.216 -1.828 -1.825 862 HB2 PHE 109 HB2 PHE 109 7.805 -0.009 -2.933 863 HB3 PHE 109 HB3 PHE 109 7.214 -0.757 -4.406 864 HD1 PHE 109 HD1 PHE 109 4.670 -0.953 -4.687 865 HD2 PHE 109 HD2 PHE 109 6.552 1.563 -1.827 866 HE1 PHE 109 HE1 PHE 109 2.614 0.384 -4.540 867 HE2 PHE 109 HE2 PHE 109 4.512 2.920 -1.656 868 HZ PHE 109 HZ PHE 109 2.530 2.333 -3.017 869 H LEU 110 H LEU 110 4.521 -2.680 -3.033 870 HA LEU 110 HA LEU 110 5.234 -4.471 -5.240 871 HB2 LEU 110 HB2 LEU 110 5.048 -5.941 -3.432 872 HB3 LEU 110 HB3 LEU 110 3.637 -5.135 -2.788 873 HG LEU 110 HG LEU 110 3.308 -7.425 -3.860 874 HD11 LEU 110 HD11 LEU 110 1.144 -6.932 -4.290 875 HD12 LEU 110 HD12 LEU 110 1.535 -5.501 -5.241 876 HD13 LEU 110 HD13 LEU 110 1.607 -5.437 -3.481 877 HD21 LEU 110 HD21 LEU 110 2.871 -6.513 -6.503 878 HD22 LEU 110 HD22 LEU 110 3.983 -7.760 -5.940 879 HD23 LEU 110 HD23 LEU 110 4.521 -6.086 -6.054 880 H ALA 111 H ALA 111 4.068 -4.269 -6.944 881 HA ALA 111 HA ALA 111 1.387 -3.034 -6.826 882 HB1 ALA 111 HB1 ALA 111 2.741 -1.337 -7.766 883 HB2 ALA 111 HB2 ALA 111 1.967 -2.123 -9.148 884 HB3 ALA 111 HB3 ALA 111 3.645 -2.490 -8.753 885 H ILE 112 H ILE 112 0.137 -4.783 -7.099 886 HA ILE 112 HA ILE 112 0.993 -7.077 -8.505 887 HB ILE 112 HB ILE 112 -1.653 -6.293 -7.343 888 HG12 ILE 112 HG12 ILE 112 -0.050 -8.661 -6.539 889 HG13 ILE 112 HG13 ILE 112 0.593 -7.080 -6.134 890 HG21 ILE 112 HG21 ILE 112 -0.994 -8.613 -9.084 891 HG22 ILE 112 HG22 ILE 112 -2.487 -7.686 -8.953 892 HG23 ILE 112 HG23 ILE 112 -2.072 -8.865 -7.711 893 HD11 ILE 112 HD11 ILE 112 -2.205 -7.336 -5.442 894 HD12 ILE 112 HD12 ILE 112 -0.832 -6.831 -4.460 895 HD13 ILE 112 HD13 ILE 112 -1.192 -8.548 -4.653 896 H ASN 113 H ASN 113 -1.355 -4.563 -9.497 897 HA ASN 113 HA ASN 113 -1.964 -5.962 -11.938 898 HB2 ASN 113 HB2 ASN 113 -3.137 -3.881 -10.421 899 HB3 ASN 113 HB3 ASN 113 -2.846 -3.243 -12.035 900 HD21 ASN 113 HD21 ASN 113 -3.576 -4.699 -13.839 901 HD22 ASN 113 HD22 ASN 113 -5.080 -5.516 -13.620 902 H ASN 114 H ASN 114 0.868 -4.643 -11.350 903 HA ASN 114 HA ASN 114 1.569 -4.229 -14.024 904 HB2 ASN 114 HB2 ASN 114 0.317 -1.954 -12.863 905 HB3 ASN 114 HB3 ASN 114 2.020 -1.585 -13.090 906 HD21 ASN 114 HD21 ASN 114 -1.008 -2.023 -14.597 907 HD22 ASN 114 HD22 ASN 114 -0.495 -1.763 -16.223 908 H SER 115 H SER 115 3.781 -3.325 -14.295 909 HA SER 115 HA SER 115 5.538 -4.437 -12.366 910 HB2 SER 115 HB2 SER 115 7.342 -3.500 -13.779 911 HB3 SER 115 HB3 SER 115 6.143 -4.371 -14.731 912 HG SER 115 HG SER 115 6.645 -2.399 -15.715 913 H ILE 116 H ILE 116 5.701 -3.555 -10.407 914 HA ILE 116 HA ILE 116 5.186 -0.960 -9.641 915 HB ILE 116 HB ILE 116 5.748 -3.184 -8.283 916 HG12 ILE 116 HG12 ILE 116 4.608 -1.096 -7.499 917 HG13 ILE 116 HG13 ILE 116 5.593 -1.882 -6.273 918 HG21 ILE 116 HG21 ILE 116 7.816 -3.015 -7.057 919 HG22 ILE 116 HG22 ILE 116 8.238 -1.532 -7.910 920 HG23 ILE 116 HG23 ILE 116 8.163 -3.059 -8.788 921 HD11 ILE 116 HD11 ILE 116 6.197 0.286 -5.955 922 HD12 ILE 116 HD12 ILE 116 5.977 0.715 -7.651 923 HD13 ILE 116 HD13 ILE 116 7.409 -0.183 -7.147 924 H ASP 117 H ASP 117 8.291 -2.328 -10.647 925 HA ASP 117 HA ASP 117 9.302 0.129 -11.602 926 HB2 ASP 117 HB2 ASP 117 9.520 0.768 -9.279 927 HB3 ASP 117 HB3 ASP 117 10.301 -0.758 -8.883 928 H SER 118 H SER 118 10.072 -3.019 -10.172 929 HA SER 118 HA SER 118 12.499 -3.385 -11.578 930 HB2 SER 118 HB2 SER 118 10.935 -4.850 -9.635 931 HB3 SER 118 HB3 SER 118 11.571 -5.923 -10.880 932 HG SER 118 HG SER 118 12.874 -4.643 -8.867 933 H ASN 119 H ASN 119 12.939 -4.955 -13.255 934 HA ASN 119 HA ASN 119 10.809 -6.172 -14.734 935 HB2 ASN 119 HB2 ASN 119 11.285 -3.493 -15.338 936 HB3 ASN 119 HB3 ASN 119 12.133 -4.396 -16.601 937 HD21 ASN 119 HD21 ASN 119 9.048 -4.112 -14.924 938 HD22 ASN 119 HD22 ASN 119 8.080 -4.575 -16.267 939 H ASN 120 H ASN 120 12.096 -6.206 -17.266 940 HA ASN 120 HA ASN 120 14.694 -7.404 -16.728 941 HB2 ASN 120 HB2 ASN 120 12.874 -9.161 -16.846 942 HB3 ASN 120 HB3 ASN 120 12.659 -8.701 -18.528 943 HD21 ASN 120 HD21 ASN 120 13.733 -11.132 -16.947 944 HD22 ASN 120 HD22 ASN 120 15.166 -11.551 -17.815 Start of MODEL 3 1 H1 GLY 1 H1 GLY 1 15.924 -12.410 17.182 2 H2 GLY 1 H2 GLY 1 15.771 -11.657 18.688 3 H3 GLY 1 H3 GLY 1 15.319 -10.834 17.281 4 HA2 GLY 1 HA2 GLY 1 13.421 -12.097 16.963 5 HA3 GLY 1 HA3 GLY 1 14.016 -13.371 18.014 6 H SER 2 H SER 2 11.837 -10.922 17.792 7 HA SER 2 HA SER 2 10.352 -10.033 19.265 8 HB2 SER 2 HB2 SER 2 11.113 -12.375 20.503 9 HB3 SER 2 HB3 SER 2 11.431 -11.159 21.739 10 HG SER 2 HG SER 2 9.342 -11.578 22.044 11 H ARG 3 H ARG 3 10.645 -7.923 19.499 12 HA ARG 3 HA ARG 3 12.051 -6.834 21.701 13 HB2 ARG 3 HB2 ARG 3 13.577 -7.222 19.297 14 HB3 ARG 3 HB3 ARG 3 13.414 -5.500 19.615 15 HG2 ARG 3 HG2 ARG 3 14.073 -6.961 22.019 16 HG3 ARG 3 HG3 ARG 3 15.252 -7.245 20.738 17 HD2 ARG 3 HD2 ARG 3 15.601 -4.872 20.478 18 HD3 ARG 3 HD3 ARG 3 14.327 -4.525 21.645 19 HE ARG 3 HE ARG 3 16.421 -6.153 22.727 20 HH11 ARG 3 HH11 ARG 3 15.467 -2.854 22.038 21 HH12 ARG 3 HH12 ARG 3 16.494 -2.175 23.254 22 HH21 ARG 3 HH21 ARG 3 17.772 -5.252 24.326 23 HH22 ARG 3 HH22 ARG 3 17.804 -3.535 24.552 24 H THR 4 H THR 4 11.373 -5.786 18.349 25 HA THR 4 HA THR 4 9.533 -3.761 19.436 26 HB THR 4 HB THR 4 10.531 -2.758 17.014 27 HG1 THR 4 HG1 THR 4 12.679 -3.450 18.726 28 HG21 THR 4 HG21 THR 4 11.282 -1.924 19.798 29 HG22 THR 4 HG22 THR 4 9.839 -1.408 18.927 30 HG23 THR 4 HG23 THR 4 11.436 -0.958 18.332 31 H SER 5 H SER 5 10.522 -5.188 16.314 32 HA SER 5 HA SER 5 9.341 -6.072 14.592 33 HB2 SER 5 HB2 SER 5 7.615 -6.620 16.923 34 HB3 SER 5 HB3 SER 5 6.815 -6.679 15.353 35 HG SER 5 HG SER 5 8.200 -8.267 14.709 36 H ARG 6 H ARG 6 9.262 -4.341 13.268 37 HA ARG 6 HA ARG 6 7.359 -2.211 13.529 38 HB2 ARG 6 HB2 ARG 6 8.145 -1.839 11.048 39 HB3 ARG 6 HB3 ARG 6 9.201 -1.466 12.377 40 HG2 ARG 6 HG2 ARG 6 10.425 -2.562 10.638 41 HG3 ARG 6 HG3 ARG 6 10.332 -3.614 12.043 42 HD2 ARG 6 HD2 ARG 6 8.290 -3.860 9.882 43 HD3 ARG 6 HD3 ARG 6 9.892 -4.551 9.642 44 HE ARG 6 HE ARG 6 7.827 -5.514 11.394 45 HH11 ARG 6 HH11 ARG 6 11.265 -5.517 10.748 46 HH12 ARG 6 HH12 ARG 6 11.551 -6.987 11.614 47 HH21 ARG 6 HH21 ARG 6 8.206 -7.446 12.533 48 HH22 ARG 6 HH22 ARG 6 9.811 -8.087 12.623 49 H ILE 7 H ILE 7 6.505 -2.219 10.586 50 HA ILE 7 HA ILE 7 4.826 -4.597 10.584 51 HB ILE 7 HB ILE 7 2.777 -3.471 10.399 52 HG12 ILE 7 HG12 ILE 7 3.397 -0.748 10.979 53 HG13 ILE 7 HG13 ILE 7 4.334 -1.245 9.575 54 HG21 ILE 7 HG21 ILE 7 3.704 -3.836 12.669 55 HG22 ILE 7 HG22 ILE 7 2.526 -2.528 12.583 56 HG23 ILE 7 HG23 ILE 7 4.247 -2.159 12.663 57 HD11 ILE 7 HD11 ILE 7 2.543 -0.960 8.304 58 HD12 ILE 7 HD12 ILE 7 1.585 -0.526 9.721 59 HD13 ILE 7 HD13 ILE 7 1.698 -2.211 9.215 60 H THR 8 H THR 8 3.352 -4.766 8.735 61 HA THR 8 HA THR 8 4.666 -3.932 6.237 62 HB THR 8 HB THR 8 2.856 -6.236 6.974 63 HG1 THR 8 HG1 THR 8 5.238 -6.363 5.479 64 HG21 THR 8 HG21 THR 8 3.499 -5.286 4.198 65 HG22 THR 8 HG22 THR 8 1.915 -5.595 4.909 66 HG23 THR 8 HG23 THR 8 3.007 -6.939 4.571 67 H ALA 9 H ALA 9 3.418 -2.886 4.579 68 HA ALA 9 HA ALA 9 0.887 -1.833 5.639 69 HB1 ALA 9 HB1 ALA 9 1.268 0.030 3.955 70 HB2 ALA 9 HB2 ALA 9 2.905 -0.607 3.801 71 HB3 ALA 9 HB3 ALA 9 2.329 -0.022 5.362 72 H LEU 10 H LEU 10 -0.876 -2.531 4.820 73 HA LEU 10 HA LEU 10 -0.962 -3.428 2.010 74 HB2 LEU 10 HB2 LEU 10 -1.434 -5.010 4.023 75 HB3 LEU 10 HB3 LEU 10 -2.962 -4.168 4.123 76 HG LEU 10 HG LEU 10 -2.325 -5.175 1.443 77 HD11 LEU 10 HD11 LEU 10 -1.336 -6.993 2.682 78 HD12 LEU 10 HD12 LEU 10 -2.902 -7.512 2.060 79 HD13 LEU 10 HD13 LEU 10 -2.731 -7.069 3.757 80 HD21 LEU 10 HD21 LEU 10 -4.497 -4.662 1.448 81 HD22 LEU 10 HD22 LEU 10 -4.584 -4.676 3.205 82 HD23 LEU 10 HD23 LEU 10 -4.727 -6.190 2.300 83 H TYR 11 H TYR 11 -1.625 -1.616 0.924 84 HA TYR 11 HA TYR 11 -3.947 -0.173 2.010 85 HB2 TYR 11 HB2 TYR 11 -2.395 1.472 2.012 86 HB3 TYR 11 HB3 TYR 11 -1.425 0.724 0.772 87 HD1 TYR 11 HD1 TYR 11 -4.615 2.591 1.243 88 HD2 TYR 11 HD2 TYR 11 -1.367 1.675 -1.343 89 HE1 TYR 11 HE1 TYR 11 -5.407 4.293 -0.342 90 HE2 TYR 11 HE2 TYR 11 -2.145 3.377 -2.932 91 HH TYR 11 HH TYR 11 -3.519 5.228 -3.131 92 H GLU 12 H GLU 12 -5.833 -0.125 0.846 93 HA GLU 12 HA GLU 12 -5.729 -0.596 -2.040 94 HB2 GLU 12 HB2 GLU 12 -7.794 -2.284 -1.057 95 HB3 GLU 12 HB3 GLU 12 -6.368 -2.726 -1.985 96 HG2 GLU 12 HG2 GLU 12 -6.386 -4.057 -0.031 97 HG3 GLU 12 HG3 GLU 12 -5.116 -2.855 0.181 98 H ARG 13 H ARG 13 -7.441 0.100 -3.219 99 HA ARG 13 HA ARG 13 -9.713 1.363 -1.833 100 HB2 ARG 13 HB2 ARG 13 -9.409 3.286 -2.969 101 HB3 ARG 13 HB3 ARG 13 -7.862 2.664 -3.531 102 HG2 ARG 13 HG2 ARG 13 -8.700 2.072 -5.586 103 HG3 ARG 13 HG3 ARG 13 -10.348 1.926 -5.001 104 HD2 ARG 13 HD2 ARG 13 -10.061 3.865 -6.468 105 HD3 ARG 13 HD3 ARG 13 -10.567 4.315 -4.846 106 HE ARG 13 HE ARG 13 -8.746 5.645 -4.796 107 HH11 ARG 13 HH11 ARG 13 -7.897 2.892 -6.809 108 HH12 ARG 13 HH12 ARG 13 -6.298 3.462 -7.100 109 HH21 ARG 13 HH21 ARG 13 -6.697 6.426 -5.303 110 HH22 ARG 13 HH22 ARG 13 -5.640 5.507 -6.311 111 H LEU 14 H LEU 14 -11.738 0.646 -2.460 112 HA LEU 14 HA LEU 14 -11.863 -1.055 -4.850 113 HB2 LEU 14 HB2 LEU 14 -12.718 -2.692 -3.625 114 HB3 LEU 14 HB3 LEU 14 -12.522 -1.726 -2.189 115 HG LEU 14 HG LEU 14 -14.756 -2.629 -2.319 116 HD11 LEU 14 HD11 LEU 14 -15.501 0.113 -2.924 117 HD12 LEU 14 HD12 LEU 14 -14.146 -0.020 -1.801 118 HD13 LEU 14 HD13 LEU 14 -15.676 -0.817 -1.436 119 HD21 LEU 14 HD21 LEU 14 -14.550 -2.232 -5.042 120 HD22 LEU 14 HD22 LEU 14 -15.765 -1.062 -4.529 121 HD23 LEU 14 HD23 LEU 14 -15.980 -2.772 -4.163 122 H SER 15 H SER 15 -13.434 -0.707 -6.323 123 HA SER 15 HA SER 15 -14.680 1.892 -6.287 124 HB2 SER 15 HB2 SER 15 -14.345 -0.242 -8.358 125 HB3 SER 15 HB3 SER 15 -15.481 1.080 -8.624 126 HG SER 15 HG SER 15 -13.668 2.504 -8.169 127 H ARG 16 H ARG 16 -16.646 2.386 -5.718 128 HA ARG 16 HA ARG 16 -18.570 0.356 -5.029 129 HB2 ARG 16 HB2 ARG 16 -18.056 2.746 -3.956 130 HB3 ARG 16 HB3 ARG 16 -19.345 3.219 -5.051 131 HG2 ARG 16 HG2 ARG 16 -19.732 0.876 -3.246 132 HG3 ARG 16 HG3 ARG 16 -19.885 2.512 -2.606 133 HD2 ARG 16 HD2 ARG 16 -21.352 2.599 -4.939 134 HD3 ARG 16 HD3 ARG 16 -21.691 0.989 -4.306 135 HE ARG 16 HE ARG 16 -21.946 3.227 -2.458 136 HH11 ARG 16 HH11 ARG 16 -23.557 0.920 -4.546 137 HH12 ARG 16 HH12 ARG 16 -25.096 1.123 -3.783 138 HH21 ARG 16 HH21 ARG 16 -23.976 3.487 -1.461 139 HH22 ARG 16 HH22 ARG 16 -25.335 2.580 -2.033 140 H ASP 17 H ASP 17 -17.837 1.965 -7.920 141 HA ASP 17 HA ASP 17 -20.446 2.395 -8.951 142 HB2 ASP 17 HB2 ASP 17 -18.100 1.697 -10.698 143 HB3 ASP 17 HB3 ASP 17 -19.421 2.814 -11.019 144 H ASP 18 H ASP 18 -18.508 -0.399 -8.472 145 HA ASP 18 HA ASP 18 -18.597 -2.539 -9.319 146 HB2 ASP 18 HB2 ASP 18 -19.943 -2.324 -7.263 147 HB3 ASP 18 HB3 ASP 18 -21.389 -2.174 -8.253 148 H ASP 19 H ASP 19 -18.761 -1.179 -11.549 149 HA ASP 19 HA ASP 19 -21.096 -2.003 -13.072 150 HB2 ASP 19 HB2 ASP 19 -19.771 -0.892 -14.989 151 HB3 ASP 19 HB3 ASP 19 -20.399 0.152 -13.720 152 H LEU 20 H LEU 20 -18.862 -3.730 -11.866 153 HA LEU 20 HA LEU 20 -18.377 -5.406 -14.210 154 HB2 LEU 20 HB2 LEU 20 -16.118 -5.884 -13.237 155 HB3 LEU 20 HB3 LEU 20 -16.320 -4.251 -13.839 156 HG LEU 20 HG LEU 20 -16.634 -4.948 -10.932 157 HD11 LEU 20 HD11 LEU 20 -14.448 -4.893 -10.538 158 HD12 LEU 20 HD12 LEU 20 -14.168 -3.600 -11.704 159 HD13 LEU 20 HD13 LEU 20 -14.288 -5.271 -12.254 160 HD21 LEU 20 HD21 LEU 20 -15.694 -2.334 -11.258 161 HD22 LEU 20 HD22 LEU 20 -17.310 -2.837 -10.760 162 HD23 LEU 20 HD23 LEU 20 -16.962 -2.538 -12.466 163 H THR 21 H THR 21 -18.410 -5.172 -10.658 164 HA THR 21 HA THR 21 -19.105 -6.547 -9.014 165 HB THR 21 HB THR 21 -20.372 -8.483 -10.863 166 HG1 THR 21 HG1 THR 21 -21.259 -5.810 -10.543 167 HG21 THR 21 HG21 THR 21 -21.293 -7.076 -8.378 168 HG22 THR 21 HG22 THR 21 -20.806 -8.764 -8.531 169 HG23 THR 21 HG23 THR 21 -22.275 -8.194 -9.323 170 H GLY 22 H GLY 22 -18.466 -8.330 -7.855 171 HA2 GLY 22 HA2 GLY 22 -17.648 -10.706 -8.070 172 HA3 GLY 22 HA3 GLY 22 -16.476 -10.051 -9.197 173 H GLU 23 H GLU 23 -14.994 -11.159 -7.651 174 HA GLU 23 HA GLU 23 -14.578 -10.296 -5.005 175 HB2 GLU 23 HB2 GLU 23 -13.342 -12.154 -5.238 176 HB3 GLU 23 HB3 GLU 23 -13.194 -11.944 -6.972 177 HG2 GLU 23 HG2 GLU 23 -11.483 -10.054 -6.142 178 HG3 GLU 23 HG3 GLU 23 -11.357 -11.186 -4.801 179 H SER 24 H SER 24 -13.682 -8.882 -8.050 180 HA SER 24 HA SER 24 -11.723 -7.081 -6.975 181 HB2 SER 24 HB2 SER 24 -11.891 -6.008 -9.240 182 HB3 SER 24 HB3 SER 24 -11.513 -7.729 -9.283 183 HG SER 24 HG SER 24 -13.197 -7.900 -10.513 184 H ASN 25 H ASN 25 -14.897 -7.160 -6.328 185 HA ASN 25 HA ASN 25 -15.111 -4.231 -6.205 186 HB2 ASN 25 HB2 ASN 25 -17.350 -6.141 -6.880 187 HB3 ASN 25 HB3 ASN 25 -17.477 -4.392 -6.787 188 HD21 ASN 25 HD21 ASN 25 -16.080 -7.078 -8.526 189 HD22 ASN 25 HD22 ASN 25 -15.804 -6.227 -10.000 190 H SER 26 H SER 26 -14.164 -5.019 -4.016 191 HA SER 26 HA SER 26 -16.152 -4.668 -2.054 192 HB2 SER 26 HB2 SER 26 -15.206 -7.149 -1.132 193 HB3 SER 26 HB3 SER 26 -16.841 -6.767 -1.660 194 HG SER 26 HG SER 26 -16.238 -8.414 -2.946 195 H ILE 27 H ILE 27 -15.180 -3.656 -0.424 196 HA ILE 27 HA ILE 27 -12.487 -3.082 -0.324 197 HB ILE 27 HB ILE 27 -14.618 -3.016 1.784 198 HG12 ILE 27 HG12 ILE 27 -14.615 -1.334 -0.037 199 HG13 ILE 27 HG13 ILE 27 -14.404 -0.617 1.552 200 HG21 ILE 27 HG21 ILE 27 -11.693 -2.530 2.166 201 HG22 ILE 27 HG22 ILE 27 -12.825 -3.421 3.186 202 HG23 ILE 27 HG23 ILE 27 -12.889 -1.659 3.127 203 HD11 ILE 27 HD11 ILE 27 -12.205 -1.123 -0.446 204 HD12 ILE 27 HD12 ILE 27 -12.019 -0.363 1.133 205 HD13 ILE 27 HD13 ILE 27 -12.973 0.433 -0.121 206 H THR 28 H THR 28 -14.164 -5.308 1.902 207 HA THR 28 HA THR 28 -11.912 -6.398 3.107 208 HB THR 28 HB THR 28 -14.471 -6.597 3.599 209 HG1 THR 28 HG1 THR 28 -13.870 -7.901 5.164 210 HG21 THR 28 HG21 THR 28 -15.217 -7.902 1.792 211 HG22 THR 28 HG22 THR 28 -15.228 -8.945 3.214 212 HG23 THR 28 HG23 THR 28 -13.932 -9.081 2.027 213 H ASN 29 H ASN 29 -13.454 -7.273 0.071 214 HA ASN 29 HA ASN 29 -12.199 -9.760 -0.293 215 HB2 ASN 29 HB2 ASN 29 -14.077 -8.355 -1.696 216 HB3 ASN 29 HB3 ASN 29 -12.693 -8.270 -2.777 217 HD21 ASN 29 HD21 ASN 29 -15.353 -10.030 -1.976 218 HD22 ASN 29 HD22 ASN 29 -14.895 -11.555 -2.639 219 H GLN 30 H GLN 30 -11.211 -6.569 -1.698 220 HA GLN 30 HA GLN 30 -8.846 -7.676 -2.817 221 HB2 GLN 30 HB2 GLN 30 -8.416 -4.907 -2.095 222 HB3 GLN 30 HB3 GLN 30 -8.410 -5.665 -3.670 223 HG2 GLN 30 HG2 GLN 30 -10.303 -4.679 -4.187 224 HG3 GLN 30 HG3 GLN 30 -11.109 -5.361 -2.782 225 HE21 GLN 30 HE21 GLN 30 -10.676 -4.252 -0.712 226 HE22 GLN 30 HE22 GLN 30 -10.533 -2.539 -0.723 227 H LYS 31 H LYS 31 -9.627 -6.446 0.367 228 HA LYS 31 HA LYS 31 -7.088 -6.043 1.402 229 HB2 LYS 31 HB2 LYS 31 -9.436 -7.302 2.842 230 HB3 LYS 31 HB3 LYS 31 -8.045 -6.547 3.598 231 HG2 LYS 31 HG2 LYS 31 -9.021 -4.578 1.937 232 HG3 LYS 31 HG3 LYS 31 -10.468 -5.364 2.571 233 HD2 LYS 31 HD2 LYS 31 -8.744 -5.123 4.750 234 HD3 LYS 31 HD3 LYS 31 -8.632 -3.589 3.887 235 HE2 LYS 31 HE2 LYS 31 -11.355 -4.299 3.937 236 HE3 LYS 31 HE3 LYS 31 -10.729 -4.578 5.559 237 HZ1 LYS 31 HZ1 LYS 31 -10.058 -2.354 5.745 238 HZ2 LYS 31 HZ2 LYS 31 -11.604 -2.282 5.069 239 HZ3 LYS 31 HZ3 LYS 31 -10.245 -2.058 4.091 240 H LYS 32 H LYS 32 -9.056 -9.003 1.328 241 HA LYS 32 HA LYS 32 -7.169 -10.772 2.414 242 HB2 LYS 32 HB2 LYS 32 -9.778 -10.939 1.420 243 HB3 LYS 32 HB3 LYS 32 -8.835 -12.062 0.448 244 HG2 LYS 32 HG2 LYS 32 -8.873 -13.528 2.090 245 HG3 LYS 32 HG3 LYS 32 -8.057 -12.388 3.150 246 HD2 LYS 32 HD2 LYS 32 -11.011 -12.203 2.688 247 HD3 LYS 32 HD3 LYS 32 -10.351 -13.334 3.870 248 HE2 LYS 32 HE2 LYS 32 -9.629 -10.416 3.869 249 HE3 LYS 32 HE3 LYS 32 -11.047 -11.028 4.716 250 HZ1 LYS 32 HZ1 LYS 32 -8.408 -12.240 5.201 251 HZ2 LYS 32 HZ2 LYS 32 -9.760 -12.190 6.212 252 HZ3 LYS 32 HZ3 LYS 32 -8.830 -10.799 5.977 253 H TYR 33 H TYR 33 -7.716 -9.702 -0.914 254 HA TYR 33 HA TYR 33 -6.150 -11.509 -2.314 255 HB2 TYR 33 HB2 TYR 33 -7.524 -9.681 -3.343 256 HB3 TYR 33 HB3 TYR 33 -6.297 -8.531 -2.845 257 HD1 TYR 33 HD1 TYR 33 -6.862 -11.507 -4.990 258 HD2 TYR 33 HD2 TYR 33 -4.381 -8.161 -4.145 259 HE1 TYR 33 HE1 TYR 33 -5.590 -11.928 -7.053 260 HE2 TYR 33 HE2 TYR 33 -3.108 -8.566 -6.185 261 HH TYR 33 HH TYR 33 -2.704 -10.878 -7.685 262 H LEU 34 H LEU 34 -5.057 -8.275 -1.292 263 HA LEU 34 HA LEU 34 -2.347 -8.588 -1.744 264 HB2 LEU 34 HB2 LEU 34 -3.917 -6.947 0.224 265 HB3 LEU 34 HB3 LEU 34 -2.172 -6.907 0.226 266 HG LEU 34 HG LEU 34 -2.084 -5.535 -1.555 267 HD11 LEU 34 HD11 LEU 34 -4.476 -6.849 -2.812 268 HD12 LEU 34 HD12 LEU 34 -2.811 -7.380 -3.061 269 HD13 LEU 34 HD13 LEU 34 -3.312 -5.772 -3.583 270 HD21 LEU 34 HD21 LEU 34 -5.011 -5.320 -0.905 271 HD22 LEU 34 HD22 LEU 34 -4.086 -4.141 -1.841 272 HD23 LEU 34 HD23 LEU 34 -3.686 -4.429 -0.144 273 H GLU 35 H GLU 35 -4.279 -9.420 1.129 274 HA GLU 35 HA GLU 35 -2.229 -10.098 2.860 275 HB2 GLU 35 HB2 GLU 35 -5.050 -10.368 2.785 276 HB3 GLU 35 HB3 GLU 35 -4.383 -11.936 3.220 277 HG2 GLU 35 HG2 GLU 35 -3.295 -9.557 4.599 278 HG3 GLU 35 HG3 GLU 35 -4.928 -10.070 5.007 279 H ASP 36 H ASP 36 -3.953 -12.101 0.493 280 HA ASP 36 HA ASP 36 -2.709 -14.552 0.962 281 HB2 ASP 36 HB2 ASP 36 -4.694 -13.887 -0.618 282 HB3 ASP 36 HB3 ASP 36 -3.420 -13.730 -1.820 283 H TYR 37 H TYR 37 -1.679 -11.765 -0.870 284 HA TYR 37 HA TYR 37 0.587 -13.061 -2.073 285 HB2 TYR 37 HB2 TYR 37 -0.277 -11.194 -3.257 286 HB3 TYR 37 HB3 TYR 37 -0.295 -10.188 -1.821 287 HD1 TYR 37 HD1 TYR 37 1.829 -9.317 -0.902 288 HD2 TYR 37 HD2 TYR 37 1.673 -11.383 -4.610 289 HE1 TYR 37 HE1 TYR 37 4.047 -8.440 -1.473 290 HE2 TYR 37 HE2 TYR 37 3.888 -10.496 -5.208 291 HH TYR 37 HH TYR 37 6.026 -9.421 -3.267 292 H ALA 38 H ALA 38 0.266 -10.478 0.345 293 HA ALA 38 HA ALA 38 2.835 -10.263 1.233 294 HB1 ALA 38 HB1 ALA 38 0.369 -10.140 2.964 295 HB2 ALA 38 HB2 ALA 38 0.998 -8.824 1.974 296 HB3 ALA 38 HB3 ALA 38 1.941 -9.431 3.334 297 H ARG 39 H ARG 39 0.493 -12.788 2.121 298 HA ARG 39 HA ARG 39 2.215 -13.917 4.130 299 HB2 ARG 39 HB2 ARG 39 0.655 -15.795 4.192 300 HB3 ARG 39 HB3 ARG 39 -0.196 -14.261 4.277 301 HG2 ARG 39 HG2 ARG 39 -0.377 -14.576 1.691 302 HG3 ARG 39 HG3 ARG 39 -0.135 -16.277 2.103 303 HD2 ARG 39 HD2 ARG 39 -1.972 -15.599 3.954 304 HD3 ARG 39 HD3 ARG 39 -2.434 -14.509 2.652 305 HE ARG 39 HE ARG 39 -3.288 -16.301 1.537 306 HH11 ARG 39 HH11 ARG 39 -0.965 -17.513 3.863 307 HH12 ARG 39 HH12 ARG 39 -1.359 -19.172 3.570 308 HH21 ARG 39 HH21 ARG 39 -3.801 -18.484 1.162 309 HH22 ARG 39 HH22 ARG 39 -2.971 -19.724 2.039 310 H ARG 40 H ARG 40 1.384 -14.739 0.774 311 HA ARG 40 HA ARG 40 3.070 -16.996 0.573 312 HB2 ARG 40 HB2 ARG 40 2.362 -17.104 -1.585 313 HB3 ARG 40 HB3 ARG 40 1.169 -15.962 -1.009 314 HG2 ARG 40 HG2 ARG 40 1.939 -14.323 -2.316 315 HG3 ARG 40 HG3 ARG 40 3.624 -14.702 -1.970 316 HD2 ARG 40 HD2 ARG 40 1.837 -16.166 -3.906 317 HD3 ARG 40 HD3 ARG 40 3.112 -15.028 -4.333 318 HE ARG 40 HE ARG 40 4.323 -16.981 -2.813 319 HH11 ARG 40 HH11 ARG 40 2.561 -16.855 -5.833 320 HH12 ARG 40 HH12 ARG 40 3.372 -18.227 -6.507 321 HH21 ARG 40 HH21 ARG 40 5.384 -18.793 -3.702 322 HH22 ARG 40 HH22 ARG 40 4.976 -19.328 -5.297 323 H ASN 41 H ASN 41 3.696 -13.635 0.647 324 HA ASN 41 HA ASN 41 6.315 -13.827 -0.596 325 HB2 ASN 41 HB2 ASN 41 4.418 -11.695 0.063 326 HB3 ASN 41 HB3 ASN 41 6.084 -11.266 0.419 327 HD21 ASN 41 HD21 ASN 41 4.244 -12.888 -2.148 328 HD22 ASN 41 HD22 ASN 41 5.055 -12.100 -3.450 329 H GLY 42 H GLY 42 4.861 -13.437 2.572 330 HA2 GLY 42 HA2 GLY 42 5.941 -14.274 4.531 331 HA3 GLY 42 HA3 GLY 42 7.491 -13.930 3.787 332 H PHE 43 H PHE 43 4.625 -11.850 4.194 333 HA PHE 43 HA PHE 43 6.339 -9.914 5.595 334 HB2 PHE 43 HB2 PHE 43 3.775 -9.477 4.053 335 HB3 PHE 43 HB3 PHE 43 4.721 -8.216 4.830 336 HD1 PHE 43 HD1 PHE 43 7.457 -9.004 4.136 337 HD2 PHE 43 HD2 PHE 43 3.912 -9.025 1.805 338 HE1 PHE 43 HE1 PHE 43 8.808 -8.777 2.094 339 HE2 PHE 43 HE2 PHE 43 5.248 -8.803 -0.243 340 HZ PHE 43 HZ PHE 43 7.702 -8.678 -0.103 341 H GLU 44 H GLU 44 5.908 -9.363 7.638 342 HA GLU 44 HA GLU 44 3.586 -10.527 8.948 343 HB2 GLU 44 HB2 GLU 44 6.245 -9.523 9.851 344 HB3 GLU 44 HB3 GLU 44 4.921 -9.656 11.000 345 HG2 GLU 44 HG2 GLU 44 6.562 -11.569 10.771 346 HG3 GLU 44 HG3 GLU 44 4.850 -11.935 10.850 347 H ASN 45 H ASN 45 2.707 -9.297 10.792 348 HA ASN 45 HA ASN 45 1.436 -7.574 11.523 349 HB2 ASN 45 HB2 ASN 45 3.809 -5.998 10.565 350 HB3 ASN 45 HB3 ASN 45 2.605 -5.419 11.710 351 HD21 ASN 45 HD21 ASN 45 5.544 -6.962 11.309 352 HD22 ASN 45 HD22 ASN 45 5.777 -7.517 12.931 353 H ILE 46 H ILE 46 1.144 -8.347 8.672 354 HA ILE 46 HA ILE 46 0.868 -6.282 6.898 355 HB ILE 46 HB ILE 46 -0.871 -8.731 7.195 356 HG12 ILE 46 HG12 ILE 46 1.333 -8.299 5.201 357 HG13 ILE 46 HG13 ILE 46 1.693 -8.883 6.825 358 HG21 ILE 46 HG21 ILE 46 -2.125 -7.325 5.823 359 HG22 ILE 46 HG22 ILE 46 -1.207 -8.312 4.685 360 HG23 ILE 46 HG23 ILE 46 -0.693 -6.661 5.036 361 HD11 ILE 46 HD11 ILE 46 0.590 -10.881 6.490 362 HD12 ILE 46 HD12 ILE 46 1.364 -10.588 4.934 363 HD13 ILE 46 HD13 ILE 46 -0.357 -10.256 5.139 364 H ARG 47 H ARG 47 0.121 -4.435 7.653 365 HA ARG 47 HA ARG 47 -2.427 -4.272 9.037 366 HB2 ARG 47 HB2 ARG 47 -0.211 -2.841 9.386 367 HB3 ARG 47 HB3 ARG 47 -0.982 -1.830 8.171 368 HG2 ARG 47 HG2 ARG 47 -2.830 -2.625 10.251 369 HG3 ARG 47 HG3 ARG 47 -1.434 -1.759 10.888 370 HD2 ARG 47 HD2 ARG 47 -2.168 0.170 10.083 371 HD3 ARG 47 HD3 ARG 47 -2.392 -0.530 8.483 372 HE ARG 47 HE ARG 47 -4.560 -1.439 9.616 373 HH11 ARG 47 HH11 ARG 47 -3.160 1.744 10.021 374 HH12 ARG 47 HH12 ARG 47 -4.685 2.510 10.295 375 HH21 ARG 47 HH21 ARG 47 -6.562 -0.421 9.982 376 HH22 ARG 47 HH22 ARG 47 -6.615 1.284 10.278 377 H HIS 48 H HIS 48 -4.305 -3.648 8.184 378 HA HIS 48 HA HIS 48 -4.303 -3.222 5.306 379 HB2 HIS 48 HB2 HIS 48 -6.467 -4.106 7.200 380 HB3 HIS 48 HB3 HIS 48 -6.782 -3.715 5.512 381 HD1 HIS 48 HD1 HIS 48 -6.523 -5.586 3.911 382 HD2 HIS 48 HD2 HIS 48 -4.470 -6.252 7.449 383 HE1 HIS 48 HE1 HIS 48 -5.612 -7.924 3.722 384 HE2 HIS 48 HE2 HIS 48 -4.254 -8.244 5.818 385 H PHE 49 H PHE 49 -4.461 -1.267 4.533 386 HA PHE 49 HA PHE 49 -5.796 0.820 6.107 387 HB2 PHE 49 HB2 PHE 49 -3.855 1.183 3.802 388 HB3 PHE 49 HB3 PHE 49 -4.493 2.445 4.847 389 HD1 PHE 49 HD1 PHE 49 -3.715 2.681 7.128 390 HD2 PHE 49 HD2 PHE 49 -2.079 -0.286 4.549 391 HE1 PHE 49 HE1 PHE 49 -1.830 2.388 8.672 392 HE2 PHE 49 HE2 PHE 49 -0.195 -0.582 6.108 393 HZ PHE 49 HZ PHE 49 -0.070 0.749 8.158 394 H THR 50 H THR 50 -7.801 0.756 5.607 395 HA THR 50 HA THR 50 -8.840 0.072 3.050 396 HB THR 50 HB THR 50 -9.847 -0.391 5.316 397 HG1 THR 50 HG1 THR 50 -10.989 -0.353 3.159 398 HG21 THR 50 HG21 THR 50 -11.458 1.356 6.114 399 HG22 THR 50 HG22 THR 50 -10.572 2.512 5.121 400 HG23 THR 50 HG23 THR 50 -9.755 1.672 6.438 401 H ASP 51 H ASP 51 -10.187 1.228 1.738 402 HA ASP 51 HA ASP 51 -9.825 4.139 1.798 403 HB2 ASP 51 HB2 ASP 51 -9.969 2.409 -0.674 404 HB3 ASP 51 HB3 ASP 51 -9.700 4.140 -0.633 405 H ASP 52 H ASP 52 -11.571 5.392 1.163 406 HA ASP 52 HA ASP 52 -13.982 4.189 0.190 407 HB2 ASP 52 HB2 ASP 52 -14.098 3.602 2.585 408 HB3 ASP 52 HB3 ASP 52 -13.957 5.306 2.998 409 H GLY 53 H GLY 53 -14.421 5.632 -1.334 410 HA2 GLY 53 HA2 GLY 53 -14.832 7.648 -2.372 411 HA3 GLY 53 HA3 GLY 53 -15.336 8.225 -0.790 412 H PHE 54 H PHE 54 -12.349 7.456 -2.566 413 HA PHE 54 HA PHE 54 -10.908 9.495 -1.086 414 HB2 PHE 54 HB2 PHE 54 -10.128 7.250 -2.916 415 HB3 PHE 54 HB3 PHE 54 -9.000 8.562 -2.632 416 HD1 PHE 54 HD1 PHE 54 -10.617 8.468 0.357 417 HD2 PHE 54 HD2 PHE 54 -8.000 6.043 -1.979 418 HE1 PHE 54 HE1 PHE 54 -9.858 7.326 2.386 419 HE2 PHE 54 HE2 PHE 54 -7.204 4.957 0.065 420 HZ PHE 54 HZ PHE 54 -8.141 5.567 2.250 421 H SER 55 H SER 55 -10.058 11.319 -1.971 422 HA SER 55 HA SER 55 -11.302 12.491 -4.221 423 HB2 SER 55 HB2 SER 55 -9.444 13.309 -2.181 424 HB3 SER 55 HB3 SER 55 -8.874 13.869 -3.751 425 HG SER 55 HG SER 55 -10.977 14.781 -4.062 426 H GLY 56 H GLY 56 -9.926 13.461 -6.096 427 HA2 GLY 56 HA2 GLY 56 -8.228 11.273 -7.120 428 HA3 GLY 56 HA3 GLY 56 -9.259 12.270 -8.122 429 H VAL 57 H VAL 57 -7.108 13.518 -5.579 430 HA VAL 57 HA VAL 57 -5.723 15.002 -7.690 431 HB VAL 57 HB VAL 57 -6.672 16.348 -5.888 432 HG11 VAL 57 HG11 VAL 57 -4.736 14.932 -4.070 433 HG12 VAL 57 HG12 VAL 57 -6.489 14.741 -4.060 434 HG13 VAL 57 HG13 VAL 57 -5.769 16.292 -3.634 435 HG21 VAL 57 HG21 VAL 57 -4.074 16.489 -6.909 436 HG22 VAL 57 HG22 VAL 57 -3.955 16.911 -5.201 437 HG23 VAL 57 HG23 VAL 57 -5.052 17.801 -6.256 438 H ASN 58 H ASN 58 -4.918 13.038 -4.795 439 HA ASN 58 HA ASN 58 -2.993 11.408 -5.632 440 HB2 ASN 58 HB2 ASN 58 -0.800 12.532 -5.398 441 HB3 ASN 58 HB3 ASN 58 -1.735 13.202 -6.723 442 HD21 ASN 58 HD21 ASN 58 -2.332 15.324 -6.663 443 HD22 ASN 58 HD22 ASN 58 -1.899 16.410 -5.399 444 H PHE 59 H PHE 59 -2.567 10.149 -3.965 445 HA PHE 59 HA PHE 59 -2.642 9.378 -1.805 446 HB2 PHE 59 HB2 PHE 59 -0.718 11.573 -1.130 447 HB3 PHE 59 HB3 PHE 59 -0.680 9.878 -0.666 448 HD1 PHE 59 HD1 PHE 59 -0.375 12.064 -3.670 449 HD2 PHE 59 HD2 PHE 59 0.788 8.442 -1.767 450 HE1 PHE 59 HE1 PHE 59 1.216 11.623 -5.485 451 HE2 PHE 59 HE2 PHE 59 2.381 8.000 -3.581 452 HZ PHE 59 HZ PHE 59 2.597 9.590 -5.444 453 H ASN 60 H ASN 60 -2.048 10.746 0.646 454 HA ASN 60 HA ASN 60 -3.117 11.726 2.385 455 HB2 ASN 60 HB2 ASN 60 -4.234 13.656 0.347 456 HB3 ASN 60 HB3 ASN 60 -3.985 13.941 2.066 457 HD21 ASN 60 HD21 ASN 60 -1.425 12.667 2.221 458 HD22 ASN 60 HD22 ASN 60 -0.294 13.674 1.401 459 H ARG 61 H ARG 61 -4.417 10.074 2.917 460 HA ARG 61 HA ARG 61 -7.287 10.433 2.443 461 HB2 ARG 61 HB2 ARG 61 -6.634 7.621 2.377 462 HB3 ARG 61 HB3 ARG 61 -7.574 8.568 1.242 463 HG2 ARG 61 HG2 ARG 61 -4.617 8.784 1.094 464 HG3 ARG 61 HG3 ARG 61 -5.367 7.293 0.534 465 HD2 ARG 61 HD2 ARG 61 -6.912 9.335 -0.551 466 HD3 ARG 61 HD3 ARG 61 -5.245 9.880 -0.715 467 HE ARG 61 HE ARG 61 -5.794 7.165 -1.574 468 HH11 ARG 61 HH11 ARG 61 -5.410 10.518 -2.509 469 HH12 ARG 61 HH12 ARG 61 -5.047 10.139 -4.155 470 HH21 ARG 61 HH21 ARG 61 -5.318 6.682 -3.738 471 HH22 ARG 61 HH22 ARG 61 -5.011 7.965 -4.859 472 HA PRO 62 HA PRO 62 -7.745 9.346 6.716 473 HB2 PRO 62 HB2 PRO 62 -9.614 7.287 6.594 474 HB3 PRO 62 HB3 PRO 62 -9.999 9.010 6.608 475 HG2 PRO 62 HG2 PRO 62 -9.804 7.129 4.296 476 HG3 PRO 62 HG3 PRO 62 -10.954 8.445 4.575 477 HD2 PRO 62 HD2 PRO 62 -8.909 8.729 2.872 478 HD3 PRO 62 HD3 PRO 62 -9.449 10.073 3.899 479 H GLY 63 H GLY 63 -8.300 6.166 5.177 480 HA2 GLY 63 HA2 GLY 63 -6.742 4.706 7.000 481 HA3 GLY 63 HA3 GLY 63 -7.223 4.151 5.402 482 H PHE 64 H PHE 64 -5.925 6.307 3.982 483 HA PHE 64 HA PHE 64 -3.356 5.193 3.597 484 HB2 PHE 64 HB2 PHE 64 -4.642 6.370 1.861 485 HB3 PHE 64 HB3 PHE 64 -4.479 7.871 2.761 486 HD1 PHE 64 HD1 PHE 64 -1.987 8.543 3.293 487 HD2 PHE 64 HD2 PHE 64 -3.207 5.976 0.143 488 HE1 PHE 64 HE1 PHE 64 0.092 9.044 2.093 489 HE2 PHE 64 HE2 PHE 64 -1.140 6.468 -1.064 490 HZ PHE 64 HZ PHE 64 0.530 7.996 -0.088 491 H GLN 65 H GLN 65 -4.515 8.093 5.284 492 HA GLN 65 HA GLN 65 -2.007 9.156 5.964 493 HB2 GLN 65 HB2 GLN 65 -4.775 9.447 7.062 494 HB3 GLN 65 HB3 GLN 65 -3.424 10.075 7.996 495 HG2 GLN 65 HG2 GLN 65 -2.989 10.995 5.399 496 HG3 GLN 65 HG3 GLN 65 -4.721 11.172 5.667 497 HE21 GLN 65 HE21 GLN 65 -1.952 11.493 7.876 498 HE22 GLN 65 HE22 GLN 65 -2.303 13.115 8.346 499 H SER 66 H SER 66 -3.906 6.536 7.232 500 HA SER 66 HA SER 66 -2.437 6.211 9.674 501 HB2 SER 66 HB2 SER 66 -4.726 5.037 8.502 502 HB3 SER 66 HB3 SER 66 -3.552 3.735 8.670 503 HG SER 66 HG SER 66 -4.628 5.405 10.678 504 H LEU 67 H LEU 67 -2.355 4.862 6.399 505 HA LEU 67 HA LEU 67 -0.273 3.039 6.636 506 HB2 LEU 67 HB2 LEU 67 -1.047 2.804 4.530 507 HB3 LEU 67 HB3 LEU 67 -1.721 4.420 4.535 508 HG LEU 67 HG LEU 67 0.594 5.268 3.947 509 HD11 LEU 67 HD11 LEU 67 2.062 3.582 4.521 510 HD12 LEU 67 HD12 LEU 67 1.913 3.349 2.779 511 HD13 LEU 67 HD13 LEU 67 1.013 2.312 3.890 512 HD21 LEU 67 HD21 LEU 67 -1.250 4.989 2.325 513 HD22 LEU 67 HD22 LEU 67 -0.686 3.350 2.004 514 HD23 LEU 67 HD23 LEU 67 0.341 4.729 1.609 515 H ILE 68 H ILE 68 -0.228 6.511 5.907 516 HA ILE 68 HA ILE 68 2.583 6.787 5.745 517 HB ILE 68 HB ILE 68 0.355 8.758 6.214 518 HG12 ILE 68 HG12 ILE 68 0.542 7.774 3.964 519 HG13 ILE 68 HG13 ILE 68 0.880 9.500 3.950 520 HG21 ILE 68 HG21 ILE 68 2.468 9.480 7.352 521 HG22 ILE 68 HG22 ILE 68 1.864 10.576 6.112 522 HG23 ILE 68 HG23 ILE 68 3.226 9.515 5.761 523 HD11 ILE 68 HD11 ILE 68 2.936 7.299 3.864 524 HD12 ILE 68 HD12 ILE 68 3.277 9.029 3.839 525 HD13 ILE 68 HD13 ILE 68 2.402 8.283 2.499 526 H LYS 69 H LYS 69 0.249 7.086 8.400 527 HA LYS 69 HA LYS 69 1.851 8.206 10.372 528 HB2 LYS 69 HB2 LYS 69 -0.599 7.747 10.557 529 HB3 LYS 69 HB3 LYS 69 -0.223 6.046 10.794 530 HG2 LYS 69 HG2 LYS 69 1.306 7.595 12.631 531 HG3 LYS 69 HG3 LYS 69 -0.387 8.085 12.729 532 HD2 LYS 69 HD2 LYS 69 -0.444 6.337 14.186 533 HD3 LYS 69 HD3 LYS 69 -0.740 5.449 12.690 534 HE2 LYS 69 HE2 LYS 69 1.186 4.342 12.853 535 HE3 LYS 69 HE3 LYS 69 2.089 5.809 13.212 536 HZ1 LYS 69 HZ1 LYS 69 1.509 3.766 14.951 537 HZ2 LYS 69 HZ2 LYS 69 0.491 5.025 15.428 538 HZ3 LYS 69 HZ3 LYS 69 2.161 5.274 15.346 539 H GLU 70 H GLU 70 1.645 4.876 9.267 540 HA GLU 70 HA GLU 70 3.426 3.828 11.271 541 HB2 GLU 70 HB2 GLU 70 2.870 2.515 8.616 542 HB3 GLU 70 HB3 GLU 70 3.252 1.756 10.154 543 HG2 GLU 70 HG2 GLU 70 0.748 3.335 9.972 544 HG3 GLU 70 HG3 GLU 70 0.807 1.779 9.155 545 H VAL 71 H VAL 71 3.668 5.066 7.979 546 HA VAL 71 HA VAL 71 6.352 4.306 7.520 547 HB VAL 71 HB VAL 71 5.024 6.733 6.304 548 HG11 VAL 71 HG11 VAL 71 6.533 6.441 4.512 549 HG12 VAL 71 HG12 VAL 71 7.033 4.854 5.096 550 HG13 VAL 71 HG13 VAL 71 7.489 6.304 5.989 551 HG21 VAL 71 HG21 VAL 71 3.642 5.491 5.070 552 HG22 VAL 71 HG22 VAL 71 3.996 4.159 6.168 553 HG23 VAL 71 HG23 VAL 71 4.917 4.339 4.675 554 H GLU 72 H GLU 72 4.915 7.303 8.836 555 HA GLU 72 HA GLU 72 7.326 8.762 9.034 556 HB2 GLU 72 HB2 GLU 72 5.956 9.923 10.996 557 HB3 GLU 72 HB3 GLU 72 5.579 10.209 9.306 558 HG2 GLU 72 HG2 GLU 72 3.661 8.941 9.380 559 HG3 GLU 72 HG3 GLU 72 4.199 8.019 10.778 560 H ALA 73 H ALA 73 5.544 6.841 11.439 561 HA ALA 73 HA ALA 73 7.384 7.102 13.550 562 HB1 ALA 73 HB1 ALA 73 5.996 5.700 14.646 563 HB2 ALA 73 HB2 ALA 73 5.985 4.523 13.331 564 HB3 ALA 73 HB3 ALA 73 4.949 5.948 13.247 565 H GLY 74 H GLY 74 7.436 5.226 10.645 566 HA2 GLY 74 HA2 GLY 74 9.199 4.115 9.685 567 HA3 GLY 74 HA3 GLY 74 10.128 4.282 11.165 568 H ASN 75 H ASN 75 7.010 2.822 10.310 569 HA ASN 75 HA ASN 75 7.840 0.307 11.605 570 HB2 ASN 75 HB2 ASN 75 5.289 1.849 11.540 571 HB3 ASN 75 HB3 ASN 75 5.167 0.100 11.566 572 HD21 ASN 75 HD21 ASN 75 4.157 1.601 13.578 573 HD22 ASN 75 HD22 ASN 75 5.083 1.365 15.009 574 H VAL 76 H VAL 76 6.004 1.692 8.874 575 HA VAL 76 HA VAL 76 5.371 -0.754 7.650 576 HB VAL 76 HB VAL 76 4.300 1.380 7.029 577 HG11 VAL 76 HG11 VAL 76 6.898 2.313 6.780 578 HG12 VAL 76 HG12 VAL 76 5.411 3.174 6.413 579 HG13 VAL 76 HG13 VAL 76 6.255 2.302 5.139 580 HG21 VAL 76 HG21 VAL 76 4.120 0.959 4.670 581 HG22 VAL 76 HG22 VAL 76 4.285 -0.587 5.503 582 HG23 VAL 76 HG23 VAL 76 5.668 0.112 4.660 583 H GLU 77 H GLU 77 7.183 -2.134 7.604 584 HA GLU 77 HA GLU 77 9.593 -1.264 6.235 585 HB2 GLU 77 HB2 GLU 77 10.640 -3.182 7.021 586 HB3 GLU 77 HB3 GLU 77 9.495 -2.815 8.301 587 HG2 GLU 77 HG2 GLU 77 8.260 -4.662 7.920 588 HG3 GLU 77 HG3 GLU 77 8.551 -4.627 6.184 589 H THR 78 H THR 78 6.652 -2.282 5.187 590 HA THR 78 HA THR 78 7.640 -2.924 2.558 591 HB THR 78 HB THR 78 5.725 -4.956 3.599 592 HG1 THR 78 HG1 THR 78 8.531 -5.096 4.037 593 HG21 THR 78 HG21 THR 78 6.134 -5.258 1.364 594 HG22 THR 78 HG22 THR 78 7.271 -6.378 2.114 595 HG23 THR 78 HG23 THR 78 7.835 -4.818 1.512 596 H LEU 79 H LEU 79 6.017 -2.786 0.949 597 HA LEU 79 HA LEU 79 3.412 -1.849 1.912 598 HB2 LEU 79 HB2 LEU 79 5.069 -0.032 1.063 599 HB3 LEU 79 HB3 LEU 79 4.649 -0.640 -0.508 600 HG LEU 79 HG LEU 79 3.142 1.071 -0.368 601 HD11 LEU 79 HD11 LEU 79 1.905 -1.097 -0.535 602 HD12 LEU 79 HD12 LEU 79 0.964 0.272 0.058 603 HD13 LEU 79 HD13 LEU 79 1.556 -0.944 1.185 604 HD21 LEU 79 HD21 LEU 79 3.478 0.742 2.530 605 HD22 LEU 79 HD22 LEU 79 1.901 1.330 1.994 606 HD23 LEU 79 HD23 LEU 79 3.369 2.204 1.549 607 H ILE 80 H ILE 80 1.881 -3.029 1.153 608 HA ILE 80 HA ILE 80 2.216 -4.407 -1.425 609 HB ILE 80 HB ILE 80 0.814 -5.219 1.099 610 HG12 ILE 80 HG12 ILE 80 2.012 -7.392 0.518 611 HG13 ILE 80 HG13 ILE 80 2.843 -6.485 -0.740 612 HG21 ILE 80 HG21 ILE 80 -0.912 -5.684 -0.343 613 HG22 ILE 80 HG22 ILE 80 -0.008 -7.198 -0.354 614 HG23 ILE 80 HG23 ILE 80 0.164 -6.056 -1.688 615 HD11 ILE 80 HD11 ILE 80 2.908 -5.397 2.014 616 HD12 ILE 80 HD12 ILE 80 4.127 -5.345 0.740 617 HD13 ILE 80 HD13 ILE 80 3.875 -6.828 1.660 618 H VAL 81 H VAL 81 1.099 -3.482 -2.986 619 HA VAL 81 HA VAL 81 -1.626 -2.492 -2.456 620 HB VAL 81 HB VAL 81 0.297 -1.158 -4.363 621 HG11 VAL 81 HG11 VAL 81 -1.623 -0.299 -5.108 622 HG12 VAL 81 HG12 VAL 81 -1.607 0.678 -3.644 623 HG13 VAL 81 HG13 VAL 81 -2.524 -0.827 -3.690 624 HG21 VAL 81 HG21 VAL 81 0.176 0.745 -2.581 625 HG22 VAL 81 HG22 VAL 81 1.304 -0.591 -2.336 626 HG23 VAL 81 HG23 VAL 81 -0.234 -0.558 -1.458 627 H LYS 82 H LYS 82 -3.093 -2.711 -4.221 628 HA LYS 82 HA LYS 82 -2.752 -4.959 -5.862 629 HB2 LYS 82 HB2 LYS 82 -4.842 -3.261 -5.209 630 HB3 LYS 82 HB3 LYS 82 -4.628 -2.989 -6.931 631 HG2 LYS 82 HG2 LYS 82 -4.930 -5.712 -5.699 632 HG3 LYS 82 HG3 LYS 82 -6.273 -4.761 -6.339 633 HD2 LYS 82 HD2 LYS 82 -5.754 -5.263 -8.445 634 HD3 LYS 82 HD3 LYS 82 -4.042 -4.943 -8.193 635 HE2 LYS 82 HE2 LYS 82 -3.578 -7.111 -7.630 636 HE3 LYS 82 HE3 LYS 82 -5.204 -7.416 -7.026 637 HZ1 LYS 82 HZ1 LYS 82 -6.021 -7.591 -9.237 638 HZ2 LYS 82 HZ2 LYS 82 -4.652 -8.577 -9.132 639 HZ3 LYS 82 HZ3 LYS 82 -4.553 -7.074 -9.901 640 H ASP 83 H ASP 83 -2.015 -1.554 -6.386 641 HA ASP 83 HA ASP 83 -0.168 -2.004 -8.424 642 HB2 ASP 83 HB2 ASP 83 -1.436 -0.856 -10.315 643 HB3 ASP 83 HB3 ASP 83 -1.856 -2.526 -9.979 644 H MET 84 H MET 84 0.699 -0.008 -9.364 645 HA MET 84 HA MET 84 0.943 2.019 -7.413 646 HB2 MET 84 HB2 MET 84 1.930 1.699 -10.222 647 HB3 MET 84 HB3 MET 84 2.155 3.223 -9.378 648 HG2 MET 84 HG2 MET 84 2.964 0.856 -7.855 649 HG3 MET 84 HG3 MET 84 3.885 1.139 -9.328 650 HE1 MET 84 HE1 MET 84 4.759 2.032 -5.572 651 HE2 MET 84 HE2 MET 84 3.066 1.756 -5.985 652 HE3 MET 84 HE3 MET 84 3.605 3.363 -5.496 653 H SER 85 H SER 85 -1.629 1.601 -9.511 654 HA SER 85 HA SER 85 -2.025 4.316 -10.309 655 HB2 SER 85 HB2 SER 85 -3.303 1.811 -10.794 656 HB3 SER 85 HB3 SER 85 -4.522 2.947 -10.221 657 HG SER 85 HG SER 85 -2.799 3.191 -12.449 658 H ARG 86 H ARG 86 -2.598 2.543 -7.399 659 HA ARG 86 HA ARG 86 -4.731 4.000 -6.320 660 HB2 ARG 86 HB2 ARG 86 -2.445 2.593 -4.940 661 HB3 ARG 86 HB3 ARG 86 -3.849 3.242 -4.107 662 HG2 ARG 86 HG2 ARG 86 -4.235 1.311 -6.339 663 HG3 ARG 86 HG3 ARG 86 -3.748 0.727 -4.749 664 HD2 ARG 86 HD2 ARG 86 -5.700 1.537 -3.730 665 HD3 ARG 86 HD3 ARG 86 -6.104 2.542 -5.119 666 HE ARG 86 HE ARG 86 -7.184 0.750 -6.009 667 HH11 ARG 86 HH11 ARG 86 -4.823 -0.458 -3.723 668 HH12 ARG 86 HH12 ARG 86 -5.318 -2.105 -3.894 669 HH21 ARG 86 HH21 ARG 86 -7.826 -1.432 -6.233 670 HH22 ARG 86 HH22 ARG 86 -7.010 -2.659 -5.326 671 H LEU 87 H LEU 87 -1.262 4.354 -5.485 672 HA LEU 87 HA LEU 87 -1.662 6.867 -4.206 673 HB2 LEU 87 HB2 LEU 87 0.830 5.488 -5.187 674 HB3 LEU 87 HB3 LEU 87 0.851 7.000 -4.310 675 HG LEU 87 HG LEU 87 -0.594 5.518 -2.586 676 HD11 LEU 87 HD11 LEU 87 0.485 3.294 -2.431 677 HD12 LEU 87 HD12 LEU 87 1.244 3.590 -3.995 678 HD13 LEU 87 HD13 LEU 87 -0.512 3.491 -3.872 679 HD21 LEU 87 HD21 LEU 87 1.172 6.572 -1.616 680 HD22 LEU 87 HD22 LEU 87 2.300 6.094 -2.884 681 HD23 LEU 87 HD23 LEU 87 1.824 4.934 -1.644 682 H GLY 88 H GLY 88 -0.844 5.969 -7.516 683 HA2 GLY 88 HA2 GLY 88 -1.750 7.899 -8.963 684 HA3 GLY 88 HA3 GLY 88 -0.536 8.839 -8.125 685 H ARG 89 H ARG 89 -0.628 8.718 -10.840 686 HA ARG 89 HA ARG 89 1.224 6.767 -11.856 687 HB2 ARG 89 HB2 ARG 89 0.069 9.262 -13.112 688 HB3 ARG 89 HB3 ARG 89 1.050 8.078 -13.959 689 HG2 ARG 89 HG2 ARG 89 -1.014 7.351 -14.557 690 HG3 ARG 89 HG3 ARG 89 -0.803 6.422 -13.073 691 HD2 ARG 89 HD2 ARG 89 -1.860 8.890 -12.282 692 HD3 ARG 89 HD3 ARG 89 -2.769 8.422 -13.717 693 HE ARG 89 HE ARG 89 -2.490 6.311 -11.785 694 HH11 ARG 89 HH11 ARG 89 -4.405 9.094 -12.707 695 HH12 ARG 89 HH12 ARG 89 -5.837 8.519 -11.925 696 HH21 ARG 89 HH21 ARG 89 -4.382 5.558 -10.765 697 HH22 ARG 89 HH22 ARG 89 -5.826 6.512 -10.826 698 H ASN 90 H ASN 90 1.310 10.099 -10.771 699 HA ASN 90 HA ASN 90 3.741 10.980 -11.766 700 HB2 ASN 90 HB2 ASN 90 3.771 12.302 -9.470 701 HB3 ASN 90 HB3 ASN 90 2.597 12.682 -10.722 702 HD21 ASN 90 HD21 ASN 90 3.024 10.673 -7.829 703 HD22 ASN 90 HD22 ASN 90 1.383 10.783 -7.306 704 H TYR 91 H TYR 91 5.273 9.342 -11.764 705 HA TYR 91 HA TYR 91 6.057 7.815 -9.553 706 HB2 TYR 91 HB2 TYR 91 6.577 7.148 -11.788 707 HB3 TYR 91 HB3 TYR 91 7.550 8.586 -12.060 708 HD1 TYR 91 HD1 TYR 91 9.780 8.777 -11.005 709 HD2 TYR 91 HD2 TYR 91 7.459 5.232 -10.656 710 HE1 TYR 91 HE1 TYR 91 11.785 7.542 -10.312 711 HE2 TYR 91 HE2 TYR 91 9.463 3.979 -9.970 712 HH TYR 91 HH TYR 91 12.146 4.410 -10.416 713 H LEU 92 H LEU 92 6.605 11.135 -10.143 714 HA LEU 92 HA LEU 92 9.117 11.429 -8.845 715 HB2 LEU 92 HB2 LEU 92 6.876 13.415 -9.197 716 HB3 LEU 92 HB3 LEU 92 8.482 13.815 -8.623 717 HG LEU 92 HG LEU 92 9.313 12.860 -10.865 718 HD11 LEU 92 HD11 LEU 92 7.555 11.772 -11.829 719 HD12 LEU 92 HD12 LEU 92 7.416 13.347 -12.609 720 HD13 LEU 92 HD13 LEU 92 6.368 12.937 -11.250 721 HD21 LEU 92 HD21 LEU 92 9.673 15.069 -10.949 722 HD22 LEU 92 HD22 LEU 92 8.120 15.445 -10.203 723 HD23 LEU 92 HD23 LEU 92 8.212 15.125 -11.935 724 H GLN 93 H GLN 93 5.795 12.106 -7.782 725 HA GLN 93 HA GLN 93 6.463 12.461 -5.034 726 HB2 GLN 93 HB2 GLN 93 3.890 12.051 -6.541 727 HB3 GLN 93 HB3 GLN 93 3.914 12.142 -4.785 728 HG2 GLN 93 HG2 GLN 93 4.469 14.256 -6.804 729 HG3 GLN 93 HG3 GLN 93 3.421 14.302 -5.391 730 HE21 GLN 93 HE21 GLN 93 6.668 14.634 -6.576 731 HE22 GLN 93 HE22 GLN 93 7.335 15.333 -5.144 732 H VAL 94 H VAL 94 4.937 9.805 -6.864 733 HA VAL 94 HA VAL 94 4.577 8.011 -4.748 734 HB VAL 94 HB VAL 94 5.372 7.101 -7.519 735 HG11 VAL 94 HG11 VAL 94 4.152 5.153 -7.047 736 HG12 VAL 94 HG12 VAL 94 3.349 5.890 -5.658 737 HG13 VAL 94 HG13 VAL 94 5.065 5.490 -5.576 738 HG21 VAL 94 HG21 VAL 94 3.545 7.944 -8.458 739 HG22 VAL 94 HG22 VAL 94 3.234 8.843 -6.968 740 HG23 VAL 94 HG23 VAL 94 2.520 7.248 -7.199 741 H GLY 95 H GLY 95 7.371 8.575 -6.853 742 HA2 GLY 95 HA2 GLY 95 9.019 6.530 -5.809 743 HA3 GLY 95 HA3 GLY 95 9.575 7.954 -6.669 744 H PHE 96 H PHE 96 8.859 10.017 -5.086 745 HA PHE 96 HA PHE 96 10.821 10.281 -3.211 746 HB2 PHE 96 HB2 PHE 96 9.685 12.260 -3.639 747 HB3 PHE 96 HB3 PHE 96 8.102 11.510 -3.490 748 HD1 PHE 96 HD1 PHE 96 7.248 10.937 -1.189 749 HD2 PHE 96 HD2 PHE 96 10.680 13.367 -1.836 750 HE1 PHE 96 HE1 PHE 96 7.059 11.811 1.101 751 HE2 PHE 96 HE2 PHE 96 10.494 14.245 0.453 752 HZ PHE 96 HZ PHE 96 8.683 13.468 1.924 753 H TYR 97 H TYR 97 7.562 8.949 -2.692 754 HA TYR 97 HA TYR 97 7.862 8.489 0.082 755 HB2 TYR 97 HB2 TYR 97 6.052 7.232 -1.980 756 HB3 TYR 97 HB3 TYR 97 5.955 6.852 -0.263 757 HD1 TYR 97 HD1 TYR 97 6.024 9.176 1.213 758 HD2 TYR 97 HD2 TYR 97 4.461 8.718 -2.713 759 HE1 TYR 97 HE1 TYR 97 4.602 11.145 1.558 760 HE2 TYR 97 HE2 TYR 97 3.035 10.690 -2.380 761 HH TYR 97 HH TYR 97 2.077 12.002 -0.609 762 H THR 98 H THR 98 8.302 6.351 -2.733 763 HA THR 98 HA THR 98 9.199 4.159 -1.078 764 HB THR 98 HB THR 98 9.432 2.960 -3.200 765 HG1 THR 98 HG1 THR 98 9.246 3.964 -5.117 766 HG21 THR 98 HG21 THR 98 7.216 2.756 -3.696 767 HG22 THR 98 HG22 THR 98 6.920 4.492 -3.601 768 HG23 THR 98 HG23 THR 98 7.116 3.549 -2.124 769 H GLU 99 H GLU 99 10.835 6.857 -2.452 770 HA GLU 99 HA GLU 99 13.380 5.381 -2.565 771 HB2 GLU 99 HB2 GLU 99 12.932 8.177 -3.576 772 HB3 GLU 99 HB3 GLU 99 14.232 7.069 -3.988 773 HG2 GLU 99 HG2 GLU 99 11.602 6.019 -4.618 774 HG3 GLU 99 HG3 GLU 99 11.957 7.528 -5.445 775 H VAL 100 H VAL 100 12.031 8.398 -1.231 776 HA VAL 100 HA VAL 100 14.429 8.581 0.457 777 HB VAL 100 HB VAL 100 14.223 10.536 -0.850 778 HG11 VAL 100 HG11 VAL 100 11.376 10.755 0.080 779 HG12 VAL 100 HG12 VAL 100 11.930 10.351 -1.548 780 HG13 VAL 100 HG13 VAL 100 12.233 11.958 -0.883 781 HG21 VAL 100 HG21 VAL 100 14.792 10.835 1.560 782 HG22 VAL 100 HG22 VAL 100 13.112 11.286 1.843 783 HG23 VAL 100 HG23 VAL 100 14.123 12.270 0.786 784 H LEU 101 H LEU 101 10.912 8.746 0.593 785 HA LEU 101 HA LEU 101 10.669 9.284 3.352 786 HB2 LEU 101 HB2 LEU 101 8.956 9.335 1.336 787 HB3 LEU 101 HB3 LEU 101 8.578 7.723 1.914 788 HG LEU 101 HG LEU 101 7.016 9.316 2.846 789 HD11 LEU 101 HD11 LEU 101 7.074 8.568 5.026 790 HD12 LEU 101 HD12 LEU 101 8.830 8.691 5.138 791 HD13 LEU 101 HD13 LEU 101 8.095 7.382 4.215 792 HD21 LEU 101 HD21 LEU 101 8.456 11.305 2.699 793 HD22 LEU 101 HD22 LEU 101 9.414 10.699 4.049 794 HD23 LEU 101 HD23 LEU 101 7.722 11.129 4.292 795 H PHE 102 H PHE 102 9.915 6.203 1.715 796 HA PHE 102 HA PHE 102 9.615 4.664 4.016 797 HB2 PHE 102 HB2 PHE 102 10.256 3.899 1.178 798 HB3 PHE 102 HB3 PHE 102 9.920 2.724 2.432 799 HD1 PHE 102 HD1 PHE 102 8.075 5.771 2.746 800 HD2 PHE 102 HD2 PHE 102 8.078 1.961 0.830 801 HE1 PHE 102 HE1 PHE 102 5.677 5.993 2.280 802 HE2 PHE 102 HE2 PHE 102 5.672 2.186 0.378 803 HZ PHE 102 HZ PHE 102 4.470 4.206 1.104 804 HA PRO 103 HA PRO 103 14.404 3.292 2.848 805 HB2 PRO 103 HB2 PRO 103 15.119 6.141 3.419 806 HB3 PRO 103 HB3 PRO 103 15.960 4.949 2.428 807 HG2 PRO 103 HG2 PRO 103 14.422 6.824 1.322 808 HG3 PRO 103 HG3 PRO 103 14.492 5.184 0.656 809 HD2 PRO 103 HD2 PRO 103 12.312 6.523 2.119 810 HD3 PRO 103 HD3 PRO 103 12.256 5.158 1.007 811 H GLN 104 H GLN 104 13.349 5.732 5.227 812 HA GLN 104 HA GLN 104 15.197 5.308 7.213 813 HB2 GLN 104 HB2 GLN 104 12.596 5.521 8.438 814 HB3 GLN 104 HB3 GLN 104 13.930 6.662 8.442 815 HG2 GLN 104 HG2 GLN 104 13.182 7.617 6.384 816 HG3 GLN 104 HG3 GLN 104 11.938 6.382 6.225 817 HE21 GLN 104 HE21 GLN 104 9.977 6.972 6.821 818 HE22 GLN 104 HE22 GLN 104 9.592 8.197 7.975 819 H LYS 105 H LYS 105 12.613 3.191 6.253 820 HA LYS 105 HA LYS 105 13.265 1.384 8.485 821 HB2 LYS 105 HB2 LYS 105 10.636 1.468 7.017 822 HB3 LYS 105 HB3 LYS 105 11.009 0.651 8.512 823 HG2 LYS 105 HG2 LYS 105 9.649 2.559 8.964 824 HG3 LYS 105 HG3 LYS 105 11.262 2.821 9.630 825 HD2 LYS 105 HD2 LYS 105 10.322 4.811 8.532 826 HD3 LYS 105 HD3 LYS 105 11.801 4.261 7.774 827 HE2 LYS 105 HE2 LYS 105 10.306 4.810 6.027 828 HE3 LYS 105 HE3 LYS 105 10.383 3.051 6.103 829 HZ1 LYS 105 HZ1 LYS 105 8.228 4.811 7.084 830 HZ2 LYS 105 HZ2 LYS 105 8.337 3.181 7.515 831 HZ3 LYS 105 HZ3 LYS 105 8.133 3.615 5.893 832 H ASN 106 H ASN 106 13.586 1.695 5.158 833 HA ASN 106 HA ASN 106 14.146 0.232 3.505 834 HB2 ASN 106 HB2 ASN 106 15.598 -0.886 5.080 835 HB3 ASN 106 HB3 ASN 106 14.244 -1.755 5.789 836 HD21 ASN 106 HD21 ASN 106 16.715 -2.734 4.594 837 HD22 ASN 106 HD22 ASN 106 16.241 -3.797 3.322 838 H VAL 107 H VAL 107 12.447 0.174 2.208 839 HA VAL 107 HA VAL 107 10.108 -1.445 2.972 840 HB VAL 107 HB VAL 107 9.821 1.035 2.731 841 HG11 VAL 107 HG11 VAL 107 9.916 0.499 -0.224 842 HG12 VAL 107 HG12 VAL 107 11.323 1.078 0.661 843 HG13 VAL 107 HG13 VAL 107 9.858 2.051 0.605 844 HG21 VAL 107 HG21 VAL 107 8.017 -0.113 0.718 845 HG22 VAL 107 HG22 VAL 107 7.652 0.665 2.258 846 HG23 VAL 107 HG23 VAL 107 8.133 -1.030 2.219 847 H ARG 108 H ARG 108 9.032 -2.623 1.528 848 HA ARG 108 HA ARG 108 10.274 -3.159 -1.060 849 HB2 ARG 108 HB2 ARG 108 10.136 -4.976 1.036 850 HB3 ARG 108 HB3 ARG 108 8.734 -5.380 0.059 851 HG2 ARG 108 HG2 ARG 108 10.651 -6.722 -0.568 852 HG3 ARG 108 HG3 ARG 108 10.163 -5.668 -1.893 853 HD2 ARG 108 HD2 ARG 108 12.622 -5.794 -1.560 854 HD3 ARG 108 HD3 ARG 108 11.971 -4.162 -1.448 855 HE ARG 108 HE ARG 108 12.737 -4.069 0.692 856 HH11 ARG 108 HH11 ARG 108 12.466 -7.447 -0.193 857 HH12 ARG 108 HH12 ARG 108 13.183 -8.014 1.275 858 HH21 ARG 108 HH21 ARG 108 13.699 -4.825 2.616 859 HH22 ARG 108 HH22 ARG 108 13.885 -6.527 2.869 860 H PHE 109 H PHE 109 8.906 -1.783 -2.130 861 HA PHE 109 HA PHE 109 6.099 -1.782 -1.586 862 HB2 PHE 109 HB2 PHE 109 7.709 0.090 -2.591 863 HB3 PHE 109 HB3 PHE 109 7.130 -0.589 -4.106 864 HD1 PHE 109 HD1 PHE 109 4.602 -0.792 -4.412 865 HD2 PHE 109 HD2 PHE 109 6.426 1.626 -1.430 866 HE1 PHE 109 HE1 PHE 109 2.533 0.523 -4.235 867 HE2 PHE 109 HE2 PHE 109 4.366 2.964 -1.239 868 HZ PHE 109 HZ PHE 109 2.412 2.409 -2.643 869 H LEU 110 H LEU 110 4.438 -2.607 -2.856 870 HA LEU 110 HA LEU 110 5.217 -4.257 -5.147 871 HB2 LEU 110 HB2 LEU 110 5.039 -5.846 -3.460 872 HB3 LEU 110 HB3 LEU 110 3.641 -5.084 -2.737 873 HG LEU 110 HG LEU 110 3.315 -7.303 -3.965 874 HD11 LEU 110 HD11 LEU 110 1.440 -5.380 -5.159 875 HD12 LEU 110 HD12 LEU 110 1.620 -5.312 -3.406 876 HD13 LEU 110 HD13 LEU 110 1.137 -6.817 -4.185 877 HD21 LEU 110 HD21 LEU 110 4.517 -5.904 -6.054 878 HD22 LEU 110 HD22 LEU 110 2.818 -6.046 -6.503 879 HD23 LEU 110 HD23 LEU 110 3.755 -7.492 -6.127 880 H ALA 111 H ALA 111 4.079 -3.974 -6.856 881 HA ALA 111 HA ALA 111 1.367 -2.840 -6.691 882 HB1 ALA 111 HB1 ALA 111 1.867 -1.693 -8.870 883 HB2 ALA 111 HB2 ALA 111 3.560 -2.132 -8.643 884 HB3 ALA 111 HB3 ALA 111 2.763 -1.063 -7.484 885 H ILE 112 H ILE 112 0.298 -4.713 -6.953 886 HA ILE 112 HA ILE 112 1.166 -6.872 -8.489 887 HB ILE 112 HB ILE 112 -1.532 -6.181 -7.385 888 HG12 ILE 112 HG12 ILE 112 0.041 -8.571 -6.600 889 HG13 ILE 112 HG13 ILE 112 0.700 -7.009 -6.139 890 HG21 ILE 112 HG21 ILE 112 -0.755 -8.499 -9.108 891 HG22 ILE 112 HG22 ILE 112 -2.216 -7.512 -9.152 892 HG23 ILE 112 HG23 ILE 112 -1.983 -8.686 -7.857 893 HD11 ILE 112 HD11 ILE 112 -2.107 -7.174 -5.524 894 HD12 ILE 112 HD12 ILE 112 -0.738 -6.818 -4.474 895 HD13 ILE 112 HD13 ILE 112 -1.201 -8.493 -4.780 896 H ASN 113 H ASN 113 -0.975 -4.225 -9.539 897 HA ASN 113 HA ASN 113 -1.345 -5.626 -12.083 898 HB2 ASN 113 HB2 ASN 113 -2.946 -3.769 -10.525 899 HB3 ASN 113 HB3 ASN 113 -2.858 -3.310 -12.222 900 HD21 ASN 113 HD21 ASN 113 -4.637 -3.981 -13.192 901 HD22 ASN 113 HD22 ASN 113 -5.356 -5.540 -13.018 902 H ASN 114 H ASN 114 1.245 -4.465 -11.617 903 HA ASN 114 HA ASN 114 1.838 -3.381 -14.046 904 HB2 ASN 114 HB2 ASN 114 0.503 -1.407 -12.454 905 HB3 ASN 114 HB3 ASN 114 2.168 -0.908 -12.717 906 HD21 ASN 114 HD21 ASN 114 1.180 0.834 -13.942 907 HD22 ASN 114 HD22 ASN 114 0.750 0.563 -15.592 908 H SER 115 H SER 115 3.980 -2.331 -14.185 909 HA SER 115 HA SER 115 5.833 -3.635 -12.466 910 HB2 SER 115 HB2 SER 115 6.423 -1.402 -14.422 911 HB3 SER 115 HB3 SER 115 7.553 -2.608 -13.806 912 HG SER 115 HG SER 115 5.600 -2.831 -15.769 913 H ILE 116 H ILE 116 5.951 -3.010 -10.393 914 HA ILE 116 HA ILE 116 5.391 -0.477 -9.379 915 HB ILE 116 HB ILE 116 5.830 -2.855 -8.220 916 HG12 ILE 116 HG12 ILE 116 4.656 -0.847 -7.304 917 HG13 ILE 116 HG13 ILE 116 5.578 -1.740 -6.101 918 HG21 ILE 116 HG21 ILE 116 7.820 -2.792 -6.829 919 HG22 ILE 116 HG22 ILE 116 8.315 -1.275 -7.575 920 HG23 ILE 116 HG23 ILE 116 8.266 -2.752 -8.538 921 HD11 ILE 116 HD11 ILE 116 6.096 0.946 -7.280 922 HD12 ILE 116 HD12 ILE 116 7.439 -0.005 -6.648 923 HD13 ILE 116 HD13 ILE 116 6.098 0.437 -5.593 924 H ASP 117 H ASP 117 8.498 -1.872 -10.342 925 HA ASP 117 HA ASP 117 9.630 0.646 -10.971 926 HB2 ASP 117 HB2 ASP 117 9.799 -0.111 -8.222 927 HB3 ASP 117 HB3 ASP 117 11.411 -0.232 -8.918 928 H SER 118 H SER 118 10.554 -2.568 -9.718 929 HA SER 118 HA SER 118 11.618 -3.481 -12.151 930 HB2 SER 118 HB2 SER 118 13.399 -1.884 -10.483 931 HB3 SER 118 HB3 SER 118 14.053 -3.487 -10.827 932 HG SER 118 HG SER 118 14.184 -3.009 -12.909 933 H ASN 119 H ASN 119 12.737 -5.565 -11.941 934 HA ASN 119 HA ASN 119 12.793 -6.890 -9.398 935 HB2 ASN 119 HB2 ASN 119 10.344 -6.931 -10.676 936 HB3 ASN 119 HB3 ASN 119 11.080 -8.462 -11.158 937 HD21 ASN 119 HD21 ASN 119 10.457 -6.426 -8.345 938 HD22 ASN 119 HD22 ASN 119 10.192 -7.727 -7.251 939 H ASN 120 H ASN 120 12.373 -7.771 -12.805 940 HA ASN 120 HA ASN 120 14.313 -9.860 -12.645 941 HB2 ASN 120 HB2 ASN 120 12.866 -8.650 -15.009 942 HB3 ASN 120 HB3 ASN 120 13.902 -10.068 -15.098 943 HD21 ASN 120 HD21 ASN 120 12.760 -11.862 -15.220 944 HD22 ASN 120 HD22 ASN 120 11.283 -12.186 -14.387 Start of MODEL 4 1 H1 GLY 1 H1 GLY 1 4.488 2.480 22.218 2 H2 GLY 1 H2 GLY 1 3.430 3.083 23.389 3 H3 GLY 1 H3 GLY 1 2.876 1.965 22.251 4 HA2 GLY 1 HA2 GLY 1 5.035 1.336 24.174 5 HA3 GLY 1 HA3 GLY 1 3.339 1.077 24.553 6 H SER 2 H SER 2 6.074 -0.010 22.712 7 HA SER 2 HA SER 2 4.666 -2.515 22.148 8 HB2 SER 2 HB2 SER 2 5.547 -2.582 19.851 9 HB3 SER 2 HB3 SER 2 4.511 -1.178 20.090 10 HG SER 2 HG SER 2 6.155 -0.088 19.386 11 H ARG 3 H ARG 3 6.796 -3.710 20.668 12 HA ARG 3 HA ARG 3 8.968 -3.722 22.656 13 HB2 ARG 3 HB2 ARG 3 7.325 -5.952 21.614 14 HB3 ARG 3 HB3 ARG 3 9.052 -6.262 21.743 15 HG2 ARG 3 HG2 ARG 3 8.909 -5.496 24.128 16 HG3 ARG 3 HG3 ARG 3 7.156 -5.477 23.939 17 HD2 ARG 3 HD2 ARG 3 7.356 -7.889 23.189 18 HD3 ARG 3 HD3 ARG 3 9.020 -7.831 23.766 19 HE ARG 3 HE ARG 3 7.815 -7.060 25.951 20 HH11 ARG 3 HH11 ARG 3 6.759 -9.558 23.728 21 HH12 ARG 3 HH12 ARG 3 5.929 -10.460 24.949 22 HH21 ARG 3 HH21 ARG 3 6.721 -8.257 27.549 23 HH22 ARG 3 HH22 ARG 3 5.907 -9.724 27.116 24 H THR 4 H THR 4 8.496 -5.477 19.595 25 HA THR 4 HA THR 4 10.531 -3.919 18.249 26 HB THR 4 HB THR 4 11.883 -6.000 17.737 27 HG1 THR 4 HG1 THR 4 10.451 -7.040 19.954 28 HG21 THR 4 HG21 THR 4 13.281 -5.806 19.551 29 HG22 THR 4 HG22 THR 4 11.953 -5.552 20.682 30 HG23 THR 4 HG23 THR 4 12.425 -4.266 19.573 31 H SER 5 H SER 5 11.092 -5.523 16.106 32 HA SER 5 HA SER 5 10.307 -6.375 14.143 33 HB2 SER 5 HB2 SER 5 8.454 -7.424 16.090 34 HB3 SER 5 HB3 SER 5 7.632 -7.072 14.571 35 HG SER 5 HG SER 5 9.751 -8.843 15.077 36 H ARG 6 H ARG 6 10.121 -4.816 12.680 37 HA ARG 6 HA ARG 6 8.323 -2.616 12.924 38 HB2 ARG 6 HB2 ARG 6 9.231 -1.820 10.919 39 HB3 ARG 6 HB3 ARG 6 10.555 -2.706 11.650 40 HG2 ARG 6 HG2 ARG 6 8.763 -3.861 9.546 41 HG3 ARG 6 HG3 ARG 6 10.253 -3.006 9.188 42 HD2 ARG 6 HD2 ARG 6 10.949 -5.209 9.195 43 HD3 ARG 6 HD3 ARG 6 11.342 -4.678 10.828 44 HE ARG 6 HE ARG 6 8.748 -5.874 10.643 45 HH11 ARG 6 HH11 ARG 6 12.164 -6.559 10.971 46 HH12 ARG 6 HH12 ARG 6 11.909 -8.087 11.741 47 HH21 ARG 6 HH21 ARG 6 8.422 -7.894 11.651 48 HH22 ARG 6 HH22 ARG 6 9.787 -8.844 12.129 49 H ILE 7 H ILE 7 7.357 -2.682 10.022 50 HA ILE 7 HA ILE 7 5.572 -4.979 10.159 51 HB ILE 7 HB ILE 7 3.569 -3.831 10.130 52 HG12 ILE 7 HG12 ILE 7 4.303 -1.065 10.343 53 HG13 ILE 7 HG13 ILE 7 5.002 -1.752 8.882 54 HG21 ILE 7 HG21 ILE 7 5.275 -2.338 12.099 55 HG22 ILE 7 HG22 ILE 7 4.625 -3.960 12.339 56 HG23 ILE 7 HG23 ILE 7 3.532 -2.585 12.195 57 HD11 ILE 7 HD11 ILE 7 2.298 -2.629 9.089 58 HD12 ILE 7 HD12 ILE 7 3.045 -1.601 7.864 59 HD13 ILE 7 HD13 ILE 7 2.356 -0.880 9.317 60 H THR 8 H THR 8 4.053 -5.175 8.361 61 HA THR 8 HA THR 8 5.274 -4.365 5.805 62 HB THR 8 HB THR 8 3.457 -6.678 6.570 63 HG1 THR 8 HG1 THR 8 5.481 -7.348 6.797 64 HG21 THR 8 HG21 THR 8 3.203 -7.352 4.348 65 HG22 THR 8 HG22 THR 8 4.395 -6.193 3.760 66 HG23 THR 8 HG23 THR 8 2.825 -5.631 4.327 67 H ALA 9 H ALA 9 3.886 -3.389 4.175 68 HA ALA 9 HA ALA 9 1.422 -2.321 5.404 69 HB1 ALA 9 HB1 ALA 9 3.015 -0.596 4.936 70 HB2 ALA 9 HB2 ALA 9 1.616 -0.419 3.885 71 HB3 ALA 9 HB3 ALA 9 3.116 -1.095 3.249 72 H LEU 10 H LEU 10 -0.436 -2.798 4.661 73 HA LEU 10 HA LEU 10 -0.761 -3.827 1.912 74 HB2 LEU 10 HB2 LEU 10 -1.075 -5.397 3.938 75 HB3 LEU 10 HB3 LEU 10 -2.530 -4.490 4.253 76 HG LEU 10 HG LEU 10 -2.348 -5.494 1.515 77 HD11 LEU 10 HD11 LEU 10 -2.716 -7.815 2.084 78 HD12 LEU 10 HD12 LEU 10 -2.577 -7.448 3.801 79 HD13 LEU 10 HD13 LEU 10 -1.170 -7.291 2.751 80 HD21 LEU 10 HD21 LEU 10 -4.621 -6.418 2.410 81 HD22 LEU 10 HD22 LEU 10 -4.415 -4.688 2.107 82 HD23 LEU 10 HD23 LEU 10 -4.307 -5.313 3.747 83 H TYR 11 H TYR 11 -1.520 -1.988 0.858 84 HA TYR 11 HA TYR 11 -3.825 -0.665 2.113 85 HB2 TYR 11 HB2 TYR 11 -1.857 0.748 2.243 86 HB3 TYR 11 HB3 TYR 11 -1.654 0.674 0.512 87 HD1 TYR 11 HD1 TYR 11 -3.408 1.753 -0.947 88 HD2 TYR 11 HD2 TYR 11 -3.280 2.309 3.256 89 HE1 TYR 11 HE1 TYR 11 -4.800 3.764 -1.179 90 HE2 TYR 11 HE2 TYR 11 -4.675 4.310 3.042 91 HH TYR 11 HH TYR 11 -5.882 5.588 1.661 92 H GLU 12 H GLU 12 -5.686 -0.730 0.988 93 HA GLU 12 HA GLU 12 -5.603 -0.745 -1.941 94 HB2 GLU 12 HB2 GLU 12 -5.805 -3.133 -0.459 95 HB3 GLU 12 HB3 GLU 12 -7.394 -2.830 -1.136 96 HG2 GLU 12 HG2 GLU 12 -4.888 -2.802 -2.794 97 HG3 GLU 12 HG3 GLU 12 -5.828 -4.258 -2.511 98 H ARG 13 H ARG 13 -7.449 -0.146 -2.991 99 HA ARG 13 HA ARG 13 -9.769 0.651 -1.366 100 HB2 ARG 13 HB2 ARG 13 -9.662 2.721 -2.231 101 HB3 ARG 13 HB3 ARG 13 -8.180 2.298 -3.074 102 HG2 ARG 13 HG2 ARG 13 -9.297 1.843 -5.060 103 HG3 ARG 13 HG3 ARG 13 -10.850 1.627 -4.257 104 HD2 ARG 13 HD2 ARG 13 -10.557 3.759 -5.590 105 HD3 ARG 13 HD3 ARG 13 -11.129 3.938 -3.934 106 HE ARG 13 HE ARG 13 -9.278 5.179 -3.507 107 HH11 ARG 13 HH11 ARG 13 -8.575 3.169 -6.293 108 HH12 ARG 13 HH12 ARG 13 -6.981 3.804 -6.503 109 HH21 ARG 13 HH21 ARG 13 -7.213 6.048 -3.820 110 HH22 ARG 13 HH22 ARG 13 -6.217 5.471 -5.110 111 H LEU 14 H LEU 14 -11.835 0.186 -2.209 112 HA LEU 14 HA LEU 14 -11.831 -1.696 -4.452 113 HB2 LEU 14 HB2 LEU 14 -13.228 -3.033 -3.328 114 HB3 LEU 14 HB3 LEU 14 -12.776 -2.109 -1.917 115 HG LEU 14 HG LEU 14 -15.137 -2.368 -1.908 116 HD11 LEU 14 HD11 LEU 14 -15.367 0.346 -2.831 117 HD12 LEU 14 HD12 LEU 14 -13.910 0.122 -1.865 118 HD13 LEU 14 HD13 LEU 14 -15.484 -0.306 -1.197 119 HD21 LEU 14 HD21 LEU 14 -16.308 -2.624 -3.762 120 HD22 LEU 14 HD22 LEU 14 -14.906 -2.171 -4.727 121 HD23 LEU 14 HD23 LEU 14 -16.033 -0.933 -4.174 122 H SER 15 H SER 15 -13.335 -1.473 -6.081 123 HA SER 15 HA SER 15 -14.065 1.246 -6.646 124 HB2 SER 15 HB2 SER 15 -13.183 -0.623 -8.267 125 HB3 SER 15 HB3 SER 15 -14.895 -1.016 -8.414 126 HG SER 15 HG SER 15 -15.287 0.978 -9.244 127 H ARG 16 H ARG 16 -15.895 2.197 -6.182 128 HA ARG 16 HA ARG 16 -18.168 0.740 -5.196 129 HB2 ARG 16 HB2 ARG 16 -17.578 2.856 -4.186 130 HB3 ARG 16 HB3 ARG 16 -17.733 3.678 -5.730 131 HG2 ARG 16 HG2 ARG 16 -19.662 4.167 -4.426 132 HG3 ARG 16 HG3 ARG 16 -20.144 3.088 -5.733 133 HD2 ARG 16 HD2 ARG 16 -19.749 1.208 -3.997 134 HD3 ARG 16 HD3 ARG 16 -19.860 2.507 -2.812 135 HE ARG 16 HE ARG 16 -22.005 1.349 -4.322 136 HH11 ARG 16 HH11 ARG 16 -20.953 4.238 -2.645 137 HH12 ARG 16 HH12 ARG 16 -22.563 4.801 -2.352 138 HH21 ARG 16 HH21 ARG 16 -24.122 2.097 -3.932 139 HH22 ARG 16 HH22 ARG 16 -24.362 3.587 -3.082 140 H ASP 17 H ASP 17 -17.139 1.568 -8.324 141 HA ASP 17 HA ASP 17 -19.666 2.149 -9.508 142 HB2 ASP 17 HB2 ASP 17 -17.186 1.042 -10.844 143 HB3 ASP 17 HB3 ASP 17 -18.535 1.847 -11.639 144 H ASP 18 H ASP 18 -18.082 -0.750 -8.530 145 HA ASP 18 HA ASP 18 -18.434 -2.969 -8.967 146 HB2 ASP 18 HB2 ASP 18 -19.951 -2.304 -7.158 147 HB3 ASP 18 HB3 ASP 18 -21.228 -2.034 -8.333 148 H ASP 19 H ASP 19 -18.131 -2.048 -11.377 149 HA ASP 19 HA ASP 19 -20.386 -2.877 -13.029 150 HB2 ASP 19 HB2 ASP 19 -18.935 -2.045 -14.931 151 HB3 ASP 19 HB3 ASP 19 -19.442 -0.817 -13.779 152 H LEU 20 H LEU 20 -18.388 -4.549 -11.396 153 HA LEU 20 HA LEU 20 -17.607 -6.421 -13.524 154 HB2 LEU 20 HB2 LEU 20 -16.110 -6.780 -11.086 155 HB3 LEU 20 HB3 LEU 20 -15.528 -6.501 -12.714 156 HG LEU 20 HG LEU 20 -16.044 -4.005 -12.248 157 HD11 LEU 20 HD11 LEU 20 -15.485 -4.502 -9.408 158 HD12 LEU 20 HD12 LEU 20 -17.110 -4.935 -9.934 159 HD13 LEU 20 HD13 LEU 20 -16.518 -3.290 -10.168 160 HD21 LEU 20 HD21 LEU 20 -13.844 -3.657 -11.465 161 HD22 LEU 20 HD22 LEU 20 -13.796 -5.129 -12.434 162 HD23 LEU 20 HD23 LEU 20 -13.796 -5.232 -10.674 163 H THR 21 H THR 21 -18.905 -6.012 -10.275 164 HA THR 21 HA THR 21 -19.952 -7.374 -8.817 165 HB THR 21 HB THR 21 -21.568 -9.023 -9.863 166 HG1 THR 21 HG1 THR 21 -20.607 -9.484 -11.792 167 HG21 THR 21 HG21 THR 21 -22.810 -7.201 -9.579 168 HG22 THR 21 HG22 THR 21 -22.606 -6.979 -11.316 169 HG23 THR 21 HG23 THR 21 -21.553 -6.125 -10.188 170 H GLY 22 H GLY 22 -18.076 -8.246 -7.919 171 HA2 GLY 22 HA2 GLY 22 -17.998 -11.072 -7.868 172 HA3 GLY 22 HA3 GLY 22 -16.649 -10.463 -8.814 173 H GLU 23 H GLU 23 -14.830 -10.198 -7.711 174 HA GLU 23 HA GLU 23 -14.903 -10.107 -4.800 175 HB2 GLU 23 HB2 GLU 23 -13.311 -11.497 -6.410 176 HB3 GLU 23 HB3 GLU 23 -12.344 -10.033 -6.325 177 HG2 GLU 23 HG2 GLU 23 -11.501 -10.724 -4.408 178 HG3 GLU 23 HG3 GLU 23 -13.109 -10.652 -3.690 179 H SER 24 H SER 24 -13.839 -8.116 -7.515 180 HA SER 24 HA SER 24 -12.475 -6.128 -6.122 181 HB2 SER 24 HB2 SER 24 -13.483 -6.520 -8.801 182 HB3 SER 24 HB3 SER 24 -13.685 -4.843 -8.296 183 HG SER 24 HG SER 24 -11.393 -6.255 -8.843 184 H ASN 25 H ASN 25 -15.925 -6.609 -6.404 185 HA ASN 25 HA ASN 25 -16.456 -3.903 -5.484 186 HB2 ASN 25 HB2 ASN 25 -18.611 -4.159 -6.222 187 HB3 ASN 25 HB3 ASN 25 -17.796 -5.304 -7.273 188 HD21 ASN 25 HD21 ASN 25 -17.594 -7.576 -6.005 189 HD22 ASN 25 HD22 ASN 25 -19.112 -8.143 -5.414 190 H SER 26 H SER 26 -15.025 -5.061 -3.550 191 HA SER 26 HA SER 26 -16.753 -4.925 -1.310 192 HB2 SER 26 HB2 SER 26 -15.618 -7.470 -0.826 193 HB3 SER 26 HB3 SER 26 -17.321 -7.068 -1.004 194 HG SER 26 HG SER 26 -15.519 -7.838 -3.058 195 H ILE 27 H ILE 27 -15.548 -3.803 0.033 196 HA ILE 27 HA ILE 27 -12.843 -3.375 -0.142 197 HB ILE 27 HB ILE 27 -14.791 -3.066 2.100 198 HG12 ILE 27 HG12 ILE 27 -14.650 -1.461 0.175 199 HG13 ILE 27 HG13 ILE 27 -14.424 -0.723 1.754 200 HG21 ILE 27 HG21 ILE 27 -12.877 -1.868 3.332 201 HG22 ILE 27 HG22 ILE 27 -11.814 -2.854 2.330 202 HG23 ILE 27 HG23 ILE 27 -12.967 -3.628 3.417 203 HD11 ILE 27 HD11 ILE 27 -12.876 0.210 0.155 204 HD12 ILE 27 HD12 ILE 27 -12.257 -1.397 -0.227 205 HD13 ILE 27 HD13 ILE 27 -11.995 -0.710 1.375 206 H THR 28 H THR 28 -14.400 -5.460 2.311 207 HA THR 28 HA THR 28 -12.066 -6.545 3.370 208 HB THR 28 HB THR 28 -14.740 -6.751 3.899 209 HG1 THR 28 HG1 THR 28 -13.607 -6.991 5.647 210 HG21 THR 28 HG21 THR 28 -15.116 -8.611 2.418 211 HG22 THR 28 HG22 THR 28 -15.210 -9.151 4.094 212 HG23 THR 28 HG23 THR 28 -13.768 -9.489 3.137 213 H ASN 29 H ASN 29 -13.854 -7.524 0.483 214 HA ASN 29 HA ASN 29 -12.676 -10.053 0.130 215 HB2 ASN 29 HB2 ASN 29 -14.178 -8.170 -1.563 216 HB3 ASN 29 HB3 ASN 29 -13.068 -9.205 -2.446 217 HD21 ASN 29 HD21 ASN 29 -13.216 -11.557 -1.869 218 HD22 ASN 29 HD22 ASN 29 -14.799 -12.197 -1.630 219 H GLN 30 H GLN 30 -11.750 -6.915 -1.357 220 HA GLN 30 HA GLN 30 -9.414 -7.900 -2.571 221 HB2 GLN 30 HB2 GLN 30 -9.449 -5.868 -3.470 222 HB3 GLN 30 HB3 GLN 30 -10.735 -5.409 -2.370 223 HG2 GLN 30 HG2 GLN 30 -7.922 -5.276 -1.410 224 HG3 GLN 30 HG3 GLN 30 -8.509 -4.046 -2.521 225 HE21 GLN 30 HE21 GLN 30 -11.022 -3.593 -1.778 226 HE22 GLN 30 HE22 GLN 30 -11.097 -3.040 -0.151 227 H LYS 31 H LYS 31 -10.051 -6.853 0.720 228 HA LYS 31 HA LYS 31 -7.419 -6.457 1.593 229 HB2 LYS 31 HB2 LYS 31 -9.681 -7.671 3.199 230 HB3 LYS 31 HB3 LYS 31 -8.249 -6.883 3.839 231 HG2 LYS 31 HG2 LYS 31 -9.189 -4.874 2.371 232 HG3 LYS 31 HG3 LYS 31 -10.701 -5.707 2.698 233 HD2 LYS 31 HD2 LYS 31 -8.786 -5.138 4.909 234 HD3 LYS 31 HD3 LYS 31 -9.870 -3.875 4.335 235 HE2 LYS 31 HE2 LYS 31 -11.109 -6.492 4.895 236 HE3 LYS 31 HE3 LYS 31 -10.475 -5.627 6.292 237 HZ1 LYS 31 HZ1 LYS 31 -12.769 -5.029 4.649 238 HZ2 LYS 31 HZ2 LYS 31 -11.804 -3.687 5.005 239 HZ3 LYS 31 HZ3 LYS 31 -12.451 -4.618 6.256 240 H LYS 32 H LYS 32 -9.444 -9.362 1.545 241 HA LYS 32 HA LYS 32 -7.541 -11.186 2.497 242 HB2 LYS 32 HB2 LYS 32 -10.056 -11.405 0.907 243 HB3 LYS 32 HB3 LYS 32 -9.012 -12.814 1.026 244 HG2 LYS 32 HG2 LYS 32 -9.240 -12.896 3.379 245 HG3 LYS 32 HG3 LYS 32 -10.000 -11.307 3.429 246 HD2 LYS 32 HD2 LYS 32 -11.278 -13.469 1.824 247 HD3 LYS 32 HD3 LYS 32 -11.436 -13.505 3.581 248 HE2 LYS 32 HE2 LYS 32 -11.929 -10.852 2.665 249 HE3 LYS 32 HE3 LYS 32 -12.905 -11.969 1.713 250 HZ1 LYS 32 HZ1 LYS 32 -14.210 -11.446 3.558 251 HZ2 LYS 32 HZ2 LYS 32 -12.917 -11.563 4.640 252 HZ3 LYS 32 HZ3 LYS 32 -13.563 -12.961 3.941 253 H TYR 33 H TYR 33 -8.138 -9.873 -0.722 254 HA TYR 33 HA TYR 33 -6.671 -11.645 -2.301 255 HB2 TYR 33 HB2 TYR 33 -8.055 -9.774 -3.198 256 HB3 TYR 33 HB3 TYR 33 -6.843 -8.636 -2.633 257 HD1 TYR 33 HD1 TYR 33 -7.356 -11.489 -4.952 258 HD2 TYR 33 HD2 TYR 33 -4.976 -8.096 -3.971 259 HE1 TYR 33 HE1 TYR 33 -6.128 -11.732 -7.067 260 HE2 TYR 33 HE2 TYR 33 -3.744 -8.343 -6.053 261 HH TYR 33 HH TYR 33 -3.752 -11.046 -7.908 262 H LEU 34 H LEU 34 -5.500 -8.505 -1.042 263 HA LEU 34 HA LEU 34 -2.797 -8.857 -1.611 264 HB2 LEU 34 HB2 LEU 34 -4.029 -7.444 0.766 265 HB3 LEU 34 HB3 LEU 34 -2.379 -7.268 0.236 266 HG LEU 34 HG LEU 34 -2.932 -5.616 -1.122 267 HD11 LEU 34 HD11 LEU 34 -5.292 -7.077 -2.250 268 HD12 LEU 34 HD12 LEU 34 -3.636 -7.439 -2.738 269 HD13 LEU 34 HD13 LEU 34 -4.303 -5.829 -3.006 270 HD21 LEU 34 HD21 LEU 34 -4.378 -4.560 0.198 271 HD22 LEU 34 HD22 LEU 34 -5.301 -6.028 0.523 272 HD23 LEU 34 HD23 LEU 34 -5.603 -5.109 -0.948 273 H GLU 35 H GLU 35 -4.729 -9.763 1.221 274 HA GLU 35 HA GLU 35 -2.796 -10.690 2.927 275 HB2 GLU 35 HB2 GLU 35 -5.581 -10.822 2.788 276 HB3 GLU 35 HB3 GLU 35 -5.057 -12.497 2.901 277 HG2 GLU 35 HG2 GLU 35 -3.537 -11.463 4.820 278 HG3 GLU 35 HG3 GLU 35 -4.855 -10.307 4.872 279 H ASP 36 H ASP 36 -4.536 -12.552 0.464 280 HA ASP 36 HA ASP 36 -3.210 -14.981 0.690 281 HB2 ASP 36 HB2 ASP 36 -5.235 -14.028 -0.832 282 HB3 ASP 36 HB3 ASP 36 -3.963 -14.142 -2.039 283 H TYR 37 H TYR 37 -2.221 -12.010 -0.855 284 HA TYR 37 HA TYR 37 -0.066 -13.180 -2.342 285 HB2 TYR 37 HB2 TYR 37 -1.019 -11.147 -3.198 286 HB3 TYR 37 HB3 TYR 37 -0.775 -10.314 -1.674 287 HD1 TYR 37 HD1 TYR 37 1.507 -9.661 -0.979 288 HD2 TYR 37 HD2 TYR 37 0.730 -11.303 -4.816 289 HE1 TYR 37 HE1 TYR 37 3.700 -8.886 -1.742 290 HE2 TYR 37 HE2 TYR 37 2.920 -10.514 -5.606 291 HH TYR 37 HH TYR 37 5.364 -9.748 -3.768 292 H ALA 38 H ALA 38 -0.015 -10.796 0.329 293 HA ALA 38 HA ALA 38 2.635 -10.905 0.960 294 HB1 ALA 38 HB1 ALA 38 2.123 -9.976 3.044 295 HB2 ALA 38 HB2 ALA 38 0.556 -10.779 3.109 296 HB3 ALA 38 HB3 ALA 38 0.820 -9.455 1.979 297 H ARG 39 H ARG 39 0.179 -13.315 1.826 298 HA ARG 39 HA ARG 39 1.977 -14.709 3.605 299 HB2 ARG 39 HB2 ARG 39 0.274 -16.509 3.608 300 HB3 ARG 39 HB3 ARG 39 -0.368 -14.938 4.056 301 HG2 ARG 39 HG2 ARG 39 -0.873 -14.903 1.418 302 HG3 ARG 39 HG3 ARG 39 -0.964 -16.641 1.737 303 HD2 ARG 39 HD2 ARG 39 -2.304 -15.257 3.839 304 HD3 ARG 39 HD3 ARG 39 -2.915 -14.666 2.302 305 HE ARG 39 HE ARG 39 -3.112 -17.241 1.861 306 HH11 ARG 39 HH11 ARG 39 -3.844 -15.512 4.820 307 HH12 ARG 39 HH12 ARG 39 -5.058 -16.638 5.319 308 HH21 ARG 39 HH21 ARG 39 -4.727 -18.711 2.523 309 HH22 ARG 39 HH22 ARG 39 -5.564 -18.449 4.016 310 H ARG 40 H ARG 40 0.807 -15.156 0.287 311 HA ARG 40 HA ARG 40 2.306 -17.516 -0.229 312 HB2 ARG 40 HB2 ARG 40 1.503 -17.360 -2.392 313 HB3 ARG 40 HB3 ARG 40 0.303 -16.419 -1.537 314 HG2 ARG 40 HG2 ARG 40 1.286 -14.379 -2.280 315 HG3 ARG 40 HG3 ARG 40 2.674 -15.232 -2.954 316 HD2 ARG 40 HD2 ARG 40 0.044 -16.114 -3.932 317 HD3 ARG 40 HD3 ARG 40 0.501 -14.475 -4.372 318 HE ARG 40 HE ARG 40 2.574 -16.388 -4.871 319 HH11 ARG 40 HH11 ARG 40 -0.333 -14.941 -6.179 320 HH12 ARG 40 HH12 ARG 40 0.081 -15.300 -7.820 321 HH21 ARG 40 HH21 ARG 40 3.111 -16.857 -7.041 322 HH22 ARG 40 HH22 ARG 40 2.033 -16.384 -8.310 323 H ASN 41 H ASN 41 3.196 -14.264 0.175 324 HA ASN 41 HA ASN 41 5.661 -14.518 -1.366 325 HB2 ASN 41 HB2 ASN 41 3.983 -12.277 -0.410 326 HB3 ASN 41 HB3 ASN 41 5.713 -11.985 -0.421 327 HD21 ASN 41 HD21 ASN 41 3.064 -13.149 -2.441 328 HD22 ASN 41 HD22 ASN 41 3.705 -12.556 -3.930 329 H GLY 42 H GLY 42 4.491 -13.972 1.922 330 HA2 GLY 42 HA2 GLY 42 5.670 -14.896 3.801 331 HA3 GLY 42 HA3 GLY 42 7.169 -14.677 2.921 332 H PHE 43 H PHE 43 4.484 -12.438 3.749 333 HA PHE 43 HA PHE 43 6.504 -10.615 4.894 334 HB2 PHE 43 HB2 PHE 43 3.831 -10.025 3.625 335 HB3 PHE 43 HB3 PHE 43 4.815 -8.818 4.428 336 HD1 PHE 43 HD1 PHE 43 7.435 -9.016 3.525 337 HD2 PHE 43 HD2 PHE 43 3.889 -9.915 1.393 338 HE1 PHE 43 HE1 PHE 43 8.616 -8.616 1.402 339 HE2 PHE 43 HE2 PHE 43 5.039 -9.536 -0.732 340 HZ PHE 43 HZ PHE 43 7.418 -8.877 -0.737 341 H GLU 44 H GLU 44 6.264 -9.829 6.950 342 HA GLU 44 HA GLU 44 4.124 -10.959 8.582 343 HB2 GLU 44 HB2 GLU 44 6.862 -9.905 9.139 344 HB3 GLU 44 HB3 GLU 44 5.677 -10.032 10.430 345 HG2 GLU 44 HG2 GLU 44 7.272 -11.917 10.157 346 HG3 GLU 44 HG3 GLU 44 5.572 -12.339 10.256 347 H ASN 45 H ASN 45 3.475 -9.632 10.477 348 HA ASN 45 HA ASN 45 2.299 -7.875 11.273 349 HB2 ASN 45 HB2 ASN 45 4.680 -6.480 10.093 350 HB3 ASN 45 HB3 ASN 45 3.516 -5.675 11.140 351 HD21 ASN 45 HD21 ASN 45 6.375 -7.330 10.992 352 HD22 ASN 45 HD22 ASN 45 6.567 -7.710 12.671 353 H ILE 46 H ILE 46 1.661 -8.681 8.506 354 HA ILE 46 HA ILE 46 1.255 -6.612 6.747 355 HB ILE 46 HB ILE 46 -0.504 -9.009 7.204 356 HG12 ILE 46 HG12 ILE 46 1.563 -8.736 5.057 357 HG13 ILE 46 HG13 ILE 46 2.029 -9.267 6.673 358 HG21 ILE 46 HG21 ILE 46 -0.281 -7.800 4.533 359 HG22 ILE 46 HG22 ILE 46 -1.182 -6.869 5.728 360 HG23 ILE 46 HG23 ILE 46 -1.672 -8.518 5.344 361 HD11 ILE 46 HD11 ILE 46 -0.231 -10.632 5.281 362 HD12 ILE 46 HD12 ILE 46 0.890 -11.249 6.499 363 HD13 ILE 46 HD13 ILE 46 1.436 -11.014 4.841 364 H ARG 47 H ARG 47 0.496 -4.760 7.435 365 HA ARG 47 HA ARG 47 -1.963 -4.649 8.997 366 HB2 ARG 47 HB2 ARG 47 0.279 -3.126 9.158 367 HB3 ARG 47 HB3 ARG 47 -0.778 -2.104 8.186 368 HG2 ARG 47 HG2 ARG 47 -2.440 -3.021 10.169 369 HG3 ARG 47 HG3 ARG 47 -0.913 -2.769 11.005 370 HD2 ARG 47 HD2 ARG 47 -1.003 -0.519 9.574 371 HD3 ARG 47 HD3 ARG 47 -2.732 -0.830 9.724 372 HE ARG 47 HE ARG 47 -1.280 -1.005 12.207 373 HH11 ARG 47 HH11 ARG 47 -2.981 1.143 10.034 374 HH12 ARG 47 HH12 ARG 47 -3.321 2.311 11.262 375 HH21 ARG 47 HH21 ARG 47 -1.721 0.537 13.814 376 HH22 ARG 47 HH22 ARG 47 -2.604 1.968 13.408 377 H HIS 48 H HIS 48 -3.868 -4.337 8.147 378 HA HIS 48 HA HIS 48 -4.030 -3.788 5.306 379 HB2 HIS 48 HB2 HIS 48 -6.063 -4.704 7.336 380 HB3 HIS 48 HB3 HIS 48 -6.525 -4.256 5.696 381 HD1 HIS 48 HD1 HIS 48 -6.629 -6.162 4.152 382 HD2 HIS 48 HD2 HIS 48 -3.954 -6.829 7.247 383 HE1 HIS 48 HE1 HIS 48 -5.801 -8.511 3.811 384 HE2 HIS 48 HE2 HIS 48 -4.031 -8.814 5.589 385 H PHE 49 H PHE 49 -4.070 -1.767 4.653 386 HA PHE 49 HA PHE 49 -5.405 0.263 6.284 387 HB2 PHE 49 HB2 PHE 49 -3.562 0.667 3.906 388 HB3 PHE 49 HB3 PHE 49 -4.180 1.919 4.974 389 HD1 PHE 49 HD1 PHE 49 -3.349 2.134 7.240 390 HD2 PHE 49 HD2 PHE 49 -1.728 -0.746 4.563 391 HE1 PHE 49 HE1 PHE 49 -1.414 1.859 8.721 392 HE2 PHE 49 HE2 PHE 49 0.211 -1.034 6.045 393 HZ PHE 49 HZ PHE 49 0.364 0.263 8.124 394 H THR 50 H THR 50 -7.436 0.136 5.852 395 HA THR 50 HA THR 50 -8.551 -0.481 3.325 396 HB THR 50 HB THR 50 -9.472 -1.002 5.616 397 HG1 THR 50 HG1 THR 50 -11.414 -1.175 4.748 398 HG21 THR 50 HG21 THR 50 -9.803 1.905 5.645 399 HG22 THR 50 HG22 THR 50 -9.705 0.751 6.972 400 HG23 THR 50 HG23 THR 50 -11.229 0.984 6.119 401 H ASP 51 H ASP 51 -9.981 0.678 2.097 402 HA ASP 51 HA ASP 51 -9.530 3.575 2.110 403 HB2 ASP 51 HB2 ASP 51 -9.910 1.727 -0.249 404 HB3 ASP 51 HB3 ASP 51 -9.788 3.472 -0.363 405 H ASP 52 H ASP 52 -11.274 4.918 1.694 406 HA ASP 52 HA ASP 52 -13.818 3.874 0.933 407 HB2 ASP 52 HB2 ASP 52 -13.721 3.109 3.279 408 HB3 ASP 52 HB3 ASP 52 -13.485 4.773 3.800 409 H GLY 53 H GLY 53 -14.455 5.430 -0.378 410 HA2 GLY 53 HA2 GLY 53 -14.925 7.513 -1.227 411 HA3 GLY 53 HA3 GLY 53 -15.200 7.986 0.441 412 H PHE 54 H PHE 54 -12.311 7.099 -1.461 413 HA PHE 54 HA PHE 54 -10.840 9.253 -0.211 414 HB2 PHE 54 HB2 PHE 54 -10.052 6.973 -2.015 415 HB3 PHE 54 HB3 PHE 54 -8.939 8.288 -1.662 416 HD1 PHE 54 HD1 PHE 54 -10.154 8.545 1.274 417 HD2 PHE 54 HD2 PHE 54 -8.489 5.358 -1.026 418 HE1 PHE 54 HE1 PHE 54 -9.525 7.383 3.326 419 HE2 PHE 54 HE2 PHE 54 -7.825 4.248 1.060 420 HZ PHE 54 HZ PHE 54 -8.354 5.219 3.229 421 H SER 55 H SER 55 -10.186 11.076 -1.187 422 HA SER 55 HA SER 55 -11.554 12.064 -3.429 423 HB2 SER 55 HB2 SER 55 -9.084 13.019 -1.981 424 HB3 SER 55 HB3 SER 55 -9.770 13.899 -3.347 425 HG SER 55 HG SER 55 -10.523 13.984 -0.812 426 H GLY 56 H GLY 56 -10.388 13.001 -5.404 427 HA2 GLY 56 HA2 GLY 56 -8.624 10.897 -6.482 428 HA3 GLY 56 HA3 GLY 56 -9.720 11.873 -7.443 429 H VAL 57 H VAL 57 -7.410 12.948 -4.951 430 HA VAL 57 HA VAL 57 -6.240 14.720 -6.969 431 HB VAL 57 HB VAL 57 -5.239 15.955 -5.096 432 HG11 VAL 57 HG11 VAL 57 -7.346 16.833 -4.146 433 HG12 VAL 57 HG12 VAL 57 -8.205 15.476 -4.873 434 HG13 VAL 57 HG13 VAL 57 -7.395 16.658 -5.900 435 HG21 VAL 57 HG21 VAL 57 -5.992 15.438 -2.779 436 HG22 VAL 57 HG22 VAL 57 -4.915 14.224 -3.466 437 HG23 VAL 57 HG23 VAL 57 -6.648 13.915 -3.379 438 H ASN 58 H ASN 58 -5.185 12.402 -4.447 439 HA ASN 58 HA ASN 58 -3.241 11.112 -5.860 440 HB2 ASN 58 HB2 ASN 58 -1.152 12.323 -4.829 441 HB3 ASN 58 HB3 ASN 58 -1.860 12.892 -6.330 442 HD21 ASN 58 HD21 ASN 58 -1.887 15.011 -6.414 443 HD22 ASN 58 HD22 ASN 58 -2.230 16.077 -5.104 444 H PHE 59 H PHE 59 -1.952 12.480 -2.914 445 HA PHE 59 HA PHE 59 -2.630 9.966 -1.546 446 HB2 PHE 59 HB2 PHE 59 -0.248 11.661 -0.819 447 HB3 PHE 59 HB3 PHE 59 -0.537 9.964 -0.471 448 HD1 PHE 59 HD1 PHE 59 -0.100 12.233 -3.407 449 HD2 PHE 59 HD2 PHE 59 0.600 8.385 -1.734 450 HE1 PHE 59 HE1 PHE 59 1.208 11.613 -5.387 451 HE2 PHE 59 HE2 PHE 59 1.906 7.766 -3.719 452 HZ PHE 59 HZ PHE 59 2.213 9.377 -5.547 453 H ASN 60 H ASN 60 -1.893 10.599 1.033 454 HA ASN 60 HA ASN 60 -2.562 11.619 2.953 455 HB2 ASN 60 HB2 ASN 60 -3.454 13.891 1.156 456 HB3 ASN 60 HB3 ASN 60 -3.371 13.951 2.912 457 HD21 ASN 60 HD21 ASN 60 -0.943 12.493 3.207 458 HD22 ASN 60 HD22 ASN 60 0.337 13.484 2.620 459 H ARG 61 H ARG 61 -3.964 10.017 3.308 460 HA ARG 61 HA ARG 61 -6.831 10.655 3.102 461 HB2 ARG 61 HB2 ARG 61 -6.393 7.824 2.760 462 HB3 ARG 61 HB3 ARG 61 -7.287 8.933 1.742 463 HG2 ARG 61 HG2 ARG 61 -4.326 8.941 1.504 464 HG3 ARG 61 HG3 ARG 61 -5.198 7.559 0.854 465 HD2 ARG 61 HD2 ARG 61 -6.657 9.653 -0.105 466 HD3 ARG 61 HD3 ARG 61 -5.022 10.310 -0.114 467 HE ARG 61 HE ARG 61 -4.506 8.101 -1.347 468 HH11 ARG 61 HH11 ARG 61 -7.446 9.973 -1.701 469 HH12 ARG 61 HH12 ARG 61 -7.715 9.464 -3.331 470 HH21 ARG 61 HH21 ARG 61 -4.868 7.441 -3.494 471 HH22 ARG 61 HH22 ARG 61 -6.253 8.029 -4.351 472 HA PRO 62 HA PRO 62 -6.967 9.204 7.293 473 HB2 PRO 62 HB2 PRO 62 -9.079 7.432 7.306 474 HB3 PRO 62 HB3 PRO 62 -9.250 9.188 7.370 475 HG2 PRO 62 HG2 PRO 62 -9.509 7.342 5.045 476 HG3 PRO 62 HG3 PRO 62 -10.467 8.771 5.446 477 HD2 PRO 62 HD2 PRO 62 -8.550 8.833 3.547 478 HD3 PRO 62 HD3 PRO 62 -8.902 10.232 4.583 479 H GLY 63 H GLY 63 -7.935 6.302 5.414 480 HA2 GLY 63 HA2 GLY 63 -6.517 4.444 6.970 481 HA3 GLY 63 HA3 GLY 63 -7.038 4.190 5.309 482 H PHE 64 H PHE 64 -5.589 6.421 4.236 483 HA PHE 64 HA PHE 64 -3.086 5.204 3.663 484 HB2 PHE 64 HB2 PHE 64 -4.362 6.653 2.116 485 HB3 PHE 64 HB3 PHE 64 -4.065 8.022 3.173 486 HD1 PHE 64 HD1 PHE 64 -1.461 8.351 3.718 487 HD2 PHE 64 HD2 PHE 64 -3.079 6.467 0.279 488 HE1 PHE 64 HE1 PHE 64 0.603 8.847 2.489 489 HE2 PHE 64 HE2 PHE 64 -1.029 6.948 -0.959 490 HZ PHE 64 HZ PHE 64 0.836 8.136 0.146 491 H GLN 65 H GLN 65 -4.086 7.977 5.635 492 HA GLN 65 HA GLN 65 -1.541 8.843 6.390 493 HB2 GLN 65 HB2 GLN 65 -4.282 9.167 7.529 494 HB3 GLN 65 HB3 GLN 65 -2.902 9.647 8.506 495 HG2 GLN 65 HG2 GLN 65 -2.147 11.090 6.625 496 HG3 GLN 65 HG3 GLN 65 -3.645 10.701 5.779 497 HE21 GLN 65 HE21 GLN 65 -2.167 12.913 7.715 498 HE22 GLN 65 HE22 GLN 65 -3.558 13.686 8.384 499 H SER 66 H SER 66 -3.445 6.126 7.387 500 HA SER 66 HA SER 66 -1.964 5.579 9.790 501 HB2 SER 66 HB2 SER 66 -4.280 4.528 8.486 502 HB3 SER 66 HB3 SER 66 -3.130 3.209 8.675 503 HG SER 66 HG SER 66 -4.712 3.914 10.483 504 H LEU 67 H LEU 67 -2.041 4.407 6.434 505 HA LEU 67 HA LEU 67 0.081 2.599 6.498 506 HB2 LEU 67 HB2 LEU 67 -0.852 2.395 4.442 507 HB3 LEU 67 HB3 LEU 67 -1.525 4.010 4.525 508 HG LEU 67 HG LEU 67 0.737 4.877 3.805 509 HD11 LEU 67 HD11 LEU 67 2.262 3.216 4.234 510 HD12 LEU 67 HD12 LEU 67 1.969 2.970 2.513 511 HD13 LEU 67 HD13 LEU 67 1.175 1.934 3.701 512 HD21 LEU 67 HD21 LEU 67 -0.777 3.013 1.984 513 HD22 LEU 67 HD22 LEU 67 0.375 4.238 1.452 514 HD23 LEU 67 HD23 LEU 67 -1.116 4.721 2.260 515 H ILE 68 H ILE 68 0.036 6.075 5.736 516 HA ILE 68 HA ILE 68 2.830 6.365 5.425 517 HB ILE 68 HB ILE 68 0.632 7.989 4.999 518 HG12 ILE 68 HG12 ILE 68 2.216 9.592 4.076 519 HG13 ILE 68 HG13 ILE 68 3.529 8.875 5.001 520 HG21 ILE 68 HG21 ILE 68 1.203 10.098 6.220 521 HG22 ILE 68 HG22 ILE 68 2.249 9.135 7.265 522 HG23 ILE 68 HG23 ILE 68 0.514 8.820 7.218 523 HD11 ILE 68 HD11 ILE 68 3.684 8.188 2.715 524 HD12 ILE 68 HD12 ILE 68 2.012 7.620 2.724 525 HD13 ILE 68 HD13 ILE 68 3.230 6.794 3.696 526 H LYS 69 H LYS 69 0.699 6.440 8.226 527 HA LYS 69 HA LYS 69 2.408 7.671 10.088 528 HB2 LYS 69 HB2 LYS 69 -0.006 7.173 10.483 529 HB3 LYS 69 HB3 LYS 69 0.410 5.473 10.652 530 HG2 LYS 69 HG2 LYS 69 2.074 7.042 12.360 531 HG3 LYS 69 HG3 LYS 69 0.382 7.451 12.640 532 HD2 LYS 69 HD2 LYS 69 0.187 5.605 13.863 533 HD3 LYS 69 HD3 LYS 69 0.500 4.651 12.413 534 HE2 LYS 69 HE2 LYS 69 2.352 3.921 13.396 535 HE3 LYS 69 HE3 LYS 69 3.005 5.549 13.224 536 HZ1 LYS 69 HZ1 LYS 69 1.423 4.610 15.556 537 HZ2 LYS 69 HZ2 LYS 69 2.202 6.102 15.398 538 HZ3 LYS 69 HZ3 LYS 69 3.112 4.683 15.512 539 H GLU 70 H GLU 70 2.216 4.396 8.891 540 HA GLU 70 HA GLU 70 4.135 3.303 10.746 541 HB2 GLU 70 HB2 GLU 70 3.585 2.079 8.059 542 HB3 GLU 70 HB3 GLU 70 3.932 1.284 9.586 543 HG2 GLU 70 HG2 GLU 70 1.368 2.735 9.000 544 HG3 GLU 70 HG3 GLU 70 1.611 1.017 8.736 545 H VAL 71 H VAL 71 4.124 4.713 7.523 546 HA VAL 71 HA VAL 71 6.807 4.115 6.864 547 HB VAL 71 HB VAL 71 5.267 6.505 5.842 548 HG11 VAL 71 HG11 VAL 71 6.637 5.814 3.760 549 HG12 VAL 71 HG12 VAL 71 7.628 4.927 4.918 550 HG13 VAL 71 HG13 VAL 71 7.441 6.674 5.074 551 HG21 VAL 71 HG21 VAL 71 4.336 3.923 5.672 552 HG22 VAL 71 HG22 VAL 71 5.232 4.117 4.165 553 HG23 VAL 71 HG23 VAL 71 3.932 5.235 4.566 554 H GLU 72 H GLU 72 5.306 6.976 8.370 555 HA GLU 72 HA GLU 72 7.636 8.550 8.499 556 HB2 GLU 72 HB2 GLU 72 6.341 9.577 10.559 557 HB3 GLU 72 HB3 GLU 72 5.807 9.859 8.909 558 HG2 GLU 72 HG2 GLU 72 3.938 8.633 9.158 559 HG3 GLU 72 HG3 GLU 72 4.693 7.494 10.255 560 H ALA 73 H ALA 73 6.158 6.366 10.870 561 HA ALA 73 HA ALA 73 8.124 6.723 12.881 562 HB1 ALA 73 HB1 ALA 73 6.662 5.536 14.053 563 HB2 ALA 73 HB2 ALA 73 6.911 4.131 13.016 564 HB3 ALA 73 HB3 ALA 73 5.702 5.342 12.586 565 H GLY 74 H GLY 74 8.111 4.924 9.946 566 HA2 GLY 74 HA2 GLY 74 9.836 3.806 8.928 567 HA3 GLY 74 HA3 GLY 74 10.810 3.989 10.370 568 H ASN 75 H ASN 75 7.611 2.549 10.016 569 HA ASN 75 HA ASN 75 8.600 0.007 11.123 570 HB2 ASN 75 HB2 ASN 75 5.961 1.443 11.117 571 HB3 ASN 75 HB3 ASN 75 5.986 -0.301 11.307 572 HD21 ASN 75 HD21 ASN 75 4.932 1.182 13.263 573 HD22 ASN 75 HD22 ASN 75 5.962 1.207 14.639 574 H VAL 76 H VAL 76 6.587 1.393 8.555 575 HA VAL 76 HA VAL 76 5.936 -1.022 7.291 576 HB VAL 76 HB VAL 76 4.793 1.139 6.846 577 HG11 VAL 76 HG11 VAL 76 6.769 1.965 4.839 578 HG12 VAL 76 HG12 VAL 76 7.232 2.218 6.522 579 HG13 VAL 76 HG13 VAL 76 5.744 2.924 5.899 580 HG21 VAL 76 HG21 VAL 76 4.748 -0.868 5.299 581 HG22 VAL 76 HG22 VAL 76 5.903 0.007 4.293 582 HG23 VAL 76 HG23 VAL 76 4.299 0.681 4.585 583 H GLU 77 H GLU 77 7.732 -2.343 7.047 584 HA GLU 77 HA GLU 77 10.016 -1.385 5.510 585 HB2 GLU 77 HB2 GLU 77 11.055 -3.480 6.043 586 HB3 GLU 77 HB3 GLU 77 10.310 -2.848 7.501 587 HG2 GLU 77 HG2 GLU 77 9.079 -4.663 7.739 588 HG3 GLU 77 HG3 GLU 77 8.452 -4.509 6.101 589 H THR 78 H THR 78 7.010 -2.420 4.732 590 HA THR 78 HA THR 78 7.778 -3.188 2.059 591 HB THR 78 HB THR 78 5.957 -5.161 2.560 592 HG1 THR 78 HG1 THR 78 6.395 -6.089 4.480 593 HG21 THR 78 HG21 THR 78 8.113 -5.376 1.362 594 HG22 THR 78 HG22 THR 78 7.715 -6.734 2.411 595 HG23 THR 78 HG23 THR 78 8.905 -5.541 2.927 596 H LEU 79 H LEU 79 6.038 -3.156 0.560 597 HA LEU 79 HA LEU 79 3.494 -2.155 1.587 598 HB2 LEU 79 HB2 LEU 79 5.107 -0.303 0.709 599 HB3 LEU 79 HB3 LEU 79 4.663 -0.912 -0.856 600 HG LEU 79 HG LEU 79 3.126 0.759 -0.694 601 HD11 LEU 79 HD11 LEU 79 1.866 -1.347 -0.840 602 HD12 LEU 79 HD12 LEU 79 0.960 -0.052 -0.058 603 HD13 LEU 79 HD13 LEU 79 1.683 -1.329 0.912 604 HD21 LEU 79 HD21 LEU 79 3.536 0.464 2.210 605 HD22 LEU 79 HD22 LEU 79 1.975 1.098 1.681 606 HD23 LEU 79 HD23 LEU 79 3.467 1.913 1.206 607 H ILE 80 H ILE 80 1.864 -3.210 0.748 608 HA ILE 80 HA ILE 80 2.188 -4.514 -1.869 609 HB ILE 80 HB ILE 80 0.770 -5.547 0.585 610 HG12 ILE 80 HG12 ILE 80 2.115 -7.621 -0.100 611 HG13 ILE 80 HG13 ILE 80 2.988 -6.555 -1.195 612 HG21 ILE 80 HG21 ILE 80 -0.851 -6.182 -0.861 613 HG22 ILE 80 HG22 ILE 80 0.292 -7.476 -1.224 614 HG23 ILE 80 HG23 ILE 80 0.205 -6.058 -2.267 615 HD11 ILE 80 HD11 ILE 80 4.065 -5.481 0.492 616 HD12 ILE 80 HD12 ILE 80 3.872 -7.078 1.215 617 HD13 ILE 80 HD13 ILE 80 2.773 -5.771 1.657 618 H VAL 81 H VAL 81 1.051 -3.461 -3.301 619 HA VAL 81 HA VAL 81 -1.652 -2.505 -2.617 620 HB VAL 81 HB VAL 81 0.215 -1.205 -4.595 621 HG11 VAL 81 HG11 VAL 81 -2.394 -1.051 -4.696 622 HG12 VAL 81 HG12 VAL 81 -1.403 0.379 -4.968 623 HG13 VAL 81 HG13 VAL 81 -2.172 0.122 -3.405 624 HG21 VAL 81 HG21 VAL 81 0.061 0.716 -2.781 625 HG22 VAL 81 HG22 VAL 81 1.266 -0.570 -2.625 626 HG23 VAL 81 HG23 VAL 81 -0.232 -0.637 -1.676 627 H LYS 82 H LYS 82 -3.246 -2.968 -4.124 628 HA LYS 82 HA LYS 82 -2.941 -5.108 -5.864 629 HB2 LYS 82 HB2 LYS 82 -5.063 -3.682 -4.972 630 HB3 LYS 82 HB3 LYS 82 -4.983 -3.119 -6.635 631 HG2 LYS 82 HG2 LYS 82 -4.910 -6.040 -6.011 632 HG3 LYS 82 HG3 LYS 82 -6.441 -5.162 -6.086 633 HD2 LYS 82 HD2 LYS 82 -6.360 -4.970 -8.316 634 HD3 LYS 82 HD3 LYS 82 -4.633 -4.635 -8.329 635 HE2 LYS 82 HE2 LYS 82 -4.377 -7.142 -7.764 636 HE3 LYS 82 HE3 LYS 82 -6.042 -7.279 -8.331 637 HZ1 LYS 82 HZ1 LYS 82 -4.372 -7.713 -10.070 638 HZ2 LYS 82 HZ2 LYS 82 -3.817 -6.124 -9.922 639 HZ3 LYS 82 HZ3 LYS 82 -5.393 -6.421 -10.457 640 H ASP 83 H ASP 83 -2.509 -1.633 -6.391 641 HA ASP 83 HA ASP 83 -0.740 -1.948 -8.524 642 HB2 ASP 83 HB2 ASP 83 -2.226 -0.866 -10.318 643 HB3 ASP 83 HB3 ASP 83 -2.484 -2.572 -9.983 644 H MET 84 H MET 84 -0.035 0.091 -9.450 645 HA MET 84 HA MET 84 0.168 2.139 -7.529 646 HB2 MET 84 HB2 MET 84 0.898 2.077 -10.451 647 HB3 MET 84 HB3 MET 84 1.301 3.408 -9.377 648 HG2 MET 84 HG2 MET 84 2.125 0.865 -8.280 649 HG3 MET 84 HG3 MET 84 2.814 1.149 -9.875 650 HE1 MET 84 HE1 MET 84 3.713 0.861 -6.815 651 HE2 MET 84 HE2 MET 84 3.214 2.329 -5.975 652 HE3 MET 84 HE3 MET 84 4.910 2.090 -6.399 653 H SER 85 H SER 85 -2.567 1.566 -9.319 654 HA SER 85 HA SER 85 -3.139 4.222 -10.208 655 HB2 SER 85 HB2 SER 85 -5.191 2.077 -9.654 656 HB3 SER 85 HB3 SER 85 -5.291 3.408 -10.804 657 HG SER 85 HG SER 85 -3.902 0.989 -10.987 658 H ARG 86 H ARG 86 -3.314 2.553 -7.206 659 HA ARG 86 HA ARG 86 -5.366 4.087 -5.999 660 HB2 ARG 86 HB2 ARG 86 -3.129 2.536 -4.706 661 HB3 ARG 86 HB3 ARG 86 -4.591 3.098 -3.906 662 HG2 ARG 86 HG2 ARG 86 -4.809 1.332 -6.300 663 HG3 ARG 86 HG3 ARG 86 -4.411 0.639 -4.731 664 HD2 ARG 86 HD2 ARG 86 -6.446 1.216 -3.814 665 HD3 ARG 86 HD3 ARG 86 -6.718 2.502 -4.971 666 HE ARG 86 HE ARG 86 -7.655 -0.121 -5.165 667 HH11 ARG 86 HH11 ARG 86 -6.108 2.235 -7.262 668 HH12 ARG 86 HH12 ARG 86 -6.873 1.630 -8.687 669 HH21 ARG 86 HH21 ARG 86 -8.642 -0.892 -7.046 670 HH22 ARG 86 HH22 ARG 86 -8.313 -0.135 -8.566 671 H LEU 87 H LEU 87 -1.807 4.214 -5.530 672 HA LEU 87 HA LEU 87 -2.009 6.679 -4.080 673 HB2 LEU 87 HB2 LEU 87 0.278 5.032 -5.095 674 HB3 LEU 87 HB3 LEU 87 0.563 6.645 -4.471 675 HG LEU 87 HG LEU 87 -0.931 5.558 -2.459 676 HD11 LEU 87 HD11 LEU 87 -0.303 3.356 -2.015 677 HD12 LEU 87 HD12 LEU 87 0.903 3.349 -3.300 678 HD13 LEU 87 HD13 LEU 87 -0.814 3.371 -3.701 679 HD21 LEU 87 HD21 LEU 87 1.232 6.804 -2.332 680 HD22 LEU 87 HD22 LEU 87 2.058 5.284 -2.655 681 HD23 LEU 87 HD23 LEU 87 1.083 5.467 -1.197 682 H GLY 88 H GLY 88 -1.668 5.915 -7.472 683 HA2 GLY 88 HA2 GLY 88 -2.434 8.016 -8.716 684 HA3 GLY 88 HA3 GLY 88 -1.040 8.759 -7.965 685 H ARG 89 H ARG 89 -1.677 8.537 -10.755 686 HA ARG 89 HA ARG 89 0.047 6.570 -11.940 687 HB2 ARG 89 HB2 ARG 89 -1.210 9.034 -13.164 688 HB3 ARG 89 HB3 ARG 89 -0.463 7.713 -14.046 689 HG2 ARG 89 HG2 ARG 89 -2.483 6.687 -12.297 690 HG3 ARG 89 HG3 ARG 89 -3.147 7.980 -13.295 691 HD2 ARG 89 HD2 ARG 89 -3.469 6.203 -14.687 692 HD3 ARG 89 HD3 ARG 89 -1.860 6.702 -15.202 693 HE ARG 89 HE ARG 89 -0.972 4.800 -14.228 694 HH11 ARG 89 HH11 ARG 89 -4.386 5.049 -13.484 695 HH12 ARG 89 HH12 ARG 89 -4.503 3.423 -12.908 696 HH21 ARG 89 HH21 ARG 89 -1.134 2.661 -13.463 697 HH22 ARG 89 HH22 ARG 89 -2.657 2.069 -12.890 698 H ASN 90 H ASN 90 0.457 9.676 -10.565 699 HA ASN 90 HA ASN 90 2.679 10.594 -12.062 700 HB2 ASN 90 HB2 ASN 90 3.072 11.924 -9.807 701 HB3 ASN 90 HB3 ASN 90 1.742 12.334 -10.881 702 HD21 ASN 90 HD21 ASN 90 2.553 10.410 -8.023 703 HD22 ASN 90 HD22 ASN 90 0.998 10.536 -7.281 704 H TYR 91 H TYR 91 3.939 8.687 -12.229 705 HA TYR 91 HA TYR 91 5.044 7.206 -10.164 706 HB2 TYR 91 HB2 TYR 91 5.095 6.467 -12.430 707 HB3 TYR 91 HB3 TYR 91 6.069 7.840 -12.929 708 HD1 TYR 91 HD1 TYR 91 6.091 4.548 -11.322 709 HD2 TYR 91 HD2 TYR 91 8.466 7.870 -12.510 710 HE1 TYR 91 HE1 TYR 91 8.125 3.171 -11.081 711 HE2 TYR 91 HE2 TYR 91 10.497 6.513 -12.270 712 HH TYR 91 HH TYR 91 10.691 3.761 -10.606 713 H LEU 92 H LEU 92 5.700 10.472 -10.939 714 HA LEU 92 HA LEU 92 8.414 10.592 -10.053 715 HB2 LEU 92 HB2 LEU 92 6.324 12.767 -10.227 716 HB3 LEU 92 HB3 LEU 92 8.027 13.035 -9.924 717 HG LEU 92 HG LEU 92 8.471 11.978 -12.188 718 HD11 LEU 92 HD11 LEU 92 6.391 12.317 -13.712 719 HD12 LEU 92 HD12 LEU 92 5.488 12.101 -12.212 720 HD13 LEU 92 HD13 LEU 92 6.565 10.828 -12.783 721 HD21 LEU 92 HD21 LEU 92 7.869 14.044 -13.401 722 HD22 LEU 92 HD22 LEU 92 8.638 14.362 -11.847 723 HD23 LEU 92 HD23 LEU 92 6.893 14.541 -12.020 724 H GLN 93 H GLN 93 5.366 11.745 -8.601 725 HA GLN 93 HA GLN 93 6.421 12.143 -5.993 726 HB2 GLN 93 HB2 GLN 93 3.678 11.975 -7.188 727 HB3 GLN 93 HB3 GLN 93 3.846 11.918 -5.439 728 HG2 GLN 93 HG2 GLN 93 4.713 14.131 -7.279 729 HG3 GLN 93 HG3 GLN 93 3.390 14.162 -6.115 730 HE21 GLN 93 HE21 GLN 93 6.885 14.021 -6.457 731 HE22 GLN 93 HE22 GLN 93 7.249 14.651 -4.894 732 H VAL 94 H VAL 94 4.497 9.508 -7.438 733 HA VAL 94 HA VAL 94 4.293 7.872 -5.193 734 HB VAL 94 HB VAL 94 4.730 6.798 -7.993 735 HG11 VAL 94 HG11 VAL 94 4.627 5.278 -5.944 736 HG12 VAL 94 HG12 VAL 94 3.546 4.903 -7.287 737 HG13 VAL 94 HG13 VAL 94 2.922 5.721 -5.851 738 HG21 VAL 94 HG21 VAL 94 2.696 8.599 -7.181 739 HG22 VAL 94 HG22 VAL 94 1.951 7.012 -7.354 740 HG23 VAL 94 HG23 VAL 94 2.836 7.721 -8.707 741 H GLY 95 H GLY 95 6.862 8.185 -7.604 742 HA2 GLY 95 HA2 GLY 95 8.565 6.159 -6.632 743 HA3 GLY 95 HA3 GLY 95 9.064 7.545 -7.590 744 H PHE 96 H PHE 96 8.519 9.679 -6.014 745 HA PHE 96 HA PHE 96 10.642 9.984 -4.330 746 HB2 PHE 96 HB2 PHE 96 9.495 11.969 -4.700 747 HB3 PHE 96 HB3 PHE 96 7.923 11.238 -4.406 748 HD1 PHE 96 HD1 PHE 96 7.219 10.763 -2.033 749 HD2 PHE 96 HD2 PHE 96 10.676 13.056 -2.989 750 HE1 PHE 96 HE1 PHE 96 7.236 11.682 0.245 751 HE2 PHE 96 HE2 PHE 96 10.697 13.977 -0.709 752 HZ PHE 96 HZ PHE 96 8.976 13.291 0.910 753 H TYR 97 H TYR 97 7.416 8.797 -3.471 754 HA TYR 97 HA TYR 97 7.847 8.425 -0.734 755 HB2 TYR 97 HB2 TYR 97 5.972 7.152 -2.708 756 HB3 TYR 97 HB3 TYR 97 5.982 6.654 -1.019 757 HD1 TYR 97 HD1 TYR 97 5.824 8.653 0.702 758 HD2 TYR 97 HD2 TYR 97 4.566 8.863 -3.352 759 HE1 TYR 97 HE1 TYR 97 4.373 10.549 1.257 760 HE2 TYR 97 HE2 TYR 97 3.108 10.762 -2.810 761 HH TYR 97 HH TYR 97 2.998 12.558 -1.037 762 H THR 98 H THR 98 8.193 6.106 -3.442 763 HA THR 98 HA THR 98 9.168 4.053 -1.671 764 HB THR 98 HB THR 98 9.572 2.804 -3.819 765 HG1 THR 98 HG1 THR 98 9.504 3.865 -5.608 766 HG21 THR 98 HG21 THR 98 7.441 2.134 -3.933 767 HG22 THR 98 HG22 THR 98 6.819 3.775 -4.102 768 HG23 THR 98 HG23 THR 98 7.260 3.159 -2.510 769 H GLU 99 H GLU 99 10.758 6.537 -3.593 770 HA GLU 99 HA GLU 99 13.301 5.117 -3.451 771 HB2 GLU 99 HB2 GLU 99 14.178 7.003 -4.828 772 HB3 GLU 99 HB3 GLU 99 12.897 6.063 -5.574 773 HG2 GLU 99 HG2 GLU 99 11.733 7.893 -5.902 774 HG3 GLU 99 HG3 GLU 99 11.693 8.208 -4.173 775 H VAL 100 H VAL 100 11.985 8.214 -2.228 776 HA VAL 100 HA VAL 100 14.459 8.460 -0.655 777 HB VAL 100 HB VAL 100 14.051 10.380 -2.088 778 HG11 VAL 100 HG11 VAL 100 12.125 11.914 -1.457 779 HG12 VAL 100 HG12 VAL 100 11.419 10.511 -0.658 780 HG13 VAL 100 HG13 VAL 100 11.734 10.473 -2.392 781 HG21 VAL 100 HG21 VAL 100 13.966 12.156 -0.254 782 HG22 VAL 100 HG22 VAL 100 15.245 10.946 -0.163 783 HG23 VAL 100 HG23 VAL 100 13.822 10.804 0.869 784 H LEU 101 H LEU 101 10.954 8.565 -0.358 785 HA LEU 101 HA LEU 101 10.892 9.196 2.403 786 HB2 LEU 101 HB2 LEU 101 9.064 9.265 0.490 787 HB3 LEU 101 HB3 LEU 101 8.676 7.677 1.124 788 HG LEU 101 HG LEU 101 7.221 9.292 2.136 789 HD11 LEU 101 HD11 LEU 101 8.164 7.421 3.519 790 HD12 LEU 101 HD12 LEU 101 7.611 8.815 4.447 791 HD13 LEU 101 HD13 LEU 101 9.337 8.567 4.170 792 HD21 LEU 101 HD21 LEU 101 8.960 11.174 1.770 793 HD22 LEU 101 HD22 LEU 101 9.559 10.714 3.363 794 HD23 LEU 101 HD23 LEU 101 7.893 11.260 3.170 795 H PHE 102 H PHE 102 9.934 6.136 0.857 796 HA PHE 102 HA PHE 102 9.718 4.610 3.154 797 HB2 PHE 102 HB2 PHE 102 10.230 3.838 0.299 798 HB3 PHE 102 HB3 PHE 102 9.971 2.662 1.567 799 HD1 PHE 102 HD1 PHE 102 8.137 5.747 1.866 800 HD2 PHE 102 HD2 PHE 102 8.042 1.829 0.193 801 HE1 PHE 102 HE1 PHE 102 5.718 5.949 1.518 802 HE2 PHE 102 HE2 PHE 102 5.614 2.029 -0.144 803 HZ PHE 102 HZ PHE 102 4.452 4.094 0.520 804 HA PRO 103 HA PRO 103 14.454 3.193 1.816 805 HB2 PRO 103 HB2 PRO 103 15.177 6.036 2.409 806 HB3 PRO 103 HB3 PRO 103 16.013 4.853 1.403 807 HG2 PRO 103 HG2 PRO 103 14.462 6.720 0.317 808 HG3 PRO 103 HG3 PRO 103 14.515 5.077 -0.343 809 HD2 PRO 103 HD2 PRO 103 12.365 6.428 1.152 810 HD3 PRO 103 HD3 PRO 103 12.283 5.058 0.048 811 H GLN 104 H GLN 104 13.440 5.582 4.265 812 HA GLN 104 HA GLN 104 15.367 5.053 6.177 813 HB2 GLN 104 HB2 GLN 104 12.731 5.398 7.381 814 HB3 GLN 104 HB3 GLN 104 14.203 6.325 7.601 815 HG2 GLN 104 HG2 GLN 104 13.710 7.390 5.362 816 HG3 GLN 104 HG3 GLN 104 12.137 6.630 5.469 817 HE21 GLN 104 HE21 GLN 104 10.770 7.213 7.281 818 HE22 GLN 104 HE22 GLN 104 10.927 8.775 7.994 819 H LYS 105 H LYS 105 12.777 3.001 5.164 820 HA LYS 105 HA LYS 105 13.419 1.139 7.352 821 HB2 LYS 105 HB2 LYS 105 10.796 0.994 5.937 822 HB3 LYS 105 HB3 LYS 105 11.211 0.513 7.573 823 HG2 LYS 105 HG2 LYS 105 10.057 2.364 8.107 824 HG3 LYS 105 HG3 LYS 105 11.594 3.159 7.776 825 HD2 LYS 105 HD2 LYS 105 10.283 2.900 5.301 826 HD3 LYS 105 HD3 LYS 105 9.068 3.462 6.451 827 HE2 LYS 105 HE2 LYS 105 10.920 5.129 7.178 828 HE3 LYS 105 HE3 LYS 105 11.625 4.758 5.607 829 HZ1 LYS 105 HZ1 LYS 105 9.018 6.011 6.196 830 HZ2 LYS 105 HZ2 LYS 105 9.364 5.343 4.684 831 HZ3 LYS 105 HZ3 LYS 105 10.290 6.625 5.269 832 H ASN 106 H ASN 106 14.070 1.519 4.183 833 HA ASN 106 HA ASN 106 14.510 0.145 2.417 834 HB2 ASN 106 HB2 ASN 106 16.060 -0.814 4.054 835 HB3 ASN 106 HB3 ASN 106 14.806 -1.911 4.622 836 HD21 ASN 106 HD21 ASN 106 16.711 -0.994 1.811 837 HD22 ASN 106 HD22 ASN 106 16.720 -2.556 1.087 838 H VAL 107 H VAL 107 12.280 0.509 1.859 839 HA VAL 107 HA VAL 107 10.298 -1.473 2.440 840 HB VAL 107 HB VAL 107 9.977 1.040 2.086 841 HG11 VAL 107 HG11 VAL 107 9.847 1.883 -0.035 842 HG12 VAL 107 HG12 VAL 107 9.258 0.368 -0.708 843 HG13 VAL 107 HG13 VAL 107 10.973 0.575 -0.369 844 HG21 VAL 107 HG21 VAL 107 8.091 -0.970 0.875 845 HG22 VAL 107 HG22 VAL 107 7.658 0.635 1.458 846 HG23 VAL 107 HG23 VAL 107 8.225 -0.589 2.590 847 H ARG 108 H ARG 108 9.164 -2.720 1.075 848 HA ARG 108 HA ARG 108 10.293 -3.299 -1.568 849 HB2 ARG 108 HB2 ARG 108 10.196 -5.075 0.593 850 HB3 ARG 108 HB3 ARG 108 8.802 -5.510 -0.382 851 HG2 ARG 108 HG2 ARG 108 10.350 -6.846 -1.352 852 HG3 ARG 108 HG3 ARG 108 10.588 -5.399 -2.330 853 HD2 ARG 108 HD2 ARG 108 12.752 -5.999 -1.745 854 HD3 ARG 108 HD3 ARG 108 12.346 -4.758 -0.562 855 HE ARG 108 HE ARG 108 11.652 -7.165 0.589 856 HH11 ARG 108 HH11 ARG 108 14.584 -5.677 -0.606 857 HH12 ARG 108 HH12 ARG 108 15.613 -6.546 0.481 858 HH21 ARG 108 HH21 ARG 108 13.007 -8.303 2.018 859 HH22 ARG 108 HH22 ARG 108 14.718 -8.041 1.970 860 H PHE 109 H PHE 109 8.865 -2.002 -2.661 861 HA PHE 109 HA PHE 109 6.080 -1.985 -1.996 862 HB2 PHE 109 HB2 PHE 109 7.630 -0.135 -3.112 863 HB3 PHE 109 HB3 PHE 109 7.015 -0.864 -4.583 864 HD1 PHE 109 HD1 PHE 109 4.498 -1.013 -4.890 865 HD2 PHE 109 HD2 PHE 109 6.347 1.354 -1.883 866 HE1 PHE 109 HE1 PHE 109 2.435 0.300 -4.678 867 HE2 PHE 109 HE2 PHE 109 4.292 2.682 -1.648 868 HZ PHE 109 HZ PHE 109 2.323 2.151 -3.045 869 H LEU 110 H LEU 110 4.339 -2.679 -3.300 870 HA LEU 110 HA LEU 110 4.995 -4.483 -5.506 871 HB2 LEU 110 HB2 LEU 110 4.804 -6.022 -3.785 872 HB3 LEU 110 HB3 LEU 110 3.490 -5.170 -3.008 873 HG LEU 110 HG LEU 110 2.946 -7.393 -4.120 874 HD11 LEU 110 HD11 LEU 110 1.410 -5.270 -3.625 875 HD12 LEU 110 HD12 LEU 110 0.803 -6.762 -4.338 876 HD13 LEU 110 HD13 LEU 110 1.189 -5.386 -5.370 877 HD21 LEU 110 HD21 LEU 110 4.180 -6.179 -6.319 878 HD22 LEU 110 HD22 LEU 110 2.463 -6.253 -6.714 879 HD23 LEU 110 HD23 LEU 110 3.331 -7.724 -6.278 880 H ALA 111 H ALA 111 3.817 -4.215 -7.189 881 HA ALA 111 HA ALA 111 1.141 -2.968 -7.031 882 HB1 ALA 111 HB1 ALA 111 1.650 -1.933 -9.259 883 HB2 ALA 111 HB2 ALA 111 3.327 -2.437 -9.055 884 HB3 ALA 111 HB3 ALA 111 2.609 -1.284 -7.926 885 H ILE 112 H ILE 112 -0.081 -4.727 -7.290 886 HA ILE 112 HA ILE 112 0.760 -6.975 -8.779 887 HB ILE 112 HB ILE 112 -1.875 -6.255 -7.553 888 HG12 ILE 112 HG12 ILE 112 -0.197 -8.606 -6.831 889 HG13 ILE 112 HG13 ILE 112 0.394 -7.014 -6.385 890 HG21 ILE 112 HG21 ILE 112 -2.383 -7.628 -9.493 891 HG22 ILE 112 HG22 ILE 112 -2.614 -8.550 -8.009 892 HG23 ILE 112 HG23 ILE 112 -1.174 -8.810 -8.993 893 HD11 ILE 112 HD11 ILE 112 -1.964 -6.702 -5.375 894 HD12 ILE 112 HD12 ILE 112 -0.759 -7.659 -4.512 895 HD13 ILE 112 HD13 ILE 112 -2.024 -8.464 -5.437 896 H ASN 113 H ASN 113 -1.589 -4.424 -9.689 897 HA ASN 113 HA ASN 113 -2.155 -5.782 -12.179 898 HB2 ASN 113 HB2 ASN 113 -3.571 -4.024 -10.611 899 HB3 ASN 113 HB3 ASN 113 -3.095 -3.022 -11.976 900 HD21 ASN 113 HD21 ASN 113 -3.203 -4.677 -14.092 901 HD22 ASN 113 HD22 ASN 113 -4.803 -5.290 -14.308 902 H ASN 114 H ASN 114 0.643 -4.857 -11.809 903 HA ASN 114 HA ASN 114 1.314 -4.128 -14.350 904 HB2 ASN 114 HB2 ASN 114 0.122 -1.890 -13.091 905 HB3 ASN 114 HB3 ASN 114 1.844 -1.564 -13.210 906 HD21 ASN 114 HD21 ASN 114 2.820 -1.408 -15.228 907 HD22 ASN 114 HD22 ASN 114 1.901 -1.201 -16.675 908 H SER 115 H SER 115 3.549 -3.352 -14.607 909 HA SER 115 HA SER 115 5.276 -4.571 -12.701 910 HB2 SER 115 HB2 SER 115 7.088 -3.450 -14.152 911 HB3 SER 115 HB3 SER 115 6.049 -4.639 -14.933 912 HG SER 115 HG SER 115 6.222 -1.901 -15.316 913 H ILE 116 H ILE 116 5.556 -3.687 -10.743 914 HA ILE 116 HA ILE 116 5.143 -1.034 -10.047 915 HB ILE 116 HB ILE 116 5.614 -3.272 -8.620 916 HG12 ILE 116 HG12 ILE 116 4.460 -1.146 -7.948 917 HG13 ILE 116 HG13 ILE 116 5.380 -1.915 -6.662 918 HG21 ILE 116 HG21 ILE 116 8.119 -1.625 -8.347 919 HG22 ILE 116 HG22 ILE 116 8.002 -3.279 -8.952 920 HG23 ILE 116 HG23 ILE 116 7.635 -2.925 -7.260 921 HD11 ILE 116 HD11 ILE 116 5.849 0.647 -8.070 922 HD12 ILE 116 HD12 ILE 116 7.254 -0.258 -7.508 923 HD13 ILE 116 HD13 ILE 116 6.011 0.243 -6.362 924 H ASP 117 H ASP 117 8.149 -2.605 -11.075 925 HA ASP 117 HA ASP 117 9.236 -0.089 -11.915 926 HB2 ASP 117 HB2 ASP 117 9.750 -0.817 -9.257 927 HB3 ASP 117 HB3 ASP 117 11.225 -1.211 -10.134 928 H SER 118 H SER 118 10.441 -3.288 -10.842 929 HA SER 118 HA SER 118 11.472 -4.979 -11.959 930 HB2 SER 118 HB2 SER 118 9.758 -4.235 -13.791 931 HB3 SER 118 HB3 SER 118 11.185 -3.576 -14.594 932 HG SER 118 HG SER 118 10.410 -6.193 -14.236 933 H ASN 119 H ASN 119 13.239 -4.933 -14.152 934 HA ASN 119 HA ASN 119 15.584 -3.977 -12.938 935 HB2 ASN 119 HB2 ASN 119 14.873 -5.335 -15.446 936 HB3 ASN 119 HB3 ASN 119 16.337 -4.354 -15.532 937 HD21 ASN 119 HD21 ASN 119 14.728 -6.659 -13.398 938 HD22 ASN 119 HD22 ASN 119 16.154 -7.512 -12.969 939 H ASN 120 H ASN 120 17.149 -2.768 -14.682 940 HA ASN 120 HA ASN 120 17.763 -0.838 -15.685 941 HB2 ASN 120 HB2 ASN 120 15.888 -1.213 -17.220 942 HB3 ASN 120 HB3 ASN 120 14.813 -0.399 -16.096 943 HD21 ASN 120 HD21 ASN 120 16.931 -0.035 -18.697 944 HD22 ASN 120 HD22 ASN 120 16.969 1.691 -18.743 Start of MODEL 5 1 H1 GLY 1 H1 GLY 1 14.274 0.219 22.787 2 H2 GLY 1 H2 GLY 1 15.429 0.724 23.913 3 H3 GLY 1 H3 GLY 1 14.141 1.741 23.511 4 HA2 GLY 1 HA2 GLY 1 13.969 0.550 25.709 5 HA3 GLY 1 HA3 GLY 1 12.580 0.458 24.636 6 H SER 2 H SER 2 12.781 -1.470 23.019 7 HA SER 2 HA SER 2 14.180 -3.793 23.887 8 HB2 SER 2 HB2 SER 2 11.791 -3.283 25.266 9 HB3 SER 2 HB3 SER 2 11.390 -4.538 24.094 10 HG SER 2 HG SER 2 12.383 -5.071 26.304 11 H ARG 3 H ARG 3 13.438 -5.777 22.631 12 HA ARG 3 HA ARG 3 13.239 -5.088 19.880 13 HB2 ARG 3 HB2 ARG 3 13.708 -7.489 21.442 14 HB3 ARG 3 HB3 ARG 3 12.687 -7.807 20.046 15 HG2 ARG 3 HG2 ARG 3 15.086 -8.134 19.591 16 HG3 ARG 3 HG3 ARG 3 14.349 -6.905 18.562 17 HD2 ARG 3 HD2 ARG 3 15.286 -5.143 19.884 18 HD3 ARG 3 HD3 ARG 3 15.869 -6.290 21.087 19 HE ARG 3 HE ARG 3 17.169 -5.548 18.669 20 HH11 ARG 3 HH11 ARG 3 16.706 -8.259 20.839 21 HH12 ARG 3 HH12 ARG 3 18.200 -9.016 20.406 22 HH21 ARG 3 HH21 ARG 3 19.133 -6.554 18.103 23 HH22 ARG 3 HH22 ARG 3 19.578 -8.050 18.853 24 H THR 4 H THR 4 11.498 -4.652 18.726 25 HA THR 4 HA THR 4 8.920 -5.800 19.564 26 HB THR 4 HB THR 4 7.799 -3.732 19.056 27 HG1 THR 4 HG1 THR 4 10.341 -2.868 18.160 28 HG21 THR 4 HG21 THR 4 10.256 -3.090 20.667 29 HG22 THR 4 HG22 THR 4 8.784 -3.837 21.288 30 HG23 THR 4 HG23 THR 4 8.739 -2.190 20.662 31 H SER 5 H SER 5 7.237 -5.609 17.804 32 HA SER 5 HA SER 5 8.409 -6.495 15.258 33 HB2 SER 5 HB2 SER 5 5.914 -7.270 14.951 34 HB3 SER 5 HB3 SER 5 7.022 -8.211 15.947 35 HG SER 5 HG SER 5 4.845 -7.618 16.829 36 H ARG 6 H ARG 6 8.452 -5.048 13.662 37 HA ARG 6 HA ARG 6 6.872 -2.663 13.713 38 HB2 ARG 6 HB2 ARG 6 8.059 -1.977 11.825 39 HB3 ARG 6 HB3 ARG 6 9.209 -3.000 12.667 40 HG2 ARG 6 HG2 ARG 6 7.506 -3.995 10.410 41 HG3 ARG 6 HG3 ARG 6 9.076 -3.249 10.164 42 HD2 ARG 6 HD2 ARG 6 9.799 -5.379 10.299 43 HD3 ARG 6 HD3 ARG 6 9.744 -5.050 12.029 44 HE ARG 6 HE ARG 6 7.286 -6.004 11.579 45 HH11 ARG 6 HH11 ARG 6 10.424 -7.209 10.598 46 HH12 ARG 6 HH12 ARG 6 9.928 -8.865 10.610 47 HH21 ARG 6 HH21 ARG 6 6.645 -8.195 11.593 48 HH22 ARG 6 HH22 ARG 6 7.787 -9.424 11.178 49 H ILE 7 H ILE 7 6.204 -2.682 10.753 50 HA ILE 7 HA ILE 7 4.195 -4.798 10.704 51 HB ILE 7 HB ILE 7 2.339 -3.476 10.501 52 HG12 ILE 7 HG12 ILE 7 3.240 -0.764 10.590 53 HG13 ILE 7 HG13 ILE 7 4.058 -1.587 9.268 54 HG21 ILE 7 HG21 ILE 7 3.997 -1.949 12.483 55 HG22 ILE 7 HG22 ILE 7 3.242 -3.513 12.791 56 HG23 ILE 7 HG23 ILE 7 2.241 -2.100 12.465 57 HD11 ILE 7 HD11 ILE 7 2.241 -1.430 8.012 58 HD12 ILE 7 HD12 ILE 7 1.457 -0.523 9.303 59 HD13 ILE 7 HD13 ILE 7 1.284 -2.275 9.228 60 H THR 8 H THR 8 2.819 -4.690 8.710 61 HA THR 8 HA THR 8 4.436 -3.997 6.342 62 HB THR 8 HB THR 8 2.706 -6.379 6.976 63 HG1 THR 8 HG1 THR 8 5.261 -6.011 5.802 64 HG21 THR 8 HG21 THR 8 2.814 -7.052 4.598 65 HG22 THR 8 HG22 THR 8 3.364 -5.425 4.196 66 HG23 THR 8 HG23 THR 8 1.761 -5.669 4.892 67 H ALA 9 H ALA 9 3.259 -2.993 4.571 68 HA ALA 9 HA ALA 9 0.680 -1.940 5.503 69 HB1 ALA 9 HB1 ALA 9 2.772 -0.795 3.713 70 HB2 ALA 9 HB2 ALA 9 2.033 -0.109 5.161 71 HB3 ALA 9 HB3 ALA 9 1.114 -0.198 3.659 72 H LEU 10 H LEU 10 -1.122 -2.381 4.570 73 HA LEU 10 HA LEU 10 -1.145 -3.424 1.815 74 HB2 LEU 10 HB2 LEU 10 -1.641 -5.026 3.814 75 HB3 LEU 10 HB3 LEU 10 -3.173 -4.190 3.889 76 HG LEU 10 HG LEU 10 -2.465 -5.181 1.221 77 HD11 LEU 10 HD11 LEU 10 -3.172 -7.156 3.381 78 HD12 LEU 10 HD12 LEU 10 -1.537 -6.932 2.761 79 HD13 LEU 10 HD13 LEU 10 -2.819 -7.490 1.687 80 HD21 LEU 10 HD21 LEU 10 -4.693 -4.257 2.459 81 HD22 LEU 10 HD22 LEU 10 -4.925 -6.001 2.586 82 HD23 LEU 10 HD23 LEU 10 -4.703 -5.259 1.010 83 H TYR 11 H TYR 11 -1.815 -1.589 0.748 84 HA TYR 11 HA TYR 11 -4.234 -0.287 1.796 85 HB2 TYR 11 HB2 TYR 11 -2.474 1.266 1.995 86 HB3 TYR 11 HB3 TYR 11 -1.848 0.904 0.405 87 HD1 TYR 11 HD1 TYR 11 -3.200 1.674 -1.619 88 HD2 TYR 11 HD2 TYR 11 -4.033 2.969 2.348 89 HE1 TYR 11 HE1 TYR 11 -4.438 3.602 -2.511 90 HE2 TYR 11 HE2 TYR 11 -5.270 4.900 1.465 91 HH TYR 11 HH TYR 11 -6.451 5.155 -1.441 92 H GLU 12 H GLU 12 -6.044 -0.471 0.593 93 HA GLU 12 HA GLU 12 -5.812 -0.677 -2.324 94 HB2 GLU 12 HB2 GLU 12 -5.885 -2.965 -0.871 95 HB3 GLU 12 HB3 GLU 12 -7.599 -2.699 -1.150 96 HG2 GLU 12 HG2 GLU 12 -5.499 -2.809 -3.306 97 HG3 GLU 12 HG3 GLU 12 -6.547 -4.147 -2.840 98 H ARG 13 H ARG 13 -7.622 -0.141 -3.498 99 HA ARG 13 HA ARG 13 -9.984 0.782 -2.004 100 HB2 ARG 13 HB2 ARG 13 -9.778 2.833 -2.851 101 HB3 ARG 13 HB3 ARG 13 -8.194 2.366 -3.445 102 HG2 ARG 13 HG2 ARG 13 -9.121 1.787 -5.586 103 HG3 ARG 13 HG3 ARG 13 -10.758 2.081 -4.996 104 HD2 ARG 13 HD2 ARG 13 -9.409 3.914 -6.358 105 HD3 ARG 13 HD3 ARG 13 -10.530 4.345 -5.071 106 HE ARG 13 HE ARG 13 -8.767 5.187 -3.907 107 HH11 ARG 13 HH11 ARG 13 -7.506 2.821 -6.150 108 HH12 ARG 13 HH12 ARG 13 -5.867 3.235 -5.868 109 HH21 ARG 13 HH21 ARG 13 -6.590 5.656 -3.442 110 HH22 ARG 13 HH22 ARG 13 -5.334 4.814 -4.275 111 H LEU 14 H LEU 14 -11.986 0.237 -2.816 112 HA LEU 14 HA LEU 14 -12.016 -1.405 -5.244 113 HB2 LEU 14 HB2 LEU 14 -13.154 -2.933 -4.096 114 HB3 LEU 14 HB3 LEU 14 -13.010 -1.955 -2.658 115 HG LEU 14 HG LEU 14 -15.301 -2.613 -2.950 116 HD11 LEU 14 HD11 LEU 14 -15.743 0.109 -3.833 117 HD12 LEU 14 HD12 LEU 14 -14.485 -0.015 -2.603 118 HD13 LEU 14 HD13 LEU 14 -16.096 -0.658 -2.286 119 HD21 LEU 14 HD21 LEU 14 -16.467 -1.556 -5.056 120 HD22 LEU 14 HD22 LEU 14 -15.707 -3.142 -5.115 121 HD23 LEU 14 HD23 LEU 14 -14.858 -1.740 -5.746 122 H SER 15 H SER 15 -13.386 -0.903 -6.879 123 HA SER 15 HA SER 15 -14.107 1.814 -7.165 124 HB2 SER 15 HB2 SER 15 -13.366 0.494 -9.064 125 HB3 SER 15 HB3 SER 15 -14.800 -0.525 -8.939 126 HG SER 15 HG SER 15 -14.934 1.204 -10.517 127 H ARG 16 H ARG 16 -16.030 2.849 -7.459 128 HA ARG 16 HA ARG 16 -18.239 1.846 -5.915 129 HB2 ARG 16 HB2 ARG 16 -17.256 4.388 -6.684 130 HB3 ARG 16 HB3 ARG 16 -18.912 4.263 -7.252 131 HG2 ARG 16 HG2 ARG 16 -18.397 3.393 -4.478 132 HG3 ARG 16 HG3 ARG 16 -18.260 5.119 -4.812 133 HD2 ARG 16 HD2 ARG 16 -20.562 4.610 -6.079 134 HD3 ARG 16 HD3 ARG 16 -20.633 3.351 -4.848 135 HE ARG 16 HE ARG 16 -20.007 5.596 -3.448 136 HH11 ARG 16 HH11 ARG 16 -22.581 4.774 -5.672 137 HH12 ARG 16 HH12 ARG 16 -23.725 5.842 -4.936 138 HH21 ARG 16 HH21 ARG 16 -21.521 7.002 -2.483 139 HH22 ARG 16 HH22 ARG 16 -23.124 7.107 -3.126 140 H ASP 17 H ASP 17 -17.459 1.794 -9.289 141 HA ASP 17 HA ASP 17 -20.265 1.679 -10.070 142 HB2 ASP 17 HB2 ASP 17 -18.828 0.990 -12.335 143 HB3 ASP 17 HB3 ASP 17 -19.425 2.593 -11.934 144 H ASP 18 H ASP 18 -17.687 -0.502 -9.333 145 HA ASP 18 HA ASP 18 -17.409 -2.727 -9.658 146 HB2 ASP 18 HB2 ASP 18 -20.014 -2.356 -8.242 147 HB3 ASP 18 HB3 ASP 18 -19.328 -3.956 -8.483 148 H ASP 19 H ASP 19 -17.865 -2.112 -12.144 149 HA ASP 19 HA ASP 19 -20.124 -3.570 -13.216 150 HB2 ASP 19 HB2 ASP 19 -19.279 -1.432 -14.251 151 HB3 ASP 19 HB3 ASP 19 -17.849 -2.323 -14.746 152 H LEU 20 H LEU 20 -17.723 -4.731 -11.710 153 HA LEU 20 HA LEU 20 -16.717 -6.640 -13.665 154 HB2 LEU 20 HB2 LEU 20 -15.340 -7.138 -11.335 155 HB3 LEU 20 HB3 LEU 20 -14.772 -6.167 -12.671 156 HG LEU 20 HG LEU 20 -14.383 -5.023 -10.555 157 HD11 LEU 20 HD11 LEU 20 -14.649 -3.129 -11.614 158 HD12 LEU 20 HD12 LEU 20 -16.375 -3.159 -11.270 159 HD13 LEU 20 HD13 LEU 20 -15.758 -3.906 -12.741 160 HD21 LEU 20 HD21 LEU 20 -17.199 -4.515 -9.947 161 HD22 LEU 20 HD22 LEU 20 -15.838 -4.821 -8.877 162 HD23 LEU 20 HD23 LEU 20 -16.657 -6.163 -9.669 163 H THR 21 H THR 21 -18.366 -6.437 -10.545 164 HA THR 21 HA THR 21 -19.502 -7.901 -9.266 165 HB THR 21 HB THR 21 -20.990 -9.467 -10.410 166 HG1 THR 21 HG1 THR 21 -20.766 -9.972 -12.482 167 HG21 THR 21 HG21 THR 21 -20.926 -6.693 -10.819 168 HG22 THR 21 HG22 THR 21 -22.309 -7.782 -10.908 169 HG23 THR 21 HG23 THR 21 -21.370 -7.430 -12.357 170 H GLY 22 H GLY 22 -18.600 -9.195 -7.867 171 HA2 GLY 22 HA2 GLY 22 -18.152 -11.768 -7.799 172 HA3 GLY 22 HA3 GLY 22 -16.775 -11.296 -8.781 173 H GLU 23 H GLU 23 -14.953 -10.993 -7.721 174 HA GLU 23 HA GLU 23 -14.956 -10.726 -4.819 175 HB2 GLU 23 HB2 GLU 23 -13.500 -12.402 -5.711 176 HB3 GLU 23 HB3 GLU 23 -12.791 -11.272 -6.850 177 HG2 GLU 23 HG2 GLU 23 -11.635 -10.128 -5.118 178 HG3 GLU 23 HG3 GLU 23 -12.516 -11.007 -3.869 179 H SER 24 H SER 24 -14.565 -8.686 -7.562 180 HA SER 24 HA SER 24 -12.960 -6.733 -6.140 181 HB2 SER 24 HB2 SER 24 -13.785 -5.580 -8.547 182 HB3 SER 24 HB3 SER 24 -12.239 -6.357 -8.219 183 HG SER 24 HG SER 24 -14.479 -7.333 -9.562 184 H ASN 25 H ASN 25 -16.138 -7.360 -5.804 185 HA ASN 25 HA ASN 25 -16.811 -4.512 -5.694 186 HB2 ASN 25 HB2 ASN 25 -18.946 -4.886 -6.452 187 HB3 ASN 25 HB3 ASN 25 -18.049 -6.094 -7.351 188 HD21 ASN 25 HD21 ASN 25 -17.894 -8.258 -6.042 189 HD22 ASN 25 HD22 ASN 25 -19.397 -8.811 -5.404 190 H SER 26 H SER 26 -16.134 -4.149 -3.626 191 HA SER 26 HA SER 26 -17.942 -4.165 -1.625 192 HB2 SER 26 HB2 SER 26 -16.798 -6.795 -1.839 193 HB3 SER 26 HB3 SER 26 -16.396 -6.088 -0.276 194 HG SER 26 HG SER 26 -18.340 -6.882 0.129 195 H ILE 27 H ILE 27 -14.735 -5.363 -0.900 196 HA ILE 27 HA ILE 27 -13.119 -3.245 -0.809 197 HB ILE 27 HB ILE 27 -15.163 -2.881 1.296 198 HG12 ILE 27 HG12 ILE 27 -14.658 -1.343 -0.677 199 HG13 ILE 27 HG13 ILE 27 -14.777 -0.574 0.898 200 HG21 ILE 27 HG21 ILE 27 -13.431 -1.669 2.740 201 HG22 ILE 27 HG22 ILE 27 -12.234 -2.660 1.906 202 HG23 ILE 27 HG23 ILE 27 -13.510 -3.427 2.850 203 HD11 ILE 27 HD11 ILE 27 -12.351 -0.457 1.030 204 HD12 ILE 27 HD12 ILE 27 -12.949 0.330 -0.433 205 HD13 ILE 27 HD13 ILE 27 -12.218 -1.274 -0.528 206 H THR 28 H THR 28 -14.387 -5.461 1.688 207 HA THR 28 HA THR 28 -11.850 -6.157 2.744 208 HB THR 28 HB THR 28 -14.516 -6.641 3.407 209 HG1 THR 28 HG1 THR 28 -12.069 -7.476 4.542 210 HG21 THR 28 HG21 THR 28 -13.103 -9.273 3.084 211 HG22 THR 28 HG22 THR 28 -14.499 -8.737 2.151 212 HG23 THR 28 HG23 THR 28 -14.650 -9.002 3.888 213 H ASN 29 H ASN 29 -13.601 -7.252 -0.057 214 HA ASN 29 HA ASN 29 -12.418 -9.797 -0.338 215 HB2 ASN 29 HB2 ASN 29 -13.473 -7.974 -2.511 216 HB3 ASN 29 HB3 ASN 29 -13.162 -9.695 -2.663 217 HD21 ASN 29 HD21 ASN 29 -14.811 -11.009 -2.346 218 HD22 ASN 29 HD22 ASN 29 -16.270 -10.614 -1.511 219 H GLN 30 H GLN 30 -11.593 -6.702 -2.009 220 HA GLN 30 HA GLN 30 -9.212 -7.760 -3.139 221 HB2 GLN 30 HB2 GLN 30 -9.099 -4.883 -2.569 222 HB3 GLN 30 HB3 GLN 30 -8.858 -5.740 -4.078 223 HG2 GLN 30 HG2 GLN 30 -10.709 -4.479 -4.542 224 HG3 GLN 30 HG3 GLN 30 -11.441 -6.003 -4.036 225 HE21 GLN 30 HE21 GLN 30 -10.054 -3.257 -2.266 226 HE22 GLN 30 HE22 GLN 30 -11.416 -3.004 -1.250 227 H LYS 31 H LYS 31 -9.992 -6.380 -0.014 228 HA LYS 31 HA LYS 31 -7.432 -5.812 0.947 229 HB2 LYS 31 HB2 LYS 31 -9.880 -6.893 2.355 230 HB3 LYS 31 HB3 LYS 31 -8.418 -6.416 3.203 231 HG2 LYS 31 HG2 LYS 31 -9.271 -4.311 1.445 232 HG3 LYS 31 HG3 LYS 31 -10.588 -4.806 2.514 233 HD2 LYS 31 HD2 LYS 31 -8.591 -4.763 4.280 234 HD3 LYS 31 HD3 LYS 31 -7.991 -3.544 3.155 235 HE2 LYS 31 HE2 LYS 31 -10.039 -2.277 3.400 236 HE3 LYS 31 HE3 LYS 31 -10.721 -3.537 4.427 237 HZ1 LYS 31 HZ1 LYS 31 -9.917 -1.775 5.796 238 HZ2 LYS 31 HZ2 LYS 31 -8.397 -1.808 5.060 239 HZ3 LYS 31 HZ3 LYS 31 -8.904 -3.109 6.014 240 H LYS 32 H LYS 32 -9.292 -8.831 0.918 241 HA LYS 32 HA LYS 32 -7.334 -10.496 2.081 242 HB2 LYS 32 HB2 LYS 32 -9.917 -10.802 0.826 243 HB3 LYS 32 HB3 LYS 32 -8.823 -12.080 0.318 244 HG2 LYS 32 HG2 LYS 32 -9.076 -13.128 2.247 245 HG3 LYS 32 HG3 LYS 32 -8.578 -11.692 3.138 246 HD2 LYS 32 HD2 LYS 32 -10.886 -12.634 3.658 247 HD3 LYS 32 HD3 LYS 32 -10.781 -10.906 3.326 248 HE2 LYS 32 HE2 LYS 32 -12.698 -11.891 2.199 249 HE3 LYS 32 HE3 LYS 32 -11.521 -11.296 1.032 250 HZ1 LYS 32 HZ1 LYS 32 -10.681 -13.724 1.076 251 HZ2 LYS 32 HZ2 LYS 32 -12.075 -13.355 0.195 252 HZ3 LYS 32 HZ3 LYS 32 -12.206 -14.077 1.716 253 H TYR 33 H TYR 33 -7.903 -9.396 -1.209 254 HA TYR 33 HA TYR 33 -6.348 -11.161 -2.684 255 HB2 TYR 33 HB2 TYR 33 -7.756 -9.290 -3.612 256 HB3 TYR 33 HB3 TYR 33 -6.509 -8.167 -3.109 257 HD1 TYR 33 HD1 TYR 33 -7.328 -10.864 -5.471 258 HD2 TYR 33 HD2 TYR 33 -4.468 -7.940 -4.312 259 HE1 TYR 33 HE1 TYR 33 -6.125 -11.196 -7.594 260 HE2 TYR 33 HE2 TYR 33 -3.266 -8.249 -6.411 261 HH TYR 33 HH TYR 33 -4.573 -9.986 -9.044 262 H LEU 34 H LEU 34 -5.273 -7.955 -1.528 263 HA LEU 34 HA LEU 34 -2.556 -8.279 -1.991 264 HB2 LEU 34 HB2 LEU 34 -4.107 -6.672 0.019 265 HB3 LEU 34 HB3 LEU 34 -2.362 -6.645 0.006 266 HG LEU 34 HG LEU 34 -2.285 -5.210 -1.716 267 HD11 LEU 34 HD11 LEU 34 -3.577 -5.376 -3.748 268 HD12 LEU 34 HD12 LEU 34 -4.621 -6.590 -3.011 269 HD13 LEU 34 HD13 LEU 34 -2.923 -6.956 -3.318 270 HD21 LEU 34 HD21 LEU 34 -5.225 -5.025 -1.113 271 HD22 LEU 34 HD22 LEU 34 -4.272 -3.808 -1.968 272 HD23 LEU 34 HD23 LEU 34 -3.922 -4.172 -0.275 273 H GLU 35 H GLU 35 -4.581 -9.274 0.721 274 HA GLU 35 HA GLU 35 -2.619 -10.022 2.557 275 HB2 GLU 35 HB2 GLU 35 -5.455 -10.437 2.200 276 HB3 GLU 35 HB3 GLU 35 -4.693 -11.909 2.785 277 HG2 GLU 35 HG2 GLU 35 -3.735 -10.660 4.651 278 HG3 GLU 35 HG3 GLU 35 -4.509 -9.196 4.060 279 H ASP 36 H ASP 36 -4.325 -12.009 0.156 280 HA ASP 36 HA ASP 36 -3.013 -14.418 0.470 281 HB2 ASP 36 HB2 ASP 36 -4.960 -13.491 -1.168 282 HB3 ASP 36 HB3 ASP 36 -3.634 -13.636 -2.311 283 H TYR 37 H TYR 37 -1.954 -11.494 -1.115 284 HA TYR 37 HA TYR 37 0.307 -12.681 -2.428 285 HB2 TYR 37 HB2 TYR 37 -0.517 -10.707 -3.444 286 HB3 TYR 37 HB3 TYR 37 -0.556 -9.840 -1.920 287 HD1 TYR 37 HD1 TYR 37 1.518 -9.003 -0.912 288 HD2 TYR 37 HD2 TYR 37 1.512 -10.863 -4.729 289 HE1 TYR 37 HE1 TYR 37 3.761 -8.109 -1.343 290 HE2 TYR 37 HE2 TYR 37 3.756 -9.966 -5.179 291 HH TYR 37 HH TYR 37 5.800 -9.178 -3.453 292 H ALA 38 H ALA 38 0.002 -10.315 0.204 293 HA ALA 38 HA ALA 38 2.568 -10.176 1.099 294 HB1 ALA 38 HB1 ALA 38 1.674 -9.581 3.293 295 HB2 ALA 38 HB2 ALA 38 0.098 -10.223 2.828 296 HB3 ALA 38 HB3 ALA 38 0.758 -8.816 1.995 297 H ARG 39 H ARG 39 0.261 -12.795 1.741 298 HA ARG 39 HA ARG 39 2.031 -14.104 3.609 299 HB2 ARG 39 HB2 ARG 39 0.456 -16.074 3.294 300 HB3 ARG 39 HB3 ARG 39 -0.232 -14.613 3.979 301 HG2 ARG 39 HG2 ARG 39 -0.671 -14.271 1.298 302 HG3 ARG 39 HG3 ARG 39 -0.876 -16.012 1.518 303 HD2 ARG 39 HD2 ARG 39 -2.133 -14.464 3.637 304 HD3 ARG 39 HD3 ARG 39 -2.780 -14.086 2.047 305 HE ARG 39 HE ARG 39 -2.576 -16.897 2.800 306 HH11 ARG 39 HH11 ARG 39 -4.615 -14.088 2.312 307 HH12 ARG 39 HH12 ARG 39 -6.074 -15.013 2.245 308 HH21 ARG 39 HH21 ARG 39 -4.506 -18.101 2.711 309 HH22 ARG 39 HH22 ARG 39 -6.015 -17.286 2.471 310 H ARG 40 H ARG 40 1.111 -14.595 0.204 311 HA ARG 40 HA ARG 40 2.782 -16.830 -0.248 312 HB2 ARG 40 HB2 ARG 40 2.068 -16.712 -2.400 313 HB3 ARG 40 HB3 ARG 40 0.880 -15.627 -1.708 314 HG2 ARG 40 HG2 ARG 40 2.499 -13.748 -2.307 315 HG3 ARG 40 HG3 ARG 40 3.335 -14.950 -3.289 316 HD2 ARG 40 HD2 ARG 40 1.264 -15.375 -4.525 317 HD3 ARG 40 HD3 ARG 40 0.434 -14.169 -3.545 318 HE ARG 40 HE ARG 40 2.703 -13.028 -4.789 319 HH11 ARG 40 HH11 ARG 40 -0.538 -14.133 -5.517 320 HH12 ARG 40 HH12 ARG 40 -0.738 -13.055 -6.854 321 HH21 ARG 40 HH21 ARG 40 2.430 -11.610 -6.559 322 HH22 ARG 40 HH22 ARG 40 0.946 -11.628 -7.449 323 H ASN 41 H ASN 41 3.471 -13.537 0.260 324 HA ASN 41 HA ASN 41 6.087 -13.660 -1.035 325 HB2 ASN 41 HB2 ASN 41 4.187 -11.561 -0.400 326 HB3 ASN 41 HB3 ASN 41 5.801 -11.149 0.161 327 HD21 ASN 41 HD21 ASN 41 4.203 -12.544 -2.687 328 HD22 ASN 41 HD22 ASN 41 5.163 -11.695 -3.843 329 H GLY 42 H GLY 42 4.617 -13.367 2.150 330 HA2 GLY 42 HA2 GLY 42 5.697 -14.313 4.074 331 HA3 GLY 42 HA3 GLY 42 7.246 -13.937 3.345 332 H PHE 43 H PHE 43 4.375 -11.884 3.904 333 HA PHE 43 HA PHE 43 6.109 -10.052 5.423 334 HB2 PHE 43 HB2 PHE 43 3.582 -9.436 3.881 335 HB3 PHE 43 HB3 PHE 43 4.589 -8.261 4.714 336 HD1 PHE 43 HD1 PHE 43 7.278 -8.982 3.979 337 HD2 PHE 43 HD2 PHE 43 3.736 -9.043 1.647 338 HE1 PHE 43 HE1 PHE 43 8.627 -8.715 1.938 339 HE2 PHE 43 HE2 PHE 43 5.067 -8.791 -0.397 340 HZ PHE 43 HZ PHE 43 7.519 -8.617 -0.259 341 H GLU 44 H GLU 44 5.632 -9.616 7.496 342 HA GLU 44 HA GLU 44 3.286 -10.858 8.679 343 HB2 GLU 44 HB2 GLU 44 5.859 -9.766 9.717 344 HB3 GLU 44 HB3 GLU 44 4.504 -9.999 10.807 345 HG2 GLU 44 HG2 GLU 44 6.199 -11.826 10.643 346 HG3 GLU 44 HG3 GLU 44 4.516 -12.293 10.526 347 H ASN 45 H ASN 45 2.213 -9.748 10.469 348 HA ASN 45 HA ASN 45 1.042 -8.077 11.405 349 HB2 ASN 45 HB2 ASN 45 3.107 -6.367 10.071 350 HB3 ASN 45 HB3 ASN 45 1.813 -5.689 11.049 351 HD21 ASN 45 HD21 ASN 45 4.830 -7.278 11.039 352 HD22 ASN 45 HD22 ASN 45 5.070 -7.333 12.755 353 H ILE 46 H ILE 46 1.666 -7.589 8.012 354 HA ILE 46 HA ILE 46 0.447 -6.312 6.476 355 HB ILE 46 HB ILE 46 -1.098 -8.796 7.125 356 HG12 ILE 46 HG12 ILE 46 1.029 -8.378 5.042 357 HG13 ILE 46 HG13 ILE 46 1.394 -8.947 6.672 358 HG21 ILE 46 HG21 ILE 46 -2.534 -7.685 5.693 359 HG22 ILE 46 HG22 ILE 46 -1.536 -8.593 4.558 360 HG23 ILE 46 HG23 ILE 46 -1.218 -6.881 4.839 361 HD11 ILE 46 HD11 ILE 46 -0.495 -10.327 4.788 362 HD12 ILE 46 HD12 ILE 46 0.085 -10.907 6.348 363 HD13 ILE 46 HD13 ILE 46 1.204 -10.749 4.996 364 H ARG 47 H ARG 47 -0.240 -4.441 7.394 365 HA ARG 47 HA ARG 47 -2.794 -4.350 8.789 366 HB2 ARG 47 HB2 ARG 47 -0.570 -2.856 9.109 367 HB3 ARG 47 HB3 ARG 47 -1.465 -1.831 7.997 368 HG2 ARG 47 HG2 ARG 47 -3.246 -2.729 10.017 369 HG3 ARG 47 HG3 ARG 47 -1.790 -2.103 10.786 370 HD2 ARG 47 HD2 ARG 47 -1.998 -0.026 9.598 371 HD3 ARG 47 HD3 ARG 47 -3.364 -0.651 8.674 372 HE ARG 47 HE ARG 47 -3.419 0.411 11.335 373 HH11 ARG 47 HH11 ARG 47 -5.033 -1.750 9.106 374 HH12 ARG 47 HH12 ARG 47 -6.545 -1.677 9.942 375 HH21 ARG 47 HH21 ARG 47 -5.409 0.497 12.434 376 HH22 ARG 47 HH22 ARG 47 -6.757 -0.409 11.837 377 H HIS 48 H HIS 48 -4.683 -3.678 7.937 378 HA HIS 48 HA HIS 48 -4.637 -3.250 5.063 379 HB2 HIS 48 HB2 HIS 48 -6.859 -4.070 6.921 380 HB3 HIS 48 HB3 HIS 48 -7.127 -3.667 5.228 381 HD1 HIS 48 HD1 HIS 48 -6.824 -5.499 3.599 382 HD2 HIS 48 HD2 HIS 48 -4.972 -6.288 7.219 383 HE1 HIS 48 HE1 HIS 48 -5.971 -7.845 3.400 384 HE2 HIS 48 HE2 HIS 48 -4.979 -8.356 5.671 385 H PHE 49 H PHE 49 -4.709 -1.313 4.293 386 HA PHE 49 HA PHE 49 -6.035 0.818 5.805 387 HB2 PHE 49 HB2 PHE 49 -4.056 1.110 3.525 388 HB3 PHE 49 HB3 PHE 49 -4.676 2.392 4.556 389 HD1 PHE 49 HD1 PHE 49 -4.032 2.490 6.913 390 HD2 PHE 49 HD2 PHE 49 -2.252 -0.292 4.241 391 HE1 PHE 49 HE1 PHE 49 -2.203 2.141 8.509 392 HE2 PHE 49 HE2 PHE 49 -0.411 -0.639 5.839 393 HZ PHE 49 HZ PHE 49 -0.389 0.572 7.973 394 H THR 50 H THR 50 -8.045 0.762 5.271 395 HA THR 50 HA THR 50 -9.050 0.001 2.740 396 HB THR 50 HB THR 50 -10.089 -0.084 5.162 397 HG1 THR 50 HG1 THR 50 -11.630 -0.929 4.045 398 HG21 THR 50 HG21 THR 50 -11.860 1.567 5.462 399 HG22 THR 50 HG22 THR 50 -11.243 2.475 4.083 400 HG23 THR 50 HG23 THR 50 -10.256 2.302 5.536 401 H ASP 51 H ASP 51 -10.351 1.117 1.352 402 HA ASP 51 HA ASP 51 -9.847 3.999 1.226 403 HB2 ASP 51 HB2 ASP 51 -10.015 2.046 -1.074 404 HB3 ASP 51 HB3 ASP 51 -9.831 3.781 -1.242 405 H ASP 52 H ASP 52 -11.614 5.235 1.071 406 HA ASP 52 HA ASP 52 -14.078 4.102 0.013 407 HB2 ASP 52 HB2 ASP 52 -14.181 3.529 2.372 408 HB3 ASP 52 HB3 ASP 52 -13.834 5.195 2.818 409 H GLY 53 H GLY 53 -14.550 5.515 -1.512 410 HA2 GLY 53 HA2 GLY 53 -14.941 7.507 -2.598 411 HA3 GLY 53 HA3 GLY 53 -15.479 8.084 -1.029 412 H PHE 54 H PHE 54 -12.283 7.182 -2.332 413 HA PHE 54 HA PHE 54 -11.042 9.405 -1.026 414 HB2 PHE 54 HB2 PHE 54 -10.064 7.170 -2.781 415 HB3 PHE 54 HB3 PHE 54 -9.021 8.537 -2.425 416 HD1 PHE 54 HD1 PHE 54 -10.187 8.874 0.464 417 HD2 PHE 54 HD2 PHE 54 -8.596 5.559 -1.712 418 HE1 PHE 54 HE1 PHE 54 -9.545 7.790 2.551 419 HE2 PHE 54 HE2 PHE 54 -7.919 4.533 0.414 420 HZ PHE 54 HZ PHE 54 -8.408 5.616 2.543 421 H SER 55 H SER 55 -9.691 10.931 -2.154 422 HA SER 55 HA SER 55 -11.071 12.133 -4.384 423 HB2 SER 55 HB2 SER 55 -8.878 12.949 -2.533 424 HB3 SER 55 HB3 SER 55 -8.972 13.756 -4.098 425 HG SER 55 HG SER 55 -10.402 14.254 -1.946 426 H GLY 56 H GLY 56 -9.666 13.022 -6.251 427 HA2 GLY 56 HA2 GLY 56 -7.897 10.833 -7.152 428 HA3 GLY 56 HA3 GLY 56 -8.935 11.758 -8.221 429 H VAL 57 H VAL 57 -6.852 13.054 -5.654 430 HA VAL 57 HA VAL 57 -5.495 14.621 -7.713 431 HB VAL 57 HB VAL 57 -6.475 15.979 -6.004 432 HG11 VAL 57 HG11 VAL 57 -6.663 15.307 -3.911 433 HG12 VAL 57 HG12 VAL 57 -4.922 15.480 -3.705 434 HG13 VAL 57 HG13 VAL 57 -5.600 13.941 -4.223 435 HG21 VAL 57 HG21 VAL 57 -4.415 17.133 -5.132 436 HG22 VAL 57 HG22 VAL 57 -4.495 16.900 -6.878 437 HG23 VAL 57 HG23 VAL 57 -3.480 15.849 -5.895 438 H ASN 58 H ASN 58 -4.656 12.569 -4.881 439 HA ASN 58 HA ASN 58 -2.499 11.304 -6.038 440 HB2 ASN 58 HB2 ASN 58 -0.662 12.646 -4.646 441 HB3 ASN 58 HB3 ASN 58 -1.062 13.043 -6.303 442 HD21 ASN 58 HD21 ASN 58 -3.079 13.816 -3.490 443 HD22 ASN 58 HD22 ASN 58 -2.885 15.524 -3.618 444 H PHE 59 H PHE 59 -1.579 12.650 -2.965 445 HA PHE 59 HA PHE 59 -2.396 10.124 -1.694 446 HB2 PHE 59 HB2 PHE 59 -0.116 11.818 -0.702 447 HB3 PHE 59 HB3 PHE 59 -0.416 10.109 -0.430 448 HD1 PHE 59 HD1 PHE 59 0.338 12.481 -3.211 449 HD2 PHE 59 HD2 PHE 59 0.836 8.565 -1.627 450 HE1 PHE 59 HE1 PHE 59 1.886 11.940 -5.039 451 HE2 PHE 59 HE2 PHE 59 2.389 8.025 -3.450 452 HZ PHE 59 HZ PHE 59 2.914 9.712 -5.161 453 H ASN 60 H ASN 60 -1.753 10.868 0.955 454 HA ASN 60 HA ASN 60 -2.592 11.850 2.814 455 HB2 ASN 60 HB2 ASN 60 -3.333 14.119 0.951 456 HB3 ASN 60 HB3 ASN 60 -3.367 14.192 2.708 457 HD21 ASN 60 HD21 ASN 60 -0.917 12.582 2.988 458 HD22 ASN 60 HD22 ASN 60 0.383 13.623 2.544 459 H ARG 61 H ARG 61 -4.040 10.068 2.715 460 HA ARG 61 HA ARG 61 -6.880 10.872 2.457 461 HB2 ARG 61 HB2 ARG 61 -6.416 8.009 2.188 462 HB3 ARG 61 HB3 ARG 61 -7.352 9.089 1.171 463 HG2 ARG 61 HG2 ARG 61 -4.404 9.232 0.891 464 HG3 ARG 61 HG3 ARG 61 -5.195 7.770 0.314 465 HD2 ARG 61 HD2 ARG 61 -6.382 10.377 -0.459 466 HD3 ARG 61 HD3 ARG 61 -4.866 9.907 -1.223 467 HE ARG 61 HE ARG 61 -6.996 7.932 -1.255 468 HH11 ARG 61 HH11 ARG 61 -5.269 10.425 -2.997 469 HH12 ARG 61 HH12 ARG 61 -5.849 9.914 -4.544 470 HH21 ARG 61 HH21 ARG 61 -7.753 7.266 -3.304 471 HH22 ARG 61 HH22 ARG 61 -7.260 8.132 -4.719 472 HA PRO 62 HA PRO 62 -7.400 9.564 6.665 473 HB2 PRO 62 HB2 PRO 62 -9.540 7.816 6.518 474 HB3 PRO 62 HB3 PRO 62 -9.681 9.576 6.562 475 HG2 PRO 62 HG2 PRO 62 -9.759 7.727 4.225 476 HG3 PRO 62 HG3 PRO 62 -10.740 9.162 4.541 477 HD2 PRO 62 HD2 PRO 62 -8.684 9.251 2.810 478 HD3 PRO 62 HD3 PRO 62 -9.064 10.624 3.872 479 H GLY 63 H GLY 63 -8.282 6.615 4.813 480 HA2 GLY 63 HA2 GLY 63 -7.016 4.793 6.537 481 HA3 GLY 63 HA3 GLY 63 -7.430 4.481 4.857 482 H PHE 64 H PHE 64 -5.888 6.527 3.702 483 HA PHE 64 HA PHE 64 -3.379 5.281 3.369 484 HB2 PHE 64 HB2 PHE 64 -4.480 6.658 1.658 485 HB3 PHE 64 HB3 PHE 64 -4.323 8.074 2.684 486 HD1 PHE 64 HD1 PHE 64 -1.783 8.479 3.473 487 HD2 PHE 64 HD2 PHE 64 -3.020 6.474 -0.059 488 HE1 PHE 64 HE1 PHE 64 0.379 8.997 2.433 489 HE2 PHE 64 HE2 PHE 64 -0.874 6.984 -1.107 490 HZ PHE 64 HZ PHE 64 0.849 8.241 0.140 491 H GLN 65 H GLN 65 -4.446 8.112 5.219 492 HA GLN 65 HA GLN 65 -1.945 9.018 6.067 493 HB2 GLN 65 HB2 GLN 65 -4.737 9.346 7.053 494 HB3 GLN 65 HB3 GLN 65 -3.430 9.793 8.139 495 HG2 GLN 65 HG2 GLN 65 -2.579 11.090 5.995 496 HG3 GLN 65 HG3 GLN 65 -4.292 11.042 5.589 497 HE21 GLN 65 HE21 GLN 65 -1.922 12.736 7.187 498 HE22 GLN 65 HE22 GLN 65 -2.924 13.725 8.185 499 H SER 66 H SER 66 -3.965 6.399 7.165 500 HA SER 66 HA SER 66 -2.534 5.903 9.602 501 HB2 SER 66 HB2 SER 66 -4.872 5.051 9.034 502 HB3 SER 66 HB3 SER 66 -4.092 3.872 7.991 503 HG SER 66 HG SER 66 -3.588 4.174 10.767 504 H LEU 67 H LEU 67 -2.458 4.690 6.283 505 HA LEU 67 HA LEU 67 -0.426 2.798 6.466 506 HB2 LEU 67 HB2 LEU 67 -1.227 2.650 4.355 507 HB3 LEU 67 HB3 LEU 67 -1.844 4.287 4.418 508 HG LEU 67 HG LEU 67 0.451 5.100 3.818 509 HD11 LEU 67 HD11 LEU 67 1.893 3.326 2.741 510 HD12 LEU 67 HD12 LEU 67 0.892 2.142 3.587 511 HD13 LEU 67 HD13 LEU 67 1.830 3.321 4.502 512 HD21 LEU 67 HD21 LEU 67 -1.359 4.837 2.172 513 HD22 LEU 67 HD22 LEU 67 -0.825 3.184 1.872 514 HD23 LEU 67 HD23 LEU 67 0.232 4.539 1.472 515 H ILE 68 H ILE 68 -0.221 6.258 5.623 516 HA ILE 68 HA ILE 68 2.595 6.400 5.540 517 HB ILE 68 HB ILE 68 0.505 8.146 4.973 518 HG12 ILE 68 HG12 ILE 68 2.219 9.595 4.061 519 HG13 ILE 68 HG13 ILE 68 3.444 8.853 5.080 520 HG21 ILE 68 HG21 ILE 68 1.159 10.236 6.175 521 HG22 ILE 68 HG22 ILE 68 2.124 9.241 7.267 522 HG23 ILE 68 HG23 ILE 68 0.376 9.022 7.185 523 HD11 ILE 68 HD11 ILE 68 3.631 8.088 2.797 524 HD12 ILE 68 HD12 ILE 68 1.958 7.521 2.827 525 HD13 ILE 68 HD13 ILE 68 3.171 6.752 3.854 526 H LYS 69 H LYS 69 0.258 6.849 8.165 527 HA LYS 69 HA LYS 69 1.930 7.971 10.087 528 HB2 LYS 69 HB2 LYS 69 -0.537 7.664 10.327 529 HB3 LYS 69 HB3 LYS 69 -0.254 5.954 10.628 530 HG2 LYS 69 HG2 LYS 69 1.428 7.446 12.354 531 HG3 LYS 69 HG3 LYS 69 -0.199 8.112 12.464 532 HD2 LYS 69 HD2 LYS 69 0.428 6.219 14.063 533 HD3 LYS 69 HD3 LYS 69 -1.099 6.080 13.197 534 HE2 LYS 69 HE2 LYS 69 0.938 4.895 11.614 535 HE3 LYS 69 HE3 LYS 69 1.090 4.277 13.254 536 HZ1 LYS 69 HZ1 LYS 69 -1.279 4.150 11.485 537 HZ2 LYS 69 HZ2 LYS 69 -1.353 3.811 13.141 538 HZ3 LYS 69 HZ3 LYS 69 -0.390 2.864 12.129 539 H GLU 70 H GLU 70 1.572 4.631 9.056 540 HA GLU 70 HA GLU 70 3.239 3.556 11.124 541 HB2 GLU 70 HB2 GLU 70 2.436 2.395 8.439 542 HB3 GLU 70 HB3 GLU 70 3.273 1.509 9.706 543 HG2 GLU 70 HG2 GLU 70 0.717 2.824 10.418 544 HG3 GLU 70 HG3 GLU 70 0.644 1.405 9.378 545 H VAL 71 H VAL 71 3.664 4.718 7.819 546 HA VAL 71 HA VAL 71 6.347 3.908 7.471 547 HB VAL 71 HB VAL 71 5.105 6.391 6.263 548 HG11 VAL 71 HG11 VAL 71 7.553 4.825 5.800 549 HG12 VAL 71 HG12 VAL 71 7.231 6.542 5.550 550 HG13 VAL 71 HG13 VAL 71 6.688 5.362 4.358 551 HG21 VAL 71 HG21 VAL 71 3.946 3.966 6.003 552 HG22 VAL 71 HG22 VAL 71 5.105 3.912 4.675 553 HG23 VAL 71 HG23 VAL 71 3.916 5.211 4.756 554 H GLU 72 H GLU 72 4.953 6.978 8.671 555 HA GLU 72 HA GLU 72 7.391 8.336 9.019 556 HB2 GLU 72 HB2 GLU 72 5.973 9.607 10.846 557 HB3 GLU 72 HB3 GLU 72 5.661 9.824 9.133 558 HG2 GLU 72 HG2 GLU 72 3.702 8.622 9.199 559 HG3 GLU 72 HG3 GLU 72 4.163 7.744 10.647 560 H ALA 73 H ALA 73 5.484 6.384 11.275 561 HA ALA 73 HA ALA 73 7.251 6.691 13.484 562 HB1 ALA 73 HB1 ALA 73 5.543 5.719 14.521 563 HB2 ALA 73 HB2 ALA 73 5.822 4.224 13.628 564 HB3 ALA 73 HB3 ALA 73 4.761 5.465 12.961 565 H GLY 74 H GLY 74 7.563 4.998 10.573 566 HA2 GLY 74 HA2 GLY 74 9.196 3.638 9.778 567 HA3 GLY 74 HA3 GLY 74 10.043 3.802 11.302 568 H ASN 75 H ASN 75 6.897 2.474 10.338 569 HA ASN 75 HA ASN 75 7.519 -0.051 11.728 570 HB2 ASN 75 HB2 ASN 75 4.986 1.547 11.396 571 HB3 ASN 75 HB3 ASN 75 4.938 -0.152 11.815 572 HD21 ASN 75 HD21 ASN 75 3.775 1.101 13.627 573 HD22 ASN 75 HD22 ASN 75 4.747 1.476 15.000 574 H VAL 76 H VAL 76 5.804 1.376 8.952 575 HA VAL 76 HA VAL 76 5.053 -1.061 7.760 576 HB VAL 76 HB VAL 76 4.014 1.094 7.188 577 HG11 VAL 76 HG11 VAL 76 6.626 1.966 6.840 578 HG12 VAL 76 HG12 VAL 76 5.137 2.862 6.567 579 HG13 VAL 76 HG13 VAL 76 5.895 1.997 5.235 580 HG21 VAL 76 HG21 VAL 76 3.866 -0.837 5.655 581 HG22 VAL 76 HG22 VAL 76 5.277 -0.227 4.790 582 HG23 VAL 76 HG23 VAL 76 3.783 0.711 4.814 583 H GLU 77 H GLU 77 6.940 -2.390 7.845 584 HA GLU 77 HA GLU 77 9.341 -1.690 6.463 585 HB2 GLU 77 HB2 GLU 77 10.024 -3.987 6.864 586 HB3 GLU 77 HB3 GLU 77 9.331 -3.282 8.317 587 HG2 GLU 77 HG2 GLU 77 7.695 -4.782 8.399 588 HG3 GLU 77 HG3 GLU 77 7.368 -4.649 6.674 589 H THR 78 H THR 78 6.314 -2.633 5.312 590 HA THR 78 HA THR 78 7.376 -3.067 2.643 591 HB THR 78 HB THR 78 5.358 -5.084 3.420 592 HG1 THR 78 HG1 THR 78 6.868 -6.432 4.368 593 HG21 THR 78 HG21 THR 78 5.991 -5.501 1.309 594 HG22 THR 78 HG22 THR 78 7.237 -6.440 2.133 595 HG23 THR 78 HG23 THR 78 7.601 -4.820 1.539 596 H LEU 79 H LEU 79 5.803 -2.872 0.975 597 HA LEU 79 HA LEU 79 3.185 -1.905 1.868 598 HB2 LEU 79 HB2 LEU 79 4.849 -0.066 1.133 599 HB3 LEU 79 HB3 LEU 79 4.558 -0.666 -0.469 600 HG LEU 79 HG LEU 79 2.956 0.921 -0.516 601 HD11 LEU 79 HD11 LEU 79 1.495 -1.062 1.205 602 HD12 LEU 79 HD12 LEU 79 1.634 -1.113 -0.551 603 HD13 LEU 79 HD13 LEU 79 0.755 0.203 0.228 604 HD21 LEU 79 HD21 LEU 79 3.183 2.268 1.250 605 HD22 LEU 79 HD22 LEU 79 3.361 0.927 2.384 606 HD23 LEU 79 HD23 LEU 79 1.753 1.415 1.837 607 H ILE 80 H ILE 80 1.630 -2.990 0.987 608 HA ILE 80 HA ILE 80 2.038 -4.279 -1.628 609 HB ILE 80 HB ILE 80 0.541 -5.259 0.796 610 HG12 ILE 80 HG12 ILE 80 1.931 -7.304 0.375 611 HG13 ILE 80 HG13 ILE 80 2.754 -6.423 -0.907 612 HG21 ILE 80 HG21 ILE 80 -1.000 -5.772 -0.838 613 HG22 ILE 80 HG22 ILE 80 -0.014 -7.230 -0.782 614 HG23 ILE 80 HG23 ILE 80 0.232 -6.046 -2.066 615 HD11 ILE 80 HD11 ILE 80 3.675 -6.594 1.589 616 HD12 ILE 80 HD12 ILE 80 2.703 -5.131 1.741 617 HD13 ILE 80 HD13 ILE 80 3.986 -5.215 0.534 618 H VAL 81 H VAL 81 0.955 -3.164 -3.107 619 HA VAL 81 HA VAL 81 -1.778 -2.227 -2.492 620 HB VAL 81 HB VAL 81 0.095 -0.890 -4.448 621 HG11 VAL 81 HG11 VAL 81 -2.345 0.279 -3.135 622 HG12 VAL 81 HG12 VAL 81 -2.435 -0.644 -4.632 623 HG13 VAL 81 HG13 VAL 81 -1.489 0.840 -4.569 624 HG21 VAL 81 HG21 VAL 81 -0.346 -0.302 -1.523 625 HG22 VAL 81 HG22 VAL 81 0.140 0.967 -2.654 626 HG23 VAL 81 HG23 VAL 81 1.177 -0.442 -2.411 627 H LYS 82 H LYS 82 -3.307 -2.347 -4.197 628 HA LYS 82 HA LYS 82 -3.142 -4.564 -5.904 629 HB2 LYS 82 HB2 LYS 82 -5.078 -2.690 -5.178 630 HB3 LYS 82 HB3 LYS 82 -4.890 -2.456 -6.909 631 HG2 LYS 82 HG2 LYS 82 -5.364 -5.134 -5.638 632 HG3 LYS 82 HG3 LYS 82 -6.651 -4.089 -6.240 633 HD2 LYS 82 HD2 LYS 82 -6.281 -4.717 -8.335 634 HD3 LYS 82 HD3 LYS 82 -4.556 -4.396 -8.198 635 HE2 LYS 82 HE2 LYS 82 -4.076 -6.557 -7.968 636 HE3 LYS 82 HE3 LYS 82 -5.327 -6.777 -6.747 637 HZ1 LYS 82 HZ1 LYS 82 -5.355 -7.490 -9.501 638 HZ2 LYS 82 HZ2 LYS 82 -6.684 -6.519 -9.118 639 HZ3 LYS 82 HZ3 LYS 82 -6.410 -7.951 -8.265 640 H ASP 83 H ASP 83 -2.415 -1.118 -6.411 641 HA ASP 83 HA ASP 83 -0.568 -1.682 -8.478 642 HB2 ASP 83 HB2 ASP 83 -1.955 -0.148 -10.153 643 HB3 ASP 83 HB3 ASP 83 -2.121 -1.897 -10.128 644 H MET 84 H MET 84 0.386 0.275 -9.433 645 HA MET 84 HA MET 84 0.994 2.163 -7.435 646 HB2 MET 84 HB2 MET 84 1.762 1.702 -10.253 647 HB3 MET 84 HB3 MET 84 1.977 3.339 -9.651 648 HG2 MET 84 HG2 MET 84 2.995 1.094 -8.001 649 HG3 MET 84 HG3 MET 84 3.874 1.524 -9.466 650 HE1 MET 84 HE1 MET 84 4.515 2.547 -5.616 651 HE2 MET 84 HE2 MET 84 2.919 1.986 -6.122 652 HE3 MET 84 HE3 MET 84 3.153 3.668 -5.645 653 H SER 85 H SER 85 -1.742 2.075 -9.418 654 HA SER 85 HA SER 85 -1.975 4.883 -9.926 655 HB2 SER 85 HB2 SER 85 -4.055 4.415 -10.870 656 HB3 SER 85 HB3 SER 85 -3.173 2.915 -11.134 657 HG SER 85 HG SER 85 -4.546 1.924 -9.895 658 H ARG 86 H ARG 86 -2.546 2.842 -7.221 659 HA ARG 86 HA ARG 86 -4.545 4.212 -5.856 660 HB2 ARG 86 HB2 ARG 86 -2.315 2.398 -5.057 661 HB3 ARG 86 HB3 ARG 86 -3.142 3.288 -3.790 662 HG2 ARG 86 HG2 ARG 86 -4.078 1.048 -4.088 663 HG3 ARG 86 HG3 ARG 86 -5.257 2.283 -4.435 664 HD2 ARG 86 HD2 ARG 86 -4.624 2.008 -6.865 665 HD3 ARG 86 HD3 ARG 86 -3.757 0.557 -6.371 666 HE ARG 86 HE ARG 86 -5.968 -0.226 -5.494 667 HH11 ARG 86 HH11 ARG 86 -5.814 2.073 -8.142 668 HH12 ARG 86 HH12 ARG 86 -7.373 1.647 -8.754 669 HH21 ARG 86 HH21 ARG 86 -8.024 -0.761 -6.312 670 HH22 ARG 86 HH22 ARG 86 -8.623 0.046 -7.723 671 H LEU 87 H LEU 87 -1.013 4.604 -5.605 672 HA LEU 87 HA LEU 87 -1.309 6.992 -3.985 673 HB2 LEU 87 HB2 LEU 87 1.055 5.527 -5.140 674 HB3 LEU 87 HB3 LEU 87 1.229 7.066 -4.325 675 HG LEU 87 HG LEU 87 -0.023 5.865 -2.360 676 HD11 LEU 87 HD11 LEU 87 -0.613 3.849 -3.539 677 HD12 LEU 87 HD12 LEU 87 0.525 3.468 -2.248 678 HD13 LEU 87 HD13 LEU 87 1.080 3.537 -3.921 679 HD21 LEU 87 HD21 LEU 87 2.219 4.931 -1.603 680 HD22 LEU 87 HD22 LEU 87 2.168 6.644 -2.017 681 HD23 LEU 87 HD23 LEU 87 2.850 5.481 -3.155 682 H GLY 88 H GLY 88 -0.665 6.215 -7.360 683 HA2 GLY 88 HA2 GLY 88 -1.588 8.195 -8.727 684 HA3 GLY 88 HA3 GLY 88 -0.313 9.083 -7.916 685 H ARG 89 H ARG 89 -0.504 8.965 -10.662 686 HA ARG 89 HA ARG 89 1.293 6.966 -11.704 687 HB2 ARG 89 HB2 ARG 89 -0.210 9.287 -12.826 688 HB3 ARG 89 HB3 ARG 89 1.171 8.686 -13.718 689 HG2 ARG 89 HG2 ARG 89 -0.953 7.720 -14.485 690 HG3 ARG 89 HG3 ARG 89 0.187 6.506 -13.906 691 HD2 ARG 89 HD2 ARG 89 -1.717 5.790 -12.880 692 HD3 ARG 89 HD3 ARG 89 -1.078 6.866 -11.644 693 HE ARG 89 HE ARG 89 -3.001 7.954 -13.554 694 HH11 ARG 89 HH11 ARG 89 -2.330 6.837 -10.304 695 HH12 ARG 89 HH12 ARG 89 -3.729 7.590 -9.626 696 HH21 ARG 89 HH21 ARG 89 -4.846 8.939 -12.655 697 HH22 ARG 89 HH22 ARG 89 -5.161 8.782 -10.961 698 H ASN 90 H ASN 90 1.483 10.243 -10.535 699 HA ASN 90 HA ASN 90 3.889 11.070 -11.649 700 HB2 ASN 90 HB2 ASN 90 4.036 12.413 -9.371 701 HB3 ASN 90 HB3 ASN 90 2.833 12.817 -10.588 702 HD21 ASN 90 HD21 ASN 90 3.321 10.913 -7.642 703 HD22 ASN 90 HD22 ASN 90 1.692 11.042 -7.079 704 H TYR 91 H TYR 91 5.393 9.424 -11.687 705 HA TYR 91 HA TYR 91 6.203 7.915 -9.452 706 HB2 TYR 91 HB2 TYR 91 6.565 7.131 -11.689 707 HB3 TYR 91 HB3 TYR 91 7.598 8.503 -12.065 708 HD1 TYR 91 HD1 TYR 91 9.872 8.625 -11.059 709 HD2 TYR 91 HD2 TYR 91 7.398 5.202 -10.588 710 HE1 TYR 91 HE1 TYR 91 11.838 7.304 -10.424 711 HE2 TYR 91 HE2 TYR 91 9.369 3.848 -9.967 712 HH TYR 91 HH TYR 91 12.475 4.788 -10.501 713 H LEU 92 H LEU 92 6.821 11.177 -10.225 714 HA LEU 92 HA LEU 92 9.407 11.457 -9.078 715 HB2 LEU 92 HB2 LEU 92 7.202 13.494 -9.391 716 HB3 LEU 92 HB3 LEU 92 8.852 13.867 -8.937 717 HG LEU 92 HG LEU 92 9.522 12.806 -11.178 718 HD11 LEU 92 HD11 LEU 92 6.555 12.956 -11.429 719 HD12 LEU 92 HD12 LEU 92 7.668 11.694 -11.950 720 HD13 LEU 92 HD13 LEU 92 7.570 13.207 -12.850 721 HD21 LEU 92 HD21 LEU 92 8.210 15.432 -10.718 722 HD22 LEU 92 HD22 LEU 92 8.607 14.978 -12.374 723 HD23 LEU 92 HD23 LEU 92 9.877 15.061 -11.155 724 H GLN 93 H GLN 93 6.139 12.177 -7.865 725 HA GLN 93 HA GLN 93 7.004 12.582 -5.153 726 HB2 GLN 93 HB2 GLN 93 4.355 12.420 -6.557 727 HB3 GLN 93 HB3 GLN 93 4.410 12.339 -4.802 728 HG2 GLN 93 HG2 GLN 93 5.367 14.592 -6.547 729 HG3 GLN 93 HG3 GLN 93 3.960 14.585 -5.489 730 HE21 GLN 93 HE21 GLN 93 7.467 14.563 -5.582 731 HE22 GLN 93 HE22 GLN 93 7.698 15.179 -3.988 732 H VAL 94 H VAL 94 5.241 10.035 -6.903 733 HA VAL 94 HA VAL 94 4.830 8.253 -4.805 734 HB VAL 94 HB VAL 94 5.315 7.711 -7.748 735 HG11 VAL 94 HG11 VAL 94 5.172 5.507 -7.472 736 HG12 VAL 94 HG12 VAL 94 3.885 5.647 -6.271 737 HG13 VAL 94 HG13 VAL 94 5.570 5.810 -5.780 738 HG21 VAL 94 HG21 VAL 94 2.828 7.903 -6.046 739 HG22 VAL 94 HG22 VAL 94 2.846 7.281 -7.698 740 HG23 VAL 94 HG23 VAL 94 3.307 8.951 -7.382 741 H GLY 95 H GLY 95 7.637 8.665 -6.938 742 HA2 GLY 95 HA2 GLY 95 9.159 6.511 -5.925 743 HA3 GLY 95 HA3 GLY 95 9.803 7.911 -6.763 744 H PHE 96 H PHE 96 9.210 9.995 -5.151 745 HA PHE 96 HA PHE 96 11.168 10.108 -3.258 746 HB2 PHE 96 HB2 PHE 96 10.182 12.172 -3.603 747 HB3 PHE 96 HB3 PHE 96 8.550 11.520 -3.565 748 HD1 PHE 96 HD1 PHE 96 7.508 10.959 -1.352 749 HD2 PHE 96 HD2 PHE 96 11.189 13.072 -1.677 750 HE1 PHE 96 HE1 PHE 96 7.261 11.739 0.965 751 HE2 PHE 96 HE2 PHE 96 10.948 13.853 0.642 752 HZ PHE 96 HZ PHE 96 8.982 13.187 1.966 753 H TYR 97 H TYR 97 7.842 8.964 -2.815 754 HA TYR 97 HA TYR 97 8.013 8.455 -0.052 755 HB2 TYR 97 HB2 TYR 97 6.240 7.373 -2.230 756 HB3 TYR 97 HB3 TYR 97 6.096 6.818 -0.566 757 HD1 TYR 97 HD1 TYR 97 5.988 8.825 1.201 758 HD2 TYR 97 HD2 TYR 97 4.868 9.097 -2.891 759 HE1 TYR 97 HE1 TYR 97 4.575 10.760 1.723 760 HE2 TYR 97 HE2 TYR 97 3.451 11.037 -2.381 761 HH TYR 97 HH TYR 97 3.389 12.846 -0.547 762 H THR 98 H THR 98 8.389 6.255 -2.844 763 HA THR 98 HA THR 98 9.120 4.048 -1.151 764 HB THR 98 HB THR 98 9.291 2.778 -3.178 765 HG1 THR 98 HG1 THR 98 9.420 5.292 -4.460 766 HG21 THR 98 HG21 THR 98 7.151 2.869 -3.910 767 HG22 THR 98 HG22 THR 98 7.143 4.628 -4.023 768 HG23 THR 98 HG23 THR 98 6.990 3.845 -2.450 769 H GLU 99 H GLU 99 11.004 6.589 -2.641 770 HA GLU 99 HA GLU 99 13.435 4.946 -2.476 771 HB2 GLU 99 HB2 GLU 99 13.525 7.672 -3.644 772 HB3 GLU 99 HB3 GLU 99 14.416 6.226 -4.092 773 HG2 GLU 99 HG2 GLU 99 11.621 5.844 -4.572 774 HG3 GLU 99 HG3 GLU 99 12.169 7.326 -5.334 775 H VAL 100 H VAL 100 12.253 8.127 -1.354 776 HA VAL 100 HA VAL 100 14.623 8.229 0.389 777 HB VAL 100 HB VAL 100 14.515 10.139 -1.043 778 HG11 VAL 100 HG11 VAL 100 12.200 10.178 -1.631 779 HG12 VAL 100 HG12 VAL 100 12.639 11.742 -0.942 780 HG13 VAL 100 HG13 VAL 100 11.741 10.574 0.026 781 HG21 VAL 100 HG21 VAL 100 13.703 10.883 1.760 782 HG22 VAL 100 HG22 VAL 100 14.484 11.957 0.600 783 HG23 VAL 100 HG23 VAL 100 15.339 10.538 1.202 784 H LEU 101 H LEU 101 11.116 8.572 0.427 785 HA LEU 101 HA LEU 101 10.871 9.223 3.178 786 HB2 LEU 101 HB2 LEU 101 9.192 9.457 1.197 787 HB3 LEU 101 HB3 LEU 101 8.728 7.821 1.626 788 HG LEU 101 HG LEU 101 7.178 9.274 2.676 789 HD11 LEU 101 HD11 LEU 101 8.212 7.378 4.035 790 HD12 LEU 101 HD12 LEU 101 7.358 8.635 4.930 791 HD13 LEU 101 HD13 LEU 101 9.121 8.630 4.882 792 HD21 LEU 101 HD21 LEU 101 8.486 10.869 4.483 793 HD22 LEU 101 HD22 LEU 101 7.837 11.394 2.931 794 HD23 LEU 101 HD23 LEU 101 9.537 10.951 3.071 795 H PHE 102 H PHE 102 9.876 6.209 1.563 796 HA PHE 102 HA PHE 102 9.416 4.708 3.843 797 HB2 PHE 102 HB2 PHE 102 10.066 3.925 1.019 798 HB3 PHE 102 HB3 PHE 102 9.701 2.741 2.256 799 HD1 PHE 102 HD1 PHE 102 7.996 5.923 2.425 800 HD2 PHE 102 HD2 PHE 102 7.794 1.969 0.858 801 HE1 PHE 102 HE1 PHE 102 5.607 6.224 1.966 802 HE2 PHE 102 HE2 PHE 102 5.397 2.266 0.410 803 HZ PHE 102 HZ PHE 102 4.297 4.398 0.966 804 HA PRO 103 HA PRO 103 14.162 3.055 2.870 805 HB2 PRO 103 HB2 PRO 103 14.921 5.875 3.559 806 HB3 PRO 103 HB3 PRO 103 15.823 4.667 2.646 807 HG2 PRO 103 HG2 PRO 103 14.468 6.563 1.383 808 HG3 PRO 103 HG3 PRO 103 14.502 4.907 0.752 809 HD2 PRO 103 HD2 PRO 103 12.291 6.379 2.035 810 HD3 PRO 103 HD3 PRO 103 12.242 5.004 0.930 811 H GLN 104 H GLN 104 12.911 5.395 5.221 812 HA GLN 104 HA GLN 104 14.545 5.019 7.373 813 HB2 GLN 104 HB2 GLN 104 11.627 5.000 7.957 814 HB3 GLN 104 HB3 GLN 104 12.921 5.869 8.744 815 HG2 GLN 104 HG2 GLN 104 13.091 7.181 6.528 816 HG3 GLN 104 HG3 GLN 104 11.481 6.550 6.246 817 HE21 GLN 104 HE21 GLN 104 13.404 8.779 8.018 818 HE22 GLN 104 HE22 GLN 104 12.109 9.587 8.827 819 H LYS 105 H LYS 105 12.004 2.816 6.293 820 HA LYS 105 HA LYS 105 12.903 0.908 8.351 821 HB2 LYS 105 HB2 LYS 105 10.263 0.366 7.216 822 HB3 LYS 105 HB3 LYS 105 10.785 0.391 8.888 823 HG2 LYS 105 HG2 LYS 105 9.674 2.270 9.182 824 HG3 LYS 105 HG3 LYS 105 10.710 3.078 8.016 825 HD2 LYS 105 HD2 LYS 105 8.351 1.433 7.178 826 HD3 LYS 105 HD3 LYS 105 8.175 3.124 7.646 827 HE2 LYS 105 HE2 LYS 105 9.421 3.885 5.853 828 HE3 LYS 105 HE3 LYS 105 10.224 2.331 5.640 829 HZ1 LYS 105 HZ1 LYS 105 7.542 3.152 4.759 830 HZ2 LYS 105 HZ2 LYS 105 7.866 1.517 5.039 831 HZ3 LYS 105 HZ3 LYS 105 8.761 2.369 3.891 832 H ASN 106 H ASN 106 13.501 1.369 5.239 833 HA ASN 106 HA ASN 106 13.969 0.056 3.433 834 HB2 ASN 106 HB2 ASN 106 15.410 -1.052 5.103 835 HB3 ASN 106 HB3 ASN 106 14.092 -2.147 5.505 836 HD21 ASN 106 HD21 ASN 106 16.296 -1.127 2.976 837 HD22 ASN 106 HD22 ASN 106 16.259 -2.608 2.095 838 H VAL 107 H VAL 107 11.966 0.383 2.516 839 HA VAL 107 HA VAL 107 9.779 -1.459 3.031 840 HB VAL 107 HB VAL 107 9.607 1.078 2.747 841 HG11 VAL 107 HG11 VAL 107 9.288 0.436 -0.155 842 HG12 VAL 107 HG12 VAL 107 10.884 0.818 0.484 843 HG13 VAL 107 HG13 VAL 107 9.581 1.992 0.613 844 HG21 VAL 107 HG21 VAL 107 7.813 -0.937 2.565 845 HG22 VAL 107 HG22 VAL 107 7.592 -0.163 0.995 846 HG23 VAL 107 HG23 VAL 107 7.388 0.772 2.476 847 H ARG 108 H ARG 108 8.704 -2.635 1.567 848 HA ARG 108 HA ARG 108 9.963 -3.123 -1.026 849 HB2 ARG 108 HB2 ARG 108 9.735 -5.005 1.015 850 HB3 ARG 108 HB3 ARG 108 8.363 -5.349 -0.026 851 HG2 ARG 108 HG2 ARG 108 9.860 -6.651 -1.081 852 HG3 ARG 108 HG3 ARG 108 10.274 -5.138 -1.886 853 HD2 ARG 108 HD2 ARG 108 12.291 -6.233 -1.146 854 HD3 ARG 108 HD3 ARG 108 12.039 -4.763 -0.207 855 HE ARG 108 HE ARG 108 11.048 -7.226 0.972 856 HH11 ARG 108 HH11 ARG 108 13.651 -4.891 0.807 857 HH12 ARG 108 HH12 ARG 108 14.302 -5.328 2.349 858 HH21 ARG 108 HH21 ARG 108 11.913 -7.799 2.996 859 HH22 ARG 108 HH22 ARG 108 13.318 -6.981 3.590 860 H PHE 109 H PHE 109 8.645 -1.704 -2.090 861 HA PHE 109 HA PHE 109 5.823 -1.668 -1.618 862 HB2 PHE 109 HB2 PHE 109 7.496 0.202 -2.523 863 HB3 PHE 109 HB3 PHE 109 6.938 -0.418 -4.071 864 HD1 PHE 109 HD1 PHE 109 4.443 -0.492 -4.501 865 HD2 PHE 109 HD2 PHE 109 6.187 1.664 -1.282 866 HE1 PHE 109 HE1 PHE 109 2.402 0.862 -4.321 867 HE2 PHE 109 HE2 PHE 109 4.155 3.033 -1.086 868 HZ PHE 109 HZ PHE 109 2.256 2.633 -2.608 869 H LEU 110 H LEU 110 4.179 -2.397 -2.960 870 HA LEU 110 HA LEU 110 4.964 -3.967 -5.301 871 HB2 LEU 110 HB2 LEU 110 4.777 -5.632 -3.688 872 HB3 LEU 110 HB3 LEU 110 3.365 -4.911 -2.947 873 HG LEU 110 HG LEU 110 3.058 -7.065 -4.289 874 HD11 LEU 110 HD11 LEU 110 1.358 -5.070 -3.688 875 HD12 LEU 110 HD12 LEU 110 0.887 -6.563 -4.499 876 HD13 LEU 110 HD13 LEU 110 1.201 -5.108 -5.444 877 HD21 LEU 110 HD21 LEU 110 3.669 -7.132 -6.413 878 HD22 LEU 110 HD22 LEU 110 4.230 -5.464 -6.311 879 HD23 LEU 110 HD23 LEU 110 2.567 -5.807 -6.785 880 H ALA 111 H ALA 111 3.825 -3.614 -7.006 881 HA ALA 111 HA ALA 111 1.121 -2.453 -6.806 882 HB1 ALA 111 HB1 ALA 111 3.245 -1.751 -8.844 883 HB2 ALA 111 HB2 ALA 111 2.719 -0.725 -7.506 884 HB3 ALA 111 HB3 ALA 111 1.598 -1.124 -8.806 885 H ILE 112 H ILE 112 0.023 -4.320 -7.155 886 HA ILE 112 HA ILE 112 0.873 -6.407 -8.787 887 HB ILE 112 HB ILE 112 -1.839 -5.737 -7.699 888 HG12 ILE 112 HG12 ILE 112 -0.374 -8.192 -6.974 889 HG13 ILE 112 HG13 ILE 112 0.402 -6.689 -6.498 890 HG21 ILE 112 HG21 ILE 112 -2.604 -7.947 -8.366 891 HG22 ILE 112 HG22 ILE 112 -1.078 -8.238 -9.199 892 HG23 ILE 112 HG23 ILE 112 -2.174 -6.986 -9.780 893 HD11 ILE 112 HD11 ILE 112 -0.999 -6.419 -4.810 894 HD12 ILE 112 HD12 ILE 