NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
25543 | 2k9q | 15999 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 HT1 MET 1 10.450 15.743 7.220 2 H2 MET 1 HT2 MET 1 9.498 15.468 8.599 3 H3 MET 1 HT3 MET 1 9.453 16.977 7.820 4 HA MET 1 HA MET 1 7.484 15.655 7.307 5 HB2 MET 1 HB2 MET 1 9.443 16.146 5.048 6 HB3 MET 1 HB1 MET 1 7.730 15.800 4.810 7 HG2 MET 1 HG2 MET 1 7.130 17.779 6.147 8 HG3 MET 1 HG1 MET 1 8.839 18.126 6.413 9 HE1 MET 1 HE1 MET 1 7.078 20.392 5.314 10 HE2 MET 1 HE2 MET 1 8.163 21.000 4.066 11 HE3 MET 1 HE3 MET 1 8.825 20.416 5.590 12 H GLU 2 HN GLU 2 8.113 13.507 8.426 13 HA GLU 2 HA GLU 2 9.380 11.495 6.718 14 HB2 GLU 2 HB2 GLU 2 7.851 11.173 9.320 15 HB3 GLU 2 HB1 GLU 2 8.821 9.925 8.537 16 HG2 GLU 2 HG2 GLU 2 10.818 11.405 8.720 17 HG3 GLU 2 HG1 GLU 2 9.832 12.581 9.592 18 H LEU 3 HN LEU 3 7.903 9.261 6.868 19 HA LEU 3 HA LEU 3 5.902 9.606 4.868 20 HB2 LEU 3 HB2 LEU 3 7.140 7.482 5.315 21 HB3 LEU 3 HB1 LEU 3 6.236 7.300 6.815 22 HG LEU 3 HG LEU 3 4.111 7.312 5.473 23 HD11 LEU 3 HD11 LEU 3 4.608 6.677 2.954 24 HD12 LEU 3 HD12 LEU 3 6.113 7.552 3.230 25 HD13 LEU 3 HD13 LEU 3 4.566 8.369 3.435 26 HD21 LEU 3 HD21 LEU 3 5.059 5.194 6.177 27 HD22 LEU 3 HD22 LEU 3 6.213 5.218 4.843 28 HD23 LEU 3 HD23 LEU 3 4.493 5.012 4.516 29 H SER 4 HN SER 4 5.613 9.180 8.407 30 HA SER 4 HA SER 4 2.707 9.270 8.326 31 HB2 SER 4 HB2 SER 4 4.519 9.759 10.701 32 HB3 SER 4 HB1 SER 4 2.823 9.286 10.738 33 HG SER 4 HG SER 4 4.514 7.585 10.972 34 H ASN 5 HN ASN 5 5.290 11.631 8.816 35 HA ASN 5 HA ASN 5 3.677 13.758 9.828 36 HB2 ASN 5 HB2 ASN 5 6.150 13.780 9.872 37 HB3 ASN 5 HB1 ASN 5 6.166 13.916 8.114 38 HD21 ASN 5 HD21 ASN 5 5.209 15.943 7.169 39 HD22 ASN 5 HD22 ASN 5 5.164 17.357 8.106 40 H GLU 6 HN GLU 6 4.605 12.940 6.467 41 HA GLU 6 HA GLU 6 3.122 15.145 5.333 42 HB2 GLU 6 HB2 GLU 6 3.368 13.883 3.181 43 HB3 GLU 6 HB1 GLU 6 4.891 14.125 4.028 44 HG2 GLU 6 HG2 GLU 6 5.052 11.863 3.492 45 HG3 GLU 6 HG1 GLU 6 4.348 11.775 5.095 46 H LEU 7 HN LEU 7 2.355 11.808 6.151 47 HA LEU 7 HA LEU 7 -0.155 11.635 4.806 48 HB2 LEU 7 HB2 LEU 7 1.237 9.809 6.086 49 HB3 LEU 7 HB1 LEU 7 0.342 10.360 7.500 50 HG LEU 7 HG LEU 7 -1.769 10.052 5.923 51 HD11 LEU 7 HD11 LEU 7 -1.512 8.276 4.281 52 HD12 LEU 7 HD12 LEU 7 0.181 8.061 4.719 53 HD13 LEU 7 HD13 LEU 7 -0.338 9.535 3.906 54 HD21 LEU 7 HD21 LEU 7 -1.872 7.631 6.634 55 HD22 LEU 7 HD22 LEU 7 -1.473 8.750 7.939 56 HD23 LEU 