112 -1.568 -8.059 -5.125 895 HD13 ILE 112 HD13 ILE 112 -2.405 -6.677 -5.841 896 H ASN 113 H ASN 113 -1.298 -3.720 -9.737 897 HA ASN 113 HA ASN 113 -1.711 -4.986 -12.327 898 HB2 ASN 113 HB2 ASN 113 -3.424 -3.599 -10.859 899 HB3 ASN 113 HB3 ASN 113 -2.747 -2.253 -11.767 900 HD21 ASN 113 HD21 ASN 113 -3.124 -2.092 -13.954 901 HD22 ASN 113 HD22 ASN 113 -4.306 -3.051 -14.767 902 H ASN 114 H ASN 114 1.018 -4.130 -11.863 903 HA ASN 114 HA ASN 114 1.712 -3.066 -14.290 904 HB2 ASN 114 HB2 ASN 114 0.606 -1.013 -12.637 905 HB3 ASN 114 HB3 ASN 114 2.319 -0.694 -12.861 906 HD21 ASN 114 HD21 ASN 114 -0.652 -0.108 -14.093 907 HD22 ASN 114 HD22 ASN 114 -0.227 0.245 -15.729 908 H SER 115 H SER 115 3.947 -1.882 -14.217 909 HA SER 115 HA SER 115 5.656 -3.491 -12.501 910 HB2 SER 115 HB2 SER 115 6.474 -1.517 -14.648 911 HB3 SER 115 HB3 SER 115 7.476 -2.768 -13.916 912 HG SER 115 HG SER 115 5.864 -2.964 -16.027 913 H ILE 116 H ILE 116 5.800 -2.706 -10.493 914 HA ILE 116 HA ILE 116 5.507 -0.062 -9.693 915 HB ILE 116 HB ILE 116 5.685 -2.419 -8.375 916 HG12 ILE 116 HG12 ILE 116 4.574 -0.260 -7.708 917 HG13 ILE 116 HG13 ILE 116 5.287 -1.167 -6.380 918 HG21 ILE 116 HG21 ILE 116 8.132 -2.460 -8.498 919 HG22 ILE 116 HG22 ILE 116 7.559 -2.357 -6.834 920 HG23 ILE 116 HG23 ILE 116 8.195 -0.923 -7.638 921 HD11 ILE 116 HD11 ILE 116 5.876 1.031 -5.940 922 HD12 ILE 116 HD12 ILE 116 6.220 1.381 -7.634 923 HD13 ILE 116 HD13 ILE 116 7.321 0.367 -6.702 924 H ASP 117 H ASP 117 8.517 -1.831 -10.389 925 HA ASP 117 HA ASP 117 9.911 0.514 -11.146 926 HB2 ASP 117 HB2 ASP 117 9.754 0.201 -8.379 927 HB3 ASP 117 HB3 ASP 117 11.352 -0.407 -8.792 928 H SER 118 H SER 118 10.108 -2.777 -9.875 929 HA SER 118 HA SER 118 12.613 -3.581 -10.484 930 HB2 SER 118 HB2 SER 118 10.291 -4.851 -9.753 931 HB3 SER 118 HB3 SER 118 10.638 -5.570 -11.325 932 HG SER 118 HG SER 118 12.361 -5.459 -9.073 933 H ASN 119 H ASN 119 13.767 -4.322 -12.218 934 HA ASN 119 HA ASN 119 12.682 -3.657 -14.862 935 HB2 ASN 119 HB2 ASN 119 15.229 -3.255 -13.606 936 HB3 ASN 119 HB3 ASN 119 15.436 -4.222 -15.066 937 HD21 ASN 119 HD21 ASN 119 13.687 -1.378 -13.903 938 HD22 ASN 119 HD22 ASN 119 13.949 -0.434 -15.315 939 H ASN 120 H ASN 120 14.889 -6.043 -13.436 940 HA ASN 120 HA ASN 120 14.516 -7.887 -15.585 941 HB2 ASN 120 HB2 ASN 120 16.036 -7.901 -13.012 942 HB3 ASN 120 HB3 ASN 120 15.758 -9.430 -13.836 943 HD21 ASN 120 HD21 ASN 120 17.943 -9.711 -14.261 944 HD22 ASN 120 HD22 ASN 120 18.774 -8.781 -15.456 Start of MODEL 6 1 H1 GLY 1 H1 GLY 1 4.295 -7.746 22.087 2 H2 GLY 1 H2 GLY 1 5.094 -9.231 22.209 3 H3 GLY 1 H3 GLY 1 5.801 -7.960 21.347 4 HA2 GLY 1 HA2 GLY 1 5.954 -6.656 23.406 5 HA3 GLY 1 HA3 GLY 1 5.314 -8.043 24.274 6 H SER 2 H SER 2 8.069 -6.758 22.525 7 HA SER 2 HA SER 2 9.811 -8.564 23.995 8 HB2 SER 2 HB2 SER 2 9.560 -8.565 20.998 9 HB3 SER 2 HB3 SER 2 11.086 -8.996 21.771 10 HG SER 2 HG SER 2 9.234 -10.644 21.305 11 H ARG 3 H ARG 3 10.632 -6.723 21.083 12 HA ARG 3 HA ARG 3 11.749 -4.549 22.661 13 HB2 ARG 3 HB2 ARG 3 13.396 -6.470 21.036 14 HB3 ARG 3 HB3 ARG 3 13.935 -4.819 21.308 15 HG2 ARG 3 HG2 ARG 3 13.793 -5.222 23.745 16 HG3 ARG 3 HG3 ARG 3 13.385 -6.904 23.405 17 HD2 ARG 3 HD2 ARG 3 15.491 -7.372 22.540 18 HD3 ARG 3 HD3 ARG 3 15.852 -5.672 22.245 19 HE ARG 3 HE ARG 3 15.555 -5.977 24.989 20 HH11 ARG 3 HH11 ARG 3 17.704 -7.130 22.478 21 HH12 ARG 3 HH12 ARG 3 19.060 -7.290 23.541 22 HH21 ARG 3 HH21 ARG 3 17.344 -6.189 26.386 23 HH22 ARG 3 HH22 ARG 3 18.856 -6.756 25.762 24 H THR 4 H THR 4 12.225 -5.764 19.340 25 HA THR 4 HA THR 4 11.055 -3.250 18.344 26 HB THR 4 HB THR 4 12.609 -3.480 16.394 27 HG1 THR 4 HG1 THR 4 13.910 -5.404 18.020 28 HG21 THR 4 HG21 THR 4 13.142 -2.030 18.365 29 HG22 THR 4 HG22 THR 4 14.531 -2.585 17.431 30 HG23 THR 4 HG23 THR 4 14.141 -3.350 18.971 31 H SER 5 H SER 5 9.459 -3.403 16.883 32 HA SER 5 HA SER 5 9.133 -5.733 15.208 33 HB2 SER 5 HB2 SER 5 6.751 -6.101 16.028 34 HB3 SER 5 HB3 SER 5 8.035 -6.662 17.099 35 HG SER 5 HG SER 5 6.368 -4.403 17.357 36 H ARG 6 H ARG 6 9.310 -4.240 13.522 37 HA ARG 6 HA ARG 6 7.560 -1.980 13.317 38 HB2 ARG 6 HB2 ARG 6 8.419 -1.976 10.897 39 HB3 ARG 6 HB3 ARG 6 9.565 -1.671 12.176 40 HG2 ARG 6 HG2 ARG 6 10.566 -3.093 10.564 41 HG3 ARG 6 HG3 ARG 6 10.288 -4.023 12.028 42 HD2 ARG 6 HD2 ARG 6 8.180 -4.075 9.936 43 HD3 ARG 6 HD3 ARG 6 9.676 -4.945 9.608 44 HE ARG 6 HE ARG 6 8.370 -5.496 12.149 45 HH11 ARG 6 HH11 ARG 6 8.964 -6.537 8.859 46 HH12 ARG 6 HH12 ARG 6 8.469 -8.165 9.160 47 HH21 ARG 6 HH21 ARG 6 7.724 -7.638 12.535 48 HH22 ARG 6 HH22 ARG 6 7.766 -8.792 11.246 49 H ILE 7 H ILE 7 6.712 -2.267 10.502 50 HA ILE 7 HA ILE 7 4.978 -4.596 10.635 51 HB ILE 7 HB ILE 7 2.951 -3.478 10.487 52 HG12 ILE 7 HG12 ILE 7 3.643 -0.700 10.652 53 HG13 ILE 7 HG13 ILE 7 4.417 -1.415 9.244 54 HG21 ILE 7 HG21 ILE 7 3.930 -3.524 12.741 55 HG22 ILE 7 HG22 ILE 7 2.811 -2.183 12.512 56 HG23 ILE 7 HG23 ILE 7 4.549 -1.895 12.476 57 HD11 ILE 7 HD11 ILE 7 1.681 -0.656 9.621 58 HD12 ILE 7 HD12 ILE 7 1.783 -2.373 9.239 59 HD13 ILE 7 HD13 ILE 7 2.503 -1.184 8.153 60 H THR 8 H THR 8 3.347 -4.564 8.754 61 HA THR 8 HA THR 8 4.779 -3.965 6.242 62 HB THR 8 HB THR 8 2.943 -6.227 7.075 63 HG1 THR 8 HG1 THR 8 4.749 -7.257 6.982 64 HG21 THR 8 HG21 THR 8 2.360 -6.843 4.980 65 HG22 THR 8 HG22 THR 8 3.797 -6.137 4.244 66 HG23 THR 8 HG23 THR 8 2.442 -5.106 4.696 67 H ALA 9 H ALA 9 3.491 -2.997 4.490 68 HA ALA 9 HA ALA 9 0.999 -1.846 5.556 69 HB1 ALA 9 HB1 ALA 9 2.945 -0.739 3.571 70 HB2 ALA 9 HB2 ALA 9 2.440 -0.067 5.121 71 HB3 ALA 9 HB3 ALA 9 1.316 -0.092 3.763 72 H LEU 10 H LEU 10 -0.795 -2.523 4.835 73 HA LEU 10 HA LEU 10 -1.014 -3.605 2.098 74 HB2 LEU 10 HB2 LEU 10 -1.404 -5.068 4.205 75 HB3 LEU 10 HB3 LEU 10 -2.897 -4.179 4.369 76 HG LEU 10 HG LEU 10 -2.512 -5.317 1.705 77 HD11 LEU 10 HD11 LEU 10 -1.399 -7.016 3.193 78 HD12 LEU 10 HD12 LEU 10 -2.800 -7.606 2.300 79 HD13 LEU 10 HD13 LEU 10 -2.950 -7.207 4.010 80 HD21 LEU 10 HD21 LEU 10 -4.834 -6.225 2.477 81 HD22 LEU 10 HD22 LEU 10 -4.620 -4.509 2.118 82 HD23 LEU 10 HD23 LEU 10 -4.623 -5.061 3.786 83 H TYR 11 H TYR 11 -1.721 -1.833 0.935 84 HA TYR 11 HA TYR 11 -4.013 -0.376 2.064 85 HB2 TYR 11 HB2 TYR 11 -2.527 1.326 1.971 86 HB3 TYR 11 HB3 TYR 11 -1.576 0.599 0.705 87 HD1 TYR 11 HD1 TYR 11 -4.938 2.127 1.234 88 HD2 TYR 11 HD2 TYR 11 -1.637 1.609 -1.398 89 HE1 TYR 11 HE1 TYR 11 -5.993 3.651 -0.377 90 HE2 TYR 11 HE2 TYR 11 -2.683 3.136 -3.015 91 HH TYR 11 HH TYR 11 -5.665 3.852 -3.195 92 H GLU 12 H GLU 12 -5.906 -0.279 0.931 93 HA GLU 12 HA GLU 12 -5.846 -0.809 -1.934 94 HB2 GLU 12 HB2 GLU 12 -6.238 -2.929 -0.281 95 HB3 GLU 12 HB3 GLU 12 -7.892 -2.410 -0.571 96 HG2 GLU 12 HG2 GLU 12 -6.857 -4.169 -2.123 97 HG3 GLU 12 HG3 GLU 12 -7.774 -2.844 -2.834 98 H ARG 13 H ARG 13 -7.577 -0.066 -3.100 99 HA ARG 13 HA ARG 13 -9.753 1.243 -1.642 100 HB2 ARG 13 HB2 ARG 13 -8.400 3.098 -2.173 101 HB3 ARG 13 HB3 ARG 13 -7.988 2.467 -3.759 102 HG2 ARG 13 HG2 ARG 13 -10.848 2.972 -3.338 103 HG3 ARG 13 HG3 ARG 13 -9.817 4.402 -3.298 104 HD2 ARG 13 HD2 ARG 13 -9.295 2.492 -5.482 105 HD3 ARG 13 HD3 ARG 13 -10.836 3.339 -5.556 106 HE ARG 13 HE ARG 13 -9.568 5.427 -5.492 107 HH11 ARG 13 HH11 ARG 13 -7.826 2.525 -6.416 108 HH12 ARG 13 HH12 ARG 13 -6.597 3.398 -7.252 109 HH21 ARG 13 HH21 ARG 13 -7.931 6.552 -6.593 110 HH22 ARG 13 HH22 ARG 13 -6.645 5.673 -7.349 111 H LEU 14 H LEU 14 -11.644 0.470 -2.276 112 HA LEU 14 HA LEU 14 -11.893 -0.610 -4.998 113 HB2 LEU 14 HB2 LEU 14 -12.399 -2.491 -3.833 114 HB3 LEU 14 HB3 LEU 14 -12.748 -1.608 -2.368 115 HG LEU 14 HG LEU 14 -14.624 -2.970 -3.411 116 HD11 LEU 14 HD11 LEU 14 -15.921 -0.448 -3.167 117 HD12 LEU 14 HD12 LEU 14 -14.613 -0.559 -1.988 118 HD13 LEU 14 HD13 LEU 14 -15.868 -1.796 -2.031 119 HD21 LEU 14 HD21 LEU 14 -14.043 -1.704 -5.713 120 HD22 LEU 14 HD22 LEU 14 -15.350 -0.684 -5.110 121 HD23 LEU 14 HD23 LEU 14 -15.615 -2.407 -5.343 122 H SER 15 H SER 15 -13.268 0.328 -6.338 123 HA SER 15 HA SER 15 -15.148 2.330 -5.279 124 HB2 SER 15 HB2 SER 15 -13.550 3.398 -6.702 125 HB3 SER 15 HB3 SER 15 -13.726 2.156 -7.939 126 HG SER 15 HG SER 15 -15.426 3.151 -8.681 127 H ARG 16 H ARG 16 -17.257 2.067 -5.573 128 HA ARG 16 HA ARG 16 -18.269 -0.309 -6.852 129 HB2 ARG 16 HB2 ARG 16 -19.280 1.728 -5.011 130 HB3 ARG 16 HB3 ARG 16 -20.474 1.150 -6.162 131 HG2 ARG 16 HG2 ARG 16 -19.187 -1.139 -5.223 132 HG3 ARG 16 HG3 ARG 16 -19.441 -0.120 -3.805 133 HD2 ARG 16 HD2 ARG 16 -21.744 -0.216 -5.585 134 HD3 ARG 16 HD3 ARG 16 -21.295 -1.796 -4.949 135 HE ARG 16 HE ARG 16 -21.288 -0.243 -2.743 136 HH11 ARG 16 HH11 ARG 16 -23.668 -0.725 -5.267 137 HH12 ARG 16 HH12 ARG 16 -25.014 -0.432 -4.220 138 HH21 ARG 16 HH21 ARG 16 -23.064 0.140 -1.372 139 HH22 ARG 16 HH22 ARG 16 -24.672 0.061 -2.009 140 H ASP 17 H ASP 17 -17.556 2.795 -7.964 141 HA ASP 17 HA ASP 17 -19.707 2.900 -9.928 142 HB2 ASP 17 HB2 ASP 17 -17.418 4.818 -9.981 143 HB3 ASP 17 HB3 ASP 17 -19.121 5.097 -10.325 144 H ASP 18 H ASP 18 -16.793 1.337 -9.722 145 HA ASP 18 HA ASP 18 -15.758 1.780 -12.348 146 HB2 ASP 18 HB2 ASP 18 -15.240 -0.355 -10.288 147 HB3 ASP 18 HB3 ASP 18 -14.350 -0.226 -11.800 148 H ASP 19 H ASP 19 -15.318 -0.224 -13.753 149 HA ASP 19 HA ASP 19 -17.872 -1.409 -14.422 150 HB2 ASP 19 HB2 ASP 19 -16.660 -2.259 -16.432 151 HB3 ASP 19 HB3 ASP 19 -16.603 -0.508 -16.263 152 H LEU 20 H LEU 20 -15.881 -2.186 -12.121 153 HA LEU 20 HA LEU 20 -15.699 -5.063 -12.671 154 HB2 LEU 20 HB2 LEU 20 -14.347 -4.857 -10.393 155 HB3 LEU 20 HB3 LEU 20 -13.595 -4.552 -11.945 156 HG LEU 20 HG LEU 20 -14.173 -2.074 -11.522 157 HD11 LEU 20 HD11 LEU 20 -14.177 -1.536 -9.055 158 HD12 LEU 20 HD12 LEU 20 -14.582 -3.229 -8.779 159 HD13 LEU 20 HD13 LEU 20 -15.673 -2.201 -9.704 160 HD21 LEU 20 HD21 LEU 20 -11.912 -2.842 -11.523 161 HD22 LEU 20 HD22 LEU 20 -12.095 -3.541 -9.916 162 HD23 LEU 20 HD23 LEU 20 -12.137 -1.791 -10.126 163 H THR 21 H THR 21 -16.955 -6.478 -11.548 164 HA THR 21 HA THR 21 -18.195 -5.617 -9.065 165 HB THR 21 HB THR 21 -20.461 -6.434 -9.977 166 HG1 THR 21 HG1 THR 21 -19.798 -7.285 -11.929 167 HG21 THR 21 HG21 THR 21 -20.904 -4.237 -11.134 168 HG22 THR 21 HG22 THR 21 -19.206 -3.848 -10.849 169 HG23 THR 21 HG23 THR 21 -20.286 -4.142 -9.486 170 H GLY 22 H GLY 22 -16.398 -7.358 -8.798 171 HA2 GLY 22 HA2 GLY 22 -17.774 -9.956 -8.562 172 HA3 GLY 22 HA3 GLY 22 -16.121 -9.863 -9.152 173 H GLU 23 H GLU 23 -14.625 -10.286 -7.678 174 HA GLU 23 HA GLU 23 -15.280 -10.150 -4.834 175 HB2 GLU 23 HB2 GLU 23 -14.221 -12.170 -5.364 176 HB3 GLU 23 HB3 GLU 23 -13.084 -11.401 -6.457 177 HG2 GLU 23 HG2 GLU 23 -11.825 -10.510 -4.634 178 HG3 GLU 23 HG3 GLU 23 -13.042 -11.033 -3.471 179 H SER 24 H SER 24 -12.786 -8.907 -7.044 180 HA SER 24 HA SER 24 -11.298 -7.417 -5.264 181 HB2 SER 24 HB2 SER 24 -11.899 -6.993 -8.182 182 HB3 SER 24 HB3 SER 24 -10.778 -5.962 -7.295 183 HG SER 24 HG SER 24 -10.584 -8.732 -7.820 184 H ASN 25 H ASN 25 -14.522 -6.705 -6.363 185 HA ASN 25 HA ASN 25 -14.243 -3.957 -5.389 186 HB2 ASN 25 HB2 ASN 25 -15.828 -3.270 -6.896 187 HB3 ASN 25 HB3 ASN 25 -15.176 -4.649 -7.757 188 HD21 ASN 25 HD21 ASN 25 -16.425 -6.772 -6.679 189 HD22 ASN 25 HD22 ASN 25 -18.129 -6.650 -6.901 190 H SER 26 H SER 26 -14.247 -4.876 -3.141 191 HA SER 26 HA SER 26 -16.903 -4.586 -2.046 192 HB2 SER 26 HB2 SER 26 -15.515 -7.245 -1.982 193 HB3 SER 26 HB3 SER 26 -16.694 -6.796 -0.759 194 HG SER 26 HG SER 26 -18.148 -7.383 -2.140 195 H ILE 27 H ILE 27 -13.869 -3.725 -1.766 196 HA ILE 27 HA ILE 27 -12.545 -2.892 -0.147 197 HB ILE 27 HB ILE 27 -15.134 -2.976 1.334 198 HG12 ILE 27 HG12 ILE 27 -14.840 -1.236 -0.359 199 HG13 ILE 27 HG13 ILE 27 -14.905 -0.526 1.247 200 HG21 ILE 27 HG21 ILE 27 -13.888 -1.573 3.093 201 HG22 ILE 27 HG22 ILE 27 -12.433 -2.332 2.451 202 HG23 ILE 27 HG23 ILE 27 -13.714 -3.326 3.145 203 HD11 ILE 27 HD11 ILE 27 -12.314 -0.624 1.114 204 HD12 ILE 27 HD12 ILE 27 -13.188 0.644 0.253 205 HD13 ILE 27 HD13 ILE 27 -12.587 -0.767 -0.623 206 H THR 28 H THR 28 -14.509 -4.986 1.981 207 HA THR 28 HA THR 28 -12.355 -6.108 3.347 208 HB THR 28 HB THR 28 -15.133 -6.326 3.443 209 HG1 THR 28 HG1 THR 28 -14.704 -7.001 5.429 210 HG21 THR 28 HG21 THR 28 -15.045 -8.340 2.036 211 HG22 THR 28 HG22 THR 28 -15.620 -8.665 3.672 212 HG23 THR 28 HG23 THR 28 -13.968 -9.084 3.216 213 H ASN 29 H ASN 29 -13.857 -7.078 0.299 214 HA ASN 29 HA ASN 29 -12.594 -9.597 0.127 215 HB2 ASN 29 HB2 ASN 29 -13.778 -7.822 -2.013 216 HB3 ASN 29 HB3 ASN 29 -13.116 -9.416 -2.332 217 HD21 ASN 29 HD21 ASN 29 -14.890 -10.549 -2.835 218 HD22 ASN 29 HD22 ASN 29 -16.251 -10.759 -1.794 219 H GLN 30 H GLN 30 -11.691 -6.417 -1.364 220 HA GLN 30 HA GLN 30 -9.311 -7.454 -2.498 221 HB2 GLN 30 HB2 GLN 30 -8.732 -4.764 -1.843 222 HB3 GLN 30 HB3 GLN 30 -9.112 -5.442 -3.410 223 HG2 GLN 30 HG2 GLN 30 -11.028 -4.353 -3.486 224 HG3 GLN 30 HG3 GLN 30 -11.515 -4.931 -1.902 225 HE21 GLN 30 HE21 GLN 30 -10.810 -3.785 -0.058 226 HE22 GLN 30 HE22 GLN 30 -10.497 -2.102 -0.163 227 H LYS 31 H LYS 31 -10.090 -6.391 0.741 228 HA LYS 31 HA LYS 31 -7.512 -6.029 1.780 229 HB2 LYS 31 HB2 LYS 31 -9.903 -7.245 3.187 230 HB3 LYS 31 HB3 LYS 31 -8.493 -6.542 3.959 231 HG2 LYS 31 HG2 LYS 31 -9.379 -4.490 2.384 232 HG3 LYS 31 HG3 LYS 31 -10.876 -5.259 2.900 233 HD2 LYS 31 HD2 LYS 31 -9.065 -5.087 5.103 234 HD3 LYS 31 HD3 LYS 31 -9.249 -3.500 4.361 235 HE2 LYS 31 HE2 LYS 31 -11.793 -4.826 4.597 236 HE3 LYS 31 HE3 LYS 31 -10.974 -4.762 6.157 237 HZ1 LYS 31 HZ1 LYS 31 -10.637 -2.341 5.721 238 HZ2 LYS 31 HZ2 LYS 31 -12.246 -2.799 5.955 239 HZ3 LYS 31 HZ3 LYS 31 -11.675 -2.486 4.395 240 H LYS 32 H LYS 32 -9.577 -8.912 1.697 241 HA LYS 32 HA LYS 32 -7.698 -10.745 2.688 242 HB2 LYS 32 HB2 LYS 32 -10.285 -10.902 1.273 243 HB3 LYS 32 HB3 LYS 32 -9.254 -12.324 1.162 244 HG2 LYS 32 HG2 LYS 32 -10.020 -12.948 3.136 245 HG3 LYS 32 HG3 LYS 32 -9.170 -11.581 3.843 246 HD2 LYS 32 HD2 LYS 32 -11.792 -10.993 2.618 247 HD3 LYS 32 HD3 LYS 32 -11.819 -11.964 4.091 248 HE2 LYS 32 HE2 LYS 32 -10.242 -9.415 3.913 249 HE3 LYS 32 HE3 LYS 32 -11.957 -9.409 4.320 250 HZ1 LYS 32 HZ1 LYS 32 -10.468 -9.429 6.272 251 HZ2 LYS 32 HZ2 LYS 32 -9.899 -10.950 5.805 252 HZ3 LYS 32 HZ3 LYS 32 -11.522 -10.749 6.233 253 H TYR 33 H TYR 33 -8.166 -9.406 -0.526 254 HA TYR 33 HA TYR 33 -6.774 -11.317 -2.045 255 HB2 TYR 33 HB2 TYR 33 -8.094 -9.412 -3.020 256 HB3 TYR 33 HB3 TYR 33 -6.804 -8.323 -2.525 257 HD1 TYR 33 HD1 TYR 33 -7.581 -11.211 -4.706 258 HD2 TYR 33 HD2 TYR 33 -4.835 -8.065 -3.841 259 HE1 TYR 33 HE1 TYR 33 -6.357 -11.704 -6.780 260 HE2 TYR 33 HE2 TYR 33 -3.607 -8.570 -5.879 261 HH TYR 33 HH TYR 33 -3.818 -11.311 -7.557 262 H LEU 34 H LEU 34 -5.569 -8.181 -0.830 263 HA LEU 34 HA LEU 34 -2.871 -8.600 -1.365 264 HB2 LEU 34 HB2 LEU 34 -4.182 -7.042 0.874 265 HB3 LEU 34 HB3 LEU 34 -2.479 -6.966 0.501 266 HG LEU 34 HG LEU 34 -2.801 -5.415 -1.065 267 HD11 LEU 34 HD11 LEU 34 -3.585 -7.263 -2.582 268 HD12 LEU 34 HD12 LEU 34 -4.181 -5.649 -2.962 269 HD13 LEU 34 HD13 LEU 34 -5.232 -6.806 -2.148 270 HD21 LEU 34 HD21 LEU 34 -5.260 -4.485 -1.085 271 HD22 LEU 34 HD22 LEU 34 -4.198 -4.257 0.305 272 HD23 LEU 34 HD23 LEU 34 -5.420 -5.532 0.323 273 H GLU 35 H GLU 35 -4.907 -9.527 1.363 274 HA GLU 35 HA GLU 35 -3.025 -10.443 3.171 275 HB2 GLU 35 HB2 GLU 35 -5.845 -10.705 2.769 276 HB3 GLU 35 HB3 GLU 35 -5.194 -12.293 3.142 277 HG2 GLU 35 HG2 GLU 35 -4.128 -11.311 5.152 278 HG3 GLU 35 HG3 GLU 35 -4.953 -9.801 4.801 279 H ASP 36 H ASP 36 -4.717 -12.265 0.639 280 HA ASP 36 HA ASP 36 -3.479 -14.721 0.797 281 HB2 ASP 36 HB2 ASP 36 -5.328 -13.584 -0.831 282 HB3 ASP 36 HB3 ASP 36 -3.966 -13.697 -1.931 283 H TYR 37 H TYR 37 -2.323 -11.740 -0.635 284 HA TYR 37 HA TYR 37 -0.038 -12.902 -1.921 285 HB2 TYR 37 HB2 TYR 37 -0.872 -10.888 -2.874 286 HB3 TYR 37 HB3 TYR 37 -0.872 -10.063 -1.327 287 HD1 TYR 37 HD1 TYR 37 1.290 -9.421 -0.284 288 HD2 TYR 37 HD2 TYR 37 1.065 -10.904 -4.252 289 HE1 TYR 37 HE1 TYR 37 3.541 -8.548 -0.726 290 HE2 TYR 37 HE2 TYR 37 3.313 -10.022 -4.719 291 HH TYR 37 HH TYR 37 5.476 -9.313 -2.605 292 H ALA 38 H ALA 38 -0.317 -10.586 0.782 293 HA ALA 38 HA ALA 38 2.249 -10.573 1.671 294 HB1 ALA 38 HB1 ALA 38 1.419 -9.886 3.817 295 HB2 ALA 38 HB2 ALA 38 -0.167 -10.574 3.467 296 HB3 ALA 38 HB3 ALA 38 0.413 -9.183 2.556 297 H ARG 39 H ARG 39 -0.134 -13.139 2.203 298 HA ARG 39 HA ARG 39 1.557 -14.497 4.115 299 HB2 ARG 39 HB2 ARG 39 -0.080 -16.410 3.799 300 HB3 ARG 39 HB3 ARG 39 -0.718 -14.924 4.475 301 HG2 ARG 39 HG2 ARG 39 -1.136 -14.593 1.781 302 HG3 ARG 39 HG3 ARG 39 -1.416 -16.322 2.033 303 HD2 ARG 39 HD2 ARG 39 -2.613 -14.295 3.883 304 HD3 ARG 39 HD3 ARG 39 -3.403 -14.696 2.365 305 HE ARG 39 HE ARG 39 -2.831 -17.074 3.725 306 HH11 ARG 39 HH11 ARG 39 -4.917 -14.279 4.014 307 HH12 ARG 39 HH12 ARG 39 -6.139 -15.129 4.896 308 HH21 ARG 39 HH21 ARG 39 -4.444 -18.189 4.892 309 HH22 ARG 39 HH22 ARG 39 -5.871 -17.348 5.396 310 H ARG 40 H ARG 40 0.629 -15.053 0.708 311 HA ARG 40 HA ARG 40 2.267 -17.323 0.335 312 HB2 ARG 40 HB2 ARG 40 2.041 -16.889 -2.062 313 HB3 ARG 40 HB3 ARG 40 0.499 -16.693 -1.255 314 HG2 ARG 40 HG2 ARG 40 0.796 -14.283 -1.294 315 HG3 ARG 40 HG3 ARG 40 2.336 -14.483 -2.120 316 HD2 ARG 40 HD2 ARG 40 0.744 -15.916 -3.747 317 HD3 ARG 40 HD3 ARG 40 -0.422 -14.741 -3.142 318 HE ARG 40 HE ARG 40 2.090 -13.681 -4.157 319 HH11 ARG 40 HH11 ARG 40 -1.291 -14.346 -4.791 320 HH12 ARG 40 HH12 ARG 40 -1.388 -13.231 -6.109 321 HH21 ARG 40 HH21 ARG 40 1.947 -12.221 -5.903 322 HH22 ARG 40 HH22 ARG 40 0.448 -12.032 -6.743 323 H ASN 41 H ASN 41 3.003 -14.008 0.723 324 HA ASN 41 HA ASN 41 5.637 -14.224 -0.490 325 HB2 ASN 41 HB2 ASN 41 3.828 -12.030 0.294 326 HB3 ASN 41 HB3 ASN 41 5.538 -11.709 0.531 327 HD21 ASN 41 HD21 ASN 41 3.230 -12.883 -1.872 328 HD22 ASN 41 HD22 ASN 41 4.055 -12.229 -3.240 329 H GLY 42 H GLY 42 4.131 -13.649 2.662 330 HA2 GLY 42 HA2 GLY 42 5.055 -14.598 4.661 331 HA3 GLY 42 HA3 GLY 42 6.649 -14.482 3.941 332 H PHE 43 H PHE 43 4.024 -12.097 4.457 333 HA PHE 43 HA PHE 43 6.024 -10.330 5.706 334 HB2 PHE 43 HB2 PHE 43 3.429 -9.677 4.303 335 HB3 PHE 43 HB3 PHE 43 4.450 -8.488 5.096 336 HD1 PHE 43 HD1 PHE 43 7.072 -8.821 4.314 337 HD2 PHE 43 HD2 PHE 43 3.595 -9.707 2.058 338 HE1 PHE 43 HE1 PHE 43 8.370 -8.608 2.233 339 HE2 PHE 43 HE2 PHE 43 4.863 -9.509 -0.017 340 HZ PHE 43 HZ PHE 43 7.265 -8.952 0.059 341 H GLU 44 H GLU 44 5.709 -9.476 7.710 342 HA GLU 44 HA GLU 44 3.509 -10.535 9.290 343 HB2 GLU 44 HB2 GLU 44 6.228 -9.463 9.872 344 HB3 GLU 44 HB3 GLU 44 5.003 -9.435 11.133 345 HG2 GLU 44 HG2 GLU 44 6.634 -11.406 10.928 346 HG3 GLU 44 HG3 GLU 44 4.951 -11.687 11.324 347 H ASN 45 H ASN 45 2.828 -9.094 11.121 348 HA ASN 45 HA ASN 45 1.518 -7.341 11.723 349 HB2 ASN 45 HB2 ASN 45 4.039 -6.046 10.756 350 HB3 ASN 45 HB3 ASN 45 2.788 -5.148 11.607 351 HD21 ASN 45 HD21 ASN 45 5.592 -6.869 11.925 352 HD22 ASN 45 HD22 ASN 45 5.535 -7.190 13.624 353 H ILE 46 H ILE 46 1.051 -8.240 9.006 354 HA ILE 46 HA ILE 46 0.808 -6.239 7.119 355 HB ILE 46 HB ILE 46 -0.954 -8.644 7.544 356 HG12 ILE 46 HG12 ILE 46 1.264 -8.387 5.548 357 HG13 ILE 46 HG13 ILE 46 1.608 -8.869 7.208 358 HG21 ILE 46 HG21 ILE 46 -2.224 -7.634 5.993 359 HG22 ILE 46 HG22 ILE 46 -0.974 -8.187 4.878 360 HG23 ILE 46 HG23 ILE 46 -0.936 -6.539 5.501 361 HD11 ILE 46 HD11 ILE 46 1.311 -10.744 5.563 362 HD12 ILE 46 HD12 ILE 46 -0.393 -10.296 5.482 363 HD13 ILE 46 HD13 ILE 46 0.308 -10.828 7.009 364 H ARG 47 H ARG 47 0.062 -4.359 7.845 365 HA ARG 47 HA ARG 47 -2.511 -4.189 9.191 366 HB2 ARG 47 HB2 ARG 47 -0.261 -2.683 9.435 367 HB3 ARG 47 HB3 ARG 47 -1.232 -1.682 8.361 368 HG2 ARG 47 HG2 ARG 47 -2.967 -2.568 10.375 369 HG3 ARG 47 HG3 ARG 47 -1.481 -2.081 11.181 370 HD2 ARG 47 HD2 ARG 47 -1.572 0.085 10.136 371 HD3 ARG 47 HD3 ARG 47 -2.960 -0.408 9.171 372 HE ARG 47 HE ARG 47 -4.328 -0.174 11.031 373 HH11 ARG 47 HH11 ARG 47 -0.982 0.348 11.926 374 HH12 ARG 47 HH12 ARG 47 -1.377 1.038 13.462 375 HH21 ARG 47 HH21 ARG 47 -4.833 0.725 13.056 376 HH22 ARG 47 HH22 ARG 47 -3.561 1.251 14.105 377 H HIS 48 H HIS 48 -4.372 -3.721 8.282 378 HA HIS 48 HA HIS 48 -4.379 -3.326 5.400 379 HB2 HIS 48 HB2 HIS 48 -6.540 -4.133 7.346 380 HB3 HIS 48 HB3 HIS 48 -6.877 -3.779 5.655 381 HD1 HIS 48 HD1 HIS 48 -6.841 -5.754 4.184 382 HD2 HIS 48 HD2 HIS 48 -4.492 -6.290 7.559 383 HE1 HIS 48 HE1 HIS 48 -6.031 -8.133 4.055 384 HE2 HIS 48 HE2 HIS 48 -4.502 -8.392 6.048 385 H PHE 49 H PHE 49 -4.451 -1.351 4.621 386 HA PHE 49 HA PHE 49 -5.796 0.756 6.148 387 HB2 PHE 49 HB2 PHE 49 -3.905 1.078 3.793 388 HB3 PHE 49 HB3 PHE 49 -4.503 2.354 4.844 389 HD1 PHE 49 HD1 PHE 49 -3.774 2.486 7.159 390 HD2 PHE 49 HD2 PHE 49 -2.066 -0.326 4.466 391 HE1 PHE 49 HE1 PHE 49 -1.892 2.165 8.701 392 HE2 PHE 49 HE2 PHE 49 -0.180 -0.652 6.013 393 HZ PHE 49 HZ PHE 49 -0.093 0.590 8.125 394 H THR 50 H THR 50 -7.789 0.627 5.746 395 HA THR 50 HA THR 50 -8.967 -0.131 3.290 396 HB THR 50 HB THR 50 -9.846 -0.628 5.536 397 HG1 THR 50 HG1 THR 50 -11.229 -0.571 3.636 398 HG21 THR 50 HG21 THR 50 -10.285 0.896 7.060 399 HG22 THR 50 HG22 THR 50 -11.356 1.757 5.959 400 HG23 THR 50 HG23 THR 50 -9.631 2.123 5.976 401 H ASP 51 H ASP 51 -10.488 0.933 2.059 402 HA ASP 51 HA ASP 51 -10.020 3.818 1.789 403 HB2 ASP 51 HB2 ASP 51 -9.411 3.148 -0.294 404 HB3 ASP 51 HB3 ASP 51 -10.224 1.602 -0.125 405 H ASP 52 H ASP 52 -11.722 5.202 1.463 406 HA ASP 52 HA ASP 52 -14.404 4.312 1.179 407 HB2 ASP 52 HB2 ASP 52 -14.171 3.790 3.541 408 HB3 ASP 52 HB3 ASP 52 -13.564 5.410 3.869 409 H GLY 53 H GLY 53 -14.968 5.771 -0.296 410 HA2 GLY 53 HA2 GLY 53 -15.242 7.778 -1.386 411 HA3 GLY 53 HA3 GLY 53 -15.540 8.416 0.222 412 H PHE 54 H PHE 54 -12.661 7.302 -1.607 413 HA PHE 54 HA PHE 54 -10.997 9.291 -0.389 414 HB2 PHE 54 HB2 PHE 54 -10.590 7.160 -2.457 415 HB3 PHE 54 HB3 PHE 54 -9.396 8.437 -2.306 416 HD1 PHE 54 HD1 PHE 54 -9.725 8.706 0.766 417 HD2 PHE 54 HD2 PHE 54 -9.122 5.380 -1.836 418 HE1 PHE 54 HE1 PHE 54 -8.668 7.457 2.587 419 HE2 PHE 54 HE2 PHE 54 -8.058 4.149 0.004 420 HZ PHE 54 HZ PHE 54 -7.846 5.188 2.229 421 H SER 55 H SER 55 -9.476 10.477 -2.024 422 HA SER 55 HA SER 55 -11.207 12.052 -3.804 423 HB2 SER 55 HB2 SER 55 -8.976 12.716 -1.998 424 HB3 SER 55 HB3 SER 55 -8.883 13.497 -3.575 425 HG SER 55 HG SER 55 -10.967 13.649 -1.666 426 H GLY 56 H GLY 56 -9.975 13.008 -5.747 427 HA2 GLY 56 HA2 GLY 56 -8.337 10.849 -6.930 428 HA3 GLY 56 HA3 GLY 56 -9.433 11.870 -7.844 429 H VAL 57 H VAL 57 -7.282 13.148 -5.368 430 HA VAL 57 HA VAL 57 -5.934 14.678 -7.465 431 HB VAL 57 HB VAL 57 -7.009 15.925 -5.625 432 HG11 VAL 57 HG11 VAL 57 -4.860 14.759 -3.869 433 HG12 VAL 57 HG12 VAL 57 -6.561 14.298 -3.830 434 HG13 VAL 57 HG13 VAL 57 -6.083 15.941 -3.405 435 HG21 VAL 57 HG21 VAL 57 -5.542 17.453 -6.273 436 HG22 VAL 57 HG22 VAL 57 -4.314 16.227 -6.583 437 HG23 VAL 57 HG23 VAL 57 -4.487 16.915 -4.969 438 H ASN 58 H ASN 58 -5.091 12.711 -4.583 439 HA ASN 58 HA ASN 58 -2.917 11.387 -5.658 440 HB2 ASN 58 HB2 ASN 58 -0.962 12.610 -4.808 441 HB3 ASN 58 HB3 ASN 58 -1.841 13.563 -5.987 442 HD21 ASN 58 HD21 ASN 58 -2.937 15.403 -5.320 443 HD22 ASN 58 HD22 ASN 58 -2.681 16.122 -3.776 444 H PHE 59 H PHE 59 -1.254 12.071 -3.144 445 HA PHE 59 HA PHE 59 -2.285 9.939 -1.553 446 HB2 PHE 59 HB2 PHE 59 0.012 11.681 -0.707 447 HB3 PHE 59 HB3 PHE 59 -0.224 9.958 -0.451 448 HD1 PHE 59 HD1 PHE 59 0.431 12.448 -3.169 449 HD2 PHE 59 HD2 PHE 59 0.898 8.425 -1.842 450 HE1 PHE 59 HE1 PHE 59 1.881 11.989 -5.084 451 HE2 PHE 59 HE2 PHE 59 2.342 7.967 -3.768 452 HZ PHE 59 HZ PHE 59 2.841 9.745 -5.391 453 H ASN 60 H ASN 60 -1.628 10.700 1.044 454 HA ASN 60 HA ASN 60 -2.429 11.727 2.904 455 HB2 ASN 60 HB2 ASN 60 -3.081 13.952 0.964 456 HB3 ASN 60 HB3 ASN 60 -3.319 14.074 2.699 457 HD21 ASN 60 HD21 ASN 60 -0.688 12.229 2.628 458 HD22 ASN 60 HD22 ASN 60 0.547 13.426 2.569 459 H ARG 61 H ARG 61 -3.923 10.140 3.220 460 HA ARG 61 HA ARG 61 -6.744 10.888 2.819 461 HB2 ARG 61 HB2 ARG 61 -6.203 8.023 2.455 462 HB3 ARG 61 HB3 ARG 61 -7.272 9.082 1.558 463 HG2 ARG 61 HG2 ARG 61 -4.313 9.231 1.144 464 HG3 ARG 61 HG3 ARG 61 -5.261 7.977 0.354 465 HD2 ARG 61 HD2 ARG 61 -6.276 10.750 0.158 466 HD3 ARG 61 HD3 ARG 61 -4.802 10.380 -0.733 467 HE ARG 61 HE ARG 61 -7.458 9.517 -1.353 468 HH11 ARG 61 HH11 ARG 61 -4.080 8.640 -1.634 469 HH12 ARG 61 HH12 ARG 61 -4.317 7.716 -3.077 470 HH21 ARG 61 HH21 ARG 61 -7.754 8.300 -3.255 471 HH22 ARG 61 HH22 ARG 61 -6.399 7.519 -3.995 472 HA PRO 62 HA PRO 62 -7.526 9.372 6.919 473 HB2 PRO 62 HB2 PRO 62 -9.387 7.357 6.538 474 HB3 PRO 62 HB3 PRO 62 -9.776 9.081 6.571 475 HG2 PRO 62 HG2 PRO 62 -9.250 7.310 4.211 476 HG3 PRO 62 HG3 PRO 62 -10.545 8.486 4.433 477 HD2 PRO 62 HD2 PRO 62 -8.472 9.151 2.968 478 HD3 PRO 62 HD3 PRO 62 -9.102 10.313 4.153 479 H GLY 63 H GLY 63 -8.097 6.273 5.265 480 HA2 GLY 63 HA2 GLY 63 -6.535 4.748 7.018 481 HA3 GLY 63 HA3 GLY 63 -7.045 4.241 5.414 482 H PHE 64 H PHE 64 -5.743 6.446 4.053 483 HA PHE 64 HA PHE 64 -3.209 5.314 3.555 484 HB2 PHE 64 HB2 PHE 64 -4.550 6.670 1.949 485 HB3 PHE 64 HB3 PHE 64 -4.207 8.099 2.914 486 HD1 PHE 64 HD1 PHE 64 -1.616 8.449 3.378 487 HD2 PHE 64 HD2 PHE 64 -3.272 6.311 0.111 488 HE1 PHE 64 HE1 PHE 64 0.447 8.817 2.112 489 HE2 PHE 64 HE2 PHE 64 -1.216 6.676 -1.174 490 HZ PHE 64 HZ PHE 64 0.654 7.923 -0.174 491 H GLN 65 H GLN 65 -4.247 8.132 5.453 492 HA GLN 65 HA GLN 65 -1.680 9.045 6.146 493 HB2 GLN 65 HB2 GLN 65 -4.425 9.470 7.218 494 HB3 GLN 65 HB3 GLN 65 -3.075 9.890 8.262 495 HG2 GLN 65 HG2 GLN 65 -2.241 11.126 6.075 496 HG3 GLN 65 HG3 GLN 65 -3.967 11.130 5.720 497 HE21 GLN 65 HE21 GLN 65 -1.484 12.256 7.902 498 HE22 GLN 65 HE22 GLN 65 -2.430 13.488 8.654 499 H SER 66 H SER 66 -3.671 6.451 7.333 500 HA SER 66 HA SER 66 -2.206 6.007 9.760 501 HB2 SER 66 HB2 SER 66 -4.576 5.101 9.026 502 HB3 SER 66 HB3 SER 66 -3.633 3.798 8.311 503 HG SER 66 HG SER 66 -3.776 3.014 10.265 504 H LEU 67 H LEU 67 -2.170 4.699 6.464 505 HA LEU 67 HA LEU 67 -0.109 2.851 6.661 506 HB2 LEU 67 HB2 LEU 67 -0.919 2.637 4.561 507 HB3 LEU 67 HB3 LEU 67 -1.609 4.246 4.618 508 HG LEU 67 HG LEU 67 0.720 5.102 3.997 509 HD11 LEU 67 HD11 LEU 67 1.889 3.192 2.643 510 HD12 LEU 67 HD12 LEU 67 1.044 2.149 3.789 511 HD13 LEU 67 HD13 LEU 67 2.177 3.367 4.374 512 HD21 LEU 67 HD21 LEU 67 -0.928 3.399 2.139 513 HD22 LEU 67 HD22 LEU 67 0.367 4.471 1.602 514 HD23 LEU 67 HD23 LEU 67 -1.055 5.138 2.405 515 H ILE 68 H ILE 68 -0.004 6.337 5.940 516 HA ILE 68 HA ILE 68 2.824 6.531 5.751 517 HB ILE 68 HB ILE 68 0.673 8.596 6.186 518 HG12 ILE 68 HG12 ILE 68 0.838 7.449 3.962 519 HG13 ILE 68 HG13 ILE 68 1.046 9.194 3.894 520 HG21 ILE 68 HG21 ILE 68 2.219 10.341 6.073 521 HG22 ILE 68 HG22 ILE 68 3.524 9.274 5.555 522 HG23 ILE 68 HG23 ILE 68 2.925 9.197 7.212 523 HD11 ILE 68 HD11 ILE 68 2.598 7.958 2.433 524 HD12 ILE 68 HD12 ILE 68 3.299 7.200 3.866 525 HD13 ILE 68 HD13 ILE 68 3.429 8.944 3.640 526 H LYS 69 H LYS 69 0.509 6.993 8.409 527 HA LYS 69 HA LYS 69 2.187 8.162 10.288 528 HB2 LYS 69 HB2 LYS 69 0.468 7.931 11.712 529 HB3 LYS 69 HB3 LYS 69 -0.405 7.362 10.304 530 HG2 LYS 69 HG2 LYS 69 -0.750 5.415 11.265 531 HG3 LYS 69 HG3 LYS 69 0.974 5.162 11.484 532 HD2 LYS 69 HD2 LYS 69 -0.834 6.691 13.351 533 HD3 LYS 69 HD3 LYS 69 -0.227 5.057 13.610 534 HE2 LYS 69 HE2 LYS 69 1.352 6.159 14.799 535 HE3 LYS 69 HE3 LYS 69 2.098 6.309 13.211 536 HZ1 LYS 69 HZ1 LYS 69 1.926 8.500 13.324 537 HZ2 LYS 69 HZ2 LYS 69 1.376 8.355 14.916 538 HZ3 LYS 69 HZ3 LYS 69 0.266 8.427 13.645 539 H GLU 70 H GLU 70 1.911 4.804 9.323 540 HA GLU 70 HA GLU 70 3.674 3.827 11.384 541 HB2 GLU 70 HB2 GLU 70 1.977 2.664 9.419 542 HB3 GLU 70 HB3 GLU 70 3.605 2.081 9.113 543 HG2 GLU 70 HG2 GLU 70 2.226 0.645 10.609 544 HG3 GLU 70 HG3 GLU 70 3.778 1.140 11.271 545 H VAL 71 H VAL 71 3.886 4.863 8.019 546 HA VAL 71 HA VAL 71 6.526 4.121 7.465 547 HB VAL 71 HB VAL 71 5.021 6.574 6.505 548 HG11 VAL 71 HG11 VAL 71 6.945 7.245 5.645 549 HG12 VAL 71 HG12 VAL 71 6.912 5.823 4.602 550 HG13 VAL 71 HG13 VAL 71 7.754 5.762 6.158 551 HG21 VAL 71 HG21 VAL 71 5.524 4.195 4.789 552 HG22 VAL 71 HG22 VAL 71 4.209 5.368 4.738 553 HG23 VAL 71 HG23 VAL 71 4.225 4.117 5.980 554 H GLU 72 H GLU 72 5.278 7.228 8.724 555 HA GLU 72 HA GLU 72 7.753 8.491 9.063 556 HB2 GLU 72 HB2 GLU 72 6.425 9.840 10.860 557 HB3 GLU 72 HB3 GLU 72 5.998 9.982 9.162 558 HG2 GLU 72 HG2 GLU 72 4.034 8.866 9.415 559 HG3 GLU 72 HG3 GLU 72 4.616 7.922 10.776 560 H ALA 73 H ALA 73 5.869 6.444 11.233 561 HA ALA 73 HA ALA 73 7.615 6.758 13.478 562 HB1 ALA 73 HB1 ALA 73 5.922 5.769 14.521 563 HB2 ALA 73 HB2 ALA 73 6.145 4.302 13.568 564 HB3 ALA 73 HB3 ALA 73 5.109 5.596 12.965 565 H GLY 74 H GLY 74 8.247 5.368 10.569 566 HA2 GLY 74 HA2 GLY 74 9.781 3.897 9.795 567 HA3 GLY 74 HA3 GLY 74 10.585 4.042 11.340 568 H ASN 75 H ASN 75 7.615 2.621 10.018 569 HA ASN 75 HA ASN 75 8.184 0.100 11.449 570 HB2 ASN 75 HB2 ASN 75 5.786 1.849 11.403 571 HB3 ASN 75 HB3 ASN 75 5.458 0.132 11.248 572 HD21 ASN 75 HD21 ASN 75 4.508 1.503 13.356 573 HD22 ASN 75 HD22 ASN 75 5.336 1.037 14.791 574 H VAL 76 H VAL 76 5.944 1.386 8.971 575 HA VAL 76 HA VAL 76 5.444 -0.925 7.599 576 HB VAL 76 HB VAL 76 4.320 1.209 7.132 577 HG11 VAL 76 HG11 VAL 76 6.912 2.170 6.731 578 HG12 VAL 76 HG12 VAL 76 5.387 3.038 6.618 579 HG13 VAL 76 HG13 VAL 76 6.078 2.292 5.183 580 HG21 VAL 76 HG21 VAL 76 4.013 0.888 4.776 581 HG22 VAL 76 HG22 VAL 76 4.261 -0.691 5.521 582 HG23 VAL 76 HG23 VAL 76 5.576 0.082 4.635 583 H GLU 77 H GLU 77 7.104 -2.323 7.249 584 HA GLU 77 HA GLU 77 9.472 -1.416 5.798 585 HB2 GLU 77 HB2 GLU 77 10.522 -3.410 6.491 586 HB3 GLU 77 HB3 GLU 77 9.600 -2.849 7.876 587 HG2 GLU 77 HG2 GLU 77 8.553 -4.782 7.987 588 HG3 GLU 77 HG3 GLU 77 7.934 -4.550 6.355 589 H THR 78 H THR 78 6.505 -2.305 4.901 590 HA THR 78 HA THR 78 7.344 -3.185 2.293 591 HB THR 78 HB THR 78 5.298 -5.033 3.216 592 HG1 THR 78 HG1 THR 78 6.185 -5.556 5.036 593 HG21 THR 78 HG21 THR 78 7.646 -5.031 1.531 594 HG22 THR 78 HG22 THR 78 6.169 -5.990 1.432 595 HG23 THR 78 HG23 THR 78 7.487 -6.504 2.485 596 H LEU 79 H LEU 79 5.664 -3.117 0.731 597 HA LEU 79 HA LEU 79 3.126 -2.003 1.656 598 HB2 LEU 79 HB2 LEU 79 4.838 -0.236 0.802 599 HB3 LEU 79 HB3 LEU 79 4.431 -0.863 -0.761 600 HG LEU 79 HG LEU 79 2.963 0.877 -0.691 601 HD11 LEU 79 HD11 LEU 79 1.329 -1.074 0.899 602 HD12 LEU 79 HD12 LEU 79 1.658 -1.236 -0.824 603 HD13 LEU 79 HD13 LEU 79 0.755 0.154 -0.225 604 HD21 LEU 79 HD21 LEU 79 3.240 2.051 1.201 605 HD22 LEU 79 HD22 LEU 79 3.248 0.615 2.225 606 HD23 LEU 79 HD23 LEU 79 1.718 1.273 1.637 607 H ILE 80 H ILE 80 1.515 -3.085 0.821 608 HA ILE 80 HA ILE 80 1.894 -4.441 -1.765 609 HB ILE 80 HB ILE 80 0.369 -5.388 0.658 610 HG12 ILE 80 HG12 ILE 80 1.784 -7.425 0.297 611 HG13 ILE 80 HG13 ILE 80 2.624 -6.561 -0.985 612 HG21 ILE 80 HG21 ILE 80 0.003 -7.398 -1.063 613 HG22 ILE 80 HG22 ILE 80 0.004 -6.051 -2.202 614 HG23 ILE 80 HG23 ILE 80 -1.153 -6.080 -0.872 615 HD11 ILE 80 HD11 ILE 80 2.512 -5.277 1.680 616 HD12 ILE 80 HD12 ILE 80 3.791 -5.273 0.465 617 HD13 ILE 80 HD13 ILE 80 3.549 -6.690 1.486 618 H VAL 81 H VAL 81 0.755 -3.556 -3.296 619 HA VAL 81 HA VAL 81 -1.957 -2.554 -2.743 620 HB VAL 81 HB VAL 81 -0.004 -1.224 -4.622 621 HG11 VAL 81 HG11 VAL 81 -1.596 0.453 -4.918 622 HG12 VAL 81 HG12 VAL 81 -2.500 -0.012 -3.478 623 HG13 VAL 81 HG13 VAL 81 -2.548 -1.029 -4.916 624 HG21 VAL 81 HG21 VAL 81 -0.175 0.675 -2.810 625 HG22 VAL 81 HG22 VAL 81 0.980 -0.645 -2.592 626 HG23 VAL 81 HG23 VAL 81 -0.560 -0.659 -1.712 627 H LYS 82 H LYS 82 -3.434 -2.799 -4.463 628 HA LYS 82 HA LYS 82 -3.181 -5.005 -6.136 629 HB2 LYS 82 HB2 LYS 82 -5.161 -3.120 -5.549 630 HB3 LYS 82 HB3 LYS 82 -4.912 -2.965 -7.279 631 HG2 LYS 82 HG2 LYS 82 -5.515 -5.534 -5.834 632 HG3 LYS 82 HG3 LYS 82 -6.688 -4.553 -6.714 633 HD2 LYS 82 HD2 LYS 82 -6.050 -5.393 -8.673 634 HD3 LYS 82 HD3 LYS 82 -4.346 -5.131 -8.317 635 HE2 LYS 82 HE2 LYS 82 -4.027 -7.253 -7.658 636 HE3 LYS 82 HE3 LYS 82 -5.574 -7.329 -6.821 637 HZ1 LYS 82 HZ1 LYS 82 -5.117 -8.735 -8.966 638 HZ2 LYS 82 HZ2 LYS 82 -5.590 -7.313 -9.748 639 HZ3 LYS 82 HZ3 LYS 82 -6.645 -8.074 -8.668 640 H ASP 83 H ASP 83 -2.464 -1.585 -6.685 641 HA ASP 83 HA ASP 83 -0.514 -2.066 -8.648 642 HB2 ASP 83 HB2 ASP 83 -1.611 -1.113 -10.625 643 HB3 ASP 83 HB3 ASP 83 -2.413 -2.583 -10.099 644 H MET 84 H MET 84 0.302 -0.018 -9.645 645 HA MET 84 HA MET 84 0.625 1.971 -7.673 646 HB2 MET 84 HB2 MET 84 1.397 1.768 -10.563 647 HB3 MET 84 HB3 MET 84 1.666 3.258 -9.672 648 HG2 MET 84 HG2 MET 84 2.640 0.752 -8.440 649 HG3 MET 84 HG3 MET 84 3.490 1.343 -9.865 650 HE1 MET 84 HE1 MET 84 3.074 2.239 -5.811 651 HE2 MET 84 HE2 MET 84 4.821 2.090 -6.010 652 HE3 MET 84 HE3 MET 84 3.746 0.851 -6.665 653 H SER 85 H SER 85 -2.031 1.523 -9.697 654 HA SER 85 HA SER 85 -2.586 4.233 -10.365 655 HB2 SER 85 HB2 SER 85 -4.574 3.464 -11.287 656 HB3 SER 85 HB3 SER 85 -3.569 2.019 -11.367 657 HG SER 85 HG SER 85 -5.861 2.019 -10.376 658 H ARG 86 H ARG 86 -3.028 2.359 -7.498 659 HA ARG 86 HA ARG 86 -5.163 3.749 -6.322 660 HB2 ARG 86 HB2 ARG 86 -2.859 2.445 -4.872 661 HB3 ARG 86 HB3 ARG 86 -4.467 2.759 -4.239 662 HG2 ARG 86 HG2 ARG 86 -3.899 0.905 -6.538 663 HG3 ARG 86 HG3 ARG 86 -4.058 0.387 -4.861 664 HD2 ARG 86 HD2 ARG 86 -6.248 0.249 -5.145 665 HD3 ARG 86 HD3 ARG 86 -6.299 1.981 -5.453 666 HE ARG 86 HE ARG 86 -6.158 1.533 -7.790 667 HH11 ARG 86 HH11 ARG 86 -6.520 -1.368 -5.860 668 HH12 ARG 86 HH12 ARG 86 -7.124 -2.309 -7.179 669 HH21 ARG 86 HH21 ARG 86 -6.942 0.280 -9.516 670 HH22 ARG 86 HH22 ARG 86 -7.362 -1.378 -9.250 671 H LEU 87 H LEU 87 -1.645 4.191 -5.798 672 HA LEU 87 HA LEU 87 -2.075 6.651 -4.341 673 HB2 LEU 87 HB2 LEU 87 0.384 5.192 -5.287 674 HB3 LEU 87 HB3 LEU 87 0.484 6.782 -4.558 675 HG LEU 87 HG LEU 87 -0.965 5.499 -2.672 676 HD11 LEU 87 HD11 LEU 87 0.130 3.292 -2.318 677 HD12 LEU 87 HD12 LEU 87 0.779 3.415 -3.952 678 HD13 LEU 87 HD13 LEU 87 -0.964 3.354 -3.699 679 HD21 LEU 87 HD21 LEU 87 1.413 6.711 -2.765 680 HD22 LEU 87 HD22 LEU 87 1.948 5.054 -2.500 681 HD23 LEU 87 HD23 LEU 87 0.845 5.818 -1.357 682 H GLY 88 H GLY 88 -0.948 5.832 -7.643 683 HA2 GLY 88 HA2 GLY 88 -1.971 7.884 -9.003 684 HA3 GLY 88 HA3 GLY 88 -0.636 8.678 -8.205 685 H ARG 89 H ARG 89 -1.090 8.419 -11.010 686 HA ARG 89 HA ARG 89 0.729 6.446 -12.052 687 HB2 ARG 89 HB2 ARG 89 -0.811 8.724 -13.279 688 HB3 ARG 89 HB3 ARG 89 0.360 7.799 -14.205 689 HG2 ARG 89 HG2 ARG 89 -1.309 6.424 -14.702 690 HG3 ARG 89 HG3 ARG 89 -1.212 5.857 -13.034 691 HD2 ARG 89 HD2 ARG 89 -2.798 7.717 -12.431 692 HD3 ARG 89 HD3 ARG 89 -3.021 7.984 -14.159 693 HE ARG 89 HE ARG 89 -3.596 5.402 -13.990 694 HH11 ARG 89 HH11 ARG 89 -4.634 8.053 -11.947 695 HH12 ARG 89 HH12 ARG 89 -6.127 7.294 -11.515 696 HH21 ARG 89 HH21 ARG 89 -5.564 4.410 -13.413 697 HH22 ARG 89 HH22 ARG 89 -6.658 5.229 -12.348 698 H ASN 90 H ASN 90 0.994 9.608 -10.772 699 HA ASN 90 HA ASN 90 3.224 10.571 -12.216 700 HB2 ASN 90 HB2 ASN 90 3.522 11.979 -10.023 701 HB3 ASN 90 HB3 ASN 90 2.132 12.262 -11.063 702 HD21 ASN 90 HD21 ASN 90 3.173 10.487 -8.185 703 HD22 ASN 90 HD22 ASN 90 1.637 10.513 -7.398 704 H TYR 91 H TYR 91 4.500 8.621 -12.300 705 HA TYR 91 HA TYR 91 5.602 7.199 -10.231 706 HB2 TYR 91 HB2 TYR 91 5.795 6.571 -12.559 707 HB3 TYR 91 HB3 TYR 91 6.847 7.940 -12.879 708 HD1 TYR 91 HD1 TYR 91 6.621 4.625 -11.282 709 HD2 TYR 91 HD2 TYR 91 9.180 7.852 -12.345 710 HE1 TYR 91 HE1 TYR 91 8.588 3.194 -10.863 711 HE2 TYR 91 HE2 TYR 91 11.145 6.445 -11.916 712 HH TYR 91 HH TYR 91 11.243 3.890 -10.182 713 H LEU 92 H LEU 92 6.286 10.503 -10.978 714 HA LEU 92 HA LEU 92 8.930 10.636 -9.934 715 HB2 LEU 92 HB2 LEU 92 6.812 12.773 -10.198 716 HB3 LEU 92 HB3 LEU 92 8.476 13.081 -9.747 717 HG LEU 92 HG LEU 92 9.114 12.041 -11.994 718 HD11 LEU 92 HD11 LEU 92 7.265 10.954 -12.800 719 HD12 LEU 92 HD12 LEU 92 7.142 12.494 -13.652 720 HD13 LEU 92 HD13 LEU 92 6.148 12.193 -12.226 721 HD21 LEU 92 HD21 LEU 92 8.616 14.155 -13.197 722 HD22 LEU 92 HD22 LEU 92 9.324 14.400 -11.601 723 HD23 LEU 92 HD23 LEU 92 7.594 14.637 -11.843 724 H GLN 93 H GLN 93 5.821 11.735 -8.601 725 HA GLN 93 HA GLN 93 6.739 12.166 -5.963 726 HB2 GLN 93 HB2 GLN 93 4.085 11.924 -7.306 727 HB3 GLN 93 HB3 GLN 93 4.130 11.806 -5.553 728 HG2 GLN 93 HG2 GLN 93 5.263 14.096 -7.136 729 HG3 GLN 93 HG3 GLN 93 3.652 14.074 -6.417 730 HE21 GLN 93 HE21 GLN 93 5.866 15.876 -5.887 731 HE22 GLN 93 HE22 GLN 93 6.218 15.733 -4.204 732 H VAL 94 H VAL 94 4.955 9.460 -7.444 733 HA VAL 94 HA VAL 94 4.708 7.880 -5.161 734 HB VAL 94 HB VAL 94 5.243 6.476 -7.750 735 HG11 VAL 94 HG11 VAL 94 4.562 5.399 -5.554 736 HG12 VAL 94 HG12 VAL 94 3.614 4.968 -6.976 737 HG13 VAL 94 HG13 VAL 94 2.976 6.128 -5.806 738 HG21 VAL 94 HG21 VAL 94 3.812 7.739 -8.911 739 HG22 VAL 94 HG22 VAL 94 3.274 8.604 -7.468 740 HG23 VAL 94 HG23 VAL 94 2.542 7.058 -7.894 741 H GLY 95 H GLY 95 7.348 8.086 -7.531 742 HA2 GLY 95 HA2 GLY 95 8.970 6.039 -6.484 743 HA3 GLY 95 HA3 GLY 95 9.546 7.414 -7.410 744 H PHE 96 H PHE 96 9.017 9.550 -5.865 745 HA PHE 96 HA PHE 96 11.058 9.789 -4.074 746 HB2 PHE 96 HB2 PHE 96 10.039 11.821 -4.472 747 HB3 PHE 96 HB3 PHE 96 8.419 11.147 -4.388 748 HD1 PHE 96 HD1 PHE 96 7.414 10.666 -2.120 749 HD2 PHE 96 HD2 PHE 96 11.026 12.865 -2.617 750 HE1 PHE 96 HE1 PHE 96 7.174 11.570 0.149 751 HE2 PHE 96 HE2 PHE 96 10.787 13.769 -0.343 752 HZ PHE 96 HZ PHE 96 8.859 13.123 1.041 753 H TYR 97 H TYR 97 7.748 8.698 -3.402 754 HA TYR 97 HA TYR 97 8.067 8.348 -0.634 755 HB2 TYR 97 HB2 TYR 97 6.153 7.164 -2.626 756 HB3 TYR 97 HB3 TYR 97 6.077 6.756 -0.913 757 HD1 TYR 97 HD1 TYR 97 6.026 8.815 0.713 758 HD2 TYR 97 HD2 TYR 97 4.964 8.992 -3.397 759 HE1 TYR 97 HE1 TYR 97 4.766 10.878 1.135 760 HE2 TYR 97 HE2 TYR 97 3.707 11.057 -2.991 761 HH TYR 97 HH TYR 97 2.509 12.078 -0.761 762 H THR 98 H THR 98 8.429 6.024 -3.320 763 HA THR 98 HA THR 98 9.142 3.899 -1.514 764 HB THR 98 HB THR 98 9.592 2.618 -3.600 765 HG1 THR 98 HG1 THR 98 10.260 4.158 -5.023 766 HG21 THR 98 HG21 THR 98 6.992 4.074 -3.877 767 HG22 THR 98 HG22 THR 98 7.281 2.866 -2.626 768 HG23 THR 98 HG23 THR 98 7.377 2.414 -4.327 769 H GLU 99 H GLU 99 10.990 6.319 -3.298 770 HA GLU 99 HA GLU 99 13.451 4.802 -2.903 771 HB2 GLU 99 HB2 GLU 99 14.534 6.532 -4.276 772 HB3 GLU 99 HB3 GLU 99 13.206 5.720 -5.083 773 HG2 GLU 99 HG2 GLU 99 12.340 7.675 -5.549 774 HG3 GLU 99 HG3 GLU 99 12.096 7.975 -3.835 775 H VAL 100 H VAL 100 12.151 7.969 -1.842 776 HA VAL 100 HA VAL 100 14.499 8.141 -0.075 777 HB VAL 100 HB VAL 100 14.300 10.065 -1.544 778 HG11 VAL 100 HG11 VAL 100 12.409 11.701 -1.061 779 HG12 VAL 100 HG12 VAL 100 11.567 10.329 -0.346 780 HG13 VAL 100 HG13 VAL 100 12.032 10.290 -2.046 781 HG21 VAL 100 HG21 VAL 100 14.468 11.810 0.130 782 HG22 VAL 100 HG22 VAL 100 15.256 10.337 0.697 783 HG23 VAL 100 HG23 VAL 100 13.662 10.778 1.311 784 H LEU 101 H LEU 101 10.984 8.463 -0.069 785 HA LEU 101 HA LEU 101 10.710 9.100 2.668 786 HB2 LEU 101 HB2 LEU 101 9.046 9.171 0.601 787 HB3 LEU 101 HB3 LEU 101 8.559 7.615 1.249 788 HG LEU 101 HG LEU 101 7.071 9.301 2.089 789 HD11 LEU 101 HD11 LEU 101 8.907 8.771 4.405 790 HD12 LEU 101 HD12 LEU 101 8.025 7.457 3.627 791 HD13 LEU 101 HD13 LEU 101 7.145 8.797 4.362 792 HD21 LEU 101 HD21 LEU 101 9.169 10.759 3.585 793 HD22 LEU 101 HD22 LEU 101 7.666 11.342 2.869 794 HD23 LEU 101 HD23 LEU 101 9.076 11.054 1.850 795 H PHE 102 H PHE 102 9.945 6.023 1.036 796 HA PHE 102 HA PHE 102 9.438 4.582 3.334 797 HB2 PHE 102 HB2 PHE 102 10.131 3.726 0.559 798 HB3 PHE 102 HB3 PHE 102 9.787 2.571 1.832 799 HD1 PHE 102 HD1 PHE 102 8.037 5.693 2.018 800 HD2 PHE 102 HD2 PHE 102 7.889 1.765 0.373 801 HE1 PHE 102 HE1 PHE 102 5.645 5.960 1.598 802 HE2 PHE 102 HE2 PHE 102 5.477 2.030 -0.035 803 HZ PHE 102 HZ PHE 102 4.351 4.131 0.580 804 HA PRO 103 HA PRO 103 14.219 2.959 2.576 805 HB2 PRO 103 HB2 PRO 103 14.967 5.819 3.061 806 HB3 PRO 103 HB3 PRO 103 15.855 4.555 2.214 807 HG2 PRO 103 HG2 PRO 103 14.479 6.385 0.868 808 HG3 PRO 103 HG3 PRO 103 14.528 4.702 0.317 809 HD2 PRO 103 HD2 PRO 103 12.310 6.215 1.541 810 HD3 PRO 103 HD3 PRO 103 12.268 4.792 0.500 811 H GLN 104 H GLN 104 12.933 5.426 4.775 812 HA GLN 104 HA GLN 104 14.635 5.283 6.895 813 HB2 GLN 104 HB2 GLN 104 11.877 5.148 7.841 814 HB3 GLN 104 HB3 GLN 104 13.098 6.382 8.098 815 HG2 GLN 104 HG2 GLN 104 12.613 7.309 5.886 816 HG3 GLN 104 HG3 GLN 104 11.371 6.082 5.668 817 HE21 GLN 104 HE21 GLN 104 9.416 6.872 5.938 818 HE22 GLN 104 HE22 GLN 104 8.948 8.074 7.087 819 H LYS 105 H LYS 105 12.105 2.914 6.141 820 HA LYS 105 HA LYS 105 13.262 1.206 8.227 821 HB2 LYS 105 HB2 LYS 105 10.554 0.463 7.500 822 HB3 LYS 105 HB3 LYS 105 11.256 0.738 9.084 823 HG2 LYS 105 HG2 LYS 105 9.797 2.446 9.133 824 HG3 LYS 105 HG3 LYS 105 11.037 3.281 8.210 825 HD2 LYS 105 HD2 LYS 105 9.492 1.795 6.396 826 HD3 LYS 105 HD3 LYS 105 8.370 2.603 7.492 827 HE2 LYS 105 HE2 LYS 105 9.386 4.731 7.031 828 HE3 LYS 105 HE3 LYS 105 10.628 3.956 6.047 829 HZ1 LYS 105 HZ1 LYS 105 9.019 3.330 4.453 830 HZ2 LYS 105 HZ2 LYS 105 8.769 4.971 4.782 831 HZ3 LYS 105 HZ3 LYS 105 7.735 3.811 5.441 832 H ASN 106 H ASN 106 13.385 1.466 5.018 833 HA ASN 106 HA ASN 106 13.891 0.029 3.333 834 HB2 ASN 106 HB2 ASN 106 15.276 -1.138 4.992 835 HB3 ASN 106 HB3 ASN 106 13.885 -2.091 5.494 836 HD21 ASN 106 HD21 ASN 106 16.399 -3.022 4.501 837 HD22 ASN 106 HD22 ASN 106 16.071 -3.910 3.061 838 H VAL 107 H VAL 107 12.234 -0.052 1.983 839 HA VAL 107 HA VAL 107 9.874 -1.621 2.759 840 HB VAL 107 HB VAL 107 9.728 0.918 2.386 841 HG11 VAL 107 HG11 VAL 107 9.706 1.742 0.252 842 HG12 VAL 107 HG12 VAL 107 9.138 0.226 -0.440 843 HG13 VAL 107 HG13 VAL 107 10.831 0.413 0.012 844 HG21 VAL 107 HG21 VAL 107 7.865 -0.585 2.830 845 HG22 VAL 107 HG22 VAL 107 7.802 -1.024 1.125 846 HG23 VAL 107 HG23 VAL 107 7.419 0.620 1.626 847 H ARG 108 H ARG 108 8.764 -2.795 1.335 848 HA ARG 108 HA ARG 108 10.014 -3.442 -1.232 849 HB2 ARG 108 HB2 ARG 108 9.642 -5.177 0.982 850 HB3 ARG 108 HB3 ARG 108 8.437 -5.628 -0.214 851 HG2 ARG 108 HG2 ARG 108 10.053 -6.890 -1.085 852 HG3 ARG 108 HG3 ARG 108 10.685 -5.380 -1.742 853 HD2 ARG 108 HD2 ARG 108 12.268 -5.166 -0.039 854 HD3 ARG 108 HD3 ARG 108 11.436 -6.316 1.001 855 HE ARG 108 HE ARG 108 12.775 -7.146 -1.488 856 HH11 ARG 108 HH11 ARG 108 12.226 -7.554 1.957 857 HH12 ARG 108 HH12 ARG 108 13.182 -8.991 2.055 858 HH21 ARG 108 HH21 ARG 108 14.038 -9.031 -1.333 859 HH22 ARG 108 HH22 ARG 108 14.212 -9.826 0.195 860 H PHE 109 H PHE 109 8.679 -2.058 -2.342 861 HA PHE 109 HA PHE 109 5.860 -2.019 -1.842 862 HB2 PHE 109 HB2 PHE 109 7.514 -0.167 -2.815 863 HB3 PHE 109 HB3 PHE 109 6.946 -0.833 -4.338 864 HD1 PHE 109 HD1 PHE 109 4.347 -1.065 -4.568 865 HD2 PHE 109 HD2 PHE 109 6.310 1.465 -1.774 866 HE1 PHE 109 HE1 PHE 109 2.310 0.294 -4.394 867 HE2 PHE 109 HE2 PHE 109 4.282 2.841 -1.578 868 HZ PHE 109 HZ PHE 109 2.271 2.254 -2.891 869 H LEU 110 H LEU 110 4.205 -2.774 -3.162 870 HA LEU 110 HA LEU 110 4.973 -4.425 -5.453 871 HB2 LEU 110 HB2 LEU 110 4.775 -6.071 -3.839 872 HB3 LEU 110 HB3 LEU 110 3.443 -5.281 -3.029 873 HG LEU 110 HG LEU 110 2.983 -7.457 -4.306 874 HD11 LEU 110 HD11 LEU 110 0.882 -6.846 -4.057 875 HD12 LEU 110 HD12 LEU 110 0.996 -5.724 -5.412 876 HD13 LEU 110 HD13 LEU 110 1.431 -5.195 -3.788 877 HD21 LEU 110 HD21 LEU 110 4.120 -6.053 -6.410 878 HD22 LEU 110 HD22 LEU 110 2.393 -6.060 -6.762 879 HD23 LEU 110 HD23 LEU 110 3.246 -7.580 -6.504 880 H ALA 111 H ALA 111 3.841 -4.074 -7.150 881 HA ALA 111 HA ALA 111 1.143 -2.893 -6.976 882 HB1 ALA 111 HB1 ALA 111 3.305 -2.222 -8.986 883 HB2 ALA 111 HB2 ALA 111 2.694 -1.163 -7.709 884 HB3 ALA 111 HB3 ALA 111 1.642 -1.636 -9.045 885 H ILE 112 H ILE 112 0.222 -4.897 -7.142 886 HA ILE 112 HA ILE 112 0.987 -6.996 -8.718 887 HB ILE 112 HB ILE 112 -1.623 -6.216 -7.536 888 HG12 ILE 112 HG12 ILE 112 -0.471 -8.839 -7.028 889 HG13 ILE 112 HG13 ILE 112 0.659 -7.539 -6.702 890 HG21 ILE 112 HG21 ILE 112 -2.437 -8.540 -8.233 891 HG22 ILE 112 HG22 ILE 112 -1.200 -8.460 -9.487 892 HG23 ILE 112 HG23 ILE 112 -2.492 -7.261 -9.447 893 HD11 ILE 112 HD11 ILE 112 -1.274 -6.508 -5.357 894 HD12 ILE 112 HD12 ILE 112 -0.375 -7.865 -4.677 895 HD13 ILE 112 HD13 ILE 112 -1.954 -8.134 -5.406 896 H ASN 113 H ASN 113 -1.448 -4.568 -9.785 897 HA ASN 113 HA ASN 113 -1.732 -5.917 -12.306 898 HB2 ASN 113 HB2 ASN 113 -3.192 -3.974 -10.833 899 HB3 ASN 113 HB3 ASN 113 -2.879 -3.318 -12.436 900 HD21 ASN 113 HD21 ASN 113 -4.757 -5.434 -10.589 901 HD22 ASN 113 HD22 ASN 113 -5.631 -6.174 -11.882 902 H ASN 114 H ASN 114 1.007 -4.905 -11.836 903 HA ASN 114 HA ASN 114 1.685 -4.087 -14.367 904 HB2 ASN 114 HB2 ASN 114 0.472 -1.928 -12.996 905 HB3 ASN 114 HB3 ASN 114 2.190 -1.573 -13.108 906 HD21 ASN 114 HD21 ASN 114 -0.762 -1.578 -14.737 907 HD22 ASN 114 HD22 ASN 114 -0.172 -1.208 -16.316 908 H SER 115 H SER 115 3.858 -2.577 -14.229 909 HA SER 115 HA SER 115 5.652 -4.146 -12.559 910 HB2 SER 115 HB2 SER 115 6.086 -2.188 -14.815 911 HB3 SER 115 HB3 SER 115 7.421 -2.824 -13.855 912 HG SER 115 HG SER 115 6.841 -3.992 -15.857 913 H ILE 116 H ILE 116 5.871 -3.457 -10.519 914 HA ILE 116 HA ILE 116 5.362 -0.842 -9.643 915 HB ILE 116 HB ILE 116 5.549 -3.167 -8.355 916 HG12 ILE 116 HG12 ILE 116 4.500 -1.071 -7.559 917 HG13 ILE 116 HG13 ILE 116 5.356 -1.926 -6.283 918 HG21 ILE 116 HG21 ILE 116 7.464 -3.167 -6.835 919 HG22 ILE 116 HG22 ILE 116 8.149 -1.798 -7.708 920 HG23 ILE 116 HG23 ILE 116 7.964 -3.353 -8.517 921 HD11 ILE 116 HD11 ILE 116 5.919 0.687 -7.535 922 HD12 ILE 116 HD12 ILE 116 7.305 -0.290 -7.051 923 HD13 ILE 116 HD13 ILE 116 6.089 0.168 -5.859 924 H ASP 117 H ASP 117 8.495 -2.484 -10.160 925 HA ASP 117 HA ASP 117 9.788 -0.142 -11.055 926 HB2 ASP 117 HB2 ASP 117 9.449 -0.109 -8.312 927 HB3 ASP 117 HB3 ASP 117 11.082 -0.739 -8.496 928 H SER 118 H SER 118 9.633 -2.986 -11.717 929 HA SER 118 HA SER 118 12.323 -3.961 -11.143 930 HB2 SER 118 HB2 SER 118 9.794 -5.222 -11.617 931 HB3 SER 118 HB3 SER 118 10.951 -5.789 -12.819 932 HG SER 118 HG SER 118 12.375 -6.259 -11.046 933 H ASN 119 H ASN 119 13.736 -4.692 -12.838 934 HA ASN 119 HA ASN 119 13.513 -3.043 -15.239 935 HB2 ASN 119 HB2 ASN 119 15.679 -3.898 -13.604 936 HB3 ASN 119 HB3 ASN 119 15.930 -4.561 -15.221 937 HD21 ASN 119 HD21 ASN 119 14.995 -1.576 -13.581 938 HD22 ASN 119 HD22 ASN 119 15.850 -0.528 -14.643 939 H ASN 120 H ASN 120 15.039 -4.492 -17.025 940 HA ASN 120 HA ASN 120 14.993 -6.113 -18.587 941 HB2 ASN 120 HB2 ASN 120 15.247 -7.640 -16.658 942 HB3 ASN 120 HB3 ASN 120 13.500 -7.739 -16.541 943 HD21 ASN 120 HD21 ASN 120 16.204 -8.336 -18.732 944 HD22 ASN 120 HD22 ASN 120 15.472 -9.665 -19.555 Start of MODEL 7 1 H1 GLY 1 H1 GLY 1 14.245 0.638 24.183 2 H2 GLY 1 H2 GLY 1 15.820 0.506 23.586 3 H3 GLY 1 H3 GLY 1 14.654 -0.638 23.153 4 HA2 GLY 1 HA2 GLY 1 13.425 0.959 21.898 5 HA3 GLY 1 HA3 GLY 1 14.485 2.240 22.463 6 H SER 2 H SER 2 15.058 -1.006 21.085 7 HA SER 2 HA SER 2 16.512 0.251 18.871 8 HB2 SER 2 HB2 SER 2 17.946 -0.697 20.912 9 HB3 SER 2 HB3 SER 2 17.707 -2.213 20.044 10 HG SER 2 HG SER 2 19.609 -1.000 19.422 11 H ARG 3 H ARG 3 15.649 -2.992 20.122 12 HA ARG 3 HA ARG 3 14.828 -3.738 17.401 13 HB2 ARG 3 HB2 ARG 3 16.051 -5.207 19.650 14 HB3 ARG 3 HB3 ARG 3 14.806 -6.082 18.769 15 HG2 ARG 3 HG2 ARG 3 17.172 -6.421 17.980 16 HG3 ARG 3 HG3 ARG 3 16.003 -5.954 16.744 17 HD2 ARG 3 HD2 ARG 3 16.791 -3.715 16.721 18 HD3 ARG 3 HD3 ARG 3 17.758 -3.970 18.173 19 HE ARG 3 HE ARG 3 18.520 -4.538 15.489 20 HH11 ARG 3 HH11 ARG 3 18.948 -5.636 18.788 21 HH12 ARG 3 HH12 ARG 3 20.491 -6.354 18.477 22 HH21 ARG 3 HH21 ARG 3 20.552 -5.486 15.089 23 HH22 ARG 3 HH22 ARG 3 21.402 -6.269 16.379 24 H THR 4 H THR 4 12.816 -4.562 16.978 25 HA THR 4 HA THR 4 10.919 -5.237 18.973 26 HB THR 4 HB THR 4 10.950 -2.819 19.329 27 HG1 THR 4 HG1 THR 4 8.966 -3.589 19.713 28 HG21 THR 4 HG21 THR 4 11.497 -2.425 16.817 29 HG22 THR 4 HG22 THR 4 10.596 -1.229 17.750 30 HG23 THR 4 HG23 THR 4 9.743 -2.332 16.670 31 H SER 5 H SER 5 8.537 -4.681 17.613 32 HA SER 5 HA SER 5 8.892 -6.236 15.128 33 HB2 SER 5 HB2 SER 5 6.625 -6.220 17.123 34 HB3 SER 5 HB3 SER 5 6.527 -6.993 15.542 35 HG SER 5 HG SER 5 7.911 -7.761 17.814 36 H ARG 6 H ARG 6 8.842 -4.793 13.493 37 HA ARG 6 HA ARG 6 7.083 -2.504 13.513 38 HB2 ARG 6 HB2 ARG 6 8.118 -1.846 11.519 39 HB3 ARG 6 HB3 ARG 6 9.397 -2.665 12.396 40 HG2 ARG 6 HG2 ARG 6 7.743 -4.025 10.307 41 HG3 ARG 6 HG3 ARG 6 9.209 -3.133 9.930 42 HD2 ARG 6 HD2 ARG 6 10.222 -5.110 10.237 43 HD3 ARG 6 HD3 ARG 6 10.095 -4.698 11.945 44 HE ARG 6 HE ARG 6 7.809 -5.974 11.611 45 HH11 ARG 6 HH11 ARG 6 11.004 -6.825 10.452 46 HH12 ARG 6 HH12 ARG 6 10.675 -8.523 10.426 47 HH21 ARG 6 HH21 ARG 6 7.384 -8.217 11.563 48 HH22 ARG 6 HH22 ARG 6 8.628 -9.314 11.064 49 H ILE 7 H ILE 7 6.228 -2.668 10.662 50 HA ILE 7 HA ILE 7 4.551 -5.044 10.709 51 HB ILE 7 HB ILE 7 2.494 -3.916 10.499 52 HG12 ILE 7 HG12 ILE 7 3.213 -1.213 11.170 53 HG13 ILE 7 HG13 ILE 7 3.980 -1.710 9.663 54 HG21 ILE 7 HG21 ILE 7 3.311 -4.358 12.767 55 HG22 ILE 7 HG22 ILE 7 2.231 -2.966 12.702 56 HG23 ILE 7 HG23 ILE 7 3.973 -2.725 12.822 57 HD11 ILE 7 HD11 ILE 7 1.851 -2.285 8.714 58 HD12 ILE 7 HD12 ILE 7 1.783 -0.639 9.337 59 HD13 ILE 7 HD13 ILE 7 1.032 -1.956 10.240 60 H THR 8 H THR 8 3.080 -5.246 8.833 61 HA THR 8 HA THR 8 4.443 -4.459 6.347 62 HB THR 8 HB THR 8 2.585 -6.714 7.122 63 HG1 THR 8 HG1 THR 8 5.144 -6.509 5.931 64 HG21 THR 8 HG21 THR 8 1.543 -6.298 5.119 65 HG22 THR 8 HG22 THR 8 2.832 -7.393 4.632 66 HG23 THR 8 HG23 THR 8 2.999 -5.657 4.361 67 H ALA 9 H ALA 9 3.213 -3.416 4.608 68 HA ALA 9 HA ALA 9 0.715 -2.239 5.657 69 HB1 ALA 9 HB1 ALA 9 2.649 -1.129 3.646 70 HB2 ALA 9 HB2 ALA 9 2.330 -0.540 5.276 71 HB3 ALA 9 HB3 ALA 9 1.089 -0.406 4.035 72 H LEU 10 H LEU 10 -1.066 -2.916 4.883 73 HA LEU 10 HA LEU 10 -1.216 -3.863 2.092 74 HB2 LEU 10 HB2 LEU 10 -1.692 -5.406 4.136 75 HB3 LEU 10 HB3 LEU 10 -3.194 -4.524 4.253 76 HG LEU 10 HG LEU 10 -2.639 -5.589 1.579 77 HD11 LEU 10 HD11 LEU 10 -1.658 -7.352 3.026 78 HD12 LEU 10 HD12 LEU 10 -3.086 -7.891 2.143 79 HD13 LEU 10 HD13 LEU 10 -3.208 -7.486 3.855 80 HD21 LEU 10 HD21 LEU 10 -4.754 -4.663 1.976 81 HD22 LEU 10 HD22 LEU 10 -4.919 -5.492 3.520 82 HD23 LEU 10 HD23 LEU 10 -5.013 -6.411 2.016 83 H TYR 11 H TYR 11 -1.872 -2.049 0.993 84 HA TYR 11 HA TYR 11 -4.145 -0.576 2.124 85 HB2 TYR 11 HB2 TYR 11 -2.748 1.156 1.964 86 HB3 TYR 11 HB3 TYR 11 -1.658 0.308 0.897 87 HD1 TYR 11 HD1 TYR 11 -4.787 2.286 1.002 88 HD2 TYR 11 HD2 TYR 11 -1.612 0.801 -1.390 89 HE1 TYR 11 HE1 TYR 11 -5.509 3.739 -0.845 90 HE2 TYR 11 HE2 TYR 11 -2.315 2.240 -3.237 91 HH TYR 11 HH TYR 11 -3.712 4.595 -3.311 92 H GLU 12 H GLU 12 -6.033 -0.391 1.007 93 HA GLU 12 HA GLU 12 -6.090 -1.238 -1.804 94 HB2 GLU 12 HB2 GLU 12 -7.936 -2.802 -1.325 95 HB3 GLU 12 HB3 GLU 12 -6.423 -3.265 -0.560 96 HG2 GLU 12 HG2 GLU 12 -8.188 -1.602 1.093 97 HG3 GLU 12 HG3 GLU 12 -8.826 -3.192 0.681 98 H ARG 13 H ARG 13 -7.967 -0.733 -2.987 99 HA ARG 13 HA ARG 13 -10.089 0.809 -1.767 100 HB2 ARG 13 HB2 ARG 13 -8.776 2.688 -2.207 101 HB3 ARG 13 HB3 ARG 13 -8.110 2.013 -3.682 102 HG2 ARG 13 HG2 ARG 13 -11.018 2.499 -3.682 103 HG3 ARG 13 HG3 ARG 13 -9.983 3.927 -3.629 104 HD2 ARG 13 HD2 ARG 13 -9.317 1.798 -5.587 105 HD3 ARG 13 HD3 ARG 13 -10.726 2.799 -5.914 106 HE ARG 13 HE ARG 13 -9.237 4.737 -5.816 107 HH11 ARG 13 HH11 ARG 13 -7.733 1.601 -6.279 108 HH12 ARG 13 HH12 ARG 13 -6.323 2.257 -7.037 109 HH21 ARG 13 HH21 ARG 13 -7.382 5.585 -6.811 110 HH22 ARG 13 HH22 ARG 13 -6.126 4.520 -7.343 111 H LEU 14 H LEU 14 -11.993 0.245 -2.664 112 HA LEU 14 HA LEU 14 -11.944 -1.032 -5.314 113 HB2 LEU 14 HB2 LEU 14 -12.650 -2.871 -4.233 114 HB3 LEU 14 HB3 LEU 14 -12.935 -1.979 -2.761 115 HG LEU 14 HG LEU 14 -14.891 -3.258 -3.717 116 HD11 LEU 14 HD11 LEU 14 -14.790 -1.015 -2.225 117 HD12 LEU 14 HD12 LEU 14 -16.257 -1.927 -2.575 118 HD13 LEU 14 HD13 LEU 14 -15.855 -0.505 -3.536 119 HD21 LEU 14 HD21 LEU 14 -14.346 -2.228 -6.101 120 HD22 LEU 14 HD22 LEU 14 -15.461 -0.986 -5.534 121 HD23 LEU 14 HD23 LEU 14 -15.985 -2.658 -5.620 122 H SER 15 H SER 15 -13.311 -0.358 -6.819 123 HA SER 15 HA SER 15 -15.274 1.722 -6.117 124 HB2 SER 15 HB2 SER 15 -13.757 2.862 -7.456 125 HB3 SER 15 HB3 SER 15 -13.404 1.446 -8.443 126 HG SER 15 HG SER 15 -15.124 1.839 -9.655 127 H ARG 16 H ARG 16 -17.343 1.236 -6.467 128 HA ARG 16 HA ARG 16 -18.071 -1.243 -7.744 129 HB2 ARG 16 HB2 ARG 16 -19.612 0.900 -6.313 130 HB3 ARG 16 HB3 ARG 16 -20.444 -0.371 -7.195 131 HG2 ARG 16 HG2 ARG 16 -18.660 -0.632 -4.798 132 HG3 ARG 16 HG3 ARG 16 -20.359 -1.080 -4.958 133 HD2 ARG 16 HD2 ARG 16 -19.339 -2.626 -6.878 134 HD3 ARG 16 HD3 ARG 16 -17.918 -2.507 -5.845 135 HE ARG 16 HE ARG 16 -18.994 -3.764 -4.240 136 HH11 ARG 16 HH11 ARG 16 -21.268 -2.910 -6.763 137 HH12 ARG 16 HH12 ARG 16 -22.464 -4.043 -6.235 138 HH21 ARG 16 HH21 ARG 16 -20.571 -5.263 -3.560 139 HH22 ARG 16 HH22 ARG 16 -22.071 -5.376 -4.418 140 H ASP 17 H ASP 17 -17.541 1.856 -8.913 141 HA ASP 17 HA ASP 17 -19.612 1.913 -10.914 142 HB2 ASP 17 HB2 ASP 17 -17.328 3.647 -10.142 143 HB3 ASP 17 HB3 ASP 17 -17.874 3.752 -11.812 144 H ASP 18 H ASP 18 -16.681 0.290 -10.585 145 HA ASP 18 HA ASP 18 -15.704 0.307 -13.233 146 HB2 ASP 18 HB2 ASP 18 -15.393 -1.532 -10.884 147 HB3 ASP 18 HB3 ASP 18 -14.606 -1.871 -12.426 148 H ASP 19 H ASP 19 -15.723 -1.456 -14.767 149 HA ASP 19 HA ASP 19 -18.301 -2.500 -15.268 150 HB2 ASP 19 HB2 ASP 19 -17.150 -3.818 -17.078 151 HB3 ASP 19 HB3 ASP 19 -16.886 -2.080 -17.151 152 H LEU 20 H LEU 20 -15.696 -3.594 -13.373 153 HA LEU 20 HA LEU 20 -16.301 -6.390 -13.404 154 HB2 LEU 20 HB2 LEU 20 -14.883 -6.304 -11.221 155 HB3 LEU 20 HB3 LEU 20 -14.111 -6.053 -12.770 156 HG LEU 20 HG LEU 20 -14.222 -3.579 -12.350 157 HD11 LEU 20 HD11 LEU 20 -14.519 -2.866 -9.989 158 HD12 LEU 20 HD12 LEU 20 -15.116 -4.479 -9.618 159 HD13 LEU 20 HD13 LEU 20 -16.004 -3.448 -10.739 160 HD21 LEU 20 HD21 LEU 20 -12.470 -3.697 -10.469 161 HD22 LEU 20 HD22 LEU 20 -12.131 -4.506 -11.999 162 HD23 LEU 20 HD23 LEU 20 -12.670 -5.444 -10.607 163 H THR 21 H THR 21 -17.145 -7.608 -11.593 164 HA THR 21 HA THR 21 -18.473 -6.281 -9.431 165 HB THR 21 HB THR 21 -20.748 -7.390 -10.197 166 HG1 THR 21 HG1 THR 21 -19.648 -6.664 -12.703 167 HG21 THR 21 HG21 THR 21 -20.784 -5.070 -11.754 168 HG22 THR 21 HG22 THR 21 -19.662 -4.745 -10.432 169 HG23 THR 21 HG23 THR 21 -21.315 -5.257 -10.084 170 H GLY 22 H GLY 22 -17.983 -7.582 -7.818 171 HA2 GLY 22 HA2 GLY 22 -18.875 -9.898 -7.038 172 HA3 GLY 22 HA3 GLY 22 -17.744 -10.465 -8.251 173 H GLU 23 H GLU 23 -15.901 -11.164 -7.360 174 HA GLU 23 HA GLU 23 -15.097 -10.652 -4.710 175 HB2 GLU 23 HB2 GLU 23 -14.358 -12.633 -5.936 176 HB3 GLU 23 HB3 GLU 23 -13.459 -11.628 -7.061 177 HG2 GLU 23 HG2 GLU 23 -11.680 -11.645 -5.739 178 HG3 GLU 23 HG3 GLU 23 -12.626 -11.050 -4.379 179 H SER 24 H SER 24 -14.476 -8.920 -7.666 180 HA SER 24 HA SER 24 -12.368 -7.322 -6.459 181 HB2 SER 24 HB2 SER 24 -12.908 -6.137 -8.876 182 HB3 SER 24 HB3 SER 24 -11.723 -7.416 -8.622 183 HG SER 24 HG SER 24 -14.319 -7.573 -9.684 184 H ASN 25 H ASN 25 -15.570 -7.298 -6.014 185 HA ASN 25 HA ASN 25 -15.686 -4.371 -5.856 186 HB2 ASN 25 HB2 ASN 25 -17.937 -6.211 -6.659 187 HB3 ASN 25 HB3 ASN 25 -18.058 -4.468 -6.486 188 HD21 ASN 25 HD21 ASN 25 -16.229 -6.971 -8.190 189 HD22 ASN 25 HD22 ASN 25 -16.025 -6.066 -9.644 190 H SER 26 H SER 26 -14.862 -5.119 -3.648 191 HA SER 26 HA SER 26 -16.842 -4.656 -1.738 192 HB2 SER 26 HB2 SER 26 -16.075 -7.220 -0.806 193 HB3 SER 26 HB3 SER 26 -17.685 -6.679 -1.265 194 HG SER 26 HG SER 26 -17.514 -7.708 -3.114 195 H ILE 27 H ILE 27 -15.857 -3.811 -0.013 196 HA ILE 27 HA ILE 27 -13.161 -3.321 0.096 197 HB ILE 27 HB ILE 27 -15.287 -3.299 2.196 198 HG12 ILE 27 HG12 ILE 27 -15.258 -1.453 0.632 199 HG13 ILE 27 HG13 ILE 27 -14.736 -0.871 2.207 200 HG21 ILE 27 HG21 ILE 27 -13.661 -3.839 3.686 201 HG22 ILE 27 HG22 ILE 27 -13.380 -2.099 3.580 202 HG23 ILE 27 HG23 ILE 27 -12.363 -3.214 2.669 203 HD11 ILE 27 HD11 ILE 27 -13.393 0.120 0.471 204 HD12 ILE 27 HD12 ILE 27 -12.968 -1.473 -0.159 205 HD13 ILE 27 HD13 ILE 27 -12.396 -0.974 1.432 206 H THR 28 H THR 28 -14.806 -5.632 2.281 207 HA THR 28 HA THR 28 -12.489 -6.810 3.282 208 HB THR 28 HB THR 28 -15.218 -7.100 3.667 209 HG1 THR 28 HG1 THR 28 -14.532 -7.873 5.520 210 HG21 THR 28 HG21 THR 28 -15.722 -9.417 3.648 211 HG22 THR 28 HG22 THR 28 -14.095 -9.826 3.105 212 HG23 THR 28 HG23 THR 28 -15.198 -8.978 2.023 213 H ASN 29 H ASN 29 -14.114 -7.377 0.226 214 HA ASN 29 HA ASN 29 -13.013 -9.924 -0.306 215 HB2 ASN 29 HB2 ASN 29 -14.797 -8.239 -1.620 216 HB3 ASN 29 HB3 ASN 29 -13.438 -8.382 -2.722 217 HD21 ASN 29 HD21 ASN 29 -16.295 -9.508 -2.502 218 HD22 ASN 29 HD22 ASN 29 -16.082 -11.182 -2.867 219 H GLN 30 H GLN 30 -11.968 -6.716 -1.655 220 HA GLN 30 HA GLN 30 -9.653 -7.821 -2.825 221 HB2 GLN 30 HB2 GLN 30 -9.059 -5.129 -1.975 222 HB3 GLN 30 HB3 GLN 30 -9.186 -5.783 -3.591 223 HG2 GLN 30 HG2 GLN 30 -10.992 -4.580 -3.925 224 HG3 GLN 30 HG3 GLN 30 -11.814 -5.409 -2.611 225 HE21 GLN 30 HE21 GLN 30 -11.443 -4.596 -0.452 226 HE22 GLN 30 HE22 GLN 30 -11.202 -2.910 -0.222 227 H LYS 31 H LYS 31 -10.315 -6.706 0.456 228 HA LYS 31 HA LYS 31 -7.733 -6.532 1.458 229 HB2 LYS 31 HB2 LYS 31 -10.061 -7.794 2.928 230 HB3 LYS 31 HB3 LYS 31 -8.642 -7.042 3.642 231 HG2 LYS 31 HG2 LYS 31 -9.688 -5.023 2.110 232 HG3 LYS 31 HG3 LYS 31 -11.117 -5.847 2.729 233 HD2 LYS 31 HD2 LYS 31 -9.171 -5.597 4.807 234 HD3 LYS 31 HD3 LYS 31 -9.469 -4.022 4.078 235 HE2 LYS 31 HE2 LYS 31 -11.976 -5.264 4.391 236 HE3 LYS 31 HE3 LYS 31 -11.090 -5.522 5.894 237 HZ1 LYS 31 HZ1 LYS 31 -10.874 -3.246 6.243 238 HZ2 LYS 31 HZ2 LYS 31 -12.460 -3.409 5.681 239 HZ3 LYS 31 HZ3 LYS 31 -11.250 -2.851 4.642 240 H LYS 32 H LYS 32 -9.863 -9.342 1.188 241 HA LYS 32 HA LYS 32 -8.155 -11.331 2.120 242 HB2 LYS 32 HB2 LYS 32 -10.700 -11.199 0.894 243 HB3 LYS 32 HB3 LYS 32 -9.747 -12.321 -0.066 244 HG2 LYS 32 HG2 LYS 32 -9.332 -13.704 1.833 245 HG3 LYS 32 HG3 LYS 32 -10.050 -12.514 2.920 246 HD2 LYS 32 HD2 LYS 32 -12.024 -13.016 1.026 247 HD3 LYS 32 HD3 LYS 32 -11.316 -14.597 1.358 248 HE2 LYS 32 HE2 LYS 32 -11.553 -13.936 3.837 249 HE3 LYS 32 HE3 LYS 32 -12.655 -12.694 3.248 250 HZ1 LYS 32 HZ1 LYS 32 -13.648 -14.907 3.950 251 HZ2 LYS 32 HZ2 LYS 32 -13.004 -15.538 2.519 252 HZ3 LYS 32 HZ3 LYS 32 -14.139 -14.286 2.455 253 H TYR 33 H TYR 33 -8.466 -9.883 -1.096 254 HA TYR 33 HA TYR 33 -6.887 -11.625 -2.587 255 HB2 TYR 33 HB2 TYR 33 -8.200 -9.686 -3.510 256 HB3 TYR 33 HB3 TYR 33 -6.951 -8.614 -2.898 257 HD1 TYR 33 HD1 TYR 33 -7.459 -11.498 -5.194 258 HD2 TYR 33 HD2 TYR 33 -5.065 -8.129 -4.187 259 HE1 TYR 33 HE1 TYR 33 -6.138 -11.822 -7.242 260 HE2 TYR 33 HE2 TYR 33 -3.736 -8.453 -6.197 261 HH TYR 33 HH TYR 33 -3.672 -11.186 -7.964 262 H LEU 34 H LEU 34 -5.755 -8.493 -1.275 263 HA LEU 34 HA LEU 34 -3.032 -8.907 -1.668 264 HB2 LEU 34 HB2 LEU 34 -4.564 -7.286 0.361 265 HB3 LEU 34 HB3 LEU 34 -2.818 -7.315 0.346 266 HG LEU 34 HG LEU 34 -2.680 -5.897 -1.391 267 HD11 LEU 34 HD11 LEU 34 -4.026 -5.960 -3.380 268 HD12 LEU 34 HD12 LEU 34 -5.172 -7.058 -2.611 269 HD13 LEU 34 HD13 LEU 34 -3.530 -7.601 -2.966 270 HD21 LEU 34 HD21 LEU 34 -4.361 -4.948 0.222 271 HD22 LEU 34 HD22 LEU 34 -5.600 -5.439 -0.938 272 HD23 LEU 34 HD23 LEU 34 -4.370 -4.264 -1.405 273 H GLU 35 H GLU 35 -5.151 -9.819 1.038 274 HA GLU 35 HA GLU 35 -3.205 -10.693 2.808 275 HB2 GLU 35 HB2 GLU 35 -5.993 -10.748 2.738 276 HB3 GLU 35 HB3 GLU 35 -5.512 -12.434 2.879 277 HG2 GLU 35 HG2 GLU 35 -3.907 -10.994 4.678 278 HG3 GLU 35 HG3 GLU 35 -5.546 -10.389 4.873 279 H ASP 36 H ASP 36 -4.915 -12.449 0.263 280 HA ASP 36 HA ASP 36 -3.773 -14.957 0.548 281 HB2 ASP 36 HB2 ASP 36 -5.551 -13.815 -1.173 282 HB3 ASP 36 HB3 ASP 36 -4.164 -14.045 -2.224 283 H TYR 37 H TYR 37 -2.484 -12.020 -0.841 284 HA TYR 37 HA TYR 37 -0.218 -13.281 -2.069 285 HB2 TYR 37 HB2 TYR 37 -0.816 -11.222 -3.063 286 HB3 TYR 37 HB3 TYR 37 -0.951 -10.410 -1.515 287 HD1 TYR 37 HD1 TYR 37 1.077 -9.761 -0.279 288 HD2 TYR 37 HD2 TYR 37 1.301 -11.394 -4.188 289 HE1 TYR 37 HE1 TYR 37 3.408 -8.994 -0.456 290 HE2 TYR 37 HE2 TYR 37 3.625 -10.617 -4.391 291 HH TYR 37 HH TYR 37 5.547 -9.963 -2.147 292 H ALA 38 H ALA 38 -0.453 -10.942 0.617 293 HA ALA 38 HA ALA 38 2.053 -11.074 1.608 294 HB1 ALA 38 HB1 ALA 38 -0.304 -11.040 3.448 295 HB2 ALA 38 HB2 ALA 38 0.106 -9.675 2.412 296 HB3 ALA 38 HB3 ALA 38 1.248 -10.225 3.634 297 H ARG 39 H ARG 39 -0.493 -13.481 2.125 298 HA ARG 39 HA ARG 39 1.073 -14.936 4.062 299 HB2 ARG 39 HB2 ARG 39 -0.663 -16.691 3.842 300 HB3 ARG 39 HB3 ARG 39 -1.308 -15.109 4.245 301 HG2 ARG 39 HG2 ARG 39 -1.524 -14.998 1.578 302 HG3 ARG 39 HG3 ARG 39 -1.665 -16.744 1.827 303 HD2 ARG 39 HD2 ARG 39 -3.264 -15.786 3.816 304 HD3 ARG 39 HD3 ARG 39 -3.531 -14.597 2.547 305 HE ARG 39 HE ARG 39 -4.803 -16.148 1.479 306 HH11 ARG 39 HH11 ARG 39 -2.562 -17.887 3.534 307 HH12 ARG 39 HH12 ARG 39 -3.214 -19.438 3.131 308 HH21 ARG 39 HH21 ARG 39 -5.653 -18.188 0.958 309 HH22 ARG 39 HH22 ARG 39 -4.967 -19.610 1.670 310 H ARG 40 H ARG 40 0.209 -15.403 0.645 311 HA ARG 40 HA ARG 40 1.662 -17.782 0.257 312 HB2 ARG 40 HB2 ARG 40 1.185 -17.530 -1.997 313 HB3 ARG 40 HB3 ARG 40 -0.082 -16.571 -1.264 314 HG2 ARG 40 HG2 ARG 40 1.003 -14.556 -1.825 315 HG3 ARG 40 HG3 ARG 40 2.491 -15.392 -2.257 316 HD2 ARG 40 HD2 ARG 40 -0.099 -15.908 -3.675 317 HD3 ARG 40 HD3 ARG 40 0.982 -14.606 -4.152 318 HE ARG 40 HE ARG 40 2.261 -17.175 -3.972 319 HH11 ARG 40 HH11 ARG 40 0.473 -15.001 -6.052 320 HH12 ARG 40 HH12 ARG 40 1.062 -15.715 -7.513 321 HH21 ARG 40 HH21 ARG 40 3.031 -18.117 -5.904 322 HH22 ARG 40 HH22 ARG 40 2.514 -17.484 -7.430 323 H ASN 41 H ASN 41 2.655 -14.528 0.661 324 HA ASN 41 HA ASN 41 5.295 -14.977 -0.489 325 HB2 ASN 41 HB2 ASN 41 3.611 -12.650 0.076 326 HB3 ASN 41 HB3 ASN 41 5.295 -12.412 0.511 327 HD21 ASN 41 HD21 ASN 41 3.220 -13.508 -2.132 328 HD22 ASN 41 HD22 ASN 41 4.244 -12.940 -3.401 329 H GLY 42 H GLY 42 3.756 -14.255 2.613 330 HA2 GLY 42 HA2 GLY 42 4.604 -15.214 4.642 331 HA3 GLY 42 HA3 GLY 42 6.213 -15.167 3.950 332 H PHE 43 H PHE 43 3.683 -12.659 4.406 333 HA PHE 43 HA PHE 43 5.743 -10.999 5.705 334 HB2 PHE 43 HB2 PHE 43 3.223 -10.195 4.245 335 HB3 PHE 43 HB3 PHE 43 4.307 -9.072 5.051 336 HD1 PHE 43 HD1 PHE 43 6.819 -9.173 4.263 337 HD2 PHE 43 HD2 PHE 43 3.522 -10.640 2.049 338 HE1 PHE 43 HE1 PHE 43 8.146 -9.033 2.195 339 HE2 PHE 43 HE2 PHE 43 4.814 -10.508 -0.015 340 HZ PHE 43 HZ PHE 43 7.141 -9.704 0.048 341 H GLU 44 H GLU 44 5.386 -10.069 7.684 342 HA GLU 44 HA GLU 44 3.117 -11.079 9.209 343 HB2 GLU 44 HB2 GLU 44 5.830 -10.046 9.910 344 HB3 GLU 44 HB3 GLU 44 4.562 -10.130 11.123 345 HG2 GLU 44 HG2 GLU 44 6.188 -12.038 10.946 346 HG3 GLU 44 HG3 GLU 44 4.480 -12.421 11.062 347 H ASN 45 H ASN 45 2.406 -9.698 11.022 348 HA ASN 45 HA ASN 45 1.189 -7.919 11.703 349 HB2 ASN 45 HB2 ASN 45 3.612 -6.514 10.612 350 HB3 ASN 45 HB3 ASN 45 2.431 -5.768 11.684 351 HD21 ASN 45 HD21 ASN 45 5.315 -7.381 11.489 352 HD22 ASN 45 HD22 ASN 45 5.501 -7.825 13.152 353 H ILE 46 H ILE 46 0.728 -8.784 8.910 354 HA ILE 46 HA ILE 46 0.468 -6.740 7.092 355 HB ILE 46 HB ILE 46 -1.386 -9.079 7.463 356 HG12 ILE 46 HG12 ILE 46 0.847 -8.916 5.477 357 HG13 ILE 46 HG13 ILE 46 1.175 -9.429 7.130 358 HG21 ILE 46 HG21 ILE 46 -2.444 -8.498 5.582 359 HG22 ILE 46 HG22 ILE 46 -0.947 -8.024 4.780 360 HG23 ILE 46 HG23 ILE 46 -1.760 -6.898 5.864 361 HD11 ILE 46 HD11 ILE 46 0.647 -11.188 5.260 362 HD12 ILE 46 HD12 ILE 46 -1.027 -10.772 5.631 363 HD13 ILE 46 HD13 ILE 46 0.031 -11.398 6.896 364 H ARG 47 H ARG 47 -0.248 -4.868 7.820 365 HA ARG 47 HA ARG 47 -2.816 -4.695 9.175 366 HB2 ARG 47 HB2 ARG 47 -0.565 -3.202 9.464 367 HB3 ARG 47 HB3 ARG 47 -1.531 -2.178 8.404 368 HG2 ARG 47 HG2 ARG 47 -3.225 -3.194 10.436 369 HG3 ARG 47 HG3 ARG 47 -1.777 -2.551 11.194 370 HD2 ARG 47 HD2 ARG 47 -2.169 -0.418 10.449 371 HD3 ARG 47 HD3 ARG 47 -3.117 -0.967 9.069 372 HE ARG 47 HE ARG 47 -4.999 -0.998 10.387 373 HH11 ARG 47 HH11 ARG 47 -2.191 -0.531 12.426 374 HH12 ARG 47 HH12 ARG 47 -3.124 -0.190 13.840 375 HH21 ARG 47 HH21 ARG 47 -6.219 -0.563 12.254 376 HH22 ARG 47 HH22 ARG 47 -5.412 -0.216 13.745 377 H HIS 48 H HIS 48 -4.655 -4.264 8.237 378 HA HIS 48 HA HIS 48 -4.619 -3.773 5.367 379 HB2 HIS 48 HB2 HIS 48 -6.741 -4.765 7.258 380 HB3 HIS 48 HB3 HIS 48 -7.155 -4.252 5.625 381 HD1 HIS 48 HD1 HIS 48 -7.189 -6.075 4.002 382 HD2 HIS 48 HD2 HIS 48 -4.591 -6.855 7.134 383 HE1 HIS 48 HE1 HIS 48 -6.351 -8.407 3.596 384 HE2 HIS 48 HE2 HIS 48 -4.609 -8.768 5.389 385 H PHE 49 H PHE 49 -4.670 -1.760 4.679 386 HA PHE 49 HA PHE 49 -6.105 0.265 6.241 387 HB2 PHE 49 HB2 PHE 49 -4.147 0.693 3.955 388 HB3 PHE 49 HB3 PHE 49 -4.820 1.931 5.003 389 HD1 PHE 49 HD1 PHE 49 -4.082 2.158 7.292 390 HD2 PHE 49 HD2 PHE 49 -2.319 -0.736 4.709 391 HE1 PHE 49 HE1 PHE 49 -2.210 1.909 8.857 392 HE2 PHE 49 HE2 PHE 49 -0.444 -0.993 6.289 393 HZ PHE 49 HZ PHE 49 -0.392 0.330 8.358 394 H THR 50 H THR 50 -8.108 0.042 5.738 395 HA THR 50 HA THR 50 -9.135 -0.603 3.182 396 HB THR 50 HB THR 50 -10.091 -1.205 5.392 397 HG1 THR 50 HG1 THR 50 -11.948 0.209 3.780 398 HG21 THR 50 HG21 THR 50 -10.676 0.275 6.906 399 HG22 THR 50 HG22 THR 50 -11.774 1.056 5.772 400 HG23 THR 50 HG23 THR 50 -10.086 1.564 5.857 401 H ASP 51 H ASP 51 -10.600 0.511 1.916 402 HA ASP 51 HA ASP 51 -10.167 3.411 1.836 403 HB2 ASP 51 HB2 ASP 51 -9.475 2.946 -0.261 404 HB3 ASP 51 HB3 ASP 51 -10.134 1.326 -0.192 405 H ASP 52 H ASP 52 -11.859 4.800 1.460 406 HA ASP 52 HA ASP 52 -14.527 3.857 1.064 407 HB2 ASP 52 HB2 ASP 52 -14.316 3.408 3.461 408 HB3 ASP 52 HB3 ASP 52 -13.797 5.065 3.741 409 H GLY 53 H GLY 53 -15.059 5.273 -0.469 410 HA2 GLY 53 HA2 GLY 53 -15.327 7.258 -1.610 411 HA3 GLY 53 HA3 GLY 53 -15.650 7.937 -0.023 412 H PHE 54 H PHE 54 -12.859 6.899 -2.004 413 HA PHE 54 HA PHE 54 -11.192 8.917 -0.750 414 HB2 PHE 54 HB2 PHE 54 -10.664 6.637 -2.635 415 HB3 PHE 54 HB3 PHE 54 -9.465 7.903 -2.416 416 HD1 PHE 54 HD1 PHE 54 -10.624 8.030 0.676 417 HD2 PHE 54 HD2 PHE 54 -8.777 5.142 -1.868 418 HE1 PHE 54 HE1 PHE 54 -9.786 6.833 2.635 419 HE2 PHE 54 HE2 PHE 54 -7.923 3.967 0.112 420 HZ PHE 54 HZ PHE 54 -8.434 4.809 2.372 421 H SER 55 H SER 55 -10.589 10.776 -1.646 422 HA SER 55 HA SER 55 -11.875 11.743 -4.003 423 HB2 SER 55 HB2 SER 55 -10.068 12.836 -1.939 424 HB3 SER 55 HB3 SER 55 -9.894 13.570 -3.533 425 HG SER 55 HG SER 55 -11.777 14.017 -1.726 426 H GLY 56 H GLY 56 -10.586 12.741 -5.841 427 HA2 GLY 56 HA2 GLY 56 -8.484 10.833 -6.627 428 HA3 GLY 56 HA3 GLY 56 -9.524 11.696 -7.741 429 H VAL 57 H VAL 57 -7.571 12.931 -4.995 430 HA VAL 57 HA VAL 57 -6.388 14.832 -6.889 431 HB VAL 57 HB VAL 57 -5.543 16.005 -4.819 432 HG11 VAL 57 HG11 VAL 57 -7.884 16.225 -6.150 433 HG12 VAL 57 HG12 VAL 57 -7.364 17.312 -4.862 434 HG13 VAL 57 HG13 VAL 57 -8.461 15.979 -4.501 435 HG21 VAL 57 HG21 VAL 57 -5.652 14.217 -3.209 436 HG22 VAL 57 HG22 VAL 57 -7.389 14.044 -3.458 437 HG23 VAL 57 HG23 VAL 57 -6.747 15.504 -2.709 438 H ASN 58 H ASN 58 -5.350 12.613 -4.285 439 HA ASN 58 HA ASN 58 -3.357 11.197 -5.162 440 HB2 ASN 58 HB2 ASN 58 -1.217 12.430 -5.119 441 HB3 ASN 58 HB3 ASN 58 -2.278 13.032 -6.378 442 HD21 ASN 58 HD21 ASN 58 -1.012 13.701 -3.157 443 HD22 ASN 58 HD22 ASN 58 -1.227 15.407 -3.230 444 H PHE 59 H PHE 59 -2.946 9.982 -3.487 445 HA PHE 59 HA PHE 59 -2.821 9.256 -1.327 446 HB2 PHE 59 HB2 PHE 59 -0.965 11.563 -0.828 447 HB3 PHE 59 HB3 PHE 59 -0.847 9.904 -0.260 448 HD1 PHE 59 HD1 PHE 59 -0.508 12.045 -3.267 449 HD2 PHE 59 HD2 PHE 59 0.381 8.293 -1.483 450 HE1 PHE 59 HE1 PHE 59 1.010 11.533 -5.120 451 HE2 PHE 59 HE2 PHE 59 1.905 7.776 -3.337 452 HZ PHE 59 HZ PHE 59 2.221 9.395 -5.160 453 H ASN 60 H ASN 60 -2.330 10.509 1.116 454 HA ASN 60 HA ASN 60 -3.413 11.468 2.872 455 HB2 ASN 60 HB2 ASN 60 -4.495 13.459 0.871 456 HB3 ASN 60 HB3 ASN 60 -4.254 13.698 2.598 457 HD21 ASN 60 HD21 ASN 60 -1.725 12.585 2.895 458 HD22 ASN 60 HD22 ASN 60 -0.577 13.551 2.044 459 H ARG 61 H ARG 61 -4.740 9.794 3.300 460 HA ARG 61 HA ARG 61 -7.597 10.206 2.805 461 HB2 ARG 61 HB2 ARG 61 -6.902 7.389 2.564 462 HB3 ARG 61 HB3 ARG 61 -7.926 8.378 1.541 463 HG2 ARG 61 HG2 ARG 61 -4.988 8.714 1.269 464 HG3 ARG 61 HG3 ARG 61 -5.705 7.231 0.649 465 HD2 ARG 61 HD2 ARG 61 -7.310 9.452 -0.149 466 HD3 ARG 61 HD3 ARG 61 -5.626 9.779 -0.550 467 HE ARG 61 HE ARG 61 -6.807 7.221 -1.350 468 HH11 ARG 61 HH11 ARG 61 -5.539 10.358 -2.259 469 HH12 ARG 61 HH12 ARG 61 -5.333 9.927 -3.919 470 HH21 ARG 61 HH21 ARG 61 -6.536 6.666 -3.540 471 HH22 ARG 61 HH22 ARG 61 -5.911 7.835 -4.653 472 HA PRO 62 HA PRO 62 -8.148 8.845 6.990 473 HB2 PRO 62 HB2 PRO 62 -9.939 6.741 6.720 474 HB3 PRO 62 HB3 PRO 62 -10.393 8.447 6.762 475 HG2 PRO 62 HG2 PRO 62 -9.964 6.662 4.399 476 HG3 PRO 62 HG3 PRO 62 -11.242 7.851 4.672 477 HD2 PRO 62 HD2 PRO 62 -9.206 8.432 3.081 478 HD3 PRO 62 HD3 PRO 62 -9.833 9.653 4.208 479 H GLY 63 H GLY 63 -8.578 5.733 5.300 480 HA2 GLY 63 HA2 GLY 63 -6.990 4.225 7.041 481 HA3 GLY 63 HA3 GLY 63 -7.425 3.761 5.405 482 H PHE 64 H PHE 64 -6.195 6.083 4.173 483 HA PHE 64 HA PHE 64 -3.602 5.098 3.690 484 HB2 PHE 64 HB2 PHE 64 -4.932 6.472 2.108 485 HB3 PHE 64 HB3 PHE 64 -4.715 7.858 3.160 486 HD1 PHE 64 HD1 PHE 64 -2.192 8.384 3.736 487 HD2 PHE 64 HD2 PHE 64 -3.533 6.229 0.338 488 HE1 PHE 64 HE1 PHE 64 -0.098 8.926 2.578 489 HE2 PHE 64 HE2 PHE 64 -1.454 6.761 -0.832 490 HZ PHE 64 HZ PHE 64 0.281 8.106 0.292 491 H GLN 65 H GLN 65 -4.787 7.868 5.565 492 HA GLN 65 HA GLN 65 -2.317 8.876 6.372 493 HB2 GLN 65 HB2 GLN 65 -5.089 9.043 7.491 494 HB3 GLN 65 HB3 GLN 65 -3.741 9.681 8.421 495 HG2 GLN 65 HG2 GLN 65 -3.147 10.961 6.256 496 HG3 GLN 65 HG3 GLN 65 -4.800 10.594 5.771 497 HE21 GLN 65 HE21 GLN 65 -3.617 13.177 6.276 498 HE22 GLN 65 HE22 GLN 65 -4.524 13.899 7.554 499 H SER 66 H SER 66 -4.161 6.134 7.442 500 HA SER 66 HA SER 66 -2.703 5.688 9.878 501 HB2 SER 66 HB2 SER 66 -4.963 4.711 9.427 502 HB3 SER 66 HB3 SER 66 -4.243 3.701 8.181 503 HG SER 66 HG SER 66 -3.878 3.603 10.968 504 H LEU 67 H LEU 67 -2.642 4.415 6.573 505 HA LEU 67 HA LEU 67 -0.486 2.676 6.734 506 HB2 LEU 67 HB2 LEU 67 -1.334 2.387 4.671 507 HB3 LEU 67 HB3 LEU 67 -2.097 3.963 4.709 508 HG LEU 67 HG LEU 67 0.148 4.923 3.992 509 HD11 LEU 67 HD11 LEU 67 0.661 1.984 3.886 510 HD12 LEU 67 HD12 LEU 67 1.712 3.290 4.438 511 HD13 LEU 67 HD13 LEU 67 1.438 3.050 2.712 512 HD21 LEU 67 HD21 LEU 67 -0.184 3.990 1.623 513 HD22 LEU 67 HD22 LEU 67 -1.524 4.861 2.367 514 HD23 LEU 67 HD23 LEU 67 -1.537 3.099 2.314 515 H ILE 68 H ILE 68 -0.534 6.146 5.902 516 HA ILE 68 HA ILE 68 2.262 6.423 5.603 517 HB ILE 68 HB ILE 68 0.114 8.038 5.080 518 HG12 ILE 68 HG12 ILE 68 1.674 9.633 4.200 519 HG13 ILE 68 HG13 ILE 68 2.941 9.094 5.294 520 HG21 ILE 68 HG21 ILE 68 0.607 10.160 6.359 521 HG22 ILE 68 HG22 ILE 68 1.525 9.161 7.488 522 HG23 ILE 68 HG23 ILE 68 -0.201 8.878 7.258 523 HD11 ILE 68 HD11 ILE 68 3.416 8.312 3.091 524 HD12 ILE 68 HD12 ILE 68 1.803 7.606 2.938 525 HD13 ILE 68 HD13 ILE 68 2.963 6.924 4.078 526 H LYS 69 H LYS 69 0.105 6.785 8.391 527 HA LYS 69 HA LYS 69 1.897 7.955 10.191 528 HB2 LYS 69 HB2 LYS 69 -0.566 7.572 10.567 529 HB3 LYS 69 HB3 LYS 69 -0.183 5.892 10.917 530 HG2 LYS 69 HG2 LYS 69 1.530 7.522 12.469 531 HG3 LYS 69 HG3 LYS 69 -0.117 8.125 12.660 532 HD2 LYS 69 HD2 LYS 69 -0.250 6.524 14.240 533 HD3 LYS 69 HD3 LYS 69 -0.516 5.454 12.868 534 HE2 LYS 69 HE2 LYS 69 1.277 4.308 13.494 535 HE3 LYS 69 HE3 LYS 69 2.256 5.711 13.080 536 HZ1 LYS 69 HZ1 LYS 69 1.894 6.525 15.362 537 HZ2 LYS 69 HZ2 LYS 69 2.724 5.053 15.314 538 HZ3 LYS 69 HZ3 LYS 69 1.087 5.086 15.734 539 H GLU 70 H GLU 70 1.501 4.645 9.156 540 HA GLU 70 HA GLU 70 3.277 3.491 11.074 541 HB2 GLU 70 HB2 GLU 70 2.336 2.462 8.385 542 HB3 GLU 70 HB3 GLU 70 3.253 1.518 9.550 543 HG2 GLU 70 HG2 GLU 70 0.464 2.593 9.852 544 HG3 GLU 70 HG3 GLU 70 0.963 0.908 9.736 545 H VAL 71 H VAL 71 3.550 4.727 7.780 546 HA VAL 71 HA VAL 71 6.218 3.941 7.330 547 HB VAL 71 HB VAL 71 4.956 6.410 6.140 548 HG11 VAL 71 HG11 VAL 71 7.077 4.490 5.207 549 HG12 VAL 71 HG12 VAL 71 7.291 6.181 5.661 550 HG13 VAL 71 HG13 VAL 71 6.382 5.767 4.208 551 HG21 VAL 71 HG21 VAL 71 4.730 4.182 4.398 552 HG22 VAL 71 HG22 VAL 71 3.447 5.184 5.074 553 HG23 VAL 71 HG23 VAL 71 3.991 3.750 5.941 554 H GLU 72 H GLU 72 4.851 6.998 8.569 555 HA GLU 72 HA GLU 72 7.278 8.390 8.804 556 HB2 GLU 72 HB2 GLU 72 5.923 9.604 10.732 557 HB3 GLU 72 HB3 GLU 72 5.567 9.866 9.033 558 HG2 GLU 72 HG2 GLU 72 3.605 8.704 9.118 559 HG3 GLU 72 HG3 GLU 72 4.116 7.711 10.473 560 H ALA 73 H ALA 73 5.578 6.312 11.098 561 HA ALA 73 HA ALA 73 7.391 6.700 13.257 562 HB1 ALA 73 HB1 ALA 73 4.960 5.386 12.830 563 HB2 ALA 73 HB2 ALA 73 5.839 5.542 14.353 564 HB3 ALA 73 HB3 ALA 73 6.096 4.130 13.325 565 H GLY 74 H GLY 74 7.397 4.680 10.431 566 HA2 GLY 74 HA2 GLY 74 9.207 3.559 9.518 567 HA3 GLY 74 HA3 GLY 74 10.082 3.708 11.028 568 H ASN 75 H ASN 75 6.834 2.456 10.459 569 HA ASN 75 HA ASN 75 7.553 -0.118 11.683 570 HB2 ASN 75 HB2 ASN 75 5.046 1.500 11.447 571 HB3 ASN 75 HB3 ASN 75 4.893 -0.247 11.566 572 HD21 ASN 75 HD21 ASN 75 3.765 1.191 13.474 573 HD22 ASN 75 HD22 ASN 75 4.656 1.096 14.945 574 H VAL 76 H VAL 76 5.792 1.268 8.908 575 HA VAL 76 HA VAL 76 5.131 -1.168 7.711 576 HB VAL 76 HB VAL 76 4.139 0.991 7.012 577 HG11 VAL 76 HG11 VAL 76 5.332 2.721 6.357 578 HG12 VAL 76 HG12 VAL 76 6.072 1.781 5.066 579 HG13 VAL 76 HG13 VAL 76 6.798 1.801 6.671 580 HG21 VAL 76 HG21 VAL 76 3.855 0.391 4.750 581 HG22 VAL 76 HG22 VAL 76 4.200 -1.117 5.592 582 HG23 VAL 76 HG23 VAL 76 5.464 -0.323 4.658 583 H GLU 77 H GLU 77 6.766 -2.632 7.596 584 HA GLU 77 HA GLU 77 9.317 -1.946 6.386 585 HB2 GLU 77 HB2 GLU 77 9.947 -4.246 6.865 586 HB3 GLU 77 HB3 GLU 77 9.240 -3.492 8.284 587 HG2 GLU 77 HG2 GLU 77 7.603 -4.982 8.388 588 HG3 GLU 77 HG3 GLU 77 7.258 -4.839 6.667 589 H THR 78 H THR 78 6.297 -2.792 5.227 590 HA THR 78 HA THR 78 7.313 -3.330 2.569 591 HB THR 78 HB THR 78 5.308 -5.325 3.334 592 HG1 THR 78 HG1 THR 78 7.939 -5.636 4.343 593 HG21 THR 78 HG21 THR 78 6.182 -5.673 1.253 594 HG22 THR 78 HG22 THR 78 7.092 -6.814 2.244 595 HG23 THR 78 HG23 THR 78 7.825 -5.283 1.761 596 H LEU 79 H LEU 79 5.686 -3.174 0.945 597 HA LEU 79 HA LEU 79 3.080 -2.220 1.892 598 HB2 LEU 79 HB2 LEU 79 4.763 -0.406 1.059 599 HB3 LEU 79 HB3 LEU 79 4.338 -1.006 -0.507 600 HG LEU 79 HG LEU 79 2.859 0.727 -0.366 601 HD11 LEU 79 HD11 LEU 79 1.265 -1.319 1.140 602 HD12 LEU 79 HD12 LEU 79 1.600 -1.403 -0.587 603 HD13 LEU 79 HD13 LEU 79 0.667 -0.059 0.067 604 HD21 LEU 79 HD21 LEU 79 1.596 0.988 1.986 605 HD22 LEU 79 HD22 LEU 79 3.087 1.838 1.568 606 HD23 LEU 79 HD23 LEU 79 3.155 0.365 2.536 607 H ILE 80 H ILE 80 1.481 -3.282 1.007 608 HA ILE 80 HA ILE 80 1.889 -4.601 -1.595 609 HB ILE 80 HB ILE 80 0.367 -5.569 0.817 610 HG12 ILE 80 HG12 ILE 80 1.732 -7.647 0.298 611 HG13 ILE 80 HG13 ILE 80 2.619 -6.667 -0.865 612 HG21 ILE 80 HG21 ILE 80 -0.110 -7.546 -0.865 613 HG22 ILE 80 HG22 ILE 80 -0.019 -6.238 -2.046 614 HG23 ILE 80 HG23 ILE 80 -1.192 -6.160 -0.732 615 HD11 ILE 80 HD11 ILE 80 3.709 -5.501 0.746 616 HD12 ILE 80 HD12 ILE 80 3.469 -7.028 1.592 617 HD13 ILE 80 HD13 ILE 80 2.398 -5.666 1.915 618 H VAL 81 H VAL 81 0.836 -3.528 -3.091 619 HA VAL 81 HA VAL 81 -1.881 -2.517 -2.531 620 HB VAL 81 HB VAL 81 0.104 -1.238 -4.408 621 HG11 VAL 81 HG11 VAL 81 -2.421 -0.037 -3.296 622 HG12 VAL 81 HG12 VAL 81 -2.393 -0.969 -4.788 623 HG13 VAL 81 HG13 VAL 81 -1.452 0.514 -4.661 624 HG21 VAL 81 HG21 VAL 81 -0.074 0.656 -2.574 625 HG22 VAL 81 HG22 VAL 81 1.081 -0.668 -2.383 626 HG23 VAL 81 HG23 VAL 81 -0.458 -0.701 -1.503 627 H LYS 82 H LYS 82 -3.396 -2.708 -4.186 628 HA LYS 82 HA LYS 82 -3.335 -4.881 -5.876 629 HB2 LYS 82 HB2 LYS 82 -5.113 -2.793 -5.275 630 HB3 LYS 82 HB3 LYS 82 -4.885 -2.706 -7.017 631 HG2 LYS 82 HG2 LYS 82 -5.486 -5.311 -5.688 632 HG3 LYS 82 HG3 LYS 82 -6.774 -4.166 -6.075 633 HD2 LYS 82 HD2 LYS 82 -6.764 -4.856 -8.174 634 HD3 LYS 82 HD3 LYS 82 -5.077 -4.381 -8.337 635 HE2 LYS 82 HE2 LYS 82 -4.553 -6.622 -7.195 636 HE3 LYS 82 HE3 LYS 82 -6.217 -7.053 -7.587 637 HZ1 LYS 82 HZ1 LYS 82 -4.205 -6.160 -9.579 638 HZ2 LYS 82 HZ2 LYS 82 -5.763 -6.736 -9.900 639 HZ3 LYS 82 HZ3 LYS 82 -4.591 -7.778 -9.268 640 H ASP 83 H ASP 83 -2.383 -1.509 -6.511 641 HA ASP 83 HA ASP 83 -0.450 -2.201 -8.432 642 HB2 ASP 83 HB2 ASP 83 -1.645 -0.958 -10.373 643 HB3 ASP 83 HB3 ASP 83 -2.052 -2.640 -10.062 644 H MET 84 H MET 84 0.485 -0.280 -9.537 645 HA MET 84 HA MET 84 0.950 1.787 -7.682 646 HB2 MET 84 HB2 MET 84 1.754 1.227 -10.489 647 HB3 MET 84 HB3 MET 84 1.940 2.873 -9.906 648 HG2 MET 84 HG2 MET 84 3.032 0.536 -8.388 649 HG3 MET 84 HG3 MET 84 3.931 1.304 -9.695 650 HE1 MET 84 HE1 MET 84 4.622 2.110 -5.658 651 HE2 MET 84 HE2 MET 84 3.855 0.744 -6.470 652 HE3 MET 84 HE3 MET 84 2.863 1.991 -5.716 653 H SER 85 H SER 85 -1.630 1.393 -9.902 654 HA SER 85 HA SER 85 -2.097 4.145 -10.492 655 HB2 SER 85 HB2 SER 85 -3.045 2.324 -11.868 656 HB3 SER 85 HB3 SER 85 -4.055 1.835 -10.511 657 HG SER 85 HG SER 85 -5.137 3.211 -12.026 658 H ARG 86 H ARG 86 -2.767 2.075 -7.811 659 HA ARG 86 HA ARG 86 -4.915 3.264 -6.562 660 HB2 ARG 86 HB2 ARG 86 -2.685 1.557 -5.820 661 HB3 ARG 86 HB3 ARG 86 -3.151 2.624 -4.515 662 HG2 ARG 86 HG2 ARG 86 -4.374 0.683 -4.156 663 HG3 ARG 86 HG3 ARG 86 -5.525 1.786 -4.888 664 HD2 ARG 86 HD2 ARG 86 -4.882 0.693 -7.107 665 HD3 ARG 86 HD3 ARG 86 -4.145 -0.567 -6.120 666 HE ARG 86 HE ARG 86 -6.564 -0.533 -5.073 667 HH11 ARG 86 HH11 ARG 86 -5.673 -0.366 -8.455 668 HH12 ARG 86 HH12 ARG 86 -7.107 -1.169 -8.996 669 HH21 ARG 86 HH21 ARG 86 -8.449 -1.583 -5.798 670 HH22 ARG 86 HH22 ARG 86 -8.678 -1.863 -7.490 671 H LEU 87 H LEU 87 -1.492 3.956 -5.749 672 HA LEU 87 HA LEU 87 -2.191 6.391 -4.377 673 HB2 LEU 87 HB2 LEU 87 0.393 5.009 -5.035 674 HB3 LEU 87 HB3 LEU 87 0.397 6.642 -4.399 675 HG LEU 87 HG LEU 87 -1.157 5.487 -2.540 676 HD11 LEU 87 HD11 LEU 87 -0.960 3.292 -3.737 677 HD12 LEU 87 HD12 LEU 87 -0.526 3.287 -2.027 678 HD13 LEU 87 HD13 LEU 87 0.737 3.279 -3.258 679 HD21 LEU 87 HD21 LEU 87 1.848 5.279 -2.552 680 HD22 LEU 87 HD22 LEU 87 0.798 5.320 -1.138 681 HD23 LEU 87 HD23 LEU 87 0.937 6.736 -2.172 682 H GLY 88 H GLY 88 -1.264 5.635 -7.672 683 HA2 GLY 88 HA2 GLY 88 -2.054 7.629 -9.070 684 HA3 GLY 88 HA3 GLY 88 -0.882 8.527 -8.137 685 H ARG 89 H ARG 89 -1.023 8.271 -10.974 686 HA ARG 89 HA ARG 89 1.084 6.489 -11.805 687 HB2 ARG 89 HB2 ARG 89 -0.468 8.631 -13.259 688 HB3 ARG 89 HB3 ARG 89 0.790 7.668 -14.016 689 HG2 ARG 89 HG2 ARG 89 -0.827 5.763 -12.883 690 HG3 ARG 89 HG3 ARG 89 -1.975 6.994 -13.409 691 HD2 ARG 89 HD2 ARG 89 -0.020 6.589 -15.456 692 HD3 ARG 89 HD3 ARG 89 -0.679 5.029 -14.969 693 HE ARG 89 HE ARG 89 -2.849 6.696 -15.294 694 HH11 ARG 89 HH11 ARG 89 -0.254 5.499 -17.315 695 HH12 ARG 89 HH12 ARG 89 -1.190 5.570 -18.770 696 HH21 ARG 89 HH21 ARG 89 -4.076 6.790 -17.214 697 HH22 ARG 89 HH22 ARG 89 -3.360 6.303 -18.713 698 H ASN 90 H ASN 90 0.942 9.568 -10.398 699 HA ASN 90 HA ASN 90 3.192 10.793 -11.634 700 HB2 ASN 90 HB2 ASN 90 3.149 12.162 -9.400 701 HB3 ASN 90 HB3 ASN 90 1.847 12.357 -10.566 702 HD21 ASN 90 HD21 ASN 90 2.768 10.838 -7.538 703 HD22 ASN 90 HD22 ASN 90 1.162 10.622 -6.945 704 H TYR 91 H TYR 91 4.666 9.044 -11.644 705 HA TYR 91 HA TYR 91 5.650 7.688 -9.427 706 HB2 TYR 91 HB2 TYR 91 5.983 6.912 -11.660 707 HB3 TYR 91 HB3 TYR 91 6.934 8.330 -12.079 708 HD1 TYR 91 HD1 TYR 91 9.223 8.587 -11.055 709 HD2 TYR 91 HD2 TYR 91 6.955 5.013 -10.690 710 HE1 TYR 91 HE1 TYR 91 11.275 7.355 -10.503 711 HE2 TYR 91 HE2 TYR 91 9.007 3.750 -10.158 712 HH TYR 91 HH TYR 91 11.377 4.486 -9.081 713 H LEU 92 H LEU 92 6.127 10.986 -10.200 714 HA LEU 92 HA LEU 92 8.738 11.343 -9.150 715 HB2 LEU 92 HB2 LEU 92 6.443 13.298 -9.332 716 HB3 LEU 92 HB3 LEU 92 8.092 13.729 -8.924 717 HG LEU 92 HG LEU 92 8.723 12.734 -11.209 718 HD11 LEU 92 HD11 LEU 92 6.732 13.063 -12.816 719 HD12 LEU 92 HD12 LEU 92 5.741 12.837 -11.374 720 HD13 LEU 92 HD13 LEU 92 6.849 11.568 -11.891 721 HD21 LEU 92 HD21 LEU 92 7.697 14.899 -12.323 722 HD22 LEU 92 HD22 LEU 92 9.003 15.000 -11.142 723 HD23 LEU 92 HD23 LEU 92 7.339 15.304 -10.645 724 H GLN 93 H GLN 93 5.521 11.962 -7.765 725 HA GLN 93 HA GLN 93 6.492 12.336 -5.091 726 HB2 GLN 93 HB2 GLN 93 3.801 12.115 -6.397 727 HB3 GLN 93 HB3 GLN 93 3.916 11.977 -4.648 728 HG2 GLN 93 HG2 GLN 93 4.711 14.316 -6.358 729 HG3 GLN 93 HG3 GLN 93 3.380 14.227 -5.203 730 HE21 GLN 93 HE21 GLN 93 3.764 14.629 -3.085 731 HE22 GLN 93 HE22 GLN 93 5.307 15.053 -2.443 732 H VAL 94 H VAL 94 4.723 9.771 -6.793 733 HA VAL 94 HA VAL 94 4.453 7.939 -4.725 734 HB VAL 94 HB VAL 94 4.889 7.379 -7.676 735 HG11 VAL 94 HG11 VAL 94 5.098 5.508 -5.777 736 HG12 VAL 94 HG12 VAL 94 4.399 5.198 -7.367 737 HG13 VAL 94 HG13 VAL 94 3.348 5.510 -5.983 738 HG21 VAL 94 HG21 VAL 94 2.278 7.466 -6.160 739 HG22 VAL 94 HG22 VAL 94 2.522 7.390 -7.907 740 HG23 VAL 94 HG23 VAL 94 2.939 8.855 -7.022 741 H GLY 95 H GLY 95 7.121 8.349 -7.039 742 HA2 GLY 95 HA2 GLY 95 8.730 6.231 -6.129 743 HA3 GLY 95 HA3 GLY 95 9.308 7.652 -6.983 744 H PHE 96 H PHE 96 8.862 9.709 -5.327 745 HA PHE 96 HA PHE 96 10.924 9.789 -3.552 746 HB2 PHE 96 HB2 PHE 96 9.948 11.864 -3.854 747 HB3 PHE 96 HB3 PHE 96 8.312 11.238 -3.699 748 HD1 PHE 96 HD1 PHE 96 7.423 10.699 -1.408 749 HD2 PHE 96 HD2 PHE 96 11.089 12.777 -2.014 750 HE1 PHE 96 HE1 PHE 96 7.349 11.501 0.912 751 HE2 PHE 96 HE2 PHE 96 11.019 13.578 0.310 752 HZ PHE 96 HZ PHE 96 9.148 12.941 1.776 753 H TYR 97 H TYR 97 7.607 8.721 -2.890 754 HA TYR 97 HA TYR 97 7.920 8.231 -0.147 755 HB2 TYR 97 HB2 TYR 97 6.041 7.093 -2.207 756 HB3 TYR 97 HB3 TYR 97 5.959 6.617 -0.515 757 HD1 TYR 97 HD1 TYR 97 6.259 8.985 1.011 758 HD2 TYR 97 HD2 TYR 97 4.332 8.535 -2.752 759 HE1 TYR 97 HE1 TYR 97 4.884 10.962 1.486 760 HE2 TYR 97 HE2 TYR 97 2.949 10.509 -2.286 761 HH TYR 97 HH TYR 97 2.136 11.700 -0.034 762 H THR 98 H THR 98 8.265 6.029 -2.941 763 HA THR 98 HA THR 98 9.022 3.837 -1.231 764 HB THR 98 HB THR 98 9.429 2.636 -3.368 765 HG1 THR 98 HG1 THR 98 9.243 3.640 -5.262 766 HG21 THR 98 HG21 THR 98 7.217 2.382 -3.977 767 HG22 THR 98 HG22 THR 98 6.826 4.068 -3.639 768 HG23 THR 98 HG23 THR 98 7.115 2.946 -2.310 769 H GLU 99 H GLU 99 10.865 6.270 -3.044 770 HA GLU 99 HA GLU 99 13.310 4.715 -2.735 771 HB2 GLU 99 HB2 GLU 99 14.365 6.729 -3.920 772 HB3 GLU 99 HB3 GLU 99 13.289 5.690 -4.834 773 HG2 GLU 99 HG2 GLU 99 11.776 7.314 -5.152 774 HG3 GLU 99 HG3 GLU 99 12.001 7.999 -3.545 775 H VAL 100 H VAL 100 12.098 7.847 -1.481 776 HA VAL 100 HA VAL 100 14.488 7.867 0.231 777 HB VAL 100 HB VAL 100 14.256 9.863 -1.162 778 HG11 VAL 100 HG11 VAL 100 12.453 11.517 -0.485 779 HG12 VAL 100 HG12 VAL 100 11.629 10.149 0.261 780 HG13 VAL 100 HG13 VAL 100 11.950 10.147 -1.473 781 HG21 VAL 100 HG21 VAL 100 13.818 10.462 1.756 782 HG22 VAL 100 HG22 VAL 100 14.614 11.502 0.574 783 HG23 VAL 100 HG23 VAL 100 15.354 9.971 1.042 784 H LEU 101 H LEU 101 10.989 8.248 0.362 785 HA LEU 101 HA LEU 101 10.785 8.786 3.116 786 HB2 LEU 101 HB2 LEU 101 9.072 8.944 1.112 787 HB3 LEU 101 HB3 LEU 101 8.612 7.347 1.671 788 HG LEU 101 HG LEU 101 7.138 9.013 2.625 789 HD11 LEU 101 HD11 LEU 101 7.287 8.365 4.906 790 HD12 LEU 101 HD12 LEU 101 9.023 8.065 4.782 791 HD13 LEU 101 HD13 LEU 101 7.883 7.009 3.950 792 HD21 LEU 101 HD21 LEU 101 9.666 10.241 3.735 793 HD22 LEU 101 HD22 LEU 101 8.028 10.707 4.189 794 HD23 LEU 101 HD23 LEU 101 8.586 10.949 2.537 795 H PHE 102 H PHE 102 9.850 5.769 1.476 796 HA PHE 102 HA PHE 102 9.451 4.228 3.738 797 HB2 PHE 102 HB2 PHE 102 10.106 3.490 0.905 798 HB3 PHE 102 HB3 PHE 102 9.757 2.294 2.135 799 HD1 PHE 102 HD1 PHE 102 7.993 5.417 2.406 800 HD2 PHE 102 HD2 PHE 102 7.888 1.537 0.652 801 HE1 PHE 102 HE1 PHE 102 5.598 5.685 1.959 802 HE2 PHE 102 HE2 PHE 102 5.472 1.798 0.224 803 HZ PHE 102 HZ PHE 102 4.331 3.878 0.874 804 HA PRO 103 HA PRO 103 14.178 2.606 2.715 805 HB2 PRO 103 HB2 PRO 103 15.041 5.429 3.203 806 HB3 PRO 103 HB3 PRO 103 15.825 4.161 2.264 807 HG2 PRO 103 HG2 PRO 103 14.423 6.073 1.067 808 HG3 PRO 103 HG3 PRO 103 14.381 4.405 0.468 809 HD2 PRO 103 HD2 PRO 103 12.301 5.948 1.892 810 HD3 PRO 103 HD3 PRO 103 12.142 4.574 0.799 811 H GLN 104 H GLN 104 13.186 5.147 5.018 812 HA GLN 104 HA GLN 104 15.019 4.753 7.013 813 HB2 GLN 104 HB2 GLN 104 12.311 5.033 8.097 814 HB3 GLN 104 HB3 GLN 104 13.751 5.997 8.372 815 HG2 GLN 104 HG2 GLN 104 13.363 6.959 6.049 816 HG3 GLN 104 HG3 GLN 104 11.777 6.217 6.153 817 HE21 GLN 104 HE21 GLN 104 10.280 6.999 7.659 818 HE22 GLN 104 HE22 GLN 104 10.466 8.546 8.404 819 H LYS 105 H LYS 105 12.419 2.579 6.171 820 HA LYS 105 HA LYS 105 13.269 0.837 8.382 821 HB2 LYS 105 HB2 LYS 105 10.585 0.258 7.403 822 HB3 LYS 105 HB3 LYS 105 11.167 0.440 9.047 823 HG2 LYS 105 HG2 LYS 105 9.516 2.090 8.745 824 HG3 LYS 105 HG3 LYS 105 11.065 2.932 8.681 825 HD2 LYS 105 HD2 LYS 105 10.574 2.225 6.055 826 HD3 LYS 105 HD3 LYS 105 8.991 2.687 6.672 827 HE2 LYS 105 HE2 LYS 105 10.613 4.625 7.707 828 HE3 LYS 105 HE3 LYS 105 11.347 4.325 6.134 829 HZ1 LYS 105 HZ1 LYS 105 8.718 5.412 6.790 830 HZ2 LYS 105 HZ2 LYS 105 8.856 4.482 5.387 831 HZ3 LYS 105 HZ3 LYS 105 9.801 5.868 5.573 832 H ASN 106 H ASN 106 13.633 1.086 5.178 833 HA ASN 106 HA ASN 106 14.085 -0.354 3.483 834 HB2 ASN 106 HB2 ASN 106 15.554 -1.468 5.029 835 HB3 ASN 106 HB3 ASN 106 14.214 -2.355 5.747 836 HD21 ASN 106 HD21 ASN 106 16.240 -1.993 2.931 837 HD22 ASN 106 HD22 ASN 106 15.913 -3.545 2.257 838 H VAL 107 H VAL 107 12.219 -0.144 2.390 839 HA VAL 107 HA VAL 107 9.947 -1.852 3.074 840 HB VAL 107 HB VAL 107 9.825 0.688 2.722 841 HG11 VAL 107 HG11 VAL 107 10.937 0.286 0.379 842 HG12 VAL 107 HG12 VAL 107 9.680 1.502 0.551 843 HG13 VAL 107 HG13 VAL 107 9.287 -0.078 -0.117 844 HG21 VAL 107 HG21 VAL 107 7.514 0.421 1.975 845 HG22 VAL 107 HG22 VAL 107 7.948 -0.803 3.161 846 HG23 VAL 107 HG23 VAL 107 7.872 -1.220 1.449 847 H ARG 108 H ARG 108 8.816 -3.025 1.637 848 HA ARG 108 HA ARG 108 10.043 -3.584 -0.956 849 HB2 ARG 108 HB2 ARG 108 9.906 -5.403 1.148 850 HB3 ARG 108 HB3 ARG 108 8.527 -5.819 0.142 851 HG2 ARG 108 HG2 ARG 108 11.406 -5.677 -0.730 852 HG3 ARG 108 HG3 ARG 108 10.445 -7.136 -0.494 853 HD2 ARG 108 HD2 ARG 108 8.977 -5.520 -2.257 854 HD3 ARG 108 HD3 ARG 108 10.649 -5.433 -2.804 855 HE ARG 108 HE ARG 108 10.209 -8.095 -2.391 856 HH11 ARG 108 HH11 ARG 108 8.642 -5.624 -4.314 857 HH12 ARG 108 HH12 ARG 108 8.120 -6.732 -5.535 858 HH21 ARG 108 HH21 ARG 108 9.517 -9.550 -4.007 859 HH22 ARG 108 HH22 ARG 108 8.614 -8.959 -5.361 860 H PHE 109 H PHE 109 8.689 -2.253 -2.042 861 HA PHE 109 HA PHE 109 5.871 -2.218 -1.541 862 HB2 PHE 109 HB2 PHE 109 7.543 -0.385 -2.501 863 HB3 PHE 109 HB3 PHE 109 6.994 -1.049 -4.029 864 HD1 PHE 109 HD1 PHE 109 4.426 -1.209 -4.355 865 HD2 PHE 109 HD2 PHE 109 6.326 1.229 -1.440 866 HE1 PHE 109 HE1 PHE 109 2.412 0.190 -4.237 867 HE2 PHE 109 HE2 PHE 109 4.319 2.648 -1.301 868 HZ PHE 109 HZ PHE 109 2.351 2.125 -2.701 869 H LEU 110 H LEU 110 4.216 -2.995 -2.836 870 HA LEU 110 HA LEU 110 4.973 -4.668 -5.120 871 HB2 LEU 110 HB2 LEU 110 4.676 -6.265 -3.447 872 HB3 LEU 110 HB3 LEU 110 3.291 -5.446 -2.759 873 HG LEU 110 HG LEU 110 2.849 -7.627 -3.996 874 HD11 LEU 110 HD11 LEU 110 0.737 -6.968 -4.502 875 HD12 LEU 110 HD12 LEU 110 1.259 -5.487 -5.300 876 HD13 LEU 110 HD13 LEU 110 1.247 -5.584 -3.539 877 HD21 LEU 110 HD21 LEU 110 4.240 -6.256 -6.052 878 HD22 LEU 110 HD22 LEU 110 2.578 -6.492 -6.589 879 HD23 LEU 110 HD23 LEU 110 3.545 -7.876 -6.084 880 H ALA 111 H ALA 111 3.879 -4.323 -6.849 881 HA ALA 111 HA ALA 111 1.224 -3.041 -6.736 882 HB1 ALA 111 HB1 ALA 111 3.434 -2.481 -8.727 883 HB2 ALA 111 HB2 ALA 111 2.857 -1.383 -7.469 884 HB3 ALA 111 HB3 ALA 111 1.797 -1.829 -8.805 885 H ILE 112 H ILE 112 -0.015 -4.782 -7.110 886 HA ILE 112 HA ILE 112 0.815 -6.986 -8.630 887 HB ILE 112 HB ILE 112 -1.852 -6.174 -7.554 888 HG12 ILE 112 HG12 ILE 112 -0.462 -8.710 -6.927 889 HG13 ILE 112 HG13 ILE 112 0.305 -7.237 -6.369 890 HG21 ILE 112 HG21 ILE 112 -2.625 -8.485 -8.200 891 HG22 ILE 112 HG22 ILE 112 -1.245 -8.550 -9.296 892 HG23 ILE 112 HG23 ILE 112 -2.494 -7.328 -9.524 893 HD11 ILE 112 HD11 ILE 112 -1.730 -8.680 -5.131 894 HD12 ILE 112 HD12 ILE 112 -2.484 -7.197 -5.730 895 HD13 ILE 112 HD13 ILE 112 -1.082 -7.108 -4.670 896 H ASN 113 H ASN 113 -1.628 -4.534 -9.616 897 HA ASN 113 HA ASN 113 -1.878 -5.719 -12.219 898 HB2 ASN 113 HB2 ASN 113 -3.566 -4.282 -10.747 899 HB3 ASN 113 HB3 ASN 113 -2.895 -2.972 -11.710 900 HD21 ASN 113 HD21 ASN 113 -5.206 -5.372 -11.571 901 HD22 ASN 113 HD22 ASN 113 -5.680 -5.378 -13.232 902 H ASN 114 H ASN 114 0.862 -4.869 -11.746 903 HA ASN 114 HA ASN 114 1.627 -3.877 -14.161 904 HB2 ASN 114 HB2 ASN 114 0.418 -1.767 -12.670 905 HB3 ASN 114 HB3 ASN 114 2.138 -1.435 -12.800 906 HD21 ASN 114 HD21 ASN 114 -0.723 -0.873 -14.225 907 HD22 ASN 114 HD22 ASN 114 -0.205 -0.615 -15.852 908 H SER 115 H SER 115 3.837 -2.604 -14.025 909 HA SER 115 HA SER 115 5.514 -4.147 -12.232 910 HB2 SER 115 HB2 SER 115 6.111 -2.251 -14.509 911 HB3 SER 115 HB3 SER 115 7.379 -2.924 -13.484 912 HG SER 115 HG SER 115 7.200 -4.754 -14.499 913 H ILE 116 H ILE 116 5.886 -3.442 -10.247 914 HA ILE 116 HA ILE 116 5.258 -0.893 -9.304 915 HB ILE 116 HB ILE 116 5.740 -3.220 -8.085 916 HG12 ILE 116 HG12 ILE 116 4.567 -1.167 -7.235 917 HG13 ILE 116 HG13 ILE 116 5.452 -2.066 -6.009 918 HG21 ILE 116 HG21 ILE 116 8.229 -1.608 -7.565 919 HG22 ILE 116 HG22 ILE 116 8.147 -3.166 -8.387 920 HG23 ILE 116 HG23 ILE 116 7.734 -3.045 -6.673 921 HD11 ILE 116 HD11 ILE 116 6.001 0.610 -7.179 922 HD12 ILE 116 HD12 ILE 116 7.351 -0.356 -6.582 923 HD13 ILE 116 HD13 ILE 116 6.033 0.082 -5.497 924 H ASP 117 H ASP 117 8.479 -2.239 -10.068 925 HA ASP 117 HA ASP 117 9.496 0.282 -10.914 926 HB2 ASP 117 HB2 ASP 117 9.410 0.270 -8.255 927 HB3 ASP 117 HB3 ASP 117 10.914 -0.623 -8.447 928 H SER 118 H SER 118 9.431 -2.350 -11.989 929 HA SER 118 HA SER 118 12.083 -3.458 -11.653 930 HB2 SER 118 HB2 SER 118 9.539 -4.389 -12.756 931 HB3 SER 118 HB3 SER 118 10.929 -4.860 -13.731 932 HG SER 118 HG SER 118 10.154 -5.726 -11.250 933 H ASN 119 H ASN 119 13.635 -3.660 -13.300 934 HA ASN 119 HA ASN 119 13.227 -2.384 -15.860 935 HB2 ASN 119 HB2 ASN 119 14.298 -0.850 -13.762 936 HB3 ASN 119 HB3 ASN 119 15.661 -1.277 -14.796 937 HD21 ASN 119 HD21 ASN 119 12.356 -0.046 -14.913 938 HD22 ASN 119 HD22 ASN 119 12.625 1.038 -16.221 939 H ASN 120 H ASN 120 16.077 -3.082 -13.875 940 HA ASN 120 HA ASN 120 17.319 -4.505 -16.041 941 HB2 ASN 120 HB2 ASN 120 18.238 -3.115 -13.797 942 HB3 ASN 120 HB3 ASN 120 18.676 -4.793 -13.495 943 HD21 ASN 120 HD21 ASN 120 19.784 -5.912 -15.323 944 HD22 ASN 120 HD22 ASN 120 20.925 -4.994 -16.240 Start of MODEL 8 1 H1 GLY 1 H1 GLY 1 17.850 -3.826 18.590 2 H2 GLY 1 H2 GLY 1 17.094 -4.019 17.090 3 H3 GLY 1 H3 GLY 1 18.780 -4.037 17.194 4 HA2 GLY 1 HA2 GLY 1 17.457 -6.253 16.999 5 HA3 GLY 1 HA3 GLY 1 18.888 -6.137 18.009 6 H SER 2 H SER 2 15.845 -7.304 17.932 7 HA SER 2 HA SER 2 14.554 -8.321 19.502 8 HB2 SER 2 HB2 SER 2 16.422 -7.280 21.631 9 HB3 SER 2 HB3 SER 2 15.324 -8.654 21.734 10 HG SER 2 HG SER 2 17.431 -9.368 21.353 11 H ARG 3 H ARG 3 12.788 -7.838 20.767 12 HA ARG 3 HA ARG 3 11.129 -6.601 21.689 13 HB2 ARG 3 HB2 ARG 3 13.530 -5.489 22.748 14 HB3 ARG 3 HB3 ARG 3 12.417 -4.171 22.406 15 HG2 ARG 3 HG2 ARG 3 11.803 -6.594 24.088 16 HG3 ARG 3 HG3 ARG 3 12.188 -4.982 24.696 17 HD2 ARG 3 HD2 ARG 3 10.198 -4.070 23.756 18 HD3 ARG 3 HD3 ARG 3 9.872 -5.551 22.858 19 HE ARG 3 HE ARG 3 9.010 -6.503 24.770 20 HH11 ARG 3 HH11 ARG 3 10.566 -3.473 25.592 21 HH12 ARG 3 HH12 ARG 3 9.905 -3.428 27.191 22 HH21 ARG 3 HH21 ARG 3 8.146 -6.436 26.877 23 HH22 ARG 3 HH22 ARG 3 8.533 -5.110 27.921 24 H THR 4 H THR 4 11.519 -6.386 18.901 25 HA THR 4 HA THR 4 10.216 -3.825 18.466 26 HB THR 4 HB THR 4 11.677 -3.563 16.340 27 HG1 THR 4 HG1 THR 4 13.446 -5.100 17.938 28 HG21 THR 4 HG21 THR 4 13.208 -2.154 17.411 29 HG22 THR 4 HG22 THR 4 13.136 -3.078 18.910 30 HG23 THR 4 HG23 THR 4 11.753 -2.109 18.406 31 H SER 5 H SER 5 8.566 -3.969 17.050 32 HA SER 5 HA SER 5 8.511 -6.095 15.046 33 HB2 SER 5 HB2 SER 5 6.276 -5.752 17.054 34 HB3 SER 5 HB3 SER 5 6.292 -6.867 15.688 35 HG SER 5 HG SER 5 7.136 -7.361 18.095 36 H ARG 6 H ARG 6 8.646 -4.477 13.486 37 HA ARG 6 HA ARG 6 6.831 -2.276 13.404 38 HB2 ARG 6 HB2 ARG 6 7.859 -1.662 11.399 39 HB3 ARG 6 HB3 ARG 6 9.143 -2.449 12.300 40 HG2 ARG 6 HG2 ARG 6 7.505 -3.820 10.193 41 HG3 ARG 6 HG3 ARG 6 9.033 -3.014 9.875 42 HD2 ARG 6 HD2 ARG 6 9.836 -5.107 10.208 43 HD3 ARG 6 HD3 ARG 6 9.831 -4.562 11.882 44 HE ARG 6 HE ARG 6 7.415 -5.679 11.697 45 HH11 ARG 6 HH11 ARG 6 10.553 -6.851 10.681 46 HH12 ARG 6 HH12 ARG 6 10.126 -8.517 10.868 47 HH21 ARG 6 HH21 ARG 6 6.865 -7.873 11.950 48 HH22 ARG 6 HH22 ARG 6 8.035 -9.097 11.595 49 H ILE 7 H ILE 7 6.027 -2.523 10.527 50 HA ILE 7 HA ILE 7 4.307 -4.869 10.616 51 HB ILE 7 HB ILE 7 2.270 -3.732 10.407 52 HG12 ILE 7 HG12 ILE 7 2.901 -0.995 10.836 53 HG13 ILE 7 HG13 ILE 7 3.838 -1.568 9.461 54 HG21 ILE 7 HG21 ILE 7 3.773 -2.332 12.589 55 HG22 ILE 7 HG22 ILE 7 3.160 -3.981 12.690 56 HG23 ILE 7 HG23 ILE 7 2.038 -2.631 12.525 57 HD11 ILE 7 HD11 ILE 7 1.108 -2.484 9.299 58 HD12 ILE 7 HD12 ILE 7 2.049 -1.535 8.148 59 HD13 ILE 7 HD13 ILE 7 1.187 -0.730 9.458 60 H THR 8 H THR 8 2.878 -5.107 8.738 61 HA THR 8 HA THR 8 4.212 -4.298 6.240 62 HB THR 8 HB THR 8 2.327 -6.574 6.940 63 HG1 THR 8 HG1 THR 8 4.236 -7.426 7.178 64 HG21 THR 8 HG21 THR 8 2.417 -7.309 4.625 65 HG22 THR 8 HG22 THR 8 3.296 -5.846 4.179 66 HG23 THR 8 HG23 THR 8 1.634 -5.734 4.757 67 H ALA 9 H ALA 9 2.910 -3.238 4.561 68 HA ALA 9 HA ALA 9 0.373 -2.242 5.711 69 HB1 ALA 9 HB1 ALA 9 0.663 -0.241 4.321 70 HB2 ALA 9 HB2 ALA 9 2.223 -0.865 3.790 71 HB3 ALA 9 HB3 ALA 9 1.958 -0.475 5.489 72 H LEU 10 H LEU 10 -1.439 -2.610 4.800 73 HA LEU 10 HA LEU 10 -1.543 -3.535 1.999 74 HB2 LEU 10 HB2 LEU 10 -2.191 -5.041 4.059 75 HB3 LEU 10 HB3 LEU 10 -3.673 -4.119 4.008 76 HG LEU 10 HG LEU 10 -3.006 -5.124 1.389 77 HD11 LEU 10 HD11 LEU 10 -3.482 -7.527 2.024 78 HD12 LEU 10 HD12 LEU 10 -3.094 -7.070 3.682 79 HD13 LEU 10 HD13 LEU 10 -1.871 -6.930 2.420 80 HD21 LEU 10 HD21 LEU 10 -5.288 -6.251 1.913 81 HD22 LEU 10 HD22 LEU 10 -5.186 -4.492 1.738 82 HD23 LEU 10 HD23 LEU 10 -5.248 -5.213 3.339 83 H TYR 11 H TYR 11 -2.038 -1.683 0.925 84 HA TYR 11 HA TYR 11 -4.253 -0.031 1.952 85 HB2 TYR 11 HB2 TYR 11 -2.588 1.496 1.896 86 HB3 TYR 11 HB3 TYR 11 -1.623 0.562 0.790 87 HD1 TYR 11 HD1 TYR 11 -2.147 0.737 -1.686 88 HD2 TYR 11 HD2 TYR 11 -3.746 3.404 1.205 89 HE1 TYR 11 HE1 TYR 11 -2.554 2.395 -3.444 90 HE2 TYR 11 HE2 TYR 11 -4.149 5.075 -0.540 91 HH TYR 11 HH TYR 11 -3.191 5.603 -2.831 92 H GLU 12 H GLU 12 -6.157 -0.213 0.863 93 HA GLU 12 HA GLU 12 -5.977 -0.816 -2.020 94 HB2 GLU 12 HB2 GLU 12 -8.195 -2.238 -0.978 95 HB3 GLU 12 HB3 GLU 12 -6.759 -2.870 -1.766 96 HG2 GLU 12 HG2 GLU 12 -6.978 -3.965 0.325 97 HG3 GLU 12 HG3 GLU 12 -5.621 -2.851 0.454 98 H ARG 13 H ARG 13 -8.030 -0.771 -3.164 99 HA ARG 13 HA ARG 13 -10.278 0.640 -2.210 100 HB2 ARG 13 HB2 ARG 13 -9.119 2.666 -2.505 101 HB3 ARG 13 HB3 ARG 13 -8.358 2.122 -3.982 102 HG2 ARG 13 HG2 ARG 13 -10.680 2.110 -5.006 103 HG3 ARG 13 HG3 ARG 13 -11.186 3.005 -3.572 104 HD2 ARG 13 HD2 ARG 13 -10.361 4.899 -4.389 105 HD3 ARG 13 HD3 ARG 13 -8.790 4.153 -4.661 106 HE ARG 13 HE ARG 13 -10.951 4.447 -6.596 107 HH11 ARG 13 HH11 ARG 13 -7.750 3.227 -5.891 108 HH12 ARG 13 HH12 ARG 13 -7.308 3.017 -7.551 109 HH21 ARG 13 HH21 ARG 13 -10.384 4.170 -8.789 110 HH22 ARG 13 HH22 ARG 13 -8.818 3.558 -9.200 111 H LEU 14 H LEU 14 -12.065 0.208 -3.438 112 HA LEU 14 HA LEU 14 -11.586 -1.369 -5.861 113 HB2 LEU 14 HB2 LEU 14 -12.846 -3.012 -5.005 114 HB3 LEU 14 HB3 LEU 14 -12.787 -2.146 -3.500 115 HG LEU 14 HG LEU 14 -15.045 -2.822 -3.958 116 HD11 LEU 14 HD11 LEU 14 -14.282 -0.047 -3.679 117 HD12 LEU 14 HD12 LEU 14 -15.538 -0.968 -2.854 118 HD13 LEU 14 HD13 LEU 14 -15.871 -0.231 -4.420 119 HD21 LEU 14 HD21 LEU 14 -14.685 -2.823 -6.474 120 HD22 LEU 14 HD22 LEU 14 -15.075 -1.115 -6.406 121 HD23 LEU 14 HD23 LEU 14 -16.259 -2.300 -5.880 122 H SER 15 H SER 15 -12.858 -1.084 -7.631 123 HA SER 15 HA SER 15 -13.513 1.444 -8.432 124 HB2 SER 15 HB2 SER 15 -14.438 0.503 -10.396 125 HB3 SER 15 HB3 SER 15 -13.196 -0.626 -9.860 126 HG SER 15 HG SER 15 -15.786 -1.087 -10.261 127 H ARG 16 H ARG 16 -15.120 2.837 -8.222 128 HA ARG 16 HA ARG 16 -17.393 2.191 -6.575 129 HB2 ARG 16 HB2 ARG 16 -16.781 4.766 -8.024 130 HB3 ARG 16 HB3 ARG 16 -17.931 4.546 -6.714 131 HG2 ARG 16 HG2 ARG 16 -15.496 3.611 -5.717 132 HG3 ARG 16 HG3 ARG 16 -15.110 5.086 -6.605 133 HD2 ARG 16 HD2 ARG 16 -17.402 5.758 -5.234 134 HD3 ARG 16 HD3 ARG 16 -16.539 4.732 -4.091 135 HE ARG 16 HE ARG 16 -15.076 6.442 -3.768 136 HH11 ARG 16 HH11 ARG 16 -16.584 6.913 -6.894 137 HH12 ARG 16 HH12 ARG 16 -15.822 8.442 -7.166 138 HH21 ARG 16 HH21 ARG 16 -14.088 8.464 -4.131 139 HH22 ARG 16 HH22 ARG 16 -14.413 9.325 -5.595 140 H ASP 17 H ASP 17 -16.827 2.111 -9.962 141 HA ASP 17 HA ASP 17 -19.578 2.708 -10.666 142 HB2 ASP 17 HB2 ASP 17 -17.186 1.905 -12.318 143 HB3 ASP 17 HB3 ASP 17 -18.785 2.170 -13.000 144 H ASP 18 H ASP 18 -17.691 -0.151 -10.005 145 HA ASP 18 HA ASP 18 -18.212 -2.349 -9.974 146 HB2 ASP 18 HB2 ASP 18 -20.084 -1.632 -8.628 147 HB3 ASP 18 HB3 ASP 18 -21.042 -1.299 -10.063 148 H ASP 19 H ASP 19 -17.555 -1.267 -12.458 149 HA ASP 19 HA ASP 19 -19.288 -2.464 -14.441 150 HB2 ASP 19 HB2 ASP 19 -17.702 -0.300 -14.583 151 HB3 ASP 19 HB3 ASP 19 -16.575 -1.512 -15.177 152 H LEU 20 H LEU 20 -17.591 -3.944 -12.295 153 HA LEU 20 HA LEU 20 -16.426 -5.914 -14.125 154 HB2 LEU 20 HB2 LEU 20 -14.965 -6.302 -11.871 155 HB3 LEU 20 HB3 LEU 20 -14.441 -5.365 -13.248 156 HG LEU 20 HG LEU 20 -13.966 -4.211 -11.145 157 HD11 LEU 20 HD11 LEU 20 -15.172 -3.101 -13.372 158 HD12 LEU 20 HD12 LEU 20 -14.254 -2.260 -12.125 159 HD13 LEU 20 HD13 LEU 20 -16.007 -2.375 -11.999 160 HD21 LEU 20 HD21 LEU 20 -16.802 -3.637 -10.577 161 HD22 LEU 20 HD22 LEU 20 -15.431 -3.806 -9.484 162 HD23 LEU 20 HD23 LEU 20 -16.210 -5.241 -10.147 163 H THR 21 H THR 21 -17.972 -5.354 -10.982 164 HA THR 21 HA THR 21 -19.174 -6.655 -9.587 165 HB THR 21 HB THR 21 -20.047 -8.788 -11.251 166 HG1 THR 21 HG1 THR 21 -19.713 -7.895 -13.139 167 HG21 THR 21 HG21 THR 21 -21.403 -6.214 -10.498 168 HG22 THR 21 HG22 THR 21 -21.441 -7.727 -9.593 169 HG23 THR 21 HG23 THR 21 -22.195 -7.632 -11.183 170 H GLY 22 H GLY 22 -19.599 -9.120 -8.944 171 HA2 GLY 22 HA2 GLY 22 -18.713 -11.203 -8.394 172 HA3 GLY 22 HA3 GLY 22 -17.281 -10.819 -9.333 173 H GLU 23 H GLU 23 -15.532 -10.855 -8.106 174 HA GLU 23 HA GLU 23 -15.682 -10.244 -5.257 175 HB2 GLU 23 HB2 GLU 23 -14.218 -11.921 -5.188 176 HB3 GLU 23 HB3 GLU 23 -14.061 -11.920 -6.935 177 HG2 GLU 23 HG2 GLU 23 -12.589 -9.872 -5.369 178 HG3 GLU 23 HG3 GLU 23 -11.994 -11.530 -5.369 179 H SER 24 H SER 24 -14.535 -8.813 -8.210 180 HA SER 24 HA SER 24 -12.700 -6.979 -7.105 181 HB2 SER 24 HB2 SER 24 -13.076 -5.723 -9.268 182 HB3 SER 24 HB3 SER 24 -12.586 -7.407 -9.445 183 HG SER 24 HG SER 24 -14.420 -7.816 -10.383 184 H ASN 25 H ASN 25 -16.170 -6.971 -7.100 185 HA ASN 25 HA ASN 25 -16.187 -4.114 -6.468 186 HB2 ASN 25 HB2 ASN 25 -18.415 -3.984 -7.129 187 HB3 ASN 25 HB3 ASN 25 -17.722 -5.126 -8.268 188 HD21 ASN 25 HD21 ASN 25 -17.964 -7.471 -7.576 189 HD22 ASN 25 HD22 ASN 25 -19.491 -7.917 -6.912 190 H SER 26 H SER 26 -15.123 -4.891 -4.377 191 HA SER 26 HA SER 26 -17.005 -4.624 -2.295 192 HB2 SER 26 HB2 SER 26 -15.980 -7.093 -1.459 193 HB3 SER 26 HB3 SER 26 -17.636 -6.745 -1.943 194 HG SER 26 HG SER 26 -17.050 -8.333 -3.293 195 H ILE 27 H ILE 27 -16.051 -3.776 -0.572 196 HA ILE 27 HA ILE 27 -13.352 -3.082 -0.535 197 HB ILE 27 HB ILE 27 -15.534 -3.064 1.507 198 HG12 ILE 27 HG12 ILE 27 -15.042 -1.275 -0.297 199 HG13 ILE 27 HG13 ILE 27 -15.379 -0.739 1.345 200 HG21 ILE 27 HG21 ILE 27 -13.580 -1.814 2.897 201 HG22 ILE 27 HG22 ILE 27 -12.671 -3.127 2.153 202 HG23 ILE 27 HG23 ILE 27 -14.074 -3.486 3.156 203 HD11 ILE 27 HD11 ILE 27 -13.504 0.448 0.227 204 HD12 ILE 27 HD12 ILE 27 -12.601 -1.070 0.229 205 HD13 ILE 27 HD13 ILE 27 -13.070 -0.317 1.755 206 H THR 28 H THR 28 -14.971 -5.383 1.653 207 HA THR 28 HA THR 28 -12.705 -6.486 2.806 208 HB THR 28 HB THR 28 -15.339 -6.768 3.208 209 HG1 THR 28 HG1 THR 28 -13.502 -8.762 4.019 210 HG21 THR 28 HG21 THR 28 -14.526 -9.433 2.101 211 HG22 THR 28 HG22 THR 28 -15.631 -8.311 1.314 212 HG23 THR 28 HG23 THR 28 -16.058 -9.023 2.870 213 H ASN 29 H ASN 29 -14.304 -7.403 -0.229 214 HA ASN 29 HA ASN 29 -12.997 -9.842 -0.615 215 HB2 ASN 29 HB2 ASN 29 -14.382 -7.926 -2.417 216 HB3 ASN 29 HB3 ASN 29 -13.332 -9.123 -3.164 217 HD21 ASN 29 HD21 ASN 29 -13.989 -11.193 -3.302 218 HD22 ASN 29 HD22 ASN 29 -15.508 -11.771 -2.720 219 H GLN 30 H GLN 30 -12.068 -6.674 -2.109 220 HA GLN 30 HA GLN 30 -9.660 -7.666 -3.149 221 HB2 GLN 30 HB2 GLN 30 -9.594 -5.640 -4.061 222 HB3 GLN 30 HB3 GLN 30 -10.984 -5.184 -3.096 223 HG2 GLN 30 HG2 GLN 30 -8.252 -4.995 -1.917 224 HG3 GLN 30 HG3 GLN 30 -8.814 -3.761 -3.045 225 HE21 GLN 30 HE21 GLN 30 -11.311 -3.276 -2.485 226 HE22 GLN 30 HE22 GLN 30 -11.538 -2.815 -0.841 227 H LYS 31 H LYS 31 -10.469 -6.546 0.098 228 HA LYS 31 HA LYS 31 -7.904 -6.159 1.135 229 HB2 LYS 31 HB2 LYS 31 -10.244 -7.419 2.589 230 HB3 LYS 31 HB3 LYS 31 -8.846 -6.658 3.328 231 HG2 LYS 31 HG2 LYS 31 -9.833 -4.663 1.744 232 HG3 LYS 31 HG3 LYS 31 -11.291 -5.477 2.306 233 HD2 LYS 31 HD2 LYS 31 -9.476 -5.237 4.481 234 HD3 LYS 31 HD3 LYS 31 -9.640 -3.661 3.707 235 HE2 LYS 31 HE2 LYS 31 -12.222 -4.810 3.893 236 HE3 LYS 31 HE3 LYS 31 -11.438 -4.999 5.461 237 HZ1 LYS 31 HZ1 LYS 31 -11.483 -2.412 4.027 238 HZ2 LYS 31 HZ2 LYS 31 -11.138 -2.699 5.656 239 HZ3 LYS 31 HZ3 LYS 31 -12.719 -2.876 5.085 240 H LYS 32 H LYS 32 -9.909 -9.097 1.059 241 HA LYS 32 HA LYS 32 -8.081 -10.901 2.148 242 HB2 LYS 32 HB2 LYS 32 -10.426 -11.196 0.303 243 HB3 LYS 32 HB3 LYS 32 -9.424 -12.590 0.682 244 HG2 LYS 32 HG2 LYS 32 -10.011 -12.549 2.939 245 HG3 LYS 32 HG3 LYS 32 -10.610 -10.893 2.846 246 HD2 LYS 32 HD2 LYS 32 -11.887 -13.101 1.266 247 HD3 LYS 32 HD3 LYS 32 -12.324 -12.811 2.951 248 HE2 LYS 32 HE2 LYS 32 -13.215 -10.716 2.491 249 HE3 LYS 32 HE3 LYS 32 -12.329 -10.565 0.976 250 HZ1 LYS 32 HZ1 LYS 32 -13.770 -12.520 0.220 251 HZ2 LYS 32 HZ2 LYS 32 -14.494 -10.995 0.318 252 HZ3 LYS 32 HZ3 LYS 32 -14.761 -12.135 1.535 253 H TYR 33 H TYR 33 -8.533 -9.836 -1.198 254 HA TYR 33 HA TYR 33 -6.929 -11.633 -2.554 255 HB2 TYR 33 HB2 TYR 33 -8.284 -9.815 -3.610 256 HB3 TYR 33 HB3 TYR 33 -7.074 -8.655 -3.084 257 HD1 TYR 33 HD1 TYR 33 -7.583 -11.637 -5.231 258 HD2 TYR 33 HD2 TYR 33 -5.132 -8.265 -4.356 259 HE1 TYR 33 HE1 TYR 33 -6.270 -12.058 -7.270 260 HE2 TYR 33 HE2 TYR 33 -3.823 -8.681 -6.364 261 HH TYR 33 HH TYR 33 -4.716 -10.318 -8.852 262 H LEU 34 H LEU 34 -5.876 -8.428 -1.387 263 HA LEU 34 HA LEU 34 -3.141 -8.728 -1.806 264 HB2 LEU 34 HB2 LEU 34 -4.596 -7.249 0.395 265 HB3 LEU 34 HB3 LEU 34 -2.898 -7.069 0.045 266 HG LEU 34 HG LEU 34 -3.297 -5.541 -1.526 267 HD11 LEU 34 HD11 LEU 34 -5.641 -7.049 -2.640 268 HD12 LEU 34 HD12 LEU 34 -3.971 -7.438 -3.053 269 HD13 LEU 34 HD13 LEU 34 -4.628 -5.848 -3.439 270 HD21 LEU 34 HD21 LEU 34 -4.776 -4.593 -0.037 271 HD22 LEU 34 HD22 LEU 34 -5.991 -5.852 -0.283 272 HD23 LEU 34 HD23 LEU 34 -5.700 -4.650 -1.540 273 H GLU 35 H GLU 35 -5.178 -9.644 0.965 274 HA GLU 35 HA GLU 35 -3.200 -10.443 2.715 275 HB2 GLU 35 HB2 GLU 35 -6.017 -10.641 2.563 276 HB3 GLU 35 HB3 GLU 35 -5.397 -12.245 2.939 277 HG2 GLU 35 HG2 GLU 35 -4.283 -9.954 4.441 278 HG3 GLU 35 HG3 GLU 35 -5.928 -10.455 4.803 279 H ASP 36 H ASP 36 -4.918 -12.309 0.244 280 HA ASP 36 HA ASP 36 -3.779 -14.803 0.585 281 HB2 ASP 36 HB2 ASP 36 -5.538 -13.664 -1.179 282 HB3 ASP 36 HB3 ASP 36 -4.159 -13.991 -2.212 283 H TYR 37 H TYR 37 -2.501 -11.927 -0.940 284 HA TYR 37 HA TYR 37 -0.218 -13.221 -2.125 285 HB2 TYR 37 HB2 TYR 37 -0.813 -11.216 -3.212 286 HB3 TYR 37 HB3 TYR 37 -1.074 -10.358 -1.707 287 HD1 TYR 37 HD1 TYR 37 0.943 -9.691 -0.335 288 HD2 TYR 37 HD2 TYR 37 1.261 -11.111 -4.315 289 HE1 TYR 37 HE1 TYR 37 3.225 -8.779 -0.464 290 HE2 TYR 37 HE2 TYR 37 3.532 -10.176 -4.479 291 HH TYR 37 HH TYR 37 5.404 -9.484 -2.116 292 H ALA 38 H ALA 38 -0.473 -10.788 0.469 293 HA ALA 38 HA ALA 38 2.073 -10.924 1.415 294 HB1 ALA 38 HB1 ALA 38 0.195 -9.386 2.137 295 HB2 ALA 38 HB2 ALA 38 1.345 -9.884 3.378 296 HB3 ALA 38 HB3 ALA 38 -0.242 -10.648 3.288 297 H ARG 39 H ARG 39 -0.530 -13.224 2.087 298 HA ARG 39 HA ARG 39 0.984 -14.584 4.131 299 HB2 ARG 39 HB2 ARG 39 -0.761 -16.319 4.007 300 HB3 ARG 39 HB3 ARG 39 -1.423 -14.710 4.239 301 HG2 ARG 39 HG2 ARG 39 -1.534 -14.850 1.565 302 HG3 ARG 39 HG3 ARG 39 -1.692 -16.566 1.972 303 HD2 ARG 39 HD2 ARG 39 -3.347 -15.335 3.796 304 HD3 ARG 39 HD3 ARG 39 -3.594 -14.389 2.337 305 HE ARG 39 HE ARG 39 -3.771 -17.021 1.554 306 HH11 ARG 39 HH11 ARG 39 -5.432 -14.937 3.817 307 HH12 ARG 39 HH12 ARG 39 -6.941 -15.766 3.666 308 HH21 ARG 39 HH21 ARG 39 -5.766 -18.116 1.354 309 HH22 ARG 39 HH22 ARG 39 -7.134 -17.574 2.268 310 H ARG 40 H ARG 40 0.213 -15.170 0.721 311 HA ARG 40 HA ARG 40 1.700 -17.580 0.516 312 HB2 ARG 40 HB2 ARG 40 1.029 -17.594 -1.664 313 HB3 ARG 40 HB3 ARG 40 -0.141 -16.470 -1.035 314 HG2 ARG 40 HG2 ARG 40 0.856 -14.666 -2.057 315 HG3 ARG 40 HG3 ARG 40 2.411 -15.486 -2.220 316 HD2 ARG 40 HD2 ARG 40 1.672 -16.796 -3.997 317 HD3 ARG 40 HD3 ARG 40 -0.024 -16.522 -3.620 318 HE ARG 40 HE ARG 40 1.695 -14.860 -5.218 319 HH11 ARG 40 HH11 ARG 40 -1.213 -14.905 -3.268 320 HH12 ARG 40 HH12 ARG 40 -1.936 -13.570 -4.096 321 HH21 ARG 40 HH21 ARG 40 0.734 -13.095 -6.297 322 HH22 ARG 40 HH22 ARG 40 -0.832 -12.544 -5.810 323 H ASN 41 H ASN 41 2.652 -14.374 0.878 324 HA ASN 41 HA ASN 41 5.254 -14.785 -0.392 325 HB2 ASN 41 HB2 ASN 41 3.513 -12.490 -0.009 326 HB3 ASN 41 HB3 ASN 41 5.151 -12.154 0.532 327 HD21 ASN 41 HD21 ASN 41 3.822 -14.096 -2.123 328 HD22 ASN 41 HD22 ASN 41 4.711 -13.299 -3.373 329 H GLY 42 H GLY 42 3.734 -14.076 2.708 330 HA2 GLY 42 HA2 GLY 42 4.687 -14.921 4.742 331 HA3 GLY 42 HA3 GLY 42 6.279 -14.749 4.028 332 H PHE 43 H PHE 43 3.543 -12.461 4.458 333 HA PHE 43 HA PHE 43 5.446 -10.632 5.781 334 HB2 PHE 43 HB2 PHE 43 2.999 -9.992 4.126 335 HB3 PHE 43 HB3 PHE 43 3.946 -8.795 4.994 336 HD1 PHE 43 HD1 PHE 43 6.514 -8.767 4.412 337 HD2 PHE 43 HD2 PHE 43 3.487 -10.425 1.959 338 HE1 PHE 43 HE1 PHE 43 8.001 -8.583 2.457 339 HE2 PHE 43 HE2 PHE 43 4.935 -10.249 0.002 340 HZ PHE 43 HZ PHE 43 7.213 -9.326 0.242 341 H GLU 44 H GLU 44 5.011 -9.894 7.775 342 HA GLU 44 HA GLU 44 2.585 -10.808 9.103 343 HB2 GLU 44 HB2 GLU 44 5.308 -9.974 9.999 344 HB3 GLU 44 HB3 GLU 44 3.966 -9.970 11.132 345 HG2 GLU 44 HG2 GLU 44 5.427 -11.992 11.057 346 HG3 GLU 44 HG3 GLU 44 3.691 -12.256 11.000 347 H ASN 45 H ASN 45 1.873 -9.374 10.933 348 HA ASN 45 HA ASN 45 0.783 -7.508 11.585 349 HB2 ASN 45 HB2 ASN 45 3.330 -6.335 10.510 350 HB3 ASN 45 HB3 ASN 45 2.144 -5.388 11.401 351 HD21 ASN 45 HD21 ASN 45 4.879 -7.270 11.614 352 HD22 ASN 45 HD22 ASN 45 4.904 -7.522 13.325 353 H ILE 46 H ILE 46 0.330 -8.434 8.791 354 HA ILE 46 HA ILE 46 0.099 -6.414 6.938 355 HB ILE 46 HB ILE 46 -1.709 -8.780 7.376 356 HG12 ILE 46 HG12 ILE 46 0.445 -8.521 5.306 357 HG13 ILE 46 HG13 ILE 46 0.821 -9.070 6.939 358 HG21 ILE 46 HG21 ILE 46 -2.548 -6.800 5.937 359 HG22 ILE 46 HG22 ILE 46 -2.669 -8.439 5.300 360 HG23 ILE 46 HG23 ILE 46 -1.367 -7.378 4.763 361 HD11 ILE 46 HD11 ILE 46 0.366 -10.835 5.144 362 HD12 ILE 46 HD12 ILE 46 -1.332 -10.387 5.323 363 HD13 ILE 46 HD13 ILE 46 -0.431 -11.014 6.705 364 H ARG 47 H ARG 47 -0.611 -4.519 7.648 365 HA ARG 47 HA ARG 47 -3.160 -4.315 9.035 366 HB2 ARG 47 HB2 ARG 47 -0.904 -2.859 9.311 367 HB3 ARG 47 HB3 ARG 47 -1.811 -1.840 8.197 368 HG2 ARG 47 HG2 ARG 47 -3.650 -2.628 10.132 369 HG3 ARG 47 HG3 ARG 47 -2.180 -2.243 11.013 370 HD2 ARG 47 HD2 ARG 47 -2.109 -0.107 9.644 371 HD3 ARG 47 HD3 ARG 47 -3.758 -0.498 9.164 372 HE ARG 47 HE ARG 47 -3.025 -0.223 12.001 373 HH11 ARG 47 HH11 ARG 47 -4.990 0.771 9.269 374 HH12 ARG 47 HH12 ARG 47 -6.073 1.703 10.242 375 HH21 ARG 47 HH21 ARG 47 -4.459 1.003 13.261 376 HH22 ARG 47 HH22 ARG 47 -5.773 1.835 12.503 377 H HIS 48 H HIS 48 -5.017 -3.978 8.074 378 HA HIS 48 HA HIS 48 -4.978 -3.467 5.219 379 HB2 HIS 48 HB2 HIS 48 -7.165 -4.360 7.092 380 HB3 HIS 48 HB3 HIS 48 -7.491 -3.919 5.417 381 HD1 HIS 48 HD1 HIS 48 -7.334 -5.752 3.790 382 HD2 HIS 48 HD2 HIS 48 -5.173 -6.546 7.238 383 HE1 HIS 48 HE1 HIS 48 -6.489 -8.104 3.512 384 HE2 HIS 48 HE2 HIS 48 -5.081 -8.519 5.567 385 H PHE 49 H PHE 49 -4.934 -1.446 4.567 386 HA PHE 49 HA PHE 49 -6.307 0.628 6.110 387 HB2 PHE 49 HB2 PHE 49 -4.370 0.963 3.797 388 HB3 PHE 49 HB3 PHE 49 -4.977 2.239 4.841 389 HD1 PHE 49 HD1 PHE 49 -2.651 -0.581 4.571 390 HD2 PHE 49 HD2 PHE 49 -4.141 2.516 7.075 391 HE1 PHE 49 HE1 PHE 49 -0.748 -0.898 6.101 392 HE2 PHE 49 HE2 PHE 49 -2.248 2.206 8.599 393 HZ PHE 49 HZ PHE 49 -0.547 0.495 8.114 394 H THR 50 H THR 50 -8.316 0.490 5.635 395 HA THR 50 HA THR 50 -9.381 -0.144 3.095 396 HB THR 50 HB THR 50 -10.349 -0.656 5.359 397 HG1 THR 50 HG1 THR 50 -11.518 -0.550 3.192 398 HG21 THR 50 HG21 THR 50 -10.766 1.001 6.752 399 HG22 THR 50 HG22 THR 50 -12.114 1.443 5.706 400 HG23 THR 50 HG23 THR 50 -10.542 2.215 5.494 401 H ASP 51 H ASP 51 -10.844 0.971 1.869 402 HA ASP 51 HA ASP 51 -10.362 3.862 1.692 403 HB2 ASP 51 HB2 ASP 51 -10.785 3.625 -0.708 404 HB3 ASP 51 HB3 ASP 51 -9.479 2.557 -0.202 405 H ASP 52 H ASP 52 -12.065 5.232 1.237 406 HA ASP 52 HA ASP 52 -14.708 4.234 0.792 407 HB2 ASP 52 HB2 ASP 52 -14.578 3.866 3.192 408 HB3 ASP 52 HB3 ASP 52 -14.055 5.529 3.446 409 H GLY 53 H GLY 53 -15.220 5.560 -0.811 410 HA2 GLY 53 HA2 GLY 53 -15.489 7.468 -2.068 411 HA3 GLY 53 HA3 GLY 53 -15.896 8.221 -0.536 412 H PHE 54 H PHE 54 -13.027 7.211 -2.418 413 HA PHE 54 HA PHE 54 -11.400 9.221 -1.130 414 HB2 PHE 54 HB2 PHE 54 -10.865 7.078 -3.168 415 HB3 PHE 54 HB3 PHE 54 -9.693 8.364 -2.913 416 HD1 PHE 54 HD1 PHE 54 -10.239 8.624 0.124 417 HD2 PHE 54 HD2 PHE 54 -9.453 5.286 -2.426 418 HE1 PHE 54 HE1 PHE 54 -9.334 7.371 2.021 419 HE2 PHE 54 HE2 PHE 54 -8.534 4.058 -0.507 420 HZ PHE 54 HZ PHE 54 -8.484 5.104 1.723 421 H SER 55 H SER 55 -11.384 11.259 -1.729 422 HA SER 55 HA SER 55 -12.559 12.258 -4.098 423 HB2 SER 55 HB2 SER 55 -10.849 13.455 -1.938 424 HB3 SER 55 HB3 SER 55 -11.245 14.395 -3.376 425 HG SER 55 HG SER 55 -12.707 14.247 -1.305 426 H GLY 56 H GLY 56 -11.283 13.769 -5.629 427 HA2 GLY 56 HA2 GLY 56 -9.090 12.190 -6.721 428 HA3 GLY 56 HA3 GLY 56 -9.914 13.515 -7.521 429 H VAL 57 H VAL 57 -8.365 13.527 -4.307 430 HA VAL 57 HA VAL 57 -6.753 15.787 -5.210 431 HB VAL 57 HB VAL 57 -6.356 16.331 -2.921 432 HG11 VAL 57 HG11 VAL 57 -9.237 15.719 -3.546 433 HG12 VAL 57 HG12 VAL 57 -8.369 17.228 -3.828 434 HG13 VAL 57 HG13 VAL 57 -8.721 16.708 -2.180 435 HG21 VAL 57 HG21 VAL 57 -7.184 15.066 -1.066 436 HG22 VAL 57 HG22 VAL 57 -6.253 13.976 -2.094 437 HG23 VAL 57 HG23 VAL 57 -8.015 13.941 -2.139 438 H ASN 58 H ASN 58 -6.259 12.485 -4.845 439 HA ASN 58 HA ASN 58 -4.386 11.168 -4.838 440 HB2 ASN 58 HB2 ASN 58 -2.500 13.421 -5.239 441 HB3 ASN 58 HB3 ASN 58 -2.679 11.922 -6.141 442 HD21 ASN 58 HD21 ASN 58 -3.593 15.231 -5.885 443 HD22 ASN 58 HD22 ASN 58 -4.538 15.328 -7.321 444 H PHE 59 H PHE 59 -3.603 10.267 -3.074 445 HA PHE 59 HA PHE 59 -2.700 9.922 -1.026 446 HB2 PHE 59 HB2 PHE 59 -1.137 12.477 -1.385 447 HB3 PHE 59 HB3 PHE 59 -0.685 11.040 -0.477 448 HD1 PHE 59 HD1 PHE 59 0.073 8.995 -1.680 449 HD2 PHE 59 HD2 PHE 59 -0.733 12.645 -3.729 450 HE1 PHE 59 HE1 PHE 59 1.316 8.181 -3.634 451 HE2 PHE 59 HE2 PHE 59 0.507 11.827 -5.679 452 HZ PHE 59 HZ PHE 59 1.534 9.593 -5.636 453 H ASN 60 H ASN 60 -2.069 11.291 1.159 454 HA ASN 60 HA ASN 60 -2.972 12.306 2.988 455 HB2 ASN 60 HB2 ASN 60 -4.136 14.255 0.983 456 HB3 ASN 60 HB3 ASN 60 -3.853 14.552 2.694 457 HD21 ASN 60 HD21 ASN 60 -1.333 13.446 2.991 458 HD22 ASN 60 HD22 ASN 60 -0.197 14.363 2.073 459 H ARG 61 H ARG 61 -4.304 10.152 2.253 460 HA ARG 61 HA ARG 61 -7.189 10.745 2.262 461 HB2 ARG 61 HB2 ARG 61 -6.481 7.941 2.064 462 HB3 ARG 61 HB3 ARG 61 -7.432 8.928 0.975 463 HG2 ARG 61 HG2 ARG 61 -4.741 9.672 0.572 464 HG3 ARG 61 HG3 ARG 61 -4.781 7.920 0.655 465 HD2 ARG 61 HD2 ARG 61 -5.034 8.747 -1.621 466 HD3 ARG 61 HD3 ARG 61 -6.445 7.836 -1.083 467 HE ARG 61 HE ARG 61 -7.222 10.309 -0.528 468 HH11 ARG 61 HH11 ARG 61 -5.697 9.036 -3.404 469 HH12 ARG 61 HH12 ARG 61 -6.406 10.216 -4.450 470 HH21 ARG 61 HH21 ARG 61 -8.159 11.851 -1.908 471 HH22 ARG 61 HH22 ARG 61 -7.808 11.804 -3.601 472 HA PRO 62 HA PRO 62 -7.901 9.339 6.401 473 HB2 PRO 62 HB2 PRO 62 -9.853 7.429 6.069 474 HB3 PRO 62 HB3 PRO 62 -10.158 9.168 6.021 475 HG2 PRO 62 HG2 PRO 62 -9.723 7.264 3.746 476 HG3 PRO 62 HG3 PRO 62 -10.951 8.525 3.912 477 HD2 PRO 62 HD2 PRO 62 -8.781 8.954 2.430 478 HD3 PRO 62 HD3 PRO 62 -9.428 10.238 3.474 479 H GLY 63 H GLY 63 -8.564 6.259 4.718 480 HA2 GLY 63 HA2 GLY 63 -7.189 4.628 6.507 481 HA3 GLY 63 HA3 GLY 63 -7.572 4.198 4.845 482 H PHE 64 H PHE 64 -6.075 6.292 3.605 483 HA PHE 64 HA PHE 64 -3.516 5.077 3.437 484 HB2 PHE 64 HB2 PHE 64 -4.522 6.241 1.564 485 HB3 PHE 64 HB3 PHE 64 -4.543 7.743 2.472 486 HD1 PHE 64 HD1 PHE 64 -2.298 5.230 0.964 487 HD2 PHE 64 HD2 PHE 64 -2.727 9.165 2.477 488 HE1 PHE 64 HE1 PHE 64 -0.092 5.810 0.059 489 HE2 PHE 64 HE2 PHE 64 -0.533 9.765 1.581 490 HZ PHE 64 HZ PHE 64 0.802 8.079 0.360 491 H GLN 65 H GLN 65 -4.733 7.997 5.036 492 HA GLN 65 HA GLN 65 -2.278 9.047 5.872 493 HB2 GLN 65 HB2 GLN 65 -5.096 9.353 6.732 494 HB3 GLN 65 HB3 GLN 65 -3.887 9.753 7.939 495 HG2 GLN 65 HG2 GLN 65 -3.069 10.971 5.533 496 HG3 GLN 65 HG3 GLN 65 -4.791 11.294 5.721 497 HE21 GLN 65 HE21 GLN 65 -5.437 12.782 7.176 498 HE22 GLN 65 HE22 GLN 65 -4.383 13.618 8.258 499 H SER 66 H SER 66 -4.206 6.394 7.035 500 HA SER 66 HA SER 66 -2.799 6.055 9.515 501 HB2 SER 66 HB2 SER 66 -5.099 4.942 8.287 502 HB3 SER 66 HB3 SER 66 -3.980 3.610 8.560 503 HG SER 66 HG SER 66 -5.050 3.776 10.438 504 H LEU 67 H LEU 67 -2.681 4.701 6.236 505 HA LEU 67 HA LEU 67 -0.641 2.819 6.652 506 HB2 LEU 67 HB2 LEU 67 -1.506 2.426 4.606 507 HB3 LEU 67 HB3 LEU 67 -2.035 4.086 4.418 508 HG LEU 67 HG LEU 67 0.314 4.673 3.760 509 HD11 LEU 67 HD11 LEU 67 0.634 1.682 3.712 510 HD12 LEU 67 HD12 LEU 67 1.391 2.773 4.870 511 HD13 LEU 67 HD13 LEU 67 1.817 2.868 3.162 512 HD21 LEU 67 HD21 LEU 67 -0.033 4.106 1.551 513 HD22 LEU 67 HD22 LEU 67 -1.658 3.960 2.218 514 HD23 LEU 67 HD23 LEU 67 -0.682 2.517 1.953 515 H ILE 68 H ILE 68 -0.556 6.214 5.557 516 HA ILE 68 HA ILE 68 2.252 6.419 5.397 517 HB ILE 68 HB ILE 68 0.223 8.068 4.673 518 HG12 ILE 68 HG12 ILE 68 2.028 9.757 4.197 519 HG13 ILE 68 HG13 ILE 68 3.133 8.749 5.125 520 HG21 ILE 68 HG21 ILE 68 -0.337 9.008 6.737 521 HG22 ILE 68 HG22 ILE 68 0.692 10.219 5.977 522 HG23 ILE 68 HG23 ILE 68 1.349 9.167 7.232 523 HD11 ILE 68 HD11 ILE 68 3.346 8.408 2.712 524 HD12 ILE 68 HD12 ILE 68 1.661 7.884 2.643 525 HD13 ILE 68 HD13 ILE 68 2.846 6.938 3.550 526 H LYS 69 H LYS 69 -0.051 6.867 8.046 527 HA LYS 69 HA LYS 69 1.597 8.098 9.926 528 HB2 LYS 69 HB2 LYS 69 -0.131 7.844 11.340 529 HB3 LYS 69 HB3 LYS 69 -0.986 7.240 9.935 530 HG2 LYS 69 HG2 LYS 69 -1.328 5.336 10.972 531 HG3 LYS 69 HG3 LYS 69 0.403 5.057 11.072 532 HD2 LYS 69 HD2 LYS 69 -1.127 6.727 13.056 533 HD3 LYS 69 HD3 LYS 69 -0.828 5.001 13.262 534 HE2 LYS 69 HE2 LYS 69 0.999 5.723 14.367 535 HE3 LYS 69 HE3 LYS 69 1.672 5.846 12.743 536 HZ1 LYS 69 HZ1 LYS 69 1.577 7.855 14.532 537 HZ2 LYS 69 HZ2 LYS 69 0.213 8.184 13.591 538 HZ3 LYS 69 HZ3 LYS 69 1.733 8.062 12.861 539 H GLU 70 H GLU 70 1.349 4.743 8.956 540 HA GLU 70 HA GLU 70 3.086 3.758 11.027 541 HB2 GLU 70 HB2 GLU 70 1.539 2.631 8.841 542 HB3 GLU 70 HB3 GLU 70 3.154 1.939 8.902 543 HG2 GLU 70 HG2 GLU 70 2.140 0.515 10.317 544 HG3 GLU 70 HG3 GLU 70 2.559 1.766 11.482 545 H VAL 71 H VAL 71 3.402 4.857 7.689 546 HA VAL 71 HA VAL 71 6.076 4.067 7.275 547 HB VAL 71 HB VAL 71 4.789 6.545 6.093 548 HG11 VAL 71 HG11 VAL 71 6.827 6.750 5.224 549 HG12 VAL 71 HG12 VAL 71 6.379 5.400 4.184 550 HG13 VAL 71 HG13 VAL 71 7.285 5.106 5.670 551 HG21 VAL 71 HG21 VAL 71 3.620 4.141 5.854 552 HG22 VAL 71 HG22 VAL 71 4.786 4.035 4.535 553 HG23 VAL 71 HG23 VAL 71 3.614 5.351 4.573 554 H GLU 72 H GLU 72 4.704 7.190 8.350 555 HA GLU 72 HA GLU 72 7.111 8.558 8.711 556 HB2 GLU 72 HB2 GLU 72 5.678 9.812 10.545 557 HB3 GLU 72 HB3 GLU 72 5.350 10.015 8.833 558 HG2 GLU 72 HG2 GLU 72 3.403 8.828 8.920 559 HG3 GLU 72 HG3 GLU 72 3.907 7.882 10.307 560 H ALA 73 H ALA 73 5.210 6.641 11.002 561 HA ALA 73 HA ALA 73 6.901 6.955 13.238 562 HB1 ALA 73 HB1 ALA 73 5.626 4.393 13.255 563 HB2 ALA 73 HB2 ALA 73 4.512 5.596 12.607 564 HB3 ALA 73 HB3 ALA 73 5.236 5.831 14.199 565 H GLY 74 H GLY 74 7.046 4.917 10.424 566 HA2 GLY 74 HA2 GLY 74 8.900 3.799 9.607 567 HA3 GLY 74 HA3 GLY 74 9.695 3.965 11.161 568 H ASN 75 H ASN 75 6.547 2.627 10.244 569 HA ASN 75 HA ASN 75 7.210 0.076 11.566 570 HB2 ASN 75 HB2 ASN 75 4.681 1.672 11.243 571 HB3 ASN 75 HB3 ASN 75 4.603 -0.046 11.578 572 HD21 ASN 75 HD21 ASN 75 3.545 1.886 13.240 573 HD22 ASN 75 HD22 ASN 75 4.426 1.887 14.719 574 H VAL 76 H VAL 76 5.397 1.487 8.850 575 HA VAL 76 HA VAL 76 4.682 -0.913 7.608 576 HB VAL 76 HB VAL 76 3.659 1.256 7.066 577 HG11 VAL 76 HG11 VAL 76 6.263 2.133 6.778 578 HG12 VAL 76 HG12 VAL 76 4.781 3.031 6.473 579 HG13 VAL 76 HG13 VAL 76 5.577 2.181 5.155 580 HG21 VAL 76 HG21 VAL 76 3.264 0.816 4.803 581 HG22 VAL 76 HG22 VAL 76 3.733 -0.749 5.467 582 HG23 VAL 76 HG23 VAL 76 4.898 0.202 4.546 583 H GLU 77 H GLU 77 6.657 -2.199 7.726 584 HA GLU 77 HA GLU 77 8.961 -1.463 6.191 585 HB2 GLU 77 HB2 GLU 77 9.824 -3.628 6.752 586 HB3 GLU 77 HB3 GLU 77 9.043 -2.954 8.172 587 HG2 GLU 77 HG2 GLU 77 7.397 -4.502 8.184 588 HG3 GLU 77 HG3 GLU 77 7.392 -4.669 6.432 589 H THR 78 H THR 78 5.929 -2.430 5.230 590 HA THR 78 HA THR 78 6.867 -3.110 2.580 591 HB THR 78 HB THR 78 4.915 -5.075 3.053 592 HG1 THR 78 HG1 THR 78 5.521 -6.113 4.845 593 HG21 THR 78 HG21 THR 78 6.634 -5.485 1.528 594 HG22 THR 78 HG22 THR 78 6.842 -6.649 2.833 595 HG23 THR 78 HG23 THR 78 7.885 -5.231 2.743 596 H LEU 79 H LEU 79 5.248 -3.039 0.966 597 HA LEU 79 HA LEU 79 2.668 -1.945 1.823 598 HB2 LEU 79 HB2 LEU 79 4.405 -0.212 0.964 599 HB3 LEU 79 HB3 LEU 79 4.047 -0.888 -0.591 600 HG LEU 79 HG LEU 79 2.655 0.950 -0.539 601 HD11 LEU 79 HD11 LEU 79 1.412 -1.203 -0.926 602 HD12 LEU 79 HD12 LEU 79 0.445 0.197 -0.464 603 HD13 LEU 79 HD13 LEU 79 0.820 -1.045 0.726 604 HD21 LEU 79 HD21 LEU 79 2.789 1.934 1.495 605 HD22 LEU 79 HD22 LEU 79 2.515 0.427 2.370 606 HD23 LEU 79 HD23 LEU 79 1.162 1.259 1.600 607 H ILE 80 H ILE 80 1.033 -2.971 0.934 608 HA ILE 80 HA ILE 80 1.460 -4.511 -1.542 609 HB ILE 80 HB ILE 80 -0.128 -5.171 0.922 610 HG12 ILE 80 HG12 ILE 80 1.039 -7.367 0.611 611 HG13 ILE 80 HG13 ILE 80 1.908 -6.655 -0.744 612 HG21 ILE 80 HG21 ILE 80 -0.894 -7.199 -0.512 613 HG22 ILE 80 HG22 ILE 80 -0.615 -6.100 -1.864 614 HG23 ILE 80 HG23 ILE 80 -1.771 -5.669 -0.608 615 HD11 ILE 80 HD11 ILE 80 2.059 -5.145 1.763 616 HD12 ILE 80 HD12 ILE 80 3.310 -5.534 0.580 617 HD13 ILE 80 HD13 ILE 80 2.823 -6.735 1.780 618 H VAL 81 H VAL 81 0.467 -3.593 -3.206 619 HA VAL 81 HA VAL 81 -2.240 -2.489 -2.849 620 HB VAL 81 HB VAL 81 -0.154 -1.268 -4.653 621 HG11 VAL 81 HG11 VAL 81 -3.020 -0.840 -4.195 622 HG12 VAL 81 HG12 VAL 81 -2.017 -0.447 -5.589 623 HG13 VAL 81 HG13 VAL 81 -2.054 0.635 -4.200 624 HG21 VAL 81 HG21 VAL 81 -0.511 0.694 -2.879 625 HG22 VAL 81 HG22 VAL 81 0.714 -0.555 -2.644 626 HG23 VAL 81 HG23 VAL 81 -0.837 -0.668 -1.799 627 H LYS 82 H LYS 82 -3.666 -2.829 -4.576 628 HA LYS 82 HA LYS 82 -3.343 -5.062 -6.205 629 HB2 LYS 82 HB2 LYS 82 -5.377 -3.267 -5.627 630 HB3 LYS 82 HB3 LYS 82 -5.091 -3.002 -7.340 631 HG2 LYS 82 HG2 LYS 82 -5.533 -5.726 -6.170 632 HG3 LYS 82 HG3 LYS 82 -6.841 -4.702 -6.759 633 HD2 LYS 82 HD2 LYS 82 -6.436 -5.342 -8.832 634 HD3 LYS 82 HD3 LYS 82 -4.783 -4.753 -8.720 635 HE2 LYS 82 HE2 LYS 82 -4.047 -6.866 -7.817 636 HE3 LYS 82 HE3 LYS 82 -5.705 -7.465 -7.781 637 HZ1 LYS 82 HZ1 LYS 82 -5.774 -7.325 -10.186 638 HZ2 LYS 82 HZ2 LYS 82 -4.488 -8.304 -9.694 639 HZ3 LYS 82 HZ3 LYS 82 -4.193 -6.726 -10.227 640 H ASP 83 H ASP 83 -2.707 -1.627 -6.826 641 HA ASP 83 HA ASP 83 -0.676 -2.081 -8.679 642 HB2 ASP 83 HB2 ASP 83 -1.578 -1.731 -10.781 643 HB3 ASP 83 HB3 ASP 83 -2.811 -2.715 -10.014 644 H MET 84 H MET 84 0.156 -0.096 -9.664 645 HA MET 84 HA MET 84 0.331 1.964 -7.782 646 HB2 MET 84 HB2 MET 84 1.239 1.660 -10.616 647 HB3 MET 84 HB3 MET 84 1.441 3.197 -9.787 648 HG2 MET 84 HG2 MET 84 2.374 0.781 -8.365 649 HG3 MET 84 HG3 MET 84 3.290 1.282 -9.785 650 HE1 MET 84 HE1 MET 84 2.231 2.593 -6.003 651 HE2 MET 84 HE2 MET 84 3.971 2.595 -5.717 652 HE3 MET 84 HE3 MET 84 3.189 1.164 -6.389 653 H SER 85 H SER 85 -2.326 1.496 -9.764 654 HA SER 85 HA SER 85 -2.785 4.215 -10.533 655 HB2 SER 85 HB2 SER 85 -3.836 2.467 -11.825 656 HB3 SER 85 HB3 SER 85 -4.647 1.835 -10.396 657 HG SER 85 HG SER 85 -5.699 3.461 -12.018 658 H ARG 86 H ARG 86 -3.195 2.392 -7.656 659 HA ARG 86 HA ARG 86 -5.335 3.712 -6.437 660 HB2 ARG 86 HB2 ARG 86 -2.982 2.150 -5.463 661 HB3 ARG 86 HB3 ARG 86 -3.944 3.045 -4.300 662 HG2 ARG 86 HG2 ARG 86 -5.225 1.159 -6.228 663 HG3 ARG 86 HG3 ARG 86 -4.529 0.588 -4.710 664 HD2 ARG 86 HD2 ARG 86 -6.487 2.840 -4.814 665 HD3 ARG 86 HD3 ARG 86 -7.005 1.159 -4.735 666 HE ARG 86 HE ARG 86 -5.653 1.063 -2.625 667 HH11 ARG 86 HH11 ARG 86 -6.954 4.119 -3.747 668 HH12 ARG 86 HH12 ARG 86 -7.096 4.776 -2.157 669 HH21 ARG 86 HH21 ARG 86 -5.867 1.941 -0.533 670 HH22 ARG 86 HH22 ARG 86 -6.490 3.542 -0.335 671 H LEU 87 H LEU 87 -1.848 4.246 -5.755 672 HA LEU 87 HA LEU 87 -2.347 6.723 -4.413 673 HB2 LEU 87 HB2 LEU 87 0.147 5.326 -5.335 674 HB3 LEU 87 HB3 LEU 87 0.211 6.943 -4.663 675 HG LEU 87 HG LEU 87 -1.243 5.574 -2.756 676 HD11 LEU 87 HD11 LEU 87 0.221 3.574 -2.324 677 HD12 LEU 87 HD12 LEU 87 0.782 3.736 -3.987 678 HD13 LEU 87 HD13 LEU 87 -0.923 3.433 -3.657 679 HD21 LEU 87 HD21 LEU 87 1.097 5.461 -1.618 680 HD22 LEU 87 HD22 LEU 87 0.382 7.027 -1.999 681 HD23 LEU 87 HD23 LEU 87 1.629 6.349 -3.045 682 H GLY 88 H GLY 88 -1.464 5.871 -7.741 683 HA2 GLY 88 HA2 GLY 88 -2.439 7.832 -9.151 684 HA3 GLY 88 HA3 GLY 88 -1.189 8.743 -8.335 685 H ARG 89 H ARG 89 -1.397 8.577 -11.088 686 HA ARG 89 HA ARG 89 0.451 6.627 -12.109 687 HB2 ARG 89 HB2 ARG 89 -0.781 9.074 -13.389 688 HB3 ARG 89 HB3 ARG 89 0.210 7.899 -14.237 689 HG2 ARG 89 HG2 ARG 89 -2.205 6.960 -12.773 690 HG3 ARG 89 HG3 ARG 89 -2.398 7.774 -14.325 691 HD2 ARG 89 HD2 ARG 89 -2.212 5.621 -15.048 692 HD3 ARG 89 HD3 ARG 89 -0.510 6.074 -15.048 693 HE ARG 89 HE ARG 89 -1.859 4.355 -13.095 694 HH11 ARG 89 HH11 ARG 89 1.118 5.769 -14.299 695 HH12 ARG 89 HH12 ARG 89 2.129 4.695 -13.397 696 HH21 ARG 89 HH21 ARG 89 -0.514 2.954 -11.916 697 HH22 ARG 89 HH22 ARG 89 1.206 3.098 -12.051 698 H ASN 90 H ASN 90 0.631 9.835 -10.816 699 HA ASN 90 HA ASN 90 3.023 10.704 -12.022 700 HB2 ASN 90 HB2 ASN 90 3.161 12.107 -9.797 701 HB3 ASN 90 HB3 ASN 90 1.922 12.457 -10.996 702 HD21 ASN 90 HD21 ASN 90 2.553 10.784 -7.962 703 HD22 ASN 90 HD22 ASN 90 0.928 10.842 -7.384 704 H TYR 91 H TYR 91 4.487 9.023 -12.025 705 HA TYR 91 HA TYR 91 5.304 7.585 -9.744 706 HB2 TYR 91 HB2 TYR 91 5.623 6.649 -11.899 707 HB3 TYR 91 HB3 TYR 91 6.581 8.021 -12.441 708 HD1 TYR 91 HD1 TYR 91 8.925 8.239 -11.722 709 HD2 TYR 91 HD2 TYR 91 6.574 4.881 -10.599 710 HE1 TYR 91 HE1 TYR 91 10.972 7.018 -11.126 711 HE2 TYR 91 HE2 TYR 91 8.622 3.633 -10.015 712 HH TYR 91 HH TYR 91 11.616 4.463 -10.980 713 H LEU 92 H LEU 92 5.947 10.795 -10.652 714 HA LEU 92 HA LEU 92 8.564 11.103 -9.593 715 HB2 LEU 92 HB2 LEU 92 6.353 13.136 -9.893 716 HB3 LEU 92 HB3 LEU 92 8.023 13.515 -9.522 717 HG LEU 92 HG LEU 92 8.601 12.389 -11.750 718 HD11 LEU 92 HD11 LEU 92 6.747 11.236 -12.432 719 HD12 LEU 92 HD12 LEU 92 6.551 12.735 -13.340 720 HD13 LEU 92 HD13 LEU 92 5.628 12.471 -11.860 721 HD21 LEU 92 HD21 LEU 92 7.122 14.991 -11.499 722 HD22 LEU 92 HD22 LEU 92 7.836 14.464 -13.023 723 HD23 LEU 92 HD23 LEU 92 8.860 14.716 -11.611 724 H GLN 93 H GLN 93 5.342 11.895 -8.291 725 HA GLN 93 HA GLN 93 6.294 12.397 -5.627 726 HB2 GLN 93 HB2 GLN 93 3.593 12.147 -6.924 727 HB3 GLN 93 HB3 GLN 93 3.715 12.152 -5.171 728 HG2 GLN 93 HG2 GLN 93 4.568 14.330 -7.062 729 HG3 GLN 93 HG3 GLN 93 3.207 14.354 -5.942 730 HE21 GLN 93 HE21 GLN 93 3.534 14.939 -3.862 731 HE22 GLN 93 HE22 GLN 93 5.065 15.399 -3.214 732 H VAL 94 H VAL 94 4.430 9.806 -7.186 733 HA VAL 94 HA VAL 94 4.135 8.089 -5.018 734 HB VAL 94 HB VAL 94 4.394 7.489 -7.974 735 HG11 VAL 94 HG11 VAL 94 4.151 5.291 -7.675 736 HG12 VAL 94 HG12 VAL 94 3.050 5.493 -6.309 737 HG13 VAL 94 HG13 VAL 94 4.791 5.599 -6.060 738 HG21 VAL 94 HG21 VAL 94 2.448 8.779 -7.511 739 HG22 VAL 94 HG22 VAL 94 2.049 7.804 -6.096 740 HG23 VAL 94 HG23 VAL 94 1.910 7.113 -7.716 741 H GLY 95 H GLY 95 6.792 8.348 -7.362 742 HA2 GLY 95 HA2 GLY 95 8.332 6.189 -6.397 743 HA3 GLY 95 HA3 GLY 95 8.947 7.550 -7.317 744 H PHE 96 H PHE 96 8.564 9.688 -5.746 745 HA PHE 96 HA PHE 96 10.652 9.788 -3.995 746 HB2 PHE 96 HB2 PHE 96 9.750 11.879 -4.381 747 HB3 PHE 96 HB3 PHE 96 8.093 11.312 -4.230 748 HD1 PHE 96 HD1 PHE 96 7.201 10.821 -1.896 749 HD2 PHE 96 HD2 PHE 96 10.831 12.930 -2.603 750 HE1 PHE 96 HE1 PHE 96 7.109 11.737 0.381 751 HE2 PHE 96 HE2 PHE 96 10.743 13.847 -0.323 752 HZ PHE 96 HZ PHE 96 8.881 13.250 1.172 753 H TYR 97 H TYR 97 7.307 8.869 -3.283 754 HA TYR 97 HA TYR 97 7.586 8.482 -0.524 755 HB2 TYR 97 HB2 TYR 97 5.699 7.329 -2.568 756 HB3 TYR 97 HB3 TYR 97 5.589 6.885 -0.868 757 HD1 TYR 97 HD1 TYR 97 5.918 9.266 0.624 758 HD2 TYR 97 HD2 TYR 97 4.043 8.809 -3.167 759 HE1 TYR 97 HE1 TYR 97 4.582 11.282 1.049 760 HE2 TYR 97 HE2 TYR 97 2.704 10.830 -2.755 761 HH TYR 97 HH TYR 97 3.260 13.074 -0.945 762 H THR 98 H THR 98 7.866 6.161 -3.216 763 HA THR 98 HA THR 98 8.577 4.013 -1.439 764 HB THR 98 HB THR 98 8.842 2.701 -3.491 765 HG1 THR 98 HG1 THR 98 9.646 3.974 -5.020 766 HG21 THR 98 HG21 THR 98 6.535 3.383 -2.546 767 HG22 THR 98 HG22 THR 98 6.637 2.636 -4.139 768 HG23 THR 98 HG23 THR 98 6.434 4.382 -3.995 769 H GLU 99 H GLU 99 10.463 6.388 -3.239 770 HA GLU 99 HA GLU 99 12.876 4.765 -2.923 771 HB2 GLU 99 HB2 GLU 99 13.969 6.518 -4.324 772 HB3 GLU 99 HB3 GLU 99 12.661 5.646 -5.104 773 HG2 GLU 99 HG2 GLU 99 11.586 7.518 -5.519 774 HG3 GLU 99 HG3 GLU 99 11.626 7.992 -3.827 775 H VAL 100 H VAL 100 11.734 7.985 -1.859 776 HA VAL 100 HA VAL 100 14.143 8.090 -0.170 777 HB VAL 100 HB VAL 100 13.932 9.999 -1.672 778 HG11 VAL 100 HG11 VAL 100 11.299 10.410 -0.291 779 HG12 VAL 100 HG12 VAL 100 11.619 10.245 -2.016 780 HG13 VAL 100 HG13 VAL 100 12.136 11.695 -1.159 781 HG21 VAL 100 HG21 VAL 100 15.112 10.456 0.308 782 HG22 VAL 100 HG22 VAL 100 13.633 10.519 1.266 783 HG23 VAL 100 HG23 VAL 100 13.989 11.801 0.111 784 H LEU 101 H LEU 101 10.641 8.475 -0.057 785 HA LEU 101 HA LEU 101 10.470 9.164 2.678 786 HB2 LEU 101 HB2 LEU 101 8.736 9.251 0.670 787 HB3 LEU 101 HB3 LEU 101 8.235 7.717 1.358 788 HG LEU 101 HG LEU 101 6.834 9.454 2.237 789 HD11 LEU 101 HD11 LEU 101 6.963 8.931 4.492 790 HD12 LEU 101 HD12 LEU 101 8.725 8.909 4.496 791 HD13 LEU 101 HD13 LEU 101 7.830 7.588 3.747 792 HD21 LEU 101 HD21 LEU 101 7.529 11.508 2.760 793 HD22 LEU 101 HD22 LEU 101 9.060 11.064 2.009 794 HD23 LEU 101 HD23 LEU 101 8.853 10.902 3.752 795 H PHE 102 H PHE 102 9.443 6.103 1.165 796 HA PHE 102 HA PHE 102 9.029 4.681 3.505 797 HB2 PHE 102 HB2 PHE 102 9.645 3.767 0.710 798 HB3 PHE 102 HB3 PHE 102 9.263 2.658 2.011 799 HD1 PHE 102 HD1 PHE 102 7.589 5.844 2.091 800 HD2 PHE 102 HD2 PHE 102 7.363 1.866 0.580 801 HE1 PHE 102 HE1 PHE 102 5.201 6.157 1.625 802 HE2 PHE 102 HE2 PHE 102 4.966 2.177 0.125 803 HZ PHE 102 HZ PHE 102 3.882 4.324 0.646 804 HA PRO 103 HA PRO 103 13.745 2.970 2.515 805 HB2 PRO 103 HB2 PRO 103 14.552 5.804 3.071 806 HB3 PRO 103 HB3 PRO 103 15.412 4.550 2.182 807 HG2 PRO 103 HG2 PRO 103 14.041 6.430 0.894 808 HG3 PRO 103 HG3 PRO 103 14.058 4.759 0.304 809 HD2 PRO 103 HD2 PRO 103 11.875 6.274 1.581 810 HD3 PRO 103 HD3 PRO 103 11.803 4.859 0.529 811 H GLN 104 H GLN 104 12.515 5.376 4.794 812 HA GLN 104 HA GLN 104 14.177 5.131 6.941 813 HB2 GLN 104 HB2 GLN 104 11.422 5.008 7.861 814 HB3 GLN 104 HB3 GLN 104 12.630 6.258 8.104 815 HG2 GLN 104 HG2 GLN 104 12.099 7.245 5.983 816 HG3 GLN 104 HG3 GLN 104 10.988 5.929 5.621 817 HE21 GLN 104 HE21 GLN 104 8.963 6.518 5.794 818 HE22 GLN 104 HE22 GLN 104 8.309 7.612 6.959 819 H LYS 105 H LYS 105 11.626 2.854 6.020 820 HA LYS 105 HA LYS 105 12.617 1.035 8.112 821 HB2 LYS 105 HB2 LYS 105 9.939 0.421 7.133 822 HB3 LYS 105 HB3 LYS 105 10.533 0.562 8.775 823 HG2 LYS 105 HG2 LYS 105 9.408 2.450 8.989 824 HG3 LYS 105 HG3 LYS 105 10.392 3.186 7.736 825 HD2 LYS 105 HD2 LYS 105 8.133 1.438 6.930 826 HD3 LYS 105 HD3 LYS 105 7.760 3.039 7.567 827 HE2 LYS 105 HE2 LYS 105 8.799 4.124 5.822 828 HE3 LYS 105 HE3 LYS 105 9.852 2.754 5.488 829 HZ1 LYS 105 HZ1 LYS 105 7.499 1.680 4.912 830 HZ2 LYS 105 HZ2 LYS 105 8.449 2.483 3.772 831 HZ3 LYS 105 HZ3 LYS 105 7.170 3.293 4.520 832 H ASN 106 H ASN 106 13.246 1.337 5.055 833 HA ASN 106 HA ASN 106 13.628 -0.019 3.265 834 HB2 ASN 106 HB2 ASN 106 15.152 -1.082 4.803 835 HB3 ASN 106 HB3 ASN 106 13.855 -2.058 5.488 836 HD21 ASN 106 HD21 ASN 106 15.696 -1.425 2.560 837 HD22 ASN 106 HD22 ASN 106 15.537 -3.009 1.903 838 H VAL 107 H VAL 107 11.522 0.377 2.527 839 HA VAL 107 HA VAL 107 9.395 -1.484 3.068 840 HB VAL 107 HB VAL 107 9.227 1.043 2.658 841 HG11 VAL 107 HG11 VAL 107 9.123 1.810 0.474 842 HG12 VAL 107 HG12 VAL 107 8.732 0.220 -0.168 843 HG13 VAL 107 HG13 VAL 107 10.377 0.586 0.341 844 HG21 VAL 107 HG21 VAL 107 6.921 0.709 1.839 845 HG22 VAL 107 HG22 VAL 107 7.353 -0.413 3.125 846 HG23 VAL 107 HG23 VAL 107 7.330 -0.961 1.449 847 H ARG 108 H ARG 108 8.309 -2.732 1.634 848 HA ARG 108 HA ARG 108 9.599 -3.305 -0.930 849 HB2 ARG 108 HB2 ARG 108 9.578 -5.092 1.114 850 HB3 ARG 108 HB3 ARG 108 8.049 -5.482 0.341 851 HG2 ARG 108 HG2 ARG 108 9.534 -6.918 -0.690 852 HG3 ARG 108 HG3 ARG 108 9.417 -5.583 -1.835 853 HD2 ARG 108 HD2 ARG 108 11.525 -4.794 -1.330 854 HD3 ARG 108 HD3 ARG 108 11.543 -5.549 0.261 855 HE ARG 108 HE ARG 108 11.698 -7.717 -1.041 856 HH11 ARG 108 HH11 ARG 108 13.037 -4.709 -2.259 857 HH12 ARG 108 HH12 ARG 108 14.230 -5.499 -3.229 858 HH21 ARG 108 HH21 ARG 108 13.274 -8.736 -2.321 859 HH22 ARG 108 HH22 ARG 108 14.367 -7.779 -3.263 860 H PHE 109 H PHE 109 8.274 -1.967 -2.039 861 HA PHE 109 HA PHE 109 5.440 -1.960 -1.649 862 HB2 PHE 109 HB2 PHE 109 7.132 -0.099 -2.535 863 HB3 PHE 109 HB3 PHE 109 6.630 -0.754 -4.084 864 HD1 PHE 109 HD1 PHE 109 4.065 -0.947 -4.467 865 HD2 PHE 109 HD2 PHE 109 5.873 1.507 -1.507 866 HE1 PHE 109 HE1 PHE 109 2.030 0.425 -4.389 867 HE2 PHE 109 HE2 PHE 109 3.848 2.900 -1.405 868 HZ PHE 109 HZ PHE 109 1.915 2.359 -2.852 869 H LEU 110 H LEU 110 3.845 -2.760 -3.009 870 HA LEU 110 HA LEU 110 4.722 -4.333 -5.315 871 HB2 LEU 110 HB2 LEU 110 4.523 -6.018 -3.732 872 HB3 LEU 110 HB3 LEU 110 3.108 -5.308 -2.980 873 HG LEU 110 HG LEU 110 2.757 -7.449 -4.304 874 HD11 LEU 110 HD11 LEU 110 1.030 -5.383 -5.524 875 HD12 LEU 110 HD12 LEU 110 1.078 -5.464 -3.764 876 HD13 LEU 110 HD13 LEU 110 0.609 -6.880 -4.699 877 HD21 LEU 110 HD21 LEU 110 3.358 -7.591 -6.433 878 HD22 LEU 110 HD22 LEU 110 4.088 -5.992 -6.304 879 HD23 LEU 110 HD23 LEU 110 2.417 -6.158 -6.841 880 H ALA 111 H ALA 111 3.624 -3.998 -7.043 881 HA ALA 111 HA ALA 111 0.885 -2.912 -6.912 882 HB1 ALA 111 HB1 ALA 111 2.521 -1.164 -7.600 883 HB2 ALA 111 HB2 ALA 111 1.320 -1.528 -8.841 884 HB3 ALA 111 HB3 ALA 111 2.957 -2.168 -8.986 885 H ILE 112 H ILE 112 0.013 -4.921 -7.151 886 HA ILE 112 HA ILE 112 0.902 -6.969 -8.747 887 HB ILE 112 HB ILE 112 -1.784 -6.333 -7.627 888 HG12 ILE 112 HG12 ILE 112 -0.333 -8.842 -7.103 889 HG13 ILE 112 HG13 ILE 112 0.489 -7.382 -6.587 890 HG21 ILE 112 HG21 ILE 112 -2.549 -8.585 -8.339 891 HG22 ILE 112 HG22 ILE 112 -1.131 -8.698 -9.381 892 HG23 ILE 112 HG23 ILE 112 -2.349 -7.459 -9.680 893 HD11 ILE 112 HD11 ILE 112 -1.555 -6.771 -5.320 894 HD12 ILE 112 HD12 ILE 112 -0.755 -8.239 -4.758 895 HD13 ILE 112 HD13 ILE 112 -2.215 -8.350 -5.731 896 H ASN 113 H ASN 113 -1.193 -4.321 -9.895 897 HA ASN 113 HA ASN 113 -1.522 -5.748 -12.421 898 HB2 ASN 113 HB2 ASN 113 -3.341 -4.382 -11.091 899 HB3 ASN 113 HB3 ASN 113 -2.674 -3.034 -12.007 900 HD21 ASN 113 HD21 ASN 113 -4.578 -5.895 -12.114 901 HD22 ASN 113 HD22 ASN 113 -5.056 -5.775 -13.769 902 H ASN 114 H ASN 114 1.161 -4.781 -11.896 903 HA ASN 114 HA ASN 114 1.951 -3.844 -14.329 904 HB2 ASN 114 HB2 ASN 114 0.593 -1.746 -12.985 905 HB3 ASN 114 HB3 ASN 114 2.299 -1.335 -13.014 906 HD21 ASN 114 HD21 ASN 114 1.233 0.418 -14.353 907 HD22 ASN 114 HD22 ASN 114 1.165 0.142 -16.056 908 H SER 115 H SER 115 4.150 -2.893 -14.402 909 HA SER 115 HA SER 115 5.855 -4.128 -12.472 910 HB2 SER 115 HB2 SER 115 6.566 -2.101 -14.614 911 HB3 SER 115 HB3 SER 115 7.696 -3.144 -13.754 912 HG SER 115 HG SER 115 6.987 -4.860 -14.863 913 H ILE 116 H ILE 116 5.918 -3.320 -10.452 914 HA ILE 116 HA ILE 116 5.312 -0.676 -9.773 915 HB ILE 116 HB ILE 116 5.520 -2.933 -8.336 916 HG12 ILE 116 HG12 ILE 116 4.263 -0.866 -7.796 917 HG13 ILE 116 HG13 ILE 116 5.038 -1.581 -6.388 918 HG21 ILE 116 HG21 ILE 116 7.929 -2.971 -8.268 919 HG22 ILE 116 HG22 ILE 116 7.288 -2.665 -6.654 920 HG23 ILE 116 HG23 ILE 116 7.962 -1.339 -7.601 921 HD11 ILE 116 HD11 ILE 116 6.947 0.135 -7.058 922 HD12 ILE 116 HD12 ILE 116 5.578 0.590 -6.045 923 HD13 ILE 116 HD13 ILE 116 5.572 0.982 -7.764 924 H ASP 117 H ASP 117 8.542 -2.224 -9.990 925 HA ASP 117 HA ASP 117 9.680 0.343 -10.694 926 HB2 ASP 117 HB2 ASP 117 10.034 -0.902 -8.032 927 HB3 ASP 117 HB3 ASP 117 11.497 -0.309 -8.801 928 H SER 118 H SER 118 10.843 -2.811 -9.446 929 HA SER 118 HA SER 118 12.097 -4.457 -10.399 930 HB2 SER 118 HB2 SER 118 10.761 -3.597 -12.555 931 HB3 SER 118 HB3 SER 118 12.385 -3.108 -13.035 932 HG SER 118 HG SER 118 13.023 -5.177 -13.051 933 H ASN 119 H ASN 119 14.120 -4.616 -9.736 934 HA ASN 119 HA ASN 119 16.157 -2.813 -10.788 935 HB2 ASN 119 HB2 ASN 119 15.078 -2.458 -8.208 936 HB3 ASN 119 HB3 ASN 119 16.674 -3.174 -7.986 937 HD21 ASN 119 HD21 ASN 119 14.952 -0.612 -9.670 938 HD22 ASN 119 HD22 ASN 119 16.254 0.510 -9.659 939 H ASN 120 H ASN 120 18.361 -3.551 -9.506 940 HA ASN 120 HA ASN 120 18.552 -6.329 -8.936 941 HB2 ASN 120 HB2 ASN 120 18.467 -5.827 -11.633 942 HB3 ASN 120 HB3 ASN 120 20.198 -5.840 -11.319 943 HD21 ASN 120 HD21 ASN 120 20.853 -7.743 -12.089 944 HD22 ASN 120 HD22 ASN 120 20.201 -9.277 -11.634 Start of MODEL 9 1 H1 GLY 1 H1 GLY 1 11.313 2.714 23.569 2 H2 GLY 1 H2 GLY 1 11.793 3.705 22.287 3 H3 GLY 1 H3 GLY 1 11.851 2.023 22.121 4 HA2 GLY 1 HA2 GLY 1 9.517 3.814 22.117 5 HA3 GLY 1 HA3 GLY 1 9.942 2.555 20.968 6 H SER 2 H SER 2 9.634 0.338 21.578 7 HA SER 2 HA SER 2 7.915 -0.094 23.916 8 HB2 SER 2 HB2 SER 2 7.294 -1.087 21.122 9 HB3 SER 2 HB3 SER 2 6.392 -1.504 22.579 10 HG SER 2 HG SER 2 6.016 0.567 21.012 11 H ARG 3 H ARG 3 9.106 -2.071 21.175 12 HA ARG 3 HA ARG 3 10.907 -3.533 22.875 13 HB2 ARG 3 HB2 ARG 3 8.218 -4.560 22.324 14 HB3 ARG 3 HB3 ARG 3 9.499 -5.686 21.895 15 HG2 ARG 3 HG2 ARG 3 10.365 -4.997 24.315 16 HG3 ARG 3 HG3 ARG 3 8.643 -4.694 24.547 17 HD2 ARG 3 HD2 ARG 3 8.399 -7.061 23.443 18 HD3 ARG 3 HD3 ARG 3 10.066 -7.253 23.981 19 HE ARG 3 HE ARG 3 8.339 -6.302 26.056 20 HH11 ARG 3 HH11 ARG 3 9.416 -9.184 24.383 21 HH12 ARG 3 HH12 ARG 3 9.070 -10.234 25.715 22 HH21 ARG 3 HH21 ARG 3 7.888 -7.690 27.807 23 HH22 ARG 3 HH22 ARG 3 8.202 -9.387 27.659 24 H THR 4 H THR 4 9.121 -4.632 19.999 25 HA THR 4 HA THR 4 11.080 -3.921 18.111 26 HB THR 4 HB THR 4 12.291 -5.703 19.456 27 HG1 THR 4 HG1 THR 4 13.028 -5.209 17.416 28 HG21 THR 4 HG21 THR 4 10.253 -7.200 19.564 29 HG22 THR 4 HG22 THR 4 11.797 -7.959 19.177 30 HG23 THR 4 HG23 THR 4 10.627 -7.632 17.899 31 H SER 5 H SER 5 10.822 -5.648 16.110 32 HA SER 5 HA SER 5 9.472 -6.587 14.533 33 HB2 SER 5 HB2 SER 5 7.130 -6.446 16.411 34 HB3 SER 5 HB3 SER 5 7.411 -7.565 15.081 35 HG SER 5 HG SER 5 9.081 -8.505 16.316 36 H ARG 6 H ARG 6 9.203 -5.209 12.936 37 HA ARG 6 HA ARG 6 7.616 -2.785 13.302 38 HB2 ARG 6 HB2 ARG 6 8.401 -2.434 10.837 39 HB3 ARG 6 HB3 ARG 6 9.523 -2.200 12.147 40 HG2 ARG 6 HG2 ARG 6 10.637 -3.366 10.412 41 HG3 ARG 6 HG3 ARG 6 10.377 -4.485 11.742 42 HD2 ARG 6 HD2 ARG 6 8.330 -4.358 9.594 43 HD3 ARG 6 HD3 ARG 6 9.863 -5.142 9.228 44 HE ARG 6 HE ARG 6 7.818 -6.066 11.074 45 HH11 ARG 6 HH11 ARG 6 11.085 -6.466 9.880 46 HH12 ARG 6 HH12 ARG 6 11.202 -8.110 10.406 47 HH21 ARG 6 HH21 ARG 6 7.984 -8.226 11.763 48 HH22 ARG 6 HH22 ARG 6 9.447 -9.108 11.475 49 H ILE 7 H ILE 7 6.825 -2.901 10.270 50 HA ILE 7 HA ILE 7 4.997 -5.143 10.365 51 HB ILE 7 HB ILE 7 2.997 -3.942 10.205 52 HG12 ILE 7 HG12 ILE 7 3.898 -1.233 10.681 53 HG13 ILE 7 HG13 ILE 7 4.492 -1.867 9.150 54 HG21 ILE 7 HG21 ILE 7 3.843 -4.282 12.469 55 HG22 ILE 7 HG22 ILE 7 2.850 -2.831 12.353 56 HG23 ILE 7 HG23 ILE 7 4.606 -2.694 12.410 57 HD11 ILE 7 HD11 ILE 7 1.600 -2.010 9.954 58 HD12 ILE 7 HD12 ILE 7 2.306 -2.266 8.361 59 HD13 ILE 7 HD13 ILE 7 2.291 -0.653 9.066 60 H THR 8 H THR 8 3.474 -5.239 8.506 61 HA THR 8 HA THR 8 4.837 -4.521 5.991 62 HB THR 8 HB THR 8 2.960 -6.738 6.810 63 HG1 THR 8 HG1 THR 8 4.758 -7.768 6.643 64 HG21 THR 8 HG21 THR 8 3.323 -5.697 4.031 65 HG22 THR 8 HG22 THR 8 1.856 -6.231 4.847 66 HG23 THR 8 HG23 THR 8 3.053 -7.415 4.330 67 H ALA 9 H ALA 9 3.559 -3.473 4.263 68 HA ALA 9 HA ALA 9 1.128 -2.245 5.406 69 HB1 ALA 9 HB1 ALA 9 2.889 -0.650 4.937 70 HB2 ALA 9 HB2 ALA 9 1.474 -0.363 3.930 71 HB3 ALA 9 HB3 ALA 9 2.901 -1.145 3.246 72 H LEU 10 H LEU 10 -0.724 -2.762 4.668 73 HA LEU 10 HA LEU 10 -1.013 -3.730 1.891 74 HB2 LEU 10 HB2 LEU 10 -1.520 -5.226 3.976 75 HB3 LEU 10 HB3 LEU 10 -2.972 -4.270 4.098 76 HG LEU 10 HG LEU 10 -2.568 -5.354 1.428 77 HD11 LEU 10 HD11 LEU 10 -3.021 -7.307 3.678 78 HD12 LEU 10 HD12 LEU 10 -1.484 -7.119 2.835 79 HD13 LEU 10 HD13 LEU 10 -2.912 -7.661 1.954 80 HD21 LEU 10 HD21 LEU 10 -4.710 -5.302 3.516 81 HD22 LEU 10 HD22 LEU 10 -4.900 -6.203 2.013 82 HD23 LEU 10 HD23 LEU 10 -4.655 -4.451 1.977 83 H TYR 11 H TYR 11 -1.580 -1.864 0.824 84 HA TYR 11 HA TYR 11 -3.795 -0.303 1.965 85 HB2 TYR 11 HB2 TYR 11 -2.113 1.242 1.923 86 HB3 TYR 11 HB3 TYR 11 -1.301 0.509 0.569 87 HD1 TYR 11 HD1 TYR 11 -4.812 1.748 0.816 88 HD2 TYR 11 HD2 TYR 11 -0.959 2.271 -0.902 89 HE1 TYR 11 HE1 TYR 11 -5.696 3.538 -0.617 90 HE2 TYR 11 HE2 TYR 11 -1.836 4.059 -2.339 91 HH TYR 11 HH TYR 11 -4.229 5.749 -1.904 92 H GLU 12 H GLU 12 -5.702 -0.268 0.864 93 HA GLU 12 HA GLU 12 -5.651 -0.879 -2.004 94 HB2 GLU 12 HB2 GLU 12 -7.772 -2.413 -1.005 95 HB3 GLU 12 HB3 GLU 12 -6.282 -2.990 -1.729 96 HG2 GLU 12 HG2 GLU 12 -6.627 -4.081 0.379 97 HG3 GLU 12 HG3 GLU 12 -5.236 -3.010 0.504 98 H ARG 13 H ARG 13 -7.711 -0.696 -3.104 99 HA ARG 13 HA ARG 13 -9.803 0.850 -1.797 100 HB2 ARG 13 HB2 ARG 13 -9.454 2.772 -2.912 101 HB3 ARG 13 HB3 ARG 13 -7.933 2.121 -3.501 102 HG2 ARG 13 HG2 ARG 13 -8.807 1.566 -5.548 103 HG3 ARG 13 HG3 ARG 13 -10.449 1.428 -4.938 104 HD2 ARG 13 HD2 ARG 13 -10.013 3.399 -6.422 105 HD3 ARG 13 HD3 ARG 13 -10.729 3.764 -4.859 106 HE ARG 13 HE ARG 13 -8.943 5.089 -4.460 107 HH11 ARG 13 HH11 ARG 13 -7.842 2.541 -6.598 108 HH12 ARG 13 HH12 ARG 13 -6.311 3.270 -6.879 109 HH21 ARG 13 HH21 ARG 13 -6.939 6.060 -4.848 110 HH22 ARG 13 HH22 ARG 13 -5.799 5.296 -5.897 111 H LEU 14 H LEU 14 -11.863 0.663 -2.869 112 HA LEU 14 HA LEU 14 -11.946 -1.370 -4.983 113 HB2 LEU 14 HB2 LEU 14 -13.229 -2.735 -3.789 114 HB3 LEU 14 HB3 LEU 14 -12.867 -1.748 -2.395 115 HG LEU 14 HG LEU 14 -15.224 -2.180 -2.502 116 HD11 LEU 14 HD11 LEU 14 -14.109 0.405 -2.416 117 HD12 LEU 14 HD12 LEU 14 -15.587 -0.181 -1.655 118 HD13 LEU 14 HD13 LEU 14 -15.646 0.518 -3.273 119 HD21 LEU 14 HD21 LEU 14 -15.916 -0.648 -4.848 120 HD22 LEU 14 HD22 LEU 14 -16.435 -2.259 -4.359 121 HD23 LEU 14 HD23 LEU 14 -14.927 -2.052 -5.250 122 H SER 15 H SER 15 -13.377 -1.059 -6.619 123 HA SER 15 HA SER 15 -14.255 1.664 -7.002 124 HB2 SER 15 HB2 SER 15 -14.095 -0.752 -8.774 125 HB3 SER 15 HB3 SER 15 -14.954 0.697 -9.294 126 HG SER 15 HG SER 15 -13.087 1.827 -9.271 127 H ARG 16 H ARG 16 -16.213 2.439 -6.740 128 HA ARG 16 HA ARG 16 -18.362 0.749 -5.877 129 HB2 ARG 16 HB2 ARG 16 -17.685 3.353 -5.406 130 HB3 ARG 16 HB3 ARG 16 -19.035 3.523 -6.517 131 HG2 ARG 16 HG2 ARG 16 -20.225 3.456 -4.607 132 HG3 ARG 16 HG3 ARG 16 -20.077 1.715 -4.844 133 HD2 ARG 16 HD2 ARG 16 -19.447 1.989 -2.630 134 HD3 ARG 16 HD3 ARG 16 -17.904 1.945 -3.476 135 HE ARG 16 HE ARG 16 -19.215 4.426 -2.570 136 HH11 ARG 16 HH11 ARG 16 -16.307 2.542 -3.139 137 HH12 ARG 16 HH12 ARG 16 -15.252 3.793 -2.583 138 HH21 ARG 16 HH21 ARG 16 -17.815 6.054 -1.848 139 HH22 ARG 16 HH22 ARG 16 -16.107 5.785 -1.851 140 H ASP 17 H ASP 17 -17.257 1.653 -8.943 141 HA ASP 17 HA ASP 17 -19.757 2.002 -10.265 142 HB2 ASP 17 HB2 ASP 17 -16.947 1.458 -11.166 143 HB3 ASP 17 HB3 ASP 17 -18.274 1.317 -12.315 144 H ASP 18 H ASP 18 -17.979 -0.727 -9.147 145 HA ASP 18 HA ASP 18 -18.140 -2.974 -9.495 146 HB2 ASP 18 HB2 ASP 18 -19.855 -2.549 -7.880 147 HB3 ASP 18 HB3 ASP 18 -21.005 -2.126 -9.140 148 H ASP 19 H ASP 19 -17.513 -2.294 -11.814 149 HA ASP 19 HA ASP 19 -19.488 -3.188 -13.765 150 HB2 ASP 19 HB2 ASP 19 -18.204 -2.144 -15.435 151 HB3 ASP 19 HB3 ASP 19 -18.060 -1.053 -14.062 152 H LEU 20 H LEU 20 -17.770 -4.760 -11.750 153 HA LEU 20 HA LEU 20 -16.628 -6.707 -13.632 154 HB2 LEU 20 HB2 LEU 20 -15.645 -6.903 -10.904 155 HB3 LEU 20 HB3 LEU 20 -14.758 -6.824 -12.409 156 HG LEU 20 HG LEU 20 -15.254 -4.275 -12.313 157 HD11 LEU 20 HD11 LEU 20 -16.001 -3.314 -10.408 158 HD12 LEU 20 HD12 LEU 20 -15.223 -4.516 -9.375 159 HD13 LEU 20 HD13 LEU 20 -16.756 -4.892 -10.159 160 HD21 LEU 20 HD21 LEU 20 -13.244 -5.894 -10.883 161 HD22 LEU 20 HD22 LEU 20 -13.331 -4.187 -10.452 162 HD23 LEU 20 HD23 LEU 20 -13.039 -4.661 -12.125 163 H THR 21 H THR 21 -18.450 -6.225 -10.642 164 HA THR 21 HA THR 21 -19.735 -7.565 -9.357 165 HB THR 21 HB THR 21 -21.026 -9.365 -10.788 166 HG1 THR 21 HG1 THR 21 -19.796 -9.286 -12.640 167 HG21 THR 21 HG21 THR 21 -22.437 -7.489 -11.782 168 HG22 THR 21 HG22 THR 21 -21.329 -6.397 -10.952 169 HG23 THR 21 HG23 THR 21 -22.273 -7.564 -10.028 170 H GLY 22 H GLY 22 -18.187 -8.504 -8.073 171 HA2 GLY 22 HA2 GLY 22 -18.118 -11.258 -7.884 172 HA3 GLY 22 HA3 GLY 22 -16.704 -10.818 -8.828 173 H GLU 23 H GLU 23 -14.921 -10.650 -7.675 174 HA GLU 23 HA GLU 23 -15.050 -10.257 -4.793 175 HB2 GLU 23 HB2 GLU 23 -13.652 -12.041 -5.982 176 HB3 GLU 23 HB3 GLU 23 -12.568 -10.733 -6.427 177 HG2 GLU 23 HG2 GLU 23 -11.532 -10.986 -4.494 178 HG3 GLU 23 HG3 GLU 23 -13.003 -10.477 -3.670 179 H SER 24 H SER 24 -14.384 -8.353 -7.585 180 HA SER 24 HA SER 24 -12.669 -6.482 -6.194 181 HB2 SER 24 HB2 SER 24 -13.818 -6.518 -8.981 182 HB3 SER 24 HB3 SER 24 -12.811 -5.207 -8.368 183 HG SER 24 HG SER 24 -11.853 -7.170 -9.547 184 H ASN 25 H ASN 25 -16.042 -6.852 -6.369 185 HA ASN 25 HA ASN 25 -16.530 -3.982 -6.211 186 HB2 ASN 25 HB2 ASN 25 -18.719 -4.380 -6.798 187 HB3 ASN 25 HB3 ASN 25 -17.913 -5.725 -7.588 188 HD21 ASN 25 HD21 ASN 25 -17.782 -7.745 -6.174 189 HD22 ASN 25 HD22 ASN 25 -19.216 -8.153 -5.306 190 H SER 26 H SER 26 -15.142 -5.076 -3.960 191 HA SER 26 HA SER 26 -16.917 -4.134 -1.898 192 HB2 SER 26 HB2 SER 26 -15.771 -6.904 -1.560 193 HB3 SER 26 HB3 SER 26 -16.872 -6.059 -0.480 194 HG SER 26 HG SER 26 -18.516 -6.496 -1.770 195 H ILE 27 H ILE 27 -15.806 -3.995 0.223 196 HA ILE 27 HA ILE 27 -13.124 -3.030 -0.188 197 HB ILE 27 HB ILE 27 -15.119 -2.898 2.015 198 HG12 ILE 27 HG12 ILE 27 -15.045 -1.150 0.298 199 HG13 ILE 27 HG13 ILE 27 -14.632 -0.498 1.878 200 HG21 ILE 27 HG21 ILE 27 -12.234 -3.031 2.451 201 HG22 ILE 27 HG22 ILE 27 -13.566 -3.230 3.586 202 HG23 ILE 27 HG23 ILE 27 -13.004 -1.613 3.159 203 HD11 ILE 27 HD11 ILE 27 -12.225 -0.666 1.225 204 HD12 ILE 27 HD12 ILE 27 -13.175 0.477 0.273 205 HD13 ILE 27 HD13 ILE 27 -12.758 -1.101 -0.400 206 H THR 28 H THR 28 -14.561 -5.257 2.202 207 HA THR 28 HA THR 28 -12.189 -6.343 3.168 208 HB THR 28 HB THR 28 -14.836 -6.607 3.759 209 HG1 THR 28 HG1 THR 28 -13.959 -7.317 5.515 210 HG21 THR 28 HG21 THR 28 -13.919 -9.307 2.818 211 HG22 THR 28 HG22 THR 28 -15.219 -8.350 2.112 212 HG23 THR 28 HG23 THR 28 -15.375 -8.973 3.755 213 H ASN 29 H ASN 29 -14.006 -7.195 0.272 214 HA ASN 29 HA ASN 29 -12.873 -9.715 -0.192 215 HB2 ASN 29 HB2 ASN 29 -14.075 -7.677 -2.057 216 HB3 ASN 29 HB3 ASN 29 -13.458 -9.218 -2.628 217 HD21 ASN 29 HD21 ASN 29 -14.903 -10.773 -2.784 218 HD22 ASN 29 HD22 ASN 29 -16.357 -10.905 -1.862 219 H GLN 30 H GLN 30 -11.888 -6.559 -1.658 220 HA GLN 30 HA GLN 30 -9.599 -7.661 -2.894 221 HB2 GLN 30 HB2 GLN 30 -9.458 -5.649 -3.830 222 HB3 GLN 30 HB3 GLN 30 -10.839 -5.161 -2.867 223 HG2 GLN 30 HG2 GLN 30 -8.079 -4.969 -1.742 224 HG3 GLN 30 HG3 GLN 30 -8.691 -3.736 -2.842 225 HE21 GLN 30 HE21 GLN 30 -11.248 -3.430 -2.160 226 HE22 GLN 30 HE22 GLN 30 -11.393 -2.927 -0.521 227 H LYS 31 H LYS 31 -10.174 -6.454 0.366 228 HA LYS 31 HA LYS 31 -7.548 -6.148 1.261 229 HB2 LYS 31 HB2 LYS 31 -9.864 -7.339 2.813 230 HB3 LYS 31 HB3 LYS 31 -8.402 -6.654 3.503 231 HG2 LYS 31 HG2 LYS 31 -9.339 -4.587 1.996 232 HG3 LYS 31 HG3 LYS 31 -10.825 -5.341 2.569 233 HD2 LYS 31 HD2 LYS 31 -8.861 -5.164 4.670 234 HD3 LYS 31 HD3 LYS 31 -9.180 -3.581 3.964 235 HE2 LYS 31 HE2 LYS 31 -11.677 -4.836 4.271 236 HE3 LYS 31 HE3 LYS 31 -10.783 -5.136 5.760 237 HZ1 LYS 31 HZ1 LYS 31 -12.129 -3.048 5.719 238 HZ2 LYS 31 HZ2 LYS 31 -11.058 -2.443 4.561 239 HZ3 LYS 31 HZ3 LYS 31 -10.497 -2.832 6.106 240 H LYS 32 H LYS 32 -9.626 -8.995 1.052 241 HA LYS 32 HA LYS 32 -7.850 -10.928 2.040 242 HB2 LYS 32 HB2 LYS 32 -10.104 -11.194 0.050 243 HB3 LYS 32 HB3 LYS 32 -9.268 -12.554 0.778 244 HG2 LYS 32 HG2 LYS 32 -10.345 -12.341 2.745 245 HG3 LYS 32 HG3 LYS 32 -10.389 -10.581 2.656 246 HD2 LYS 32 HD2 LYS 32 -12.576 -12.092 2.395 247 HD3 LYS 32 HD3 LYS 32 -12.384 -10.551 1.562 248 HE2 LYS 32 HE2 LYS 32 -11.935 -11.567 -0.479 249 HE3 LYS 32 HE3 LYS 32 -11.467 -13.092 0.271 250 HZ1 LYS 32 HZ1 LYS 32 -14.116 -12.089 -0.408 251 HZ2 LYS 32 HZ2 LYS 32 -13.994 -12.982 1.023 252 HZ3 LYS 32 HZ3 LYS 32 -13.513 -13.669 -0.444 253 H TYR 33 H TYR 33 -8.351 -9.624 -1.221 254 HA TYR 33 HA TYR 33 -6.864 -11.410 -2.726 255 HB2 TYR 33 HB2 TYR 33 -8.147 -9.520 -3.700 256 HB3 TYR 33 HB3 TYR 33 -6.928 -8.402 -3.100 257 HD1 TYR 33 HD1 TYR 33 -7.352 -11.351 -5.330 258 HD2 TYR 33 HD2 TYR 33 -5.061 -7.872 -4.438 259 HE1 TYR 33 HE1 TYR 33 -6.038 -11.683 -7.381 260 HE2 TYR 33 HE2 TYR 33 -3.744 -8.207 -6.451 261 HH TYR 33 HH TYR 33 -3.723 -11.040 -8.216 262 H LEU 34 H LEU 34 -5.588 -8.295 -1.481 263 HA LEU 34 HA LEU 34 -2.886 -8.850 -1.973 264 HB2 LEU 34 HB2 LEU 34 -3.907 -7.286 0.402 265 HB3 LEU 34 HB3 LEU 34 -2.352 -7.146 -0.367 266 HG LEU 34 HG LEU 34 -3.136 -5.423 -1.508 267 HD11 LEU 34 HD11 LEU 34 -4.256 -5.764 -3.469 268 HD12 LEU 34 HD12 LEU 34 -5.368 -6.933 -2.760 269 HD13 LEU 34 HD13 LEU 34 -3.704 -7.401 -3.117 270 HD21 LEU 34 HD21 LEU 34 -5.493 -4.721 -1.294 271 HD22 LEU 34 HD22 LEU 34 -4.692 -5.049 0.245 272 HD23 LEU 34 HD23 LEU 34 -5.819 -6.225 -0.432 273 H GLU 35 H GLU 35 -4.997 -9.607 0.763 274 HA GLU 35 HA GLU 35 -3.187 -10.549 2.609 275 HB2 GLU 35 HB2 GLU 35 -6.004 -10.754 2.172 276 HB3 GLU 35 HB3 GLU 35 -5.392 -12.341 2.621 277 HG2 GLU 35 HG2 GLU 35 -4.468 -11.463 4.651 278 HG3 GLU 35 HG3 GLU 35 -4.883 -9.822 4.174 279 H ASP 36 H ASP 36 -4.849 -12.361 0.061 280 HA ASP 36 HA ASP 36 -3.642 -14.838 0.331 281 HB2 ASP 36 HB2 ASP 36 -5.515 -13.828 -1.309 282 HB3 ASP 36 HB3 ASP 36 -4.159 -13.874 -2.425 283 H TYR 37 H TYR 37 -2.435 -11.898 -1.135 284 HA TYR 37 HA TYR 37 -0.206 -13.118 -2.448 285 HB2 TYR 37 HB2 TYR 37 -0.943 -11.027 -3.335 286 HB3 TYR 37 HB3 TYR 37 -0.860 -10.250 -1.765 287 HD1 TYR 37 HD1 TYR 37 1.387 -9.825 -0.739 288 HD2 TYR 37 HD2 TYR 37 0.941 -11.085 -4.761 289 HE1 TYR 37 HE1 TYR 37 3.697 -9.115 -1.202 290 HE2 TYR 37 HE2 TYR 37 3.239 -10.360 -5.255 291 HH TYR 37 HH TYR 37 5.510 -9.954 -3.221 292 H ALA 38 H ALA 38 -0.256 -10.786 0.263 293 HA ALA 38 HA ALA 38 2.325 -11.041 1.097 294 HB1 ALA 38 HB1 ALA 38 0.098 -10.783 3.079 295 HB2 ALA 38 HB2 ALA 38 0.527 -9.484 1.970 296 HB3 ALA 38 HB3 ALA 38 1.710 -10.073 3.133 297 H ARG 39 H ARG 39 -0.314 -13.306 1.763 298 HA ARG 39 HA ARG 39 1.240 -14.770 3.702 299 HB2 ARG 39 HB2 ARG 39 -0.542 -16.490 3.535 300 HB3 ARG 39 HB3 ARG 39 -1.138 -14.887 3.927 301 HG2 ARG 39 HG2 ARG 39 -1.382 -14.828 1.250 302 HG3 ARG 39 HG3 ARG 39 -1.610 -16.557 1.561 303 HD2 ARG 39 HD2 ARG 39 -3.058 -15.098 3.534 304 HD3 ARG 39 HD3 ARG 39 -3.473 -14.451 1.955 305 HE ARG 39 HE ARG 39 -4.391 -16.513 1.354 306 HH11 ARG 39 HH11 ARG 39 -3.072 -16.610 4.597 307 HH12 ARG 39 HH12 ARG 39 -3.882 -18.080 5.011 308 HH21 ARG 39 HH21 ARG 39 -5.444 -18.454 1.908 309 HH22 ARG 39 HH22 ARG 39 -5.224 -19.129 3.486 310 H ARG 40 H ARG 40 0.402 -15.179 0.283 311 HA ARG 40 HA ARG 40 1.770 -17.615 -0.109 312 HB2 ARG 40 HB2 ARG 40 0.930 -17.419 -2.174 313 HB3 ARG 40 HB3 ARG 40 0.219 -15.918 -1.649 314 HG2 ARG 40 HG2 ARG 40 1.310 -15.000 -3.355 315 HG3 ARG 40 HG3 ARG 40 2.751 -15.144 -2.351 316 HD2 ARG 40 HD2 ARG 40 3.225 -17.328 -3.331 317 HD3 ARG 40 HD3 ARG 40 1.770 -17.207 -4.317 318 HE ARG 40 HE ARG 40 3.666 -15.054 -4.668 319 HH11 ARG 40 HH11 ARG 40 2.623 -18.207 -5.780 320 HH12 ARG 40 HH12 ARG 40 3.345 -18.029 -7.342 321 HH21 ARG 40 HH21 ARG 40 4.616 -14.828 -6.725 322 HH22 ARG 40 HH22 ARG 40 4.479 -16.113 -7.879 323 H ASN 41 H ASN 41 2.805 -14.371 0.284 324 HA ASN 41 HA ASN 41 5.449 -14.794 -0.824 325 HB2 ASN 41 HB2 ASN 41 3.851 -12.470 0.144 326 HB3 ASN 41 HB3 ASN 41 5.598 -12.324 0.146 327 HD21 ASN 41 HD21 ASN 41 2.881 -13.211 -1.928 328 HD22 ASN 41 HD22 ASN 41 3.571 -12.604 -3.388 329 H GLY 42 H GLY 42 3.915 -14.169 2.295 330 HA2 GLY 42 HA2 GLY 42 4.699 -15.218 4.301 331 HA3 GLY 42 HA3 GLY 42 6.320 -15.216 3.629 332 H PHE 43 H PHE 43 3.860 -12.659 4.063 333 HA PHE 43 HA PHE 43 5.925 -11.001 5.350 334 HB2 PHE 43 HB2 PHE 43 3.396 -10.270 3.875 335 HB3 PHE 43 HB3 PHE 43 4.375 -9.101 4.740 336 HD1 PHE 43 HD1 PHE 43 7.023 -9.358 4.074 337 HD2 PHE 43 HD2 PHE 43 3.683 -10.312 1.647 338 HE1 PHE 43 HE1 PHE 43 8.412 -9.086 2.062 339 HE2 PHE 43 HE2 PHE 43 5.042 -10.051 -0.368 340 HZ PHE 43 HZ PHE 43 7.422 -9.432 -0.167 341 H GLU 44 H GLU 44 5.619 -10.124 7.354 342 HA GLU 44 HA GLU 44 3.341 -11.082 8.897 343 HB2 GLU 44 HB2 GLU 44 6.100 -10.157 9.555 344 HB3 GLU 44 HB3 GLU 44 4.851 -10.160 10.791 345 HG2 GLU 44 HG2 GLU 44 6.397 -12.152 10.581 346 HG3 GLU 44 HG3 GLU 44 4.680 -12.435 10.799 347 H ASN 45 H ASN 45 2.688 -9.680 10.722 348 HA ASN 45 HA ASN 45 1.541 -7.856 11.415 349 HB2 ASN 45 HB2 ASN 45 3.994 -6.534 10.293 350 HB3 ASN 45 HB3 ASN 45 2.867 -5.765 11.406 351 HD21 ASN 45 HD21 ASN 45 5.693 -7.477 11.116 352 HD22 ASN 45 HD22 ASN 45 5.898 -7.958 12.765 353 H ILE 46 H ILE 46 1.008 -8.698 8.635 354 HA ILE 46 HA ILE 46 0.790 -6.622 6.829 355 HB ILE 46 HB ILE 46 -1.036 -8.994 7.187 356 HG12 ILE 46 HG12 ILE 46 1.185 -8.707 5.188 357 HG13 ILE 46 HG13 ILE 46 1.507 -9.298 6.816 358 HG21 ILE 46 HG21 ILE 46 -2.107 -8.473 5.278 359 HG22 ILE 46 HG22 ILE 46 -0.657 -7.808 4.526 360 HG23 ILE 46 HG23 ILE 46 -1.586 -6.834 5.664 361 HD11 ILE 46 HD11 ILE 46 -0.614 -10.582 5.140 362 HD12 ILE 46 HD12 ILE 46 0.313 -11.250 6.483 363 HD13 ILE 46 HD13 ILE 46 1.085 -10.996 4.920 364 H ARG 47 H ARG 47 0.110 -4.751 7.622 365 HA ARG 47 HA ARG 47 -2.425 -4.542 9.024 366 HB2 ARG 47 HB2 ARG 47 -0.163 -3.130 9.332 367 HB3 ARG 47 HB3 ARG 47 -1.021 -2.082 8.207 368 HG2 ARG 47 HG2 ARG 47 -2.909 -2.830 10.123 369 HG3 ARG 47 HG3 ARG 47 -1.440 -2.462 11.018 370 HD2 ARG 47 HD2 ARG 47 -1.425 -0.399 9.353 371 HD3 ARG 47 HD3 ARG 47 -3.157 -0.709 9.366 372 HE ARG 47 HE ARG 47 -1.512 0.198 11.598 373 HH11 ARG 47 HH11 ARG 47 -4.666 -0.812 10.461 374 HH12 ARG 47 HH12 ARG 47 -5.507 -0.104 11.795 375 HH21 ARG 47 HH21 ARG 47 -2.626 1.135 13.342 376 HH22 ARG 47 HH22 ARG 47 -4.351 1.005 13.430 377 H HIS 48 H HIS 48 -4.286 -4.152 8.104 378 HA HIS 48 HA HIS 48 -4.318 -3.613 5.256 379 HB2 HIS 48 HB2 HIS 48 -6.457 -4.468 7.199 380 HB3 HIS 48 HB3 HIS 48 -6.844 -3.992 5.549 381 HD1 HIS 48 HD1 HIS 48 -6.891 -5.829 3.934 382 HD2 HIS 48 HD2 HIS 48 -4.498 -6.708 7.202 383 HE1 HIS 48 HE1 HIS 48 -6.195 -8.223 3.612 384 HE2 HIS 48 HE2 HIS 48 -4.851 -8.770 5.683 385 H PHE 49 H PHE 49 -4.370 -1.623 4.528 386 HA PHE 49 HA PHE 49 -5.668 0.473 6.121 387 HB2 PHE 49 HB2 PHE 49 -3.760 0.828 3.782 388 HB3 PHE 49 HB3 PHE 49 -4.346 2.084 4.862 389 HD1 PHE 49 HD1 PHE 49 -3.537 2.230 7.150 390 HD2 PHE 49 HD2 PHE 49 -1.954 -0.653 4.446 391 HE1 PHE 49 HE1 PHE 49 -1.623 1.877 8.647 392 HE2 PHE 49 HE2 PHE 49 -0.040 -1.010 5.954 393 HZ PHE 49 HZ PHE 49 0.121 0.255 8.046 394 H THR 50 H THR 50 -7.687 0.321 5.666 395 HA THR 50 HA THR 50 -8.795 -0.349 3.159 396 HB THR 50 HB THR 50 -9.736 -0.843 5.403 397 HG1 THR 50 HG1 THR 50 -11.875 -0.551 4.723 398 HG21 THR 50 HG21 THR 50 -11.358 1.404 5.811 399 HG22 THR 50 HG22 THR 50 -9.699 1.992 5.687 400 HG23 THR 50 HG23 THR 50 -10.109 0.753 6.870 401 H ASP 51 H ASP 51 -10.265 0.747 1.907 402 HA ASP 51 HA ASP 51 -9.750 3.621 1.663 403 HB2 ASP 51 HB2 ASP 51 -9.217 3.008 -0.447 404 HB3 ASP 51 HB3 ASP 51 -9.933 1.423 -0.237 405 H ASP 52 H ASP 52 -11.433 5.064 1.347 406 HA ASP 52 HA ASP 52 -14.144 4.217 1.141 407 HB2 ASP 52 HB2 ASP 52 -13.855 3.721 3.502 408 HB3 ASP 52 HB3 ASP 52 -13.206 5.331 3.791 409 H GLY 53 H GLY 53 -14.743 5.657 -0.335 410 HA2 GLY 53 HA2 GLY 53 -15.019 7.651 -1.457 411 HA3 GLY 53 HA3 GLY 53 -15.293 8.310 0.146 412 H PHE 54 H PHE 54 -12.551 7.278 -1.900 413 HA PHE 54 HA PHE 54 -10.847 9.274 -0.677 414 HB2 PHE 54 HB2 PHE 54 -10.404 7.053 -2.649 415 HB3 PHE 54 HB3 PHE 54 -9.186 8.297 -2.421 416 HD1 PHE 54 HD1 PHE 54 -9.878 8.553 0.658 417 HD2 PHE 54 HD2 PHE 54 -8.899 5.301 -1.929 418 HE1 PHE 54 HE1 PHE 54 -9.019 7.282 2.564 419 HE2 PHE 54 HE2 PHE 54 -8.018 4.056 -0.005 420 HZ PHE 54 HZ PHE 54 -8.088 5.044 2.246 421 H SER 55 H SER 55 -10.642 11.270 -1.420 422 HA SER 55 HA SER 55 -11.750 12.055 -3.968 423 HB2 SER 55 HB2 SER 55 -11.136 13.368 -1.519 424 HB3 SER 55 HB3 SER 55 -10.216 14.168 -2.791 425 HG SER 55 HG SER 55 -12.090 14.612 -3.867 426 H GLY 56 H GLY 56 -10.387 13.584 -5.390 427 HA2 GLY 56 HA2 GLY 56 -7.967 12.135 -6.102 428 HA3 GLY 56 HA3 GLY 56 -8.754 13.381 -7.052 429 H VAL 57 H VAL 57 -7.339 13.302 -3.762 430 HA VAL 57 HA VAL 57 -5.967 15.812 -4.376 431 HB VAL 57 HB VAL 57 -5.593 16.096 -2.024 432 HG11 VAL 57 HG11 VAL 57 -8.456 15.244 -2.358 433 HG12 VAL 57 HG12 VAL 57 -7.793 16.696 -3.110 434 HG13 VAL 57 HG13 VAL 57 -7.811 16.542 -1.353 435 HG21 VAL 57 HG21 VAL 57 -5.214 13.840 -1.316 436 HG22 VAL 57 HG22 VAL 57 -6.865 13.382 -1.727 437 HG23 VAL 57 HG23 VAL 57 -6.566 14.492 -0.390 438 H ASN 58 H ASN 58 -5.172 12.566 -4.459 439 HA ASN 58 HA ASN 58 -3.198 11.411 -4.579 440 HB2 ASN 58 HB2 ASN 58 -1.432 13.773 -4.558 441 HB3 ASN 58 HB3 ASN 58 -1.559 12.473 -5.733 442 HD21 ASN 58 HD21 ASN 58 -2.462 15.672 -4.924 443 HD22 ASN 58 HD22 ASN 58 -3.425 16.010 -6.312 444 H PHE 59 H PHE 59 -2.895 10.373 -2.720 445 HA PHE 59 HA PHE 59 -2.091 9.822 -0.671 446 HB2 PHE 59 HB2 PHE 59 -0.394 12.310 -0.663 447 HB3 PHE 59 HB3 PHE 59 -0.074 10.762 0.104 448 HD1 PHE 59 HD1 PHE 59 0.587 8.800 -1.338 449 HD2 PHE 59 HD2 PHE 59 0.340 12.770 -2.862 450 HE1 PHE 59 HE1 PHE 59 1.981 8.154 -3.251 451 HE2 PHE 59 HE2 PHE 59 1.731 12.122 -4.774 452 HZ PHE 59 HZ PHE 59 2.555 9.813 -4.972 453 H ASN 60 H ASN 60 -1.596 11.003 1.641 454 HA ASN 60 HA ASN 60 -2.502 12.034 3.444 455 HB2 ASN 60 HB2 ASN 60 -3.635 14.035 1.481 456 HB3 ASN 60 HB3 ASN 60 -3.352 14.281 3.201 457 HD21 ASN 60 HD21 ASN 60 -0.896 13.383 3.650 458 HD22 ASN 60 HD22 ASN 60 0.273 14.218 2.695 459 H ARG 61 H ARG 61 -3.848 9.894 2.780 460 HA ARG 61 HA ARG 61 -6.729 10.556 2.820 461 HB2 ARG 61 HB2 ARG 61 -6.114 7.736 2.543 462 HB3 ARG 61 HB3 ARG 61 -7.085 8.768 1.518 463 HG2 ARG 61 HG2 ARG 61 -4.425 9.460 0.952 464 HG3 ARG 61 HG3 ARG 61 -4.461 7.712 1.088 465 HD2 ARG 61 HD2 ARG 61 -5.115 7.714 -1.025 466 HD3 ARG 61 HD3 ARG 61 -6.691 8.189 -0.390 467 HE ARG 61 HE ARG 61 -4.924 10.398 -0.887 468 HH11 ARG 61 HH11 ARG 61 -7.289 8.257 -2.325 469 HH12 ARG 61 HH12 ARG 61 -7.728 9.384 -3.563 470 HH21 ARG 61 HH21 ARG 61 -5.517 11.865 -2.498 471 HH22 ARG 61 HH22 ARG 61 -6.718 11.424 -3.665 472 HA PRO 62 HA PRO 62 -7.319 9.120 6.975 473 HB2 PRO 62 HB2 PRO 62 -9.245 7.154 6.672 474 HB3 PRO 62 HB3 PRO 62 -9.581 8.888 6.714 475 HG2 PRO 62 HG2 PRO 62 -9.248 7.084 4.345 476 HG3 PRO 62 HG3 PRO 62 -10.456 8.348 4.619 477 HD2 PRO 62 HD2 PRO 62 -8.360 8.811 3.047 478 HD3 PRO 62 HD3 PRO 62 -8.944 10.062 4.166 479 H GLY 63 H GLY 63 -8.008 6.030 5.339 480 HA2 GLY 63 HA2 GLY 63 -6.497 4.435 7.058 481 HA3 GLY 63 HA3 GLY 63 -6.981 3.983 5.431 482 H PHE 64 H PHE 64 -5.587 6.241 4.206 483 HA PHE 64 HA PHE 64 -3.050 5.036 3.760 484 HB2 PHE 64 HB2 PHE 64 -4.251 6.286 2.055 485 HB3 PHE 64 HB3 PHE 64 -4.159 7.744 3.030 486 HD1 PHE 64 HD1 PHE 64 -2.308 5.422 0.922 487 HD2 PHE 64 HD2 PHE 64 -2.156 9.019 3.161 488 HE1 PHE 64 HE1 PHE 64 -0.206 6.024 -0.196 489 HE2 PHE 64 HE2 PHE 64 -0.060 9.640 2.054 490 HZ PHE 64 HZ PHE 64 0.930 8.133 0.370 491 H GLN 65 H GLN 65 -4.168 7.868 5.575 492 HA GLN 65 HA GLN 65 -1.663 8.878 6.314 493 HB2 GLN 65 HB2 GLN 65 -4.418 9.075 7.455 494 HB3 GLN 65 HB3 GLN 65 -3.068 9.595 8.453 495 HG2 GLN 65 HG2 GLN 65 -2.378 11.157 6.701 496 HG3 GLN 65 HG3 GLN 65 -3.744 10.647 5.712 497 HE21 GLN 65 HE21 GLN 65 -5.907 10.961 6.667 498 HE22 GLN 65 HE22 GLN 65 -6.168 12.352 7.657 499 H SER 66 H SER 66 -3.501 6.132 7.339 500 HA SER 66 HA SER 66 -1.997 5.625 9.738 501 HB2 SER 66 HB2 SER 66 -4.342 4.580 8.548 502 HB3 SER 66 HB3 SER 66 -3.193 3.248 8.615 503 HG SER 66 HG SER 66 -4.368 4.698 10.692 504 H LEU 67 H LEU 67 -2.030 4.459 6.369 505 HA LEU 67 HA LEU 67 0.075 2.618 6.553 506 HB2 LEU 67 HB2 LEU 67 -0.884 2.310 4.526 507 HB3 LEU 67 HB3 LEU 67 -1.501 3.952 4.495 508 HG LEU 67 HG LEU 67 0.758 4.685 3.695 509 HD11 LEU 67 HD11 LEU 67 2.171 2.968 4.435 510 HD12 LEU 67 HD12 LEU 67 2.111 2.811 2.680 511 HD13 LEU 67 HD13 LEU 67 1.168 1.722 3.698 512 HD21 LEU 67 HD21 LEU 67 0.259 3.003 1.530 513 HD22 LEU 67 HD22 LEU 67 -0.367 4.629 1.788 514 HD23 LEU 67 HD23 LEU 67 -1.302 3.233 2.316 515 H ILE 68 H ILE 68 0.036 6.086 5.745 516 HA ILE 68 HA ILE 68 2.821 6.371 5.375 517 HB ILE 68 HB ILE 68 0.709 8.028 4.946 518 HG12 ILE 68 HG12 ILE 68 2.288 9.715 4.257 519 HG13 ILE 68 HG13 ILE 68 3.531 9.059 5.313 520 HG21 ILE 68 HG21 ILE 68 1.179 10.066 6.382 521 HG22 ILE 68 HG22 ILE 68 2.025 8.970 7.476 522 HG23 ILE 68 HG23 ILE 68 0.309 8.736 7.143 523 HD11 ILE 68 HD11 ILE 68 4.028 8.484 3.051 524 HD12 ILE 68 HD12 ILE 68 2.414 7.812 2.813 525 HD13 ILE 68 HD13 ILE 68 3.551 7.016 3.901 526 H LYS 69 H LYS 69 0.722 6.547 8.205 527 HA LYS 69 HA LYS 69 2.493 7.647 10.062 528 HB2 LYS 69 HB2 LYS 69 0.708 7.439 11.375 529 HB3 LYS 69 HB3 LYS 69 -0.089 6.525 10.110 530 HG2 LYS 69 HG2 LYS 69 -0.152 4.787 11.457 531 HG3 LYS 69 HG3 LYS 69 1.603 4.711 11.439 532 HD2 LYS 69 HD2 LYS 69 -0.092 6.309 13.355 533 HD3 LYS 69 HD3 LYS 69 0.761 4.809 13.717 534 HE2 LYS 69 HE2 LYS 69 2.636 6.621 12.607 535 HE3 LYS 69 HE3 LYS 69 1.724 7.484 13.842 536 HZ1 LYS 69 HZ1 LYS 69 2.446 4.896 14.757 537 HZ2 LYS 69 HZ2 LYS 69 2.812 6.406 15.422 538 HZ3 LYS 69 HZ3 LYS 69 3.817 5.739 14.239 539 H GLU 70 H GLU 70 2.163 4.363 8.874 540 HA GLU 70 HA GLU 70 3.987 3.228 10.777 541 HB2 GLU 70 HB2 GLU 70 3.491 1.987 8.089 542 HB3 GLU 70 HB3 GLU 70 3.768 1.201 9.634 543 HG2 GLU 70 HG2 GLU 70 1.276 2.759 9.056 544 HG3 GLU 70 HG3 GLU 70 1.443 1.061 8.647 545 H VAL 71 H VAL 71 4.179 4.491 7.486 546 HA VAL 71 HA VAL 71 6.864 3.786 6.987 547 HB VAL 71 HB VAL 71 5.596 6.258 5.831 548 HG11 VAL 71 HG11 VAL 71 6.905 5.497 3.839 549 HG12 VAL 71 HG12 VAL 71 7.613 4.250 4.866 550 HG13 VAL 71 HG13 VAL 71 7.878 5.954 5.237 551 HG21 VAL 71 HG21 VAL 71 5.171 4.115 4.073 552 HG22 VAL 71 HG22 VAL 71 3.957 5.074 4.918 553 HG23 VAL 71 HG23 VAL 71 4.567 3.590 5.645 554 H GLU 72 H GLU 72 5.431 6.752 8.342 555 HA GLU 72 HA GLU 72 7.836 8.206 8.525 556 HB2 GLU 72 HB2 GLU 72 6.522 9.417 10.443 557 HB3 GLU 72 HB3 GLU 72 6.036 9.604 8.765 558 HG2 GLU 72 HG2 GLU 72 4.101 8.523 9.063 559 HG3 GLU 72 HG3 GLU 72 4.781 7.377 10.202 560 H ALA 73 H ALA 73 6.207 6.030 10.775 561 HA ALA 73 HA ALA 73 8.083 6.422 12.906 562 HB1 ALA 73 HB1 ALA 73 5.568 5.395 12.720 563 HB2 ALA 73 HB2 ALA 73 6.629 5.226 14.120 564 HB3 ALA 73 HB3 ALA 73 6.539 3.937 12.919 565 H GLY 74 H GLY 74 8.234 4.678 9.996 566 HA2 GLY 74 HA2 GLY 74 9.885 3.349 9.139 567 HA3 GLY 74 HA3 GLY 74 10.765 3.495 10.642 568 H ASN 75 H ASN 75 7.496 2.265 10.096 569 HA ASN 75 HA ASN 75 8.261 -0.315 11.287 570 HB2 ASN 75 HB2 ASN 75 5.742 1.300 11.196 571 HB3 ASN 75 HB3 ASN 75 5.598 -0.449 11.295 572 HD21 ASN 75 HD21 ASN 75 4.777 1.464 13.232 573 HD22 ASN 75 HD22 ASN 75 5.664 1.131 14.669 574 H VAL 76 H VAL 76 6.350 1.115 8.619 575 HA VAL 76 HA VAL 76 5.662 -1.284 7.381 576 HB VAL 76 HB VAL 76 4.706 0.912 6.713 577 HG11 VAL 76 HG11 VAL 76 7.359 1.681 6.388 578 HG12 VAL 76 HG12 VAL 76 5.916 2.613 6.010 579 HG13 VAL 76 HG13 VAL 76 6.681 1.635 4.763 580 HG21 VAL 76 HG21 VAL 76 4.702 -1.185 5.270 581 HG22 VAL 76 HG22 VAL 76 5.971 -0.406 4.332 582 HG23 VAL 76 HG23 VAL 76 4.379 0.342 4.451 583 H GLU 77 H GLU 77 7.098 -2.817 6.958 584 HA GLU 77 HA GLU 77 9.723 -2.134 5.850 585 HB2 GLU 77 HB2 GLU 77 10.343 -4.427 6.357 586 HB3 GLU 77 HB3 GLU 77 9.633 -3.664 7.772 587 HG2 GLU 77 HG2 GLU 77 7.936 -5.104 7.846 588 HG3 GLU 77 HG3 GLU 77 7.695 -5.055 6.103 589 H THR 78 H THR 78 6.686 -2.920 4.742 590 HA THR 78 HA THR 78 7.631 -3.471 2.071 591 HB THR 78 HB THR 78 5.643 -5.468 2.920 592 HG1 THR 78 HG1 THR 78 6.762 -6.282 4.477 593 HG21 THR 78 HG21 THR 78 8.026 -5.367 1.167 594 HG22 THR 78 HG22 THR 78 6.363 -5.834 0.799 595 HG23 THR 78 HG23 THR 78 7.405 -6.927 1.712 596 H LEU 79 H LEU 79 5.947 -3.277 0.492 597 HA LEU 79 HA LEU 79 3.397 -2.287 1.549 598 HB2 LEU 79 HB2 LEU 79 5.077 -0.489 0.714 599 HB3 LEU 79 HB3 LEU 79 4.620 -1.048 -0.856 600 HG LEU 79 HG LEU 79 3.158 0.685 -0.675 601 HD11 LEU 79 HD11 LEU 79 1.601 -1.364 0.869 602 HD12 LEU 79 HD12 LEU 79 1.838 -1.390 -0.876 603 HD13 LEU 79 HD13 LEU 79 0.960 -0.059 -0.124 604 HD21 LEU 79 HD21 LEU 79 1.981 0.971 1.718 605 HD22 LEU 79 HD22 LEU 79 3.469 1.795 1.246 606 HD23 LEU 79 HD23 LEU 79 3.547 0.325 2.215 607 H ILE 80 H ILE 80 1.776 -3.362 0.748 608 HA ILE 80 HA ILE 80 2.039 -4.610 -1.906 609 HB ILE 80 HB ILE 80 0.535 -5.505 0.541 610 HG12 ILE 80 HG12 ILE 80 1.595 -7.704 -0.180 611 HG13 ILE 80 HG13 ILE 80 2.505 -6.773 -1.364 612 HG21 ILE 80 HG21 ILE 80 -0.084 -6.109 -2.320 613 HG22 ILE 80 HG22 ILE 80 -1.185 -5.737 -0.995 614 HG23 ILE 80 HG23 ILE 80 -0.389 -7.311 -1.066 615 HD11 ILE 80 HD11 ILE 80 3.513 -5.478 0.439 616 HD12 ILE 80 HD12 ILE 80 3.823 -7.204 0.616 617 HD13 ILE 80 HD13 ILE 80 2.604 -6.419 1.619 618 H VAL 81 H VAL 81 0.909 -3.664 -3.440 619 HA VAL 81 HA VAL 81 -1.654 -2.355 -2.802 620 HB VAL 81 HB VAL 81 0.503 -1.253 -4.607 621 HG11 VAL 81 HG11 VAL 81 -2.339 -0.684 -4.391 622 HG12 VAL 81 HG12 VAL 81 -1.180 -0.238 -5.641 623 HG13 VAL 81 HG13 VAL 81 -1.336 0.752 -4.193 624 HG21 VAL 81 HG21 VAL 81 -0.236 -0.679 -1.779 625 HG22 VAL 81 HG22 VAL 81 0.105 0.718 -2.809 626 HG23 VAL 81 HG23 VAL 81 1.329 -0.541 -2.601 627 H LYS 82 H LYS 82 -3.204 -2.398 -4.480 628 HA LYS 82 HA LYS 82 -3.243 -4.618 -6.178 629 HB2 LYS 82 HB2 LYS 82 -5.008 -2.569 -5.487 630 HB3 LYS 82 HB3 LYS 82 -4.776 -2.350 -7.214 631 HG2 LYS 82 HG2 LYS 82 -5.674 -4.875 -5.845 632 HG3 LYS 82 HG3 LYS 82 -6.687 -3.764 -6.770 633 HD2 LYS 82 HD2 LYS 82 -6.072 -4.676 -8.704 634 HD3 LYS 82 HD3 LYS 82 -4.365 -4.622 -8.277 635 HE2 LYS 82 HE2 LYS 82 -4.334 -6.764 -7.604 636 HE3 LYS 82 HE3 LYS 82 -5.916 -6.651 -6.838 637 HZ1 LYS 82 HZ1 LYS 82 -6.739 -7.765 -8.544 638 HZ2 LYS 82 HZ2 LYS 82 -5.244 -7.773 -9.330 639 HZ3 LYS 82 HZ3 LYS 82 -6.325 -6.499 -9.585 640 H ASP 83 H ASP 83 -2.309 -1.241 -6.732 641 HA ASP 83 HA ASP 83 -0.328 -1.772 -8.615 642 HB2 ASP 83 HB2 ASP 83 -1.491 -0.682 -10.628 643 HB3 ASP 83 HB3 ASP 83 -1.887 -2.356 -10.269 644 H MET 84 H MET 84 0.606 0.192 -9.551 645 HA MET 84 HA MET 84 0.914 2.224 -7.706 646 HB2 MET 84 HB2 MET 84 1.679 1.806 -10.516 647 HB3 MET 84 HB3 MET 84 1.639 3.484 -9.998 648 HG2 MET 84 HG2 MET 84 3.291 1.243 -8.885 649 HG3 MET 84 HG3 MET 84 3.841 2.721 -9.673 650 HE1 MET 84 HE1 MET 84 3.949 0.983 -6.646 651 HE2 MET 84 HE2 MET 84 4.371 2.269 -5.515 652 HE3 MET 84 HE3 MET 84 5.302 2.058 -6.996 653 H SER 85 H SER 85 -1.796 1.847 -9.763 654 HA SER 85 HA SER 85 -2.365 4.599 -10.207 655 HB2 SER 85 HB2 SER 85 -4.444 2.417 -10.104 656 HB3 SER 85 HB3 SER 85 -4.469 3.906 -11.047 657 HG SER 85 HG SER 85 -3.408 1.498 -11.673 658 H ARG 86 H ARG 86 -2.716 2.552 -7.456 659 HA ARG 86 HA ARG 86 -4.883 3.811 -6.202 660 HB2 ARG 86 HB2 ARG 86 -2.645 2.082 -5.278 661 HB3 ARG 86 HB3 ARG 86 -3.596 2.933 -4.069 662 HG2 ARG 86 HG2 ARG 86 -4.737 0.955 -4.199 663 HG3 ARG 86 HG3 ARG 86 -5.626 1.902 -5.375 664 HD2 ARG 86 HD2 ARG 86 -3.291 0.370 -6.346 665 HD3 ARG 86 HD3 ARG 86 -4.719 -0.544 -5.885 666 HE ARG 86 HE ARG 86 -4.409 1.151 -8.184 667 HH11 ARG 86 HH11 ARG 86 -6.735 -0.287 -5.993 668 HH12 ARG 86 HH12 ARG 86 -8.024 -0.249 -7.146 669 HH21 ARG 86 HH21 ARG 86 -6.110 1.184 -9.698 670 HH22 ARG 86 HH22 ARG 86 -7.670 0.582 -9.249 671 H LEU 87 H LEU 87 -1.379 4.331 -5.626 672 HA LEU 87 HA LEU 87 -1.895 6.655 -4.011 673 HB2 LEU 87 HB2 LEU 87 0.584 5.376 -5.119 674 HB3 LEU 87 HB3 LEU 87 0.660 6.962 -4.376 675 HG LEU 87 HG LEU 87 -0.704 5.518 -2.485 676 HD11 LEU 87 HD11 LEU 87 -0.472 3.385 -3.328 677 HD12 LEU 87 HD12 LEU 87 0.904 3.513 -2.234 678 HD13 LEU 87 HD13 LEU 87 1.138 3.700 -3.970 679 HD21 LEU 87 HD21 LEU 87 1.036 7.022 -1.918 680 HD22 LEU 87 HD22 LEU 87 2.232 6.075 -2.801 681 HD23 LEU 87 HD23 LEU 87 1.521 5.437 -1.321 682 H GLY 88 H GLY 88 -0.863 6.162 -7.401 683 HA2 GLY 88 HA2 GLY 88 -2.069 8.221 -8.575 684 HA3 GLY 88 HA3 GLY 88 -0.776 9.063 -7.755 685 H ARG 89 H ARG 89 -1.204 9.102 -10.516 686 HA ARG 89 HA ARG 89 0.588 7.296 -11.840 687 HB2 ARG 89 HB2 ARG 89 -0.988 9.701 -12.653 688 HB3 ARG 89 HB3 ARG 89 0.299 9.127 -13.701 689 HG2 ARG 89 HG2 ARG 89 -1.064 7.614 -14.554 690 HG3 ARG 89 HG3 ARG 89 -1.240 6.874 -12.963 691 HD2 ARG 89 HD2 ARG 89 -3.234 7.881 -12.562 692 HD3 ARG 89 HD3 ARG 89 -2.819 9.317 -13.495 693 HE ARG 89 HE ARG 89 -3.357 6.812 -14.915 694 HH11 ARG 89 HH11 ARG 89 -4.368 10.072 -14.108 695 HH12 ARG 89 HH12 ARG 89 -5.538 10.150 -15.380 696 HH21 ARG 89 HH21 ARG 89 -4.899 6.929 -16.584 697 HH22 ARG 89 HH22 ARG 89 -5.841 8.368 -16.782 698 H ASN 90 H ASN 90 0.928 10.263 -10.133 699 HA ASN 90 HA ASN 90 3.223 11.260 -11.452 700 HB2 ASN 90 HB2 ASN 90 3.525 12.533 -9.217 701 HB3 ASN 90 HB3 ASN 90 2.099 12.875 -10.188 702 HD21 ASN 90 HD21 ASN 90 3.296 11.191 -7.363 703 HD22 ASN 90 HD22 ASN 90 1.777 11.070 -6.558 704 H TYR 91 H TYR 91 4.527 9.405 -11.684 705 HA TYR 91 HA TYR 91 5.498 7.829 -9.581 706 HB2 TYR 91 HB2 TYR 91 5.546 7.059 -11.833 707 HB3 TYR 91 HB3 TYR 91 6.580 8.388 -12.340 708 HD1 TYR 91 HD1 TYR 91 8.978 8.354 -11.777 709 HD2 TYR 91 HD2 TYR 91 6.432 5.099 -10.785 710 HE1 TYR 91 HE1 TYR 91 10.946 6.916 -11.476 711 HE2 TYR 91 HE2 TYR 91 8.398 3.636 -10.500 712 HH TYR 91 HH TYR 91 11.131 3.998 -11.652 713 H LEU 92 H LEU 92 6.254 11.068 -10.340 714 HA LEU 92 HA LEU 92 8.971 11.124 -9.491 715 HB2 LEU 92 HB2 LEU 92 6.905 13.326 -9.541 716 HB3 LEU 92 HB3 LEU 92 8.615 13.565 -9.246 717 HG LEU 92 HG LEU 92 8.988 12.525 -11.557 718 HD11 LEU 92 HD11 LEU 92 6.927 13.070 -13.031 719 HD12 LEU 92 HD12 LEU 92 6.027 12.897 -11.523 720 HD13 LEU 92 HD13 LEU 92 6.982 11.550 -12.139 721 HD21 LEU 92 HD21 LEU 92 9.499 14.709 -11.701 722 HD22 LEU 92 HD22 LEU 92 8.061 15.209 -10.811 723 HD23 LEU 92 HD23 LEU 92 7.949 14.837 -12.531 724 H GLN 93 H GLN 93 5.940 12.121 -7.905 725 HA GLN 93 HA GLN 93 7.099 12.429 -5.305 726 HB2 GLN 93 HB2 GLN 93 4.327 12.397 -6.441 727 HB3 GLN 93 HB3 GLN 93 4.524 12.234 -4.702 728 HG2 GLN 93 HG2 GLN 93 5.566 14.511 -6.368 729 HG3 GLN 93 HG3 GLN 93 4.084 14.533 -5.411 730 HE21 GLN 93 HE21 GLN 93 7.560 14.534 -5.311 731 HE22 GLN 93 HE22 GLN 93 7.712 14.993 -3.657 732 H VAL 94 H VAL 94 5.050 9.978 -6.850 733 HA VAL 94 HA VAL 94 4.802 8.191 -4.736 734 HB VAL 94 HB VAL 94 4.918 7.642 -7.714 735 HG11 VAL 94 HG11 VAL 94 3.453 5.751 -6.036 736 HG12 VAL 94 HG12 VAL 94 5.198 5.732 -5.790 737 HG13 VAL 94 HG13 VAL 94 4.532 5.466 -7.403 738 HG21 VAL 94 HG21 VAL 94 2.524 7.692 -7.655 739 HG22 VAL 94 HG22 VAL 94 3.105 9.156 -6.864 740 HG23 VAL 94 HG23 VAL 94 2.512 7.811 -5.892 741 H GLY 95 H GLY 95 7.343 8.477 -7.200 742 HA2 GLY 95 HA2 GLY 95 8.869 6.234 -6.431 743 HA3 GLY 95 HA3 GLY 95 9.483 7.641 -7.283 744 H PHE 96 H PHE 96 9.184 9.678 -5.559 745 HA PHE 96 HA PHE 96 11.334 9.633 -3.879 746 HB2 PHE 96 HB2 PHE 96 10.483 11.761 -4.041 747 HB3 PHE 96 HB3 PHE 96 8.814 11.218 -3.965 748 HD1 PHE 96 HD1 PHE 96 7.893 10.515 -1.682 749 HD2 PHE 96 HD2 PHE 96 11.536 12.663 -2.171 750 HE1 PHE 96 HE1 PHE 96 7.787 11.222 0.667 751 HE2 PHE 96 HE2 PHE 96 11.432 13.372 0.181 752 HZ PHE 96 HZ PHE 96 9.557 12.652 1.603 753 H TYR 97 H TYR 97 8.010 8.671 -3.138 754 HA TYR 97 HA TYR 97 8.371 8.121 -0.416 755 HB2 TYR 97 HB2 TYR 97 6.404 7.128 -2.462 756 HB3 TYR 97 HB3 TYR 97 6.355 6.549 -0.800 757 HD1 TYR 97 HD1 TYR 97 6.534 8.586 0.973 758 HD2 TYR 97 HD2 TYR 97 4.992 8.878 -2.978 759 HE1 TYR 97 HE1 TYR 97 5.260 10.577 1.625 760 HE2 TYR 97 HE2 TYR 97 3.710 10.875 -2.339 761 HH TYR 97 HH TYR 97 2.748 11.769 0.009 762 H THR 98 H THR 98 8.562 5.933 -3.249 763 HA THR 98 HA THR 98 9.353 3.723 -1.569 764 HB THR 98 HB THR 98 9.703 2.545 -3.758 765 HG1 THR 98 HG1 THR 98 9.641 3.633 -5.542 766 HG21 THR 98 HG21 THR 98 7.019 3.831 -3.840 767 HG22 THR 98 HG22 THR 98 7.458 2.769 -2.502 768 HG23 THR 98 HG23 THR 98 7.478 2.158 -4.155 769 H GLU 99 H GLU 99 11.145 6.173 -3.368 770 HA GLU 99 HA GLU 99 13.579 4.565 -3.234 771 HB2 GLU 99 HB2 GLU 99 14.620 6.478 -4.491 772 HB3 GLU 99 HB3 GLU 99 13.343 5.611 -5.324 773 HG2 GLU 99 HG2 GLU 99 12.153 7.449 -5.566 774 HG3 GLU 99 HG3 GLU 99 12.260 7.833 -3.852 775 H VAL 100 H VAL 100 12.489 7.717 -1.916 776 HA VAL 100 HA VAL 100 14.937 7.677 -0.285 777 HB VAL 100 HB VAL 100 14.735 9.673 -1.657 778 HG11 VAL 100 HG11 VAL 100 12.124 10.042 -0.222 779 HG12 VAL 100 HG12 VAL 100 12.421 9.969 -1.958 780 HG13 VAL 100 HG13 VAL 100 12.967 11.363 -1.028 781 HG21 VAL 100 HG21 VAL 100 14.425 10.112 1.302 782 HG22 VAL 100 HG22 VAL 100 14.924 11.368 0.171 783 HG23 VAL 100 HG23 VAL 100 15.924 9.932 0.391 784 H LEU 101 H LEU 101 11.446 8.124 -0.041 785 HA LEU 101 HA LEU 101 11.358 8.663 2.729 786 HB2 LEU 101 HB2 LEU 101 9.573 8.913 0.814 787 HB3 LEU 101 HB3 LEU 101 9.100 7.305 1.330 788 HG LEU 101 HG LEU 101 7.687 8.928 2.403 789 HD11 LEU 101 HD11 LEU 101 9.619 8.053 4.536 790 HD12 LEU 101 HD12 LEU 101 8.618 6.893 3.663 791 HD13 LEU 101 HD13 LEU 101 7.860 8.172 4.612 792 HD21 LEU 101 HD21 LEU 101 8.423 10.941 2.979 793 HD22 LEU 101 HD22 LEU 101 10.055 10.475 2.504 794 HD23 LEU 101 HD23 LEU 101 9.518 10.229 4.164 795 H PHE 102 H PHE 102 10.259 5.694 1.097 796 HA PHE 102 HA PHE 102 9.894 4.137 3.347 797 HB2 PHE 102 HB2 PHE 102 10.461 3.408 0.491 798 HB3 PHE 102 HB3 PHE 102 10.130 2.207 1.721 799 HD1 PHE 102 HD1 PHE 102 8.422 5.355 2.057 800 HD2 PHE 102 HD2 PHE 102 8.198 1.479 0.296 801 HE1 PHE 102 HE1 PHE 102 6.020 5.665 1.686 802 HE2 PHE 102 HE2 PHE 102 5.773 1.782 -0.056 803 HZ PHE 102 HZ PHE 102 4.688 3.879 0.639 804 HA PRO 103 HA PRO 103 14.573 2.477 2.175 805 HB2 PRO 103 HB2 PRO 103 15.463 5.286 2.687 806 HB3 PRO 103 HB3 PRO 103 16.227 4.025 1.724 807 HG2 PRO 103 HG2 PRO 103 14.811 5.943 0.560 808 HG3 PRO 103 HG3 PRO 103 14.742 4.277 -0.040 809 HD2 PRO 103 HD2 PRO 103 12.712 5.832 1.439 810 HD3 PRO 103 HD3 PRO 103 12.513 4.467 0.342 811 H GLN 104 H GLN 104 13.646 4.967 4.560 812 HA GLN 104 HA GLN 104 15.524 4.529 6.505 813 HB2 GLN 104 HB2 GLN 104 12.829 4.751 7.646 814 HB3 GLN 104 HB3 GLN 104 14.266 5.706 7.947 815 HG2 GLN 104 HG2 GLN 104 13.873 6.872 5.789 816 HG3 GLN 104 HG3 GLN 104 12.356 5.994 5.661 817 HE21 GLN 104 HE21 GLN 104 10.635 7.061 6.357 818 HE22 GLN 104 HE22 GLN 104 10.628 8.297 7.560 819 H LYS 105 H LYS 105 12.934 2.355 5.641 820 HA LYS 105 HA LYS 105 13.856 0.535 7.758 821 HB2 LYS 105 HB2 LYS 105 11.123 0.010 6.880 822 HB3 LYS 105 HB3 LYS 105 11.780 0.124 8.502 823 HG2 LYS 105 HG2 LYS 105 10.146 1.819 8.352 824 HG3 LYS 105 HG3 LYS 105 11.704 2.638 8.211 825 HD2 LYS 105 HD2 LYS 105 11.063 2.006 5.607 826 HD3 LYS 105 HD3 LYS 105 9.513 2.450 6.317 827 HE2 LYS 105 HE2 LYS 105 11.067 4.395 7.323 828 HE3 LYS 105 HE3 LYS 105 11.906 4.089 5.805 829 HZ1 LYS 105 HZ1 LYS 105 9.340 5.308 6.286 830 HZ2 LYS 105 HZ2 LYS 105 9.350 4.181 5.028 831 HZ3 LYS 105 HZ3 LYS 105 10.403 5.499 4.985 832 H ASN 106 H ASN 106 14.101 0.916 4.562 833 HA ASN 106 HA ASN 106 14.457 -0.431 2.775 834 HB2 ASN 106 HB2 ASN 106 15.971 -1.583 4.369 835 HB3 ASN 106 HB3 ASN 106 14.653 -2.668 4.803 836 HD21 ASN 106 HD21 ASN 106 16.398 -1.444 1.981 837 HD22 ASN 106 HD22 ASN 106 16.417 -2.941 1.133 838 H VAL 107 H VAL 107 12.536 -0.215 1.791 839 HA VAL 107 HA VAL 107 10.324 -1.979 2.516 840 HB VAL 107 HB VAL 107 10.148 0.560 2.225 841 HG11 VAL 107 HG11 VAL 107 9.471 -0.061 -0.605 842 HG12 VAL 107 HG12 VAL 107 11.170 0.167 -0.198 843 HG13 VAL 107 HG13 VAL 107 10.014 1.453 0.111 844 HG21 VAL 107 HG21 VAL 107 7.822 0.277 1.523 845 HG22 VAL 107 HG22 VAL 107 8.306 -0.951 2.686 846 HG23 VAL 107 HG23 VAL 107 8.192 -1.353 0.973 847 H ARG 108 H ARG 108 9.146 -3.127 1.125 848 HA ARG 108 HA ARG 108 10.271 -3.685 -1.517 849 HB2 ARG 108 HB2 ARG 108 10.065 -5.495 0.636 850 HB3 ARG 108 HB3 ARG 108 8.761 -5.911 -0.466 851 HG2 ARG 108 HG2 ARG 108 10.263 -7.095 -1.598 852 HG3 ARG 108 HG3 ARG 108 10.940 -5.558 -2.130 853 HD2 ARG 108 HD2 ARG 108 12.639 -5.614 -0.568 854 HD3 ARG 108 HD3 ARG 108 11.763 -6.703 0.502 855 HE ARG 108 HE ARG 108 12.221 -8.478 -1.143 856 HH11 ARG 108 HH11 ARG 108 14.263 -5.621 -1.209 857 HH12 ARG 108 HH12 ARG 108 15.596 -6.450 -1.931 858 HH21 ARG 108 HH21 ARG 108 13.992 -9.548 -2.089 859 HH22 ARG 108 HH22 ARG 108 15.445 -8.670 -2.430 860 H PHE 109 H PHE 109 8.897 -2.312 -2.550 861 HA PHE 109 HA PHE 109 6.101 -2.244 -1.943 862 HB2 PHE 109 HB2 PHE 109 7.751 -0.420 -2.948 863 HB3 PHE 109 HB3 PHE 109 7.148 -1.069 -4.463 864 HD1 PHE 109 HD1 PHE 109 4.587 -1.169 -4.749 865 HD2 PHE 109 HD2 PHE 109 6.563 1.165 -1.800 866 HE1 PHE 109 HE1 PHE 109 2.594 0.253 -4.565 867 HE2 PHE 109 HE2 PHE 109 4.579 2.608 -1.593 868 HZ PHE 109 HZ PHE 109 2.582 2.148 -2.977 869 H LEU 110 H LEU 110 4.379 -2.927 -3.250 870 HA LEU 110 HA LEU 110 5.048 -4.649 -5.526 871 HB2 LEU 110 HB2 LEU 110 4.735 -6.211 -3.818 872 HB3 LEU 110 HB3 LEU 110 3.374 -5.352 -3.135 873 HG LEU 110 HG LEU 110 2.925 -7.558 -4.358 874 HD11 LEU 110 HD11 LEU 110 1.341 -5.497 -3.827 875 HD12 LEU 110 HD12 LEU 110 0.789 -6.921 -4.705 876 HD13 LEU 110 HD13 LEU 110 1.241 -5.463 -5.587 877 HD21 LEU 110 HD21 LEU 110 4.290 -6.278 -6.415 878 HD22 LEU 110 HD22 LEU 110 2.599 -6.263 -6.915 879 HD23 LEU 110 HD23 LEU 110 3.387 -7.788 -6.514 880 H ALA 111 H ALA 111 3.936 -4.273 -7.240 881 HA ALA 111 HA ALA 111 1.321 -2.918 -7.080 882 HB1 ALA 111 HB1 ALA 111 1.931 -1.824 -9.271 883 HB2 ALA 111 HB2 ALA 111 3.585 -2.374 -9.003 884 HB3 ALA 111 HB3 ALA 111 2.835 -1.248 -7.866 885 H ILE 112 H ILE 112 0.109 -4.697 -7.339 886 HA ILE 112 HA ILE 112 0.776 -6.909 -8.876 887 HB ILE 112 HB ILE 112 -1.817 -5.940 -7.756 888 HG12 ILE 112 HG12 ILE 112 -0.574 -8.566 -7.166 889 HG13 ILE 112 HG13 ILE 112 0.297 -7.142 -6.628 890 HG21 ILE 112 HG21 ILE 112 -2.954 -7.126 -9.275 891 HG22 ILE 112 HG22 ILE 112 -2.319 -8.547 -8.450 892 HG23 ILE 112 HG23 ILE 112 -1.500 -7.918 -9.878 893 HD11 ILE 112 HD11 ILE 112 -2.483 -6.959 -5.928 894 HD12 ILE 112 HD12 ILE 112 -1.050 -6.889 -4.906 895 HD13 ILE 112 HD13 ILE 112 -1.764 -8.451 -5.314 896 H ASN 113 H ASN 113 -1.604 -4.387 -9.856 897 HA ASN 113 HA ASN 113 -2.077 -5.526 -12.389 898 HB2 ASN 113 HB2 ASN 113 -3.323 -3.624 -11.000 899 HB3 ASN 113 HB3 ASN 113 -2.387 -2.588 -12.071 900 HD21 ASN 113 HD21 ASN 113 -5.322 -3.386 -11.793 901 HD22 ASN 113 HD22 ASN 113 -5.791 -3.770 -13.410 902 H ASN 114 H ASN 114 0.007 -2.743 -11.525 903 HA ASN 114 HA ASN 114 1.256 -2.992 -14.186 904 HB2 ASN 114 HB2 ASN 114 0.288 -0.726 -12.695 905 HB3 ASN 114 HB3 ASN 114 1.999 -0.536 -13.056 906 HD21 ASN 114 HD21 ASN 114 2.535 -1.194 -15.411 907 HD22 ASN 114 HD22 ASN 114 1.476 -0.547 -16.610 908 H SER 115 H SER 115 3.537 -2.714 -14.384 909 HA SER 115 HA SER 115 5.062 -4.053 -12.440 910 HB2 SER 115 HB2 SER 115 5.493 -3.418 -15.037 911 HB3 SER 115 HB3 SER 115 6.519 -2.218 -14.255 912 HG SER 115 HG SER 115 6.876 -4.903 -14.515 913 H ILE 116 H ILE 116 5.377 -3.309 -10.474 914 HA ILE 116 HA ILE 116 5.130 -0.787 -9.479 915 HB ILE 116 HB ILE 116 5.658 -3.166 -8.380 916 HG12 ILE 116 HG12 ILE 116 4.656 -1.066 -7.376 917 HG13 ILE 116 HG13 ILE 116 5.567 -2.084 -6.269 918 HG21 ILE 116 HG21 ILE 116 8.214 -1.634 -7.955 919 HG22 ILE 116 HG22 ILE 116 8.053 -3.050 -8.995 920 HG23 ILE 116 HG23 ILE 116 7.781 -3.192 -7.256 921 HD11 ILE 116 HD11 ILE 116 6.449 0.496 -7.526 922 HD12 ILE 116 HD12 ILE 116 7.513 -0.562 -6.602 923 HD13 ILE 116 HD13 ILE 116 6.119 0.184 -5.824 924 H ASP 117 H ASP 117 8.048 -2.171 -10.903 925 HA ASP 117 HA ASP 117 9.142 0.344 -11.574 926 HB2 ASP 117 HB2 ASP 117 9.544 -0.260 -8.900 927 HB3 ASP 117 HB3 ASP 117 11.043 -0.786 -9.658 928 H SER 118 H SER 118 9.714 -3.063 -10.849 929 HA SER 118 HA SER 118 12.088 -3.496 -12.159 930 HB2 SER 118 HB2 SER 118 10.715 -5.123 -10.745 931 HB3 SER 118 HB3 SER 118 9.831 -5.484 -12.226 932 HG SER 118 HG SER 118 12.544 -5.953 -11.620 933 H ASN 119 H ASN 119 12.533 -4.533 -14.233 934 HA ASN 119 HA ASN 119 11.212 -3.190 -16.392 935 HB2 ASN 119 HB2 ASN 119 13.733 -4.258 -15.994 936 HB3 ASN 119 HB3 ASN 119 13.010 -5.364 -17.163 937 HD21 ASN 119 HD21 ASN 119 13.326 -1.899 -16.511 938 HD22 ASN 119 HD22 ASN 119 13.604 -1.450 -18.149 939 H ASN 120 H ASN 120 11.482 -5.288 -18.369 940 HA ASN 120 HA ASN 120 10.284 -6.876 -19.403 941 HB2 ASN 120 HB2 ASN 120 11.108 -8.255 -17.520 942 HB3 ASN 120 HB3 ASN 120 9.650 -7.855 -16.628 943 HD21 ASN 120 HD21 ASN 120 8.020 -9.234 -16.780 944 HD22 ASN 120 HD22 ASN 120 7.806 -10.409 -18.027 Start of MODEL 10 1 H1 GLY 1 H1 GLY 1 9.436 -5.725 28.032 2 H2 GLY 1 H2 GLY 1 7.855 -5.865 27.451 3 H3 GLY 1 H3 GLY 1 8.525 -4.336 27.715 4 HA2 GLY 1 HA2 GLY 1 10.210 -4.812 25.989 5 HA3 GLY 1 HA3 GLY 1 9.348 -6.305 25.655 6 H SER 2 H SER 2 9.880 -3.646 24.171 7 HA SER 2 HA SER 2 7.149 -3.405 23.134 8 HB2 SER 2 HB2 SER 2 8.270 -1.443 24.715 9 HB3 SER 2 HB3 SER 2 8.611 -0.867 23.085 10 HG SER 2 HG SER 2 6.492 -0.317 24.134 11 H ARG 3 H ARG 3 10.353 -1.943 22.478 12 HA ARG 3 HA ARG 3 10.005 -1.967 19.669 13 HB2 ARG 3 HB2 ARG 3 11.756 -0.759 21.381 14 HB3 ARG 3 HB3 ARG 3 12.780 -1.987 20.652 15 HG2 ARG 3 HG2 ARG 3 11.134 -0.452 18.763 16 HG3 ARG 3 HG3 ARG 3 12.367 0.473 19.619 17 HD2 ARG 3 HD2 ARG 3 13.652 -1.872 18.854 18 HD3 ARG 3 HD3 ARG 3 12.649 -1.446 17.471 19 HE ARG 3 HE ARG 3 13.903 0.484 17.166 20 HH11 ARG 3 HH11 ARG 3 14.950 -1.202 20.051 21 HH12 ARG 3 HH12 ARG 3 16.413 -0.290 20.199 22 HH21 ARG 3 HH21 ARG 3 15.829 1.679 17.367 23 HH22 ARG 3 HH22 ARG 3 16.912 1.346 18.677 24 H THR 4 H THR 4 9.671 -3.873 18.667 25 HA THR 4 HA THR 4 11.852 -5.717 18.450 26 HB THR 4 HB THR 4 10.021 -7.623 19.056 27 HG1 THR 4 HG1 THR 4 9.633 -5.640 21.038 28 HG21 THR 4 HG21 THR 4 11.557 -6.538 21.350 29 HG22 THR 4 HG22 THR 4 12.433 -7.141 19.945 30 HG23 THR 4 HG23 THR 4 11.332 -8.204 20.819 31 H SER 5 H SER 5 8.351 -5.299 17.860 32 HA SER 5 HA SER 5 8.791 -6.348 15.136 33 HB2 SER 5 HB2 SER 5 6.315 -6.626 16.846 34 HB3 SER 5 HB3 SER 5 6.476 -7.180 15.179 35 HG SER 5 HG SER 5 6.854 -8.790 16.872 36 H ARG 6 H ARG 6 8.328 -5.056 13.517 37 HA ARG 6 HA ARG 6 6.868 -2.571 14.035 38 HB2 ARG 6 HB2 ARG 6 7.744 -2.123 11.584 39 HB3 ARG 6 HB3 ARG 6 8.768 -1.886 12.970 40 HG2 ARG 6 HG2 ARG 6 10.076 -2.981 11.368 41 HG3 ARG 6 HG3 ARG 6 9.657 -4.196 12.566 42 HD2 ARG 6 HD2 ARG 6 7.926 -3.869 10.164 43 HD3 ARG 6 HD3 ARG 6 9.467 -4.707 10.000 44 HE ARG 6 HE ARG 6 7.095 -5.687 11.261 45 HH11 ARG 6 HH11 ARG 6 10.589 -5.898 11.300 46 HH12 ARG 6 HH12 ARG 6 10.607 -7.504 11.942 47 HH21 ARG 6 HH21 ARG 6 7.127 -7.805 12.102 48 HH22 ARG 6 HH22 ARG 6 8.642 -8.588 12.393 49 H ILE 7 H ILE 7 6.354 -2.766 10.805 50 HA ILE 7 HA ILE 7 4.297 -4.786 10.918 51 HB ILE 7 HB ILE 7 2.421 -3.500 10.675 52 HG12 ILE 7 HG12 ILE 7 3.340 -0.779 10.602 53 HG13 ILE 7 HG13 ILE 7 4.072 -1.688 9.286 54 HG21 ILE 7 HG21 ILE 7 4.164 -1.991 12.600 55 HG22 ILE 7 HG22 ILE 7 3.164 -3.400 12.954 56 HG23 ILE 7 HG23 ILE 7 2.407 -1.868 12.522 57 HD11 ILE 7 HD11 ILE 7 1.344 -2.399 9.345 58 HD12 ILE 7 HD12 ILE 7 2.200 -1.448 8.130 59 HD13 ILE 7 HD13 ILE 7 1.429 -0.644 9.496 60 H THR 8 H THR 8 2.832 -4.713 8.945 61 HA THR 8 HA THR 8 4.417 -4.243 6.495 62 HB THR 8 HB THR 8 2.459 -6.431 7.256 63 HG1 THR 8 HG1 THR 8 4.223 -7.542 7.270 64 HG21 THR 8 HG21 THR 8 3.500 -6.334 4.477 65 HG22 THR 8 HG22 THR 8 2.081 -5.366 4.872 66 HG23 THR 8 HG23 THR 8 2.057 -7.111 5.125 67 H ALA 9 H ALA 9 3.286 -3.160 4.725 68 HA ALA 9 HA ALA 9 0.759 -1.979 5.664 69 HB1 ALA 9 HB1 ALA 9 1.194 -0.133 4.109 70 HB2 ALA 9 HB2 ALA 9 2.727 -0.890 3.673 71 HB3 ALA 9 HB3 ALA 9 2.454 -0.329 5.322 72 H LEU 10 H LEU 10 -1.004 -2.654 4.858 73 HA LEU 10 HA LEU 10 -1.108 -3.631 2.076 74 HB2 LEU 10 HB2 LEU 10 -1.641 -5.146 4.119 75 HB3 LEU 10 HB3 LEU 10 -3.131 -4.237 4.212 76 HG LEU 10 HG LEU 10 -2.544 -5.337 1.554 77 HD11 LEU 10 HD11 LEU 10 -3.074 -7.612 2.122 78 HD12 LEU 10 HD12 LEU 10 -3.251 -7.189 3.825 79 HD13 LEU 10 HD13 LEU 10 -1.666 -7.110 3.058 80 HD21 LEU 10 HD21 LEU 10 -4.804 -4.766 3.339 81 HD22 LEU 10 HD22 LEU 10 -4.996 -6.182 2.301 82 HD23 LEU 10 HD23 LEU 10 -4.667 -4.600 1.591 83 H TYR 11 H TYR 11 -1.725 -1.829 0.932 84 HA TYR 11 HA TYR 11 -4.060 -0.369 1.958 85 HB2 TYR 11 HB2 TYR 11 -2.114 1.016 2.104 86 HB3 TYR 11 HB3 TYR 11 -1.693 0.702 0.440 87 HD1 TYR 11 HD1 TYR 11 -3.385 1.540 -1.353 88 HD2 TYR 11 HD2 TYR 11 -3.341 2.876 2.681 89 HE1 TYR 11 HE1 TYR 11 -4.589 3.576 -2.019 90 HE2 TYR 11 HE2 TYR 11 -4.550 4.906 2.026 91 HH TYR 11 HH TYR 11 -6.238 5.427 -0.168 92 H GLU 12 H GLU 12 -5.870 -0.286 0.730 93 HA GLU 12 HA GLU 12 -5.619 -0.712 -2.162 94 HB2 GLU 12 HB2 GLU 12 -6.031 -2.885 -0.799 95 HB3 GLU 12 HB3 GLU 12 -7.671 -2.277 -0.648 96 HG2 GLU 12 HG2 GLU 12 -8.176 -3.053 -2.647 97 HG3 GLU 12 HG3 GLU 12 -6.888 -2.099 -3.375 98 H ARG 13 H ARG 13 -7.709 -0.416 -3.341 99 HA ARG 13 HA ARG 13 -9.754 1.134 -2.022 100 HB2 ARG 13 HB2 ARG 13 -8.990 3.144 -2.608 101 HB3 ARG 13 HB3 ARG 13 -7.651 2.442 -3.490 102 HG2 ARG 13 HG2 ARG 13 -8.979 2.309 -5.491 103 HG3 ARG 13 HG3 ARG 13 -10.407 2.864 -4.615 104 HD2 ARG 13 HD2 ARG 13 -9.740 5.015 -4.623 105 HD3 ARG 13 HD3 ARG 13 -8.046 4.598 -4.383 106 HE ARG 13 HE ARG 13 -9.278 5.250 -6.823 107 HH11 ARG 13 HH11 ARG 13 -6.959 2.952 -5.533 108 HH12 ARG 13 HH12 ARG 13 -6.084 2.811 -7.020 109 HH21 ARG 13 HH21 ARG 13 -8.120 5.060 -8.772 110 HH22 ARG 13 HH22 ARG 13 -6.743 4.016 -8.857 111 H LEU 14 H LEU 14 -11.689 0.628 -2.806 112 HA LEU 14 HA LEU 14 -11.854 -0.564 -5.493 113 HB2 LEU 14 HB2 LEU 14 -12.260 -2.462 -4.288 114 HB3 LEU 14 HB3 LEU 14 -12.749 -1.573 -2.867 115 HG LEU 14 HG LEU 14 -14.451 -3.086 -4.043 116 HD11 LEU 14 HD11 LEU 14 -15.730 -0.483 -3.690 117 HD12 LEU 14 HD12 LEU 14 -14.691 -1.000 -2.362 118 HD13 LEU 14 HD13 LEU 14 -16.028 -2.023 -2.886 119 HD21 LEU 14 HD21 LEU 14 -13.902 -1.748 -6.281 120 HD22 LEU 14 HD22 LEU 14 -15.240 -0.766 -5.685 121 HD23 LEU 14 HD23 LEU 14 -15.470 -2.486 -5.964 122 H SER 15 H SER 15 -13.257 0.349 -6.833 123 HA SER 15 HA SER 15 -15.202 2.274 -5.749 124 HB2 SER 15 HB2 SER 15 -13.614 3.333 -7.240 125 HB3 SER 15 HB3 SER 15 -13.905 2.114 -8.480 126 HG SER 15 HG SER 15 -15.674 3.117 -9.055 127 H ARG 16 H ARG 16 -17.262 1.670 -5.777 128 HA ARG 16 HA ARG 16 -18.103 -0.676 -7.215 129 HB2 ARG 16 HB2 ARG 16 -19.004 0.760 -4.949 130 HB3 ARG 16 HB3 ARG 16 -20.325 0.722 -6.106 131 HG2 ARG 16 HG2 ARG 16 -20.501 -1.162 -4.629 132 HG3 ARG 16 HG3 ARG 16 -20.092 -1.727 -6.250 133 HD2 ARG 16 HD2 ARG 16 -18.283 -2.744 -5.458 134 HD3 ARG 16 HD3 ARG 16 -17.674 -1.211 -4.839 135 HE ARG 16 HE ARG 16 -18.317 -1.840 -2.741 136 HH11 ARG 16 HH11 ARG 16 -19.921 -3.926 -5.050 137 HH12 ARG 16 HH12 ARG 16 -20.533 -4.998 -3.838 138 HH21 ARG 16 HH21 ARG 16 -19.135 -3.255 -1.154 139 HH22 ARG 16 HH22 ARG 16 -20.085 -4.620 -1.631 140 H ASP 17 H ASP 17 -17.876 2.575 -8.044 141 HA ASP 17 HA ASP 17 -20.228 2.811 -9.651 142 HB2 ASP 17 HB2 ASP 17 -17.660 4.409 -9.685 143 HB3 ASP 17 HB3 ASP 17 -19.136 4.844 -10.542 144 H ASP 18 H ASP 18 -17.250 1.212 -10.060 145 HA ASP 18 HA ASP 18 -17.082 1.425 -12.912 146 HB2 ASP 18 HB2 ASP 18 -15.681 -0.183 -10.810 147 HB3 ASP 18 HB3 ASP 18 -15.434 -0.543 -12.519 148 H ASP 19 H ASP 19 -17.141 -0.501 -14.332 149 HA ASP 19 HA ASP 19 -19.584 -1.979 -13.893 150 HB2 ASP 19 HB2 ASP 19 -18.260 -0.937 -16.137 151 HB3 ASP 19 HB3 ASP 19 -18.210 -2.685 -16.329 152 H LEU 20 H LEU 20 -16.834 -2.627 -12.558 153 HA LEU 20 HA LEU 20 -16.255 -5.267 -13.550 154 HB2 LEU 20 HB2 LEU 20 -15.041 -4.971 -11.024 155 HB3 LEU 20 HB3 LEU 20 -14.290 -4.887 -12.599 156 HG LEU 20 HG LEU 20 -15.003 -2.387 -12.554 157 HD11 LEU 20 HD11 LEU 20 -16.360 -2.103 -10.721 158 HD12 LEU 20 HD12 LEU 20 -14.797 -1.640 -10.051 159 HD13 LEU 20 HD13 LEU 20 -15.450 -3.242 -9.733 160 HD21 LEU 20 HD21 LEU 20 -12.942 -1.983 -10.968 161 HD22 LEU 20 HD22 LEU 20 -12.741 -2.689 -12.571 162 HD23 LEU 20 HD23 LEU 20 -12.754 -3.727 -11.147 163 H THR 21 H THR 21 -16.681 -4.558 -10.106 164 HA THR 21 HA THR 21 -17.878 -5.511 -8.460 165 HB THR 21 HB THR 21 -20.112 -5.973 -8.776 166 HG1 THR 21 HG1 THR 21 -19.465 -6.972 -11.347 167 HG21 THR 21 HG21 THR 21 -19.794 -4.632 -11.417 168 HG22 THR 21 HG22 THR 21 -19.384 -3.777 -9.930 169 HG23 THR 21 HG23 THR 21 -21.019 -4.393 -10.172 170 H GLY 22 H GLY 22 -17.500 -7.262 -7.282 171 HA2 GLY 22 HA2 GLY 22 -17.824 -9.846 -7.521 172 HA3 GLY 22 HA3 GLY 22 -16.501 -9.655 -8.657 173 H GLU 23 H GLU 23 -15.141 -10.995 -7.397 174 HA GLU 23 HA GLU 23 -14.580 -10.561 -4.656 175 HB2 GLU 23 HB2 GLU 23 -14.080 -12.688 -5.715 176 HB3 GLU 23 HB3 GLU 23 -12.917 -11.913 -6.782 177 HG2 GLU 23 HG2 GLU 23 -11.707 -13.009 -5.051 178 HG3 GLU 23 HG3 GLU 23 -11.596 -11.271 -4.774 179 H SER 24 H SER 24 -13.334 -9.112 -7.570 180 HA SER 24 HA SER 24 -11.130 -7.858 -6.157 181 HB2 SER 24 HB2 SER 24 -12.003 -7.880 -9.041 182 HB3 SER 24 HB3 SER 24 -10.730 -6.807 -8.460 183 HG SER 24 HG SER 24 -10.378 -9.215 -9.249 184 H ASN 25 H ASN 25 -14.314 -7.190 -6.115 185 HA ASN 25 HA ASN 25 -13.817 -4.340 -5.761 186 HB2 ASN 25 HB2 ASN 25 -16.211 -5.059 -7.396 187 HB3 ASN 25 HB3 ASN 25 -15.278 -3.568 -7.376 188 HD21 ASN 25 HD21 ASN 25 -15.300 -6.902 -8.460 189 HD22 ASN 25 HD22 ASN 25 -14.185 -6.682 -9.758 190 H SER 26 H SER 26 -14.214 -4.818 -3.504 191 HA SER 26 HA SER 26 -16.870 -4.293 -2.696 192 HB2 SER 26 HB2 SER 26 -16.022 -7.127 -2.699 193 HB3 SER 26 HB3 SER 26 -16.924 -6.565 -1.303 194 HG SER 26 HG SER 26 -18.668 -6.394 -2.484 195 H ILE 27 H ILE 27 -14.007 -3.544 -2.132 196 HA ILE 27 HA ILE 27 -12.750 -2.823 -0.403 197 HB ILE 27 HB ILE 27 -15.438 -2.978 0.868 198 HG12 ILE 27 HG12 ILE 27 -15.147 -1.115 -0.597 199 HG13 ILE 27 HG13 ILE 27 -15.035 -0.481 1.038 200 HG21 ILE 27 HG21 ILE 27 -14.512 -3.184 2.896 201 HG22 ILE 27 HG22 ILE 27 -13.980 -1.519 2.675 202 HG23 ILE 27 HG23 ILE 27 -12.892 -2.849 2.288 203 HD11 ILE 27 HD11 ILE 27 -13.338 0.608 -0.094 204 HD12 ILE 27 HD12 ILE 27 -12.870 -0.838 -0.994 205 HD13 ILE 27 HD13 ILE 27 -12.496 -0.710 0.724 206 H THR 28 H THR 28 -14.753 -4.930 1.672 207 HA THR 28 HA THR 28 -12.604 -6.119 2.983 208 HB THR 28 HB THR 28 -15.362 -6.265 3.162 209 HG1 THR 28 HG1 THR 28 -13.476 -7.861 4.549 210 HG21 THR 28 HG21 THR 28 -15.392 -8.198 1.632 211 HG22 THR 28 HG22 THR 28 -15.970 -8.575 3.255 212 HG23 THR 28 HG23 THR 28 -14.348 -9.059 2.760 213 H ASN 29 H ASN 29 -14.126 -6.956 -0.060 214 HA ASN 29 HA ASN 29 -13.001 -9.520 -0.367 215 HB2 ASN 29 HB2 ASN 29 -14.006 -7.521 -2.397 216 HB3 ASN 29 HB3 ASN 29 -13.485 -9.146 -2.809 217 HD21 ASN 29 HD21 ASN 29 -15.659 -9.383 -3.634 218 HD22 ASN 29 HD22 ASN 29 -16.933 -9.805 -2.548 219 H GLN 30 H GLN 30 -11.892 -6.312 -1.617 220 HA GLN 30 HA GLN 30 -9.565 -7.390 -2.818 221 HB2 GLN 30 HB2 GLN 30 -8.968 -4.746 -1.872 222 HB3 GLN 30 HB3 GLN 30 -9.116 -5.324 -3.514 223 HG2 GLN 30 HG2 GLN 30 -11.004 -4.218 -3.798 224 HG3 GLN 30 HG3 GLN 30 -11.710 -4.882 -2.330 225 HE21 GLN 30 HE21 GLN 30 -10.957 -3.922 -0.298 226 HE22 GLN 30 HE22 GLN 30 -10.705 -2.225 -0.258 227 H LYS 31 H LYS 31 -10.256 -6.244 0.457 228 HA LYS 31 HA LYS 31 -7.717 -6.143 1.530 229 HB2 LYS 31 HB2 LYS 31 -10.130 -7.332 2.917 230 HB3 LYS 31 HB3 LYS 31 -8.699 -6.659 3.684 231 HG2 LYS 31 HG2 LYS 31 -9.527 -4.556 2.190 232 HG3 LYS 31 HG3 LYS 31 -11.061 -5.314 2.614 233 HD2 LYS 31 HD2 LYS 31 -9.389 -5.296 4.913 234 HD3 LYS 31 HD3 LYS 31 -9.404 -3.676 4.222 235 HE2 LYS 31 HE2 LYS 31 -12.046 -4.853 4.265 236 HE3 LYS 31 HE3 LYS 31 -11.320 -4.821 5.869 237 HZ1 LYS 31 HZ1 LYS 31 -11.981 -2.718 5.957 238 HZ2 LYS 31 HZ2 LYS 31 -12.353 -2.666 4.311 239 HZ3 LYS 31 HZ3 LYS 31 -10.775 -2.354 4.829 240 H LYS 32 H LYS 32 -9.877 -8.934 1.254 241 HA LYS 32 HA LYS 32 -8.167 -10.928 2.188 242 HB2 LYS 32 HB2 LYS 32 -10.583 -10.829 0.481 243 HB3 LYS 32 HB3 LYS 32 -9.594 -12.272 0.323 244 HG2 LYS 32 HG2 LYS 32 -10.004 -12.956 2.481 245 HG3 LYS 32 HG3 LYS 32 -10.380 -11.326 3.039 246 HD2 LYS 32 HD2 LYS 32 -12.298 -13.060 2.731 247 HD3 LYS 32 HD3 LYS 32 -12.534 -11.394 2.206 248 HE2 LYS 32 HE2 LYS 32 -12.496 -11.942 -0.010 249 HE3 LYS 32 HE3 LYS 32 -11.415 -13.312 0.235 250 HZ1 LYS 32 HZ1 LYS 32 -13.326 -14.487 1.269 251 HZ2 LYS 32 HZ2 LYS 32 -13.542 -14.141 -0.372 252 HZ3 LYS 32 HZ3 LYS 32 -14.325 -13.206 0.798 253 H TYR 33 H TYR 33 -8.438 -9.453 -1.017 254 HA TYR 33 HA TYR 33 -6.931 -11.222 -2.543 255 HB2 TYR 33 HB2 TYR 33 -8.184 -9.169 -3.365 256 HB3 TYR 33 HB3 TYR 33 -6.817 -8.215 -2.825 257 HD1 TYR 33 HD1 TYR 33 -7.795 -10.909 -5.183 258 HD2 TYR 33 HD2 TYR 33 -4.884 -7.994 -4.133 259 HE1 TYR 33 HE1 TYR 33 -6.624 -11.306 -7.309 260 HE2 TYR 33 HE2 TYR 33 -3.704 -8.389 -6.218 261 HH TYR 33 HH TYR 33 -4.578 -9.341 -8.673 262 H LEU 34 H LEU 34 -5.641 -8.138 -1.237 263 HA LEU 34 HA LEU 34 -2.952 -8.758 -1.689 264 HB2 LEU 34 HB2 LEU 34 -4.324 -6.913 0.251 265 HB3 LEU 34 HB3 LEU 34 -2.592 -7.104 0.273 266 HG LEU 34 HG LEU 34 -2.289 -5.841 -1.573 267 HD11 LEU 34 HD11 LEU 34 -3.368 -7.492 -3.037 268 HD12 LEU 34 HD12 LEU 34 -3.665 -5.826 -3.532 269 HD13 LEU 34 HD13 LEU 34 -4.923 -6.734 -2.694 270 HD21 LEU 34 HD21 LEU 34 -3.743 -3.998 -1.647 271 HD22 LEU 34 HD22 LEU 34 -3.797 -4.594 0.013 272 HD23 LEU 34 HD23 LEU 34 -5.110 -4.970 -1.105 273 H GLU 35 H GLU 35 -5.127 -9.524 0.986 274 HA GLU 35 HA GLU 35 -3.270 -10.409 2.854 275 HB2 GLU 35 HB2 GLU 35 -6.053 -10.420 2.646 276 HB3 GLU 35 HB3 GLU 35 -5.611 -12.115 2.801 277 HG2 GLU 35 HG2 GLU 35 -4.068 -10.805 4.704 278 HG3 GLU 35 HG3 GLU 35 -5.644 -10.028 4.790 279 H ASP 36 H ASP 36 -4.965 -12.198 0.314 280 HA ASP 36 HA ASP 36 -3.836 -14.709 0.583 281 HB2 ASP 36 HB2 ASP 36 -5.617 -13.710 -1.103 282 HB3 ASP 36 HB3 ASP 36 -4.215 -13.581 -2.155 283 H TYR 37 H TYR 37 -2.510 -11.781 -0.791 284 HA TYR 37 HA TYR 37 -0.214 -13.029 -1.974 285 HB2 TYR 37 HB2 TYR 37 -0.906 -10.963 -2.937 286 HB3 TYR 37 HB3 TYR 37 -0.927 -10.157 -1.382 287 HD1 TYR 37 HD1 TYR 37 1.215 -9.624 -0.251 288 HD2 TYR 37 HD2 TYR 37 1.088 -11.085 -4.225 289 HE1 TYR 37 HE1 TYR 37 3.535 -8.877 -0.588 290 HE2 TYR 37 HE2 TYR 37 3.401 -10.335 -4.591 291 HH TYR 37 HH TYR 37 5.481 -9.901 -2.876 292 H ALA 38 H ALA 38 -0.461 -10.697 0.735 293 HA ALA 38 HA ALA 38 2.074 -10.877 1.719 294 HB1 ALA 38 HB1 ALA 38 0.204 -9.416 2.557 295 HB2 ALA 38 HB2 ALA 38 1.283 -10.067 3.785 296 HB3 ALA 38 HB3 ALA 38 -0.308 -10.784 3.539 297 H ARG 39 H ARG 39 -0.529 -13.241 2.204 298 HA ARG 39 HA ARG 39 0.992 -14.729 4.154 299 HB2 ARG 39 HB2 ARG 39 -0.741 -16.497 3.837 300 HB3 ARG 39 HB3 ARG 39 -1.377 -14.932 4.316 301 HG2 ARG 39 HG2 ARG 39 -1.544 -14.736 1.626 302 HG3 ARG 39 HG3 ARG 39 -1.791 -16.472 1.859 303 HD2 ARG 39 HD2 ARG 39 -3.303 -15.215 3.858 304 HD3 ARG 39 HD3 ARG 39 -3.599 -14.297 2.388 305 HE ARG 39 HE ARG 39 -3.842 -17.198 2.235 306 HH11 ARG 39 HH11 ARG 39 -5.448 -14.092 2.417 307 HH12 ARG 39 HH12 ARG 39 -6.960 -14.707 1.847 308 HH21 ARG 39 HH21 ARG 39 -5.844 -17.998 1.494 309 HH22 ARG 39 HH22 ARG 39 -7.187 -16.919 1.327 310 H ARG 40 H ARG 40 0.235 -15.105 0.705 311 HA ARG 40 HA ARG 40 1.710 -17.488 0.333 312 HB2 ARG 40 HB2 ARG 40 1.240 -17.251 -1.919 313 HB3 ARG 40 HB3 ARG 40 -0.038 -16.289 -1.210 314 HG2 ARG 40 HG2 ARG 40 1.253 -14.262 -1.669 315 HG3 ARG 40 HG3 ARG 40 2.520 -15.242 -2.402 316 HD2 ARG 40 HD2 ARG 40 0.980 -16.010 -4.102 317 HD3 ARG 40 HD3 ARG 40 -0.345 -15.142 -3.332 318 HE ARG 40 HE ARG 40 0.382 -13.212 -4.321 319 HH11 ARG 40 HH11 ARG 40 2.944 -15.586 -4.510 320 HH12 ARG 40 HH12 ARG 40 3.905 -14.643 -5.595 321 HH21 ARG 40 HH21 ARG 40 1.652 -11.978 -5.763 322 HH22 ARG 40 HH22 ARG 40 3.177 -12.591 -6.300 323 H ASN 41 H ASN 41 2.662 -14.253 0.863 324 HA ASN 41 HA ASN 41 5.320 -14.627 -0.269 325 HB2 ASN 41 HB2 ASN 41 3.650 -12.300 0.525 326 HB3 ASN 41 HB3 ASN 41 5.391 -12.117 0.630 327 HD21 ASN 41 HD21 ASN 41 2.804 -13.089 -1.555 328 HD22 ASN 41 HD22 ASN 41 3.584 -12.563 -3.001 329 H GLY 42 H GLY 42 3.715 -13.954 2.813 330 HA2 GLY 42 HA2 GLY 42 4.527 -14.922 4.857 331 HA3 GLY 42 HA3 GLY 42 6.150 -14.853 4.202 332 H PHE 43 H PHE 43 3.572 -12.383 4.606 333 HA PHE 43 HA PHE 43 5.567 -10.684 5.964 334 HB2 PHE 43 HB2 PHE 43 3.096 -9.929 4.399 335 HB3 PHE 43 HB3 PHE 43 4.102 -8.781 5.264 336 HD1 PHE 43 HD1 PHE 43 6.742 -9.111 4.638 337 HD2 PHE 43 HD2 PHE 43 3.417 -10.036 2.178 338 HE1 PHE 43 HE1 PHE 43 8.167 -8.912 2.642 339 HE2 PHE 43 HE2 PHE 43 4.811 -9.856 0.186 340 HZ PHE 43 HZ PHE 43 7.203 -9.285 0.406 341 H GLU 44 H GLU 44 5.152 -9.814 7.950 342 HA GLU 44 HA GLU 44 2.794 -10.779 9.372 343 HB2 GLU 44 HB2 GLU 44 5.515 -9.856 10.177 344 HB3 GLU 44 HB3 GLU 44 4.204 -9.875 11.346 345 HG2 GLU 44 HG2 GLU 44 5.727 -11.855 11.250 346 HG3 GLU 44 HG3 GLU 44 4.001 -12.167 11.263 347 H ASN 45 H ASN 45 2.048 -9.368 11.178 348 HA ASN 45 HA ASN 45 0.911 -7.526 11.841 349 HB2 ASN 45 HB2 ASN 45 3.361 -6.209 10.709 350 HB3 ASN 45 HB3 ASN 45 2.219 -5.424 11.794 351 HD21 ASN 45 HD21 ASN 45 5.051 -7.138 11.557 352 HD22 ASN 45 HD22 ASN 45 5.252 -7.571 13.222 353 H ILE 46 H ILE 46 0.500 -8.427 9.027 354 HA ILE 46 HA ILE 46 0.297 -6.444 7.171 355 HB ILE 46 HB ILE 46 -1.556 -8.766 7.616 356 HG12 ILE 46 HG12 ILE 46 0.616 -8.575 5.559 357 HG13 ILE 46 HG13 ILE 46 0.986 -9.083 7.206 358 HG21 ILE 46 HG21 ILE 46 -1.192 -7.579 4.935 359 HG22 ILE 46 HG22 ILE 46 -2.203 -6.694 6.075 360 HG23 ILE 46 HG23 ILE 46 -2.604 -8.356 5.647 361 HD11 ILE 46 HD11 ILE 46 -0.302 -11.024 7.016 362 HD12 ILE 46 HD12 ILE 46 0.549 -10.902 5.479 363 HD13 ILE 46 HD13 ILE 46 -1.149 -10.436 5.586 364 H ARG 47 H ARG 47 -0.388 -4.511 7.784 365 HA ARG 47 HA ARG 47 -2.971 -4.179 9.091 366 HB2 ARG 47 HB2 ARG 47 -0.660 -2.766 9.340 367 HB3 ARG 47 HB3 ARG 47 -1.565 -1.763 8.212 368 HG2 ARG 47 HG2 ARG 47 -3.385 -2.506 10.200 369 HG3 ARG 47 HG3 ARG 47 -1.900 -2.073 11.037 370 HD2 ARG 47 HD2 ARG 47 -1.890 0.088 10.132 371 HD3 ARG 47 HD3 ARG 47 -3.063 -0.348 8.890 372 HE ARG 47 HE ARG 47 -3.634 0.180 11.714 373 HH11 ARG 47 HH11 ARG 47 -4.808 -0.504 8.485 374 HH12 ARG 47 HH12 ARG 47 -6.452 -0.139 8.878 375 HH21 ARG 47 HH21 ARG 47 -5.809 0.645 12.220 376 HH22 ARG 47 HH22 ARG 47 -7.021 0.511 10.991 377 H HIS 48 H HIS 48 -4.791 -3.676 8.089 378 HA HIS 48 HA HIS 48 -4.635 -3.307 5.199 379 HB2 HIS 48 HB2 HIS 48 -6.871 -4.184 7.021 380 HB3 HIS 48 HB3 HIS 48 -7.174 -3.738 5.347 381 HD1 HIS 48 HD1 HIS 48 -7.053 -5.594 3.743 382 HD2 HIS 48 HD2 HIS 48 -4.867 -6.371 7.182 383 HE1 HIS 48 HE1 HIS 48 -6.237 -7.955 3.489 384 HE2 HIS 48 HE2 HIS 48 -4.781 -8.349 5.513 385 H PHE 49 H PHE 49 -4.579 -1.306 4.495 386 HA PHE 49 HA PHE 49 -6.004 0.794 5.939 387 HB2 PHE 49 HB2 PHE 49 -4.011 1.107 3.668 388 HB3 PHE 49 HB3 PHE 49 -4.632 2.378 4.709 389 HD1 PHE 49 HD1 PHE 49 -3.945 2.518 7.043 390 HD2 PHE 49 HD2 PHE 49 -2.225 -0.340 4.399 391 HE1 PHE 49 HE1 PHE 49 -2.104 2.170 8.626 392 HE2 PHE 49 HE2 PHE 49 -0.382 -0.689 5.988 393 HZ PHE 49 HZ PHE 49 -0.320 0.562 8.099 394 H THR 50 H THR 50 -7.973 0.787 5.429 395 HA THR 50 HA THR 50 -9.057 0.029 2.923 396 HB THR 50 HB THR 50 -10.061 -0.429 5.125 397 HG1 THR 50 HG1 THR 50 -11.643 -0.662 3.743 398 HG21 THR 50 HG21 THR 50 -10.426 1.151 6.612 399 HG22 THR 50 HG22 THR 50 -11.577 1.915 5.518 400 HG23 THR 50 HG23 THR 50 -9.875 2.380 5.475 401 H ASP 51 H ASP 51 -10.505 1.110 1.616 402 HA ASP 51 HA ASP 51 -9.979 3.986 1.360 403 HB2 ASP 51 HB2 ASP 51 -9.332 3.468 -0.737 404 HB3 ASP 51 HB3 ASP 51 -9.870 1.818 -0.542 405 H ASP 52 H ASP 52 -11.685 5.393 0.910 406 HA ASP 52 HA ASP 52 -14.345 4.409 0.556 407 HB2 ASP 52 HB2 ASP 52 -14.182 4.014 2.943 408 HB3 ASP 52 HB3 ASP 52 -13.599 5.652 3.212 409 H GLY 53 H GLY 53 -14.920 5.758 -1.001 410 HA2 GLY 53 HA2 GLY 53 -15.215 7.684 -2.223 411 HA3 GLY 53 HA3 GLY 53 -15.595 8.404 -0.667 412 H PHE 54 H PHE 54 -12.702 7.406 -2.538 413 HA PHE 54 HA PHE 54 -11.209 9.600 -1.354 414 HB2 PHE 54 HB2 PHE 54 -10.398 7.289 -3.112 415 HB3 PHE 54 HB3 PHE 54 -9.302 8.615 -2.747 416 HD1 PHE 54 HD1 PHE 54 -10.399 8.965 0.170 417 HD2 PHE 54 HD2 PHE 54 -8.993 5.622 -2.093 418 HE1 PHE 54 HE1 PHE 54 -9.812 7.804 2.238 419 HE2 PHE 54 HE2 PHE 54 -8.375 4.498 -0.001 420 HZ PHE 54 HZ PHE 54 -8.795 5.566 2.161 421 H SER 55 H SER 55 -10.969 11.505 -2.326 422 HA SER 55 HA SER 55 -12.049 12.011 -4.936 423 HB2 SER 55 HB2 SER 55 -11.358 13.564 -2.659 424 HB3 SER 55 HB3 SER 55 -10.451 14.206 -4.027 425 HG SER 55 HG SER 55 -12.365 15.215 -4.159 426 H GLY 56 H GLY 56 -10.692 13.353 -6.545 427 HA2 GLY 56 HA2 GLY 56 -8.427 11.748 -7.294 428 HA3 GLY 56 HA3 GLY 56 -9.064 13.127 -8.171 429 H VAL 57 H VAL 57 -7.661 12.780 -4.895 430 HA VAL 57 HA VAL 57 -5.929 15.060 -5.481 431 HB VAL 57 HB VAL 57 -5.557 15.332 -3.157 432 HG11 VAL 57 HG11 VAL 57 -8.493 14.810 -3.579 433 HG12 VAL 57 HG12 VAL 57 -7.633 16.235 -4.161 434 HG13 VAL 57 HG13 VAL 57 -7.766 15.932 -2.428 435 HG21 VAL 57 HG21 VAL 57 -7.267 13.594 -1.838 436 HG22 VAL 57 HG22 VAL 57 -5.507 13.535 -1.860 437 HG23 VAL 57 HG23 VAL 57 -6.433 12.586 -3.020 438 H ASN 58 H ASN 58 -5.665 11.761 -5.607 439 HA ASN 58 HA ASN 58 -3.830 10.464 -6.032 440 HB2 ASN 58 HB2 ASN 58 -1.967 12.634 -5.109 441 HB3 ASN 58 HB3 ASN 58 -1.683 11.361 -6.289 442 HD21 ASN 58 HD21 ASN 58 -2.697 14.557 -5.781 443 HD22 ASN 58 HD22 ASN 58 -3.236 14.920 -7.372 444 H PHE 59 H PHE 59 -2.268 12.247 -3.392 445 HA PHE 59 HA PHE 59 -2.575 9.815 -1.765 446 HB2 PHE 59 HB2 PHE 59 -0.439 11.864 -1.236 447 HB3 PHE 59 HB3 PHE 59 -0.488 10.172 -0.766 448 HD1 PHE 59 HD1 PHE 59 -0.577 12.110 -3.989 449 HD2 PHE 59 HD2 PHE 59 1.076 8.838 -1.821 450 HE1 PHE 59 HE1 PHE 59 0.833 11.550 -5.910 451 HE2 PHE 59 HE2 PHE 59 2.488 8.283 -3.747 452 HZ PHE 59 HZ PHE 59 2.369 9.634 -5.795 453 H ASN 60 H ASN 60 -2.026 10.656 0.732 454 HA ASN 60 HA ASN 60 -2.833 11.731 2.567 455 HB2 ASN 60 HB2 ASN 60 -3.778 13.885 0.660 456 HB3 ASN 60 HB3 ASN 60 -3.626 14.029 2.406 457 HD21 ASN 60 HD21 ASN 60 -1.182 12.787 2.809 458 HD22 ASN 60 HD22 ASN 60 0.061 13.725 2.067 459 H ARG 61 H ARG 61 -4.235 10.044 2.853 460 HA ARG 61 HA ARG 61 -7.094 10.687 2.534 461 HB2 ARG 61 HB2 ARG 61 -6.560 7.836 2.320 462 HB3 ARG 61 HB3 ARG 61 -7.584 8.859 1.336 463 HG2 ARG 61 HG2 ARG 61 -4.745 9.247 0.772 464 HG3 ARG 61 HG3 ARG 61 -5.286 7.591 0.537 465 HD2 ARG 61 HD2 ARG 61 -5.430 9.199 -1.448 466 HD3 ARG 61 HD3 ARG 61 -6.815 8.169 -1.101 467 HE ARG 61 HE ARG 61 -7.187 10.612 0.210 468 HH11 ARG 61 HH11 ARG 61 -6.994 9.362 -3.048 469 HH12 ARG 61 HH12 ARG 61 -8.068 10.553 -3.701 470 HH21 ARG 61 HH21 ARG 61 -8.604 12.178 -0.651 471 HH22 ARG 61 HH22 ARG 61 -8.975 12.157 -2.341 472 HA PRO 62 HA PRO 62 -7.561 9.430 6.763 473 HB2 PRO 62 HB2 PRO 62 -9.488 7.420 6.562 474 HB3 PRO 62 HB3 PRO 62 -9.821 9.149 6.688 475 HG2 PRO 62 HG2 PRO 62 -9.739 7.406 4.266 476 HG3 PRO 62 HG3 PRO 62 -10.824 8.753 4.643 477 HD2 PRO 62 HD2 PRO 62 -8.799 9.043 2.916 478 HD3 PRO 62 HD3 PRO 62 -9.263 10.350 4.025 479 H GLY 63 H GLY 63 -8.183 6.348 5.060 480 HA2 GLY 63 HA2 GLY 63 -6.652 4.767 6.820 481 HA3 GLY 63 HA3 GLY 63 -7.175 4.293 5.211 482 H PHE 64 H PHE 64 -5.802 6.615 3.989 483 HA PHE 64 HA PHE 64 -3.291 5.408 3.427 484 HB2 PHE 64 HB2 PHE 64 -4.594 6.770 1.822 485 HB3 PHE 64 HB3 PHE 64 -4.316 8.190 2.815 486 HD1 PHE 64 HD1 PHE 64 -1.732 8.617 3.314 487 HD2 PHE 64 HD2 PHE 64 -3.284 6.495 -0.015 488 HE1 PHE 64 HE1 PHE 64 0.321 9.082 2.064 489 HE2 PHE 64 HE2 PHE 64 -1.245 6.962 -1.272 490 HZ PHE 64 HZ PHE 64 0.568 8.258 -0.238 491 H GLN 65 H GLN 65 -4.351 8.177 5.356 492 HA GLN 65 HA GLN 65 -1.793 9.086 6.098 493 HB2 GLN 65 HB2 GLN 65 -4.540 9.431 7.259 494 HB3 GLN 65 HB3 GLN 65 -3.129 10.040 8.114 495 HG2 GLN 65 HG2 GLN 65 -2.532 11.348 6.092 496 HG3 GLN 65 HG3 GLN 65 -4.040 10.821 5.348 497 HE21 GLN 65 HE21 GLN 65 -2.846 12.335 8.332 498 HE22 GLN 65 HE22 GLN 65 -4.150 13.456 8.484 499 H SER 66 H SER 66 -3.806 6.464 7.151 500 HA SER 66 HA SER 66 -2.376 5.942 9.602 501 HB2 SER 66 HB2 SER 66 -4.742 4.977 8.381 502 HB3 SER 66 HB3 SER 66 -3.657 3.595 8.494 503 HG SER 66 HG SER 66 -4.476 5.300 10.607 504 H LEU 67 H LEU 67 -2.355 4.795 6.244 505 HA LEU 67 HA LEU 67 -0.389 2.819 6.430 506 HB2 LEU 67 HB2 LEU 67 -1.157 2.670 4.310 507 HB3 LEU 67 HB3 LEU 67 -1.802 4.298 4.382 508 HG LEU 67 HG LEU 67 0.502 5.139 3.775 509 HD11 LEU 67 HD11 LEU 67 1.804 3.225 2.570 510 HD12 LEU 67 HD12 LEU 67 0.911 2.177 3.676 511 HD13 LEU 67 HD13 LEU 67 1.972 3.435 4.313 512 HD21 LEU 67 HD21 LEU 67 -1.284 3.503 2.060 513 HD22 LEU 67 HD22 LEU 67 0.257 4.031 1.389 514 HD23 LEU 67 HD23 LEU 67 -0.900 5.221 1.985 515 H ILE 68 H ILE 68 -0.144 6.297 5.686 516 HA ILE 68 HA ILE 68 2.680 6.425 5.605 517 HB ILE 68 HB ILE 68 0.555 8.513 6.041 518 HG12 ILE 68 HG12 ILE 68 0.852 7.498 3.771 519 HG13 ILE 68 HG13 ILE 68 1.101 9.239 3.817 520 HG21 ILE 68 HG21 ILE 68 2.135 10.244 6.111 521 HG22 ILE 68 HG22 ILE 68 3.458 9.169 5.662 522 HG23 ILE 68 HG23 ILE 68 2.721 9.039 7.259 523 HD11 ILE 68 HD11 ILE 68 2.717 7.954 2.407 524 HD12 ILE 68 HD12 ILE 68 3.350 7.246 3.894 525 HD13 ILE 68 HD13 ILE 68 3.458 8.986 3.632 526 H LYS 69 H LYS 69 0.283 6.742 8.163 527 HA LYS 69 HA LYS 69 1.779 7.807 10.230 528 HB2 LYS 69 HB2 LYS 69 -0.388 7.608 10.889 529 HB3 LYS 69 HB3 LYS 69 -0.627 6.109 10.014 530 HG2 LYS 69 HG2 LYS 69 -0.882 5.581 12.285 531 HG3 LYS 69 HG3 LYS 69 0.714 4.978 11.834 532 HD2 LYS 69 HD2 LYS 69 1.259 7.532 12.625 533 HD3 LYS 69 HD3 LYS 69 -0.044 7.076 13.722 534 HE2 LYS 69 HE2 LYS 69 1.185 5.362 14.671 535 HE3 LYS 69 HE3 LYS 69 2.233 5.204 13.263 536 HZ1 LYS 69 HZ1 LYS 69 3.539 6.202 14.906 537 HZ2 LYS 69 HZ2 LYS 69 2.318 7.271 15.376 538 HZ3 LYS 69 HZ3 LYS 69 3.099 7.481 13.891 539 H GLU 70 H GLU 70 1.573 4.443 9.145 540 HA GLU 70 HA GLU 70 3.313 3.470 11.202 541 HB2 GLU 70 HB2 GLU 70 2.549 2.201 8.559 542 HB3 GLU 70 HB3 GLU 70 3.349 1.382 9.893 543 HG2 GLU 70 HG2 GLU 70 0.789 2.709 10.520 544 HG3 GLU 70 HG3 GLU 70 0.705 1.302 9.464 545 H VAL 71 H VAL 71 3.648 4.660 7.909 546 HA VAL 71 HA VAL 71 6.340 3.898 7.506 547 HB VAL 71 HB VAL 71 5.034 6.344 6.306 548 HG11 VAL 71 HG11 VAL 71 7.336 4.585 5.536 549 HG12 VAL 71 HG12 VAL 71 7.329 6.326 5.820 550 HG13 VAL 71 HG13 VAL 71 6.547 5.663 4.385 551 HG21 VAL 71 HG21 VAL 71 4.061 3.753 6.084 552 HG22 VAL 71 HG22 VAL 71 5.021 3.995 4.623 553 HG23 VAL 71 HG23 VAL 71 3.711 5.106 5.012 554 H GLU 72 H GLU 72 4.899 6.903 8.783 555 HA GLU 72 HA GLU 72 7.320 8.313 9.078 556 HB2 GLU 72 HB2 GLU 72 5.958 9.622 10.854 557 HB3 GLU 72 HB3 GLU 72 5.484 9.707 9.166 558 HG2 GLU 72 HG2 GLU 72 3.594 8.481 9.487 559 HG3 GLU 72 HG3 GLU 72 4.238 7.643 10.888 560 H ALA 73 H ALA 73 5.535 6.190 11.265 561 HA ALA 73 HA ALA 73 7.374 6.578 13.447 562 HB1 ALA 73 HB1 ALA 73 5.858 4.191 13.759 563 HB2 ALA 73 HB2 ALA 73 4.813 5.439 13.079 564 HB3 ALA 73 HB3 ALA 73 5.673 5.735 14.591 565 H GLY 74 H GLY 74 7.915 5.168 10.582 566 HA2 GLY 74 HA2 GLY 74 9.329 3.600 9.771 567 HA3 GLY 74 HA3 GLY 74 10.221 3.781 11.266 568 H ASN 75 H ASN 75 6.991 2.502 10.529 569 HA ASN 75 HA ASN 75 7.680 -0.002 11.921 570 HB2 ASN 75 HB2 ASN 75 5.140 1.572 11.595 571 HB3 ASN 75 HB3 ASN 75 5.053 -0.157 11.884 572 HD21 ASN 75 HD21 ASN 75 3.855 1.081 13.733 573 HD22 ASN 75 HD22 ASN 75 4.791 1.307 15.162 574 H VAL 76 H VAL 76 5.885 1.321 9.138 575 HA VAL 76 HA VAL 76 5.258 -1.130 7.955 576 HB VAL 76 HB VAL 76 4.253 1.039 7.283 577 HG11 VAL 76 HG11 VAL 76 6.330 1.676 5.342 578 HG12 VAL 76 HG12 VAL 76 6.823 1.926 7.017 579 HG13 VAL 76 HG13 VAL 76 5.389 2.729 6.390 580 HG21 VAL 76 HG21 VAL 76 4.069 0.499 4.925 581 HG22 VAL 76 HG22 VAL 76 4.065 -0.977 5.892 582 HG23 VAL 76 HG23 VAL 76 5.522 -0.498 5.022 583 H GLU 77 H GLU 77 6.761 -2.632 7.606 584 HA GLU 77 HA GLU 77 9.347 -1.901 6.449 585 HB2 GLU 77 HB2 GLU 77 10.073 -4.114 7.064 586 HB3 GLU 77 HB3 GLU 77 9.258 -3.381 8.437 587 HG2 GLU 77 HG2 GLU 77 7.655 -4.925 8.471 588 HG3 GLU 77 HG3 GLU 77 7.488 -4.926 6.719 589 H THR 78 H THR 78 6.355 -2.657 5.312 590 HA THR 78 HA THR 78 7.347 -3.402 2.709 591 HB THR 78 HB THR 78 5.238 -5.263 3.583 592 HG1 THR 78 HG1 THR 78 6.285 -5.916 5.274 593 HG21 THR 78 HG21 THR 78 5.994 -5.779 1.508 594 HG22 THR 78 HG22 THR 78 6.991 -6.844 2.498 595 HG23 THR 78 HG23 THR 78 7.658 -5.332 1.882 596 H LEU 79 H LEU 79 5.761 -3.252 1.053 597 HA LEU 79 HA LEU 79 3.184 -2.146 1.890 598 HB2 LEU 79 HB2 LEU 79 4.929 -0.392 1.079 599 HB3 LEU 79 HB3 LEU 79 4.566 -1.027 -0.487 600 HG LEU 79 HG LEU 79 3.088 0.700 -0.491 601 HD11 LEU 79 HD11 LEU 79 1.761 -1.369 -0.633 602 HD12 LEU 79 HD12 LEU 79 0.857 -0.006 0.024 603 HD13 LEU 79 HD13 LEU 79 1.462 -1.261 1.098 604 HD21 LEU 79 HD21 LEU 79 1.806 1.233 1.747 605 HD22 LEU 79 HD22 LEU 79 3.413 1.884 1.414 606 HD23 LEU 79 HD23 LEU 79 3.233 0.474 2.457 607 H ILE 80 H ILE 80 1.601 -3.210 1.010 608 HA ILE 80 HA ILE 80 2.015 -4.557 -1.568 609 HB ILE 80 HB ILE 80 0.728 -5.480 0.939 610 HG12 ILE 80 HG12 ILE 80 1.624 -7.680 -0.053 611 HG13 ILE 80 HG13 ILE 80 2.416 -6.657 -1.245 612 HG21 ILE 80 HG21 ILE 80 -0.340 -7.275 -0.735 613 HG22 ILE 80 HG22 ILE 80 -0.467 -5.823 -1.727 614 HG23 ILE 80 HG23 ILE 80 -1.211 -5.867 -0.129 615 HD11 ILE 80 HD11 ILE 80 3.718 -5.591 0.429 616 HD12 ILE 80 HD12 ILE 80 3.847 -7.334 0.662 617 HD13 ILE 80 HD13 ILE 80 2.805 -6.380 1.715 618 H VAL 81 H VAL 81 0.927 -3.638 -3.126 619 HA VAL 81 HA VAL 81 -1.746 -2.503 -2.609 620 HB VAL 81 HB VAL 81 0.300 -1.295 -4.471 621 HG11 VAL 81 HG11 VAL 81 -2.220 -0.034 -3.418 622 HG12 VAL 81 HG12 VAL 81 -2.166 -0.961 -4.913 623 HG13 VAL 81 HG13 VAL 81 -1.201 0.503 -4.752 624 HG21 VAL 81 HG21 VAL 81 -0.281 -0.701 -1.586 625 HG22 VAL 81 HG22 VAL 81 0.148 0.629 -2.671 626 HG23 VAL 81 HG23 VAL 81 1.267 -0.722 -2.449 627 H LYS 82 H LYS 82 -3.210 -2.609 -4.362 628 HA LYS 82 HA LYS 82 -3.142 -4.842 -6.006 629 HB2 LYS 82 HB2 LYS 82 -4.978 -2.865 -5.458 630 HB3 LYS 82 HB3 LYS 82 -4.585 -2.537 -7.138 631 HG2 LYS 82 HG2 LYS 82 -5.327 -5.279 -6.192 632 HG3 LYS 82 HG3 LYS 82 -6.538 -4.088 -6.674 633 HD2 LYS 82 HD2 LYS 82 -6.130 -4.428 -8.829 634 HD3 LYS 82 HD3 LYS 82 -4.392 -4.271 -8.603 635 HE2 LYS 82 HE2 LYS 82 -4.447 -6.640 -7.692 636 HE3 LYS 82 HE3 LYS 82 -6.088 -6.738 -8.329 637 HZ1 LYS 82 HZ1 LYS 82 -4.628 -7.625 -9.952 638 HZ2 LYS 82 HZ2 LYS 82 -3.588 -6.296 -9.861 639 HZ3 LYS 82 HZ3 LYS 82 -5.130 -6.117 -10.529 640 H ASP 83 H ASP 83 -2.188 -1.465 -6.643 641 HA ASP 83 HA ASP 83 -0.163 -2.180 -8.476 642 HB2 ASP 83 HB2 ASP 83 -1.297 -0.954 -10.470 643 HB3 ASP 83 HB3 ASP 83 -1.691 -2.641 -10.161 644 H MET 84 H MET 84 0.768 -0.232 -9.608 645 HA MET 84 HA MET 84 1.183 1.836 -7.735 646 HB2 MET 84 HB2 MET 84 2.027 1.359 -10.563 647 HB3 MET 84 HB3 MET 84 2.297 2.938 -9.840 648 HG2 MET 84 HG2 MET 84 3.184 0.504 -8.375 649 HG3 MET 84 HG3 MET 84 4.130 1.080 -9.746 650 HE1 MET 84 HE1 MET 84 4.007 0.755 -6.425 651 HE2 MET 84 HE2 MET 84 3.115 2.163 -5.853 652 HE3 MET 84 HE3 MET 84 4.870 2.101 -5.681 653 H SER 85 H SER 85 -1.423 1.409 -9.842 654 HA SER 85 HA SER 85 -1.866 4.138 -10.572 655 HB2 SER 85 HB2 SER 85 -3.881 1.882 -10.419 656 HB3 SER 85 HB3 SER 85 -4.055 3.386 -11.315 657 HG SER 85 HG SER 85 -2.650 1.100 -11.947 658 H ARG 86 H ARG 86 -2.339 2.256 -7.753 659 HA ARG 86 HA ARG 86 -4.499 3.530 -6.532 660 HB2 ARG 86 HB2 ARG 86 -2.277 1.787 -5.729 661 HB3 ARG 86 HB3 ARG 86 -2.867 2.830 -4.446 662 HG2 ARG 86 HG2 ARG 86 -3.965 0.681 -4.389 663 HG3 ARG 86 HG3 ARG 86 -5.110 1.958 -4.758 664 HD2 ARG 86 HD2 ARG 86 -4.702 1.338 -7.217 665 HD3 ARG 86 HD3 ARG 86 -4.008 -0.149 -6.570 666 HE ARG 86 HE ARG 86 -6.500 0.224 -5.371 667 HH11 ARG 86 HH11 ARG 86 -5.235 -0.400 -8.567 668 HH12 ARG 86 HH12 ARG 86 -6.621 -1.301 -9.073 669 HH21 ARG 86 HH21 ARG 86 -8.322 -0.962 -6.040 670 HH22 ARG 86 HH22 ARG 86 -8.372 -1.624 -7.639 671 H LEU 87 H LEU 87 -1.031 4.050 -5.772 672 HA LEU 87 HA LEU 87 -1.604 6.495 -4.402 673 HB2 LEU 87 HB2 LEU 87 0.882 4.999 -5.093 674 HB3 LEU 87 HB3 LEU 87 1.010 6.671 -4.578 675 HG LEU 87 HG LEU 87 -0.656 5.529 -2.665 676 HD11 LEU 87 HD11 LEU 87 1.632 3.643 -3.103 677 HD12 LEU 87 HD12 LEU 87 -0.008 3.324 -3.664 678 HD13 LEU 87 HD13 LEU 87 0.313 3.518 -1.941 679 HD21 LEU 87 HD21 LEU 87 1.701 6.957 -2.768 680 HD22 LEU 87 HD22 LEU 87 2.157 5.471 -1.938 681 HD23 LEU 87 HD23 LEU 87 0.844 6.466 -1.309 682 H GLY 88 H GLY 88 -0.634 5.719 -7.701 683 HA2 GLY 88 HA2 GLY 88 -1.494 7.745 -9.076 684 HA3 GLY 88 HA3 GLY 88 -0.244 8.592 -8.197 685 H ARG 89 H ARG 89 -0.438 8.466 -10.978 686 HA ARG 89 HA ARG 89 1.424 6.539 -12.022 687 HB2 ARG 89 HB2 ARG 89 -0.075 8.881 -13.111 688 HB3 ARG 89 HB3 ARG 89 1.348 8.340 -13.981 689 HG2 ARG 89 HG2 ARG 89 -0.654 7.345 -14.908 690 HG3 ARG 89 HG3 ARG 89 0.389 6.110 -14.202 691 HD2 ARG 89 HD2 ARG 89 -1.332 5.412 -12.996 692 HD3 ARG 89 HD3 ARG 89 -1.322 6.953 -12.148 693 HE ARG 89 HE ARG 89 -2.816 7.705 -14.077 694 HH11 ARG 89 HH11 ARG 89 -2.815 4.446 -12.787 695 HH12 ARG 89 HH12 ARG 89 -4.450 4.135 -13.254 696 HH21 ARG 89 HH21 ARG 89 -4.970 7.280 -14.677 697 HH22 ARG 89 HH22 ARG 89 -5.672 5.740 -14.317 698 H ASN 90 H ASN 90 1.516 9.821 -10.822 699 HA ASN 90 HA ASN 90 3.966 10.690 -11.786 700 HB2 ASN 90 HB2 ASN 90 3.970 11.906 -9.385 701 HB3 ASN 90 HB3 ASN 90 2.957 12.436 -10.720 702 HD21 ASN 90 HD21 ASN 90 2.922 10.172 -7.988 703 HD22 ASN 90 HD22 ASN 90 1.265 10.426 -7.579 704 H TYR 91 H TYR 91 5.566 9.225 -11.795 705 HA TYR 91 HA TYR 91 6.244 7.560 -9.604 706 HB2 TYR 91 HB2 TYR 91 6.674 6.852 -11.826 707 HB3 TYR 91 HB3 TYR 91 7.666 8.260 -12.166 708 HD1 TYR 91 HD1 TYR 91 9.945 8.405 -11.175 709 HD2 TYR 91 HD2 TYR 91 7.547 4.922 -10.791 710 HE1 TYR 91 HE1 TYR 91 11.951 7.099 -10.634 711 HE2 TYR 91 HE2 TYR 91 9.553 3.581 -10.259 712 HH TYR 91 HH TYR 91 12.326 4.786 -9.244 713 H LEU 92 H LEU 92 6.889 10.856 -10.185 714 HA LEU 92 HA LEU 92 9.435 11.069 -8.940 715 HB2 LEU 92 HB2 LEU 92 7.237 13.120 -9.202 716 HB3 LEU 92 HB3 LEU 92 8.870 13.465 -8.664 717 HG LEU 92 HG LEU 92 9.598 12.503 -10.951 718 HD11 LEU 92 HD11 LEU 92 7.725 13.088 -12.647 719 HD12 LEU 92 HD12 LEU 92 6.650 12.819 -11.273 720 HD13 LEU 92 HD13 LEU 92 7.710 11.526 -11.828 721 HD21 LEU 92 HD21 LEU 92 8.275 15.147 -10.465 722 HD22 LEU 92 HD22 LEU 92 8.977 14.757 -12.035 723 HD23 LEU 92 HD23 LEU 92 9.993 14.768 -10.594 724 H GLN 93 H GLN 93 6.171 11.891 -7.764 725 HA GLN 93 HA GLN 93 6.892 12.146 -5.026 726 HB2 GLN 93 HB2 GLN 93 4.302 11.805 -6.520 727 HB3 GLN 93 HB3 GLN 93 4.315 11.710 -4.765 728 HG2 GLN 93 HG2 GLN 93 5.322 14.059 -6.355 729 HG3 GLN 93 HG3 GLN 93 3.704 13.929 -5.664 730 HE21 GLN 93 HE21 GLN 93 7.000 14.648 -5.068 731 HE22 GLN 93 HE22 GLN 93 6.838 15.046 -3.399 732 H VAL 94 H VAL 94 5.256 9.574 -6.855 733 HA VAL 94 HA VAL 94 4.938 7.701 -4.840 734 HB VAL 94 HB VAL 94 5.412 7.314 -7.808 735 HG11 VAL 94 HG11 VAL 94 5.758 5.326 -5.943 736 HG12 VAL 94 HG12 VAL 94 5.358 5.099 -7.646 737 HG13 VAL 94 HG13 VAL 94 4.077 5.125 -6.433 738 HG21 VAL 94 HG21 VAL 94 3.362 8.504 -7.195 739 HG22 VAL 94 HG22 VAL 94 2.907 7.194 -6.108 740 HG23 VAL 94 HG23 VAL 94 2.988 6.911 -7.850 741 H GLY 95 H GLY 95 7.712 8.182 -7.016 742 HA2 GLY 95 HA2 GLY 95 9.290 6.056 -6.061 743 HA3 GLY 95 HA3 GLY 95 9.897 7.489 -6.868 744 H PHE 96 H PHE 96 9.388 9.523 -5.236 745 HA PHE 96 HA PHE 96 11.363 9.609 -3.373 746 HB2 PHE 96 HB2 PHE 96 10.354 11.666 -3.782 747 HB3 PHE 96 HB3 PHE 96 8.729 11.025 -3.595 748 HD1 PHE 96 HD1 PHE 96 7.859 10.551 -1.289 749 HD2 PHE 96 HD2 PHE 96 11.504 12.641 -1.981 750 HE1 PHE 96 HE1 PHE 96 7.789 11.430 1.004 751 HE2 PHE 96 HE2 PHE 96 11.436 13.523 0.312 752 HZ PHE 96 HZ PHE 96 9.577 12.918 1.809 753 H TYR 97 H TYR 97 8.016 8.566 -2.828 754 HA TYR 97 HA TYR 97 8.245 8.076 -0.073 755 HB2 TYR 97 HB2 TYR 97 6.400 6.963 -2.179 756 HB3 TYR 97 HB3 TYR 97 6.246 6.537 -0.478 757 HD1 TYR 97 HD1 TYR 97 6.448 8.833 1.061 758 HD2 TYR 97 HD2 TYR 97 4.903 8.553 -2.890 759 HE1 TYR 97 HE1 TYR 97 5.140 10.877 1.434 760 HE2 TYR 97 HE2 TYR 97 3.590 10.594 -2.530 761 HH TYR 97 HH TYR 97 2.617 11.782 -0.266 762 H THR 98 H THR 98 8.636 5.890 -2.868 763 HA THR 98 HA THR 98 9.292 3.664 -1.154 764 HB THR 98 HB THR 98 9.641 2.432 -3.247 765 HG1 THR 98 HG1 THR 98 9.017 4.822 -4.623 766 HG21 THR 98 HG21 THR 98 7.457 2.367 -3.984 767 HG22 THR 98 HG22 THR 98 7.207 4.092 -3.715 768 HG23 THR 98 HG23 THR 98 7.305 2.990 -2.342 769 H GLU 99 H GLU 99 11.214 6.124 -2.803 770 HA GLU 99 HA GLU 99 13.629 4.506 -2.477 771 HB2 GLU 99 HB2 GLU 99 14.752 6.431 -3.689 772 HB3 GLU 99 HB3 GLU 99 13.599 5.475 -4.600 773 HG2 GLU 99 HG2 GLU 99 12.249 7.211 -4.945 774 HG3 GLU 99 HG3 GLU 99 12.423 7.812 -3.298 775 H VAL 100 H VAL 100 12.412 7.659 -1.282 776 HA VAL 100 HA VAL 100 14.759 7.683 0.490 777 HB VAL 100 HB VAL 100 14.588 9.668 -0.921 778 HG11 VAL 100 HG11 VAL 100 12.760 11.338 -0.297 779 HG12 VAL 100 HG12 VAL 100 11.898 9.952 0.365 780 HG13 VAL 100 HG13 VAL 100 12.321 9.992 -1.346 781 HG21 VAL 100 HG21 VAL 100 14.052 10.284 1.978 782 HG22 VAL 100 HG22 VAL 100 14.860 11.336 0.815 783 HG23 VAL 100 HG23 VAL 100 15.613 9.818 1.303 784 H LEU 101 H LEU 101 11.254 8.108 0.537 785 HA LEU 101 HA LEU 101 11.007 8.667 3.286 786 HB2 LEU 101 HB2 LEU 101 9.333 8.840 1.250 787 HB3 LEU 101 HB3 LEU 101 8.838 7.253 1.809 788 HG LEU 101 HG LEU 101 7.360 8.907 2.740 789 HD11 LEU 101 HD11 LEU 101 8.098 6.968 4.141 790 HD12 LEU 101 HD12 LEU 101 7.530 8.363 5.058 791 HD13 LEU 101 HD13 LEU 101 9.260 8.041 4.920 792 HD21 LEU 101 HD21 LEU 101 8.184 10.683 4.219 793 HD22 LEU 101 HD22 LEU 101 8.815 10.852 2.582 794 HD23 LEU 101 HD23 LEU 101 9.844 10.211 3.861 795 H PHE 102 H PHE 102 10.046 5.657 1.644 796 HA PHE 102 HA PHE 102 9.572 4.129 3.894 797 HB2 PHE 102 HB2 PHE 102 10.313 3.367 1.086 798 HB3 PHE 102 HB3 PHE 102 9.913 2.178 2.308 799 HD1 PHE 102 HD1 PHE 102 8.170 5.317 2.518 800 HD2 PHE 102 HD2 PHE 102 8.080 1.436 0.765 801 HE1 PHE 102 HE1 PHE 102 5.792 5.608 1.997 802 HE2 PHE 102 HE2 PHE 102 5.684 1.722 0.260 803 HZ PHE 102 HZ PHE 102 4.542 3.811 0.877 804 HA PRO 103 HA PRO 103 14.321 2.465 3.013 805 HB2 PRO 103 HB2 PRO 103 15.164 5.297 3.497 806 HB3 PRO 103 HB3 PRO 103 15.989 4.018 2.609 807 HG2 PRO 103 HG2 PRO 103 14.623 5.897 1.324 808 HG3 PRO 103 HG3 PRO 103 14.602 4.217 0.760 809 HD2 PRO 103 HD2 PRO 103 12.479 5.789 2.082 810 HD3 PRO 103 HD3 PRO 103 12.354 4.392 1.016 811 H GLN 104 H GLN 104 13.283 5.030 5.268 812 HA GLN 104 HA GLN 104 15.069 4.559 7.312 813 HB2 GLN 104 HB2 GLN 104 12.371 5.039 8.332 814 HB3 GLN 104 HB3 GLN 104 13.861 5.922 8.609 815 HG2 GLN 104 HG2 GLN 104 13.553 6.825 6.236 816 HG3 GLN 104 HG3 GLN 104 11.918 6.213 6.374 817 HE21 GLN 104 HE21 GLN 104 10.532 7.114 7.974 818 HE22 GLN 104 HE22 GLN 104 10.830 8.690 8.612 819 H LYS 105 H LYS 105 12.478 2.479 6.316 820 HA LYS 105 HA LYS 105 13.061 0.746 8.624 821 HB2 LYS 105 HB2 LYS 105 10.434 0.418 7.308 822 HB3 LYS 105 HB3 LYS 105 10.875 0.270 8.998 823 HG2 LYS 105 HG2 LYS 105 9.536 2.117 9.045 824 HG3 LYS 105 HG3 LYS 105 11.124 2.861 8.868 825 HD2 LYS 105 HD2 LYS 105 10.249 2.354 6.266 826 HD3 LYS 105 HD3 LYS 105 8.832 2.965 7.123 827 HE2 LYS 105 HE2 LYS 105 10.635 4.696 8.025 828 HE3 LYS 105 HE3 LYS 105 11.396 4.302 6.486 829 HZ1 LYS 105 HZ1 LYS 105 9.148 4.807 5.484 830 HZ2 LYS 105 HZ2 LYS 105 10.028 6.127 6.061 831 HZ3 LYS 105 HZ3 LYS 105 8.745 5.506 6.968 832 H ASN 106 H ASN 106 13.581 0.943 5.381 833 HA ASN 106 HA ASN 106 14.101 -0.568 3.759 834 HB2 ASN 106 HB2 ASN 106 15.481 -1.644 5.419 835 HB3 ASN 106 HB3 ASN 106 14.093 -2.474 6.109 836 HD21 ASN 106 HD21 ASN 106 16.046 -4.040 5.598 837 HD22 ASN 106 HD22 ASN 106 15.845 -4.934 4.143 838 H VAL 107 H VAL 107 12.303 -0.378 2.571 839 HA VAL 107 HA VAL 107 9.958 -2.003 3.229 840 HB VAL 107 HB VAL 107 9.918 0.538 2.854 841 HG11 VAL 107 HG11 VAL 107 9.381 -0.183 0.015 842 HG12 VAL 107 HG12 VAL 107 11.054 0.046 0.518 843 HG13 VAL 107 HG13 VAL 107 9.895 1.355 0.703 844 HG21 VAL 107 HG21 VAL 107 7.997 -0.903 3.265 845 HG22 VAL 107 HG22 VAL 107 7.942 -1.326 1.555 846 HG23 VAL 107 HG23 VAL 107 7.616 0.327 2.066 847 H ARG 108 H ARG 108 8.836 -3.160 1.776 848 HA ARG 108 HA ARG 108 10.106 -3.797 -0.777 849 HB2 ARG 108 HB2 ARG 108 9.921 -5.590 1.311 850 HB3 ARG 108 HB3 ARG 108 8.472 -5.945 0.380 851 HG2 ARG 108 HG2 ARG 108 11.218 -5.827 -0.828 852 HG3 ARG 108 HG3 ARG 108 10.486 -7.306 -0.205 853 HD2 ARG 108 HD2 ARG 108 8.809 -7.299 -1.832 854 HD3 ARG 108 HD3 ARG 108 9.071 -5.602 -2.224 855 HE ARG 108 HE ARG 108 10.738 -6.219 -3.665 856 HH11 ARG 108 HH11 ARG 108 9.953 -8.961 -1.635 857 HH12 ARG 108 HH12 ARG 108 10.910 -10.070 -2.555 858 HH21 ARG 108 HH21 ARG 108 11.989 -7.685 -4.875 859 HH22 ARG 108 HH22 ARG 108 12.074 -9.344 -4.391 860 H PHE 109 H PHE 109 8.824 -2.415 -1.894 861 HA PHE 109 HA PHE 109 5.996 -2.293 -1.472 862 HB2 PHE 109 HB2 PHE 109 7.729 -0.501 -2.386 863 HB3 PHE 109 HB3 PHE 109 7.236 -1.172 -3.930 864 HD1 PHE 109 HD1 PHE 109 4.677 -1.289 -4.366 865 HD2 PHE 109 HD2 PHE 109 6.492 1.145 -1.396 866 HE1 PHE 109 HE1 PHE 109 2.693 0.148 -4.370 867 HE2 PHE 109 HE2 PHE 109 4.513 2.609 -1.369 868 HZ PHE 109 HZ PHE 109 2.600 2.107 -2.858 869 H LEU 110 H LEU 110 4.357 -2.974 -2.892 870 HA LEU 110 HA LEU 110 5.176 -4.662 -5.136 871 HB2 LEU 110 HB2 LEU 110 4.756 -6.044 -3.122 872 HB3 LEU 110 HB3 LEU 110 3.090 -5.523 -3.139 873 HG LEU 110 HG LEU 110 3.280 -7.742 -4.101 874 HD11 LEU 110 HD11 LEU 110 1.866 -7.404 -5.802 875 HD12 LEU 110 HD12 LEU 110 2.903 -6.219 -6.588 876 HD13 LEU 110 HD13 LEU 110 1.896 -5.742 -5.222 877 HD21 LEU 110 HD21 LEU 110 5.272 -6.479 -5.977 878 HD22 LEU 110 HD22 LEU 110 4.567 -8.080 -6.200 879 HD23 LEU 110 HD23 LEU 110 5.574 -7.749 -4.792 880 H ALA 111 H ALA 111 4.053 -4.471 -6.860 881 HA ALA 111 HA ALA 111 1.438 -3.113 -6.819 882 HB1 ALA 111 HB1 ALA 111 3.731 -2.682 -8.740 883 HB2 ALA 111 HB2 ALA 111 2.965 -1.491 -7.682 884 HB3 ALA 111 HB3 ALA 111 2.081 -2.148 -9.066 885 H ILE 112 H ILE 112 0.211 -4.890 -7.007 886 HA ILE 112 HA ILE 112 0.919 -7.228 -8.340 887 HB ILE 112 HB ILE 112 -1.757 -6.203 -7.456 888 HG12 ILE 112 HG12 ILE 112 -0.417 -8.639 -6.393 889 HG13 ILE 112 HG13 ILE 112 0.281 -7.079 -5.981 890 HG21 ILE 112 HG21 ILE 112 -2.247 -7.643 -9.311 891 HG22 ILE 112 HG22 ILE 112 -2.608 -8.506 -7.818 892 HG23 ILE 112 HG23 ILE 112 -1.132 -8.869 -8.711 893 HD11 ILE 112 HD11 ILE 112 -2.567 -7.071 -5.598 894 HD12 ILE 112 HD12 ILE 112 -1.269 -6.702 -4.464 895 HD13 ILE 112 HD13 ILE 112 -1.792 -8.374 -4.693 896 H ASN 113 H ASN 113 -1.150 -4.598 -9.628 897 HA ASN 113 HA ASN 113 -1.613 -6.083 -12.061 898 HB2 ASN 113 HB2 ASN 113 -3.221 -4.461 -10.833 899 HB3 ASN 113 HB3 ASN 113 -2.351 -3.204 -11.704 900 HD21 ASN 113 HD21 ASN 113 -3.378 -2.585 -13.454 901 HD22 ASN 113 HD22 ASN 113 -4.299 -3.594 -14.507 902 H ASN 114 H ASN 114 1.183 -4.720 -11.298 903 HA ASN 114 HA ASN 114 2.061 -4.400 -13.946 904 HB2 ASN 114 HB2 ASN 114 0.701 -2.116 -12.965 905 HB3 ASN 114 HB3 ASN 114 2.412 -1.724 -13.029 906 HD21 ASN 114 HD21 ASN 114 -0.398 -2.581 -14.882 907 HD22 ASN 114 HD22 ASN 114 0.263 -2.199 -16.430 908 H SER 115 H SER 115 4.292 -3.739 -14.132 909 HA SER 115 HA SER 115 5.902 -4.616 -11.984 910 HB2 SER 115 HB2 SER 115 6.352 -4.293 -14.633 911 HB3 SER 115 HB3 SER 115 7.160 -2.857 -14.007 912 HG SER 115 HG SER 115 8.661 -4.465 -13.976 913 H ILE 116 H ILE 116 6.094 -3.568 -10.146 914 HA ILE 116 HA ILE 116 5.465 -0.914 -9.658 915 HB ILE 116 HB ILE 116 5.883 -2.990 -8.076 916 HG12 ILE 116 HG12 ILE 116 4.853 -0.696 -7.613 917 HG13 ILE 116 HG13 ILE 116 5.537 -1.558 -6.242 918 HG21 ILE 116 HG21 ILE 116 8.422 -1.415 -7.716 919 HG22 ILE 116 HG22 ILE 116 8.313 -3.008 -8.463 920 HG23 ILE 116 HG23 ILE 116 7.893 -2.800 -6.761 921 HD11 ILE 116 HD11 ILE 116 6.404 0.497 -5.853 922 HD12 ILE 116 HD12 ILE 116 6.417 0.938 -7.559 923 HD13 ILE 116 HD13 ILE 116 7.671 -0.120 -6.913 924 H ASP 117 H ASP 117 8.671 -2.340 -10.240 925 HA ASP 117 HA ASP 117 9.715 0.119 -11.278 926 HB2 ASP 117 HB2 ASP 117 9.748 0.229 -8.635 927 HB3 ASP 117 HB3 ASP 117 11.175 -0.784 -8.828 928 H SER 118 H SER 118 10.430 -3.035 -9.831 929 HA SER 118 HA SER 118 12.897 -3.658 -10.654 930 HB2 SER 118 HB2 SER 118 10.523 -5.159 -10.011 931 HB3 SER 118 HB3 SER 118 11.450 -5.984 -11.261 932 HG SER 118 HG SER 118 12.230 -6.627 -9.274 933 H ASN 119 H ASN 119 13.972 -4.381 -12.464 934 HA ASN 119 HA ASN 119 12.790 -3.695 -15.009 935 HB2 ASN 119 HB2 ASN 119 15.443 -3.822 -13.928 936 HB3 ASN 119 HB3 ASN 119 15.359 -4.812 -15.387 937 HD21 ASN 119 HD21 ASN 119 14.284 -1.670 -14.165 938 HD22 ASN 119 HD22 ASN 119 14.649 -0.802 -15.603 939 H ASN 120 H ASN 120 12.721 -5.077 -16.783 940 HA ASN 120 HA ASN 120 13.401 -7.785 -16.794 941 HB2 ASN 120 HB2 ASN 120 11.337 -7.552 -15.135 942 HB3 ASN 120 HB3 ASN 120 10.431 -7.606 -16.640 943 HD21 ASN 120 HD21 ASN 120 13.009 -9.311 -14.907 944 HD22 ASN 120 HD22 ASN 120 12.549 -10.891 -15.432
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