7 HD23 LEU 7 -0.203 7.785 7.187 57 H LYS 8 HN LYS 8 0.812 13.074 7.857 58 HA LYS 8 HA LYS 8 -1.902 13.602 8.750 59 HB2 LYS 8 HB2 LYS 8 0.800 14.666 9.610 60 HB3 LYS 8 HB1 LYS 8 -0.715 15.146 10.379 61 HG2 LYS 8 HG2 LYS 8 -1.209 12.822 10.946 62 HG3 LYS 8 HG1 LYS 8 0.236 12.280 10.094 63 HD2 LYS 8 HD2 LYS 8 0.739 12.367 12.465 64 HD3 LYS 8 HD1 LYS 8 1.618 13.666 11.661 65 HE2 LYS 8 HE2 LYS 8 -1.116 14.255 12.767 66 HE3 LYS 8 HE1 LYS 8 0.251 14.155 13.876 67 HZ1 LYS 8 HZ1 LYS 8 0.651 15.711 11.449 68 HZ2 LYS 8 HZ2 LYS 8 1.201 15.997 13.030 69 HZ3 LYS 8 HZ3 LYS 8 -0.400 16.372 12.605 70 H VAL 9 HN VAL 9 0.576 15.382 6.942 71 HA VAL 9 HA VAL 9 -0.674 17.942 6.956 72 HB VAL 9 HB VAL 9 1.110 16.632 4.883 73 HG11 VAL 9 HG11 VAL 9 0.081 19.466 5.144 74 HG12 VAL 9 HG12 VAL 9 -0.019 18.403 3.740 75 HG13 VAL 9 HG13 VAL 9 1.537 19.071 4.231 76 HG21 VAL 9 HG21 VAL 9 1.963 17.063 7.263 77 HG22 VAL 9 HG22 VAL 9 1.779 18.780 6.908 78 HG23 VAL 9 HG23 VAL 9 2.896 17.800 5.961 79 H GLU 10 HN GLU 10 -0.997 15.259 4.581 80 HA GLU 10 HA GLU 10 -2.827 16.701 2.906 81 HB2 GLU 10 HB2 GLU 10 -3.332 14.539 1.894 82 HB3 GLU 10 HB1 GLU 10 -1.598 14.648 2.193 83 HG2 GLU 10 HG2 GLU 10 -1.997 13.467 4.369 84 HG3 GLU 10 HG1 GLU 10 -3.652 13.167 3.850 85 H ARG 11 HN ARG 11 -3.352 14.463 5.651 86 HA ARG 11 HA ARG 11 -6.214 14.460 5.487 87 HB2 ARG 11 HB2 ARG 11 -4.861 12.906 6.909 88 HB3 ARG 11 HB1 ARG 11 -4.485 14.262 7.971 89 HG2 ARG 11 HG2 ARG 11 -6.914 14.582 8.393 90 HG3 ARG 11 HG1 ARG 11 -7.257 13.179 7.379 91 HD2 ARG 11 HD2 ARG 11 -5.519 13.141 9.860 92 HD3 ARG 11 HD1 ARG 11 -7.195 12.598 9.801 93 HE ARG 11 HE ARG 11 -6.266 10.995 7.924 94 HH11 ARG 11 HH21 ARG 11 -4.658 11.991 10.836 95 HH12 ARG 11 HH22 ARG 11 -3.601 10.621 10.855 96 HH21 ARG 11 HH11 ARG 11 -4.895 9.222 7.967 97 HH22 ARG 11 HH12 ARG 11 -3.733 9.063 9.242 98 H ILE 12 HN ILE 12 -3.963 16.516 7.353 99 HA ILE 12 HA ILE 12 -6.021 18.168 8.499 100 HB ILE 12 HB ILE 12 -3.063 18.667 8.056 101 HG12 ILE 12 HG12 ILE 12 -4.584 18.074 10.608 102 HG13 ILE 12 HG11 ILE 12 -3.831 16.814 9.630 103 HG21 ILE 12 HG21 ILE 12 -3.467 20.446 9.859 104 HG22 ILE 12 HG22 ILE 12 -5.184 20.286 9.486 105 HG23 ILE 12 HG23 ILE 12 -4.059 20.832 8.243 106 HD11 ILE 12 HD11 ILE 12 -2.419 19.178 10.902 107 HD12 ILE 12 HD12 ILE 12 -1.647 17.998 9.843 108 HD13 ILE 12 HD13 ILE 12 -2.291 17.493 11.405 109 H ARG 13 HN ARG 13 -3.953 18.545 5.617 110 HA ARG 13 HA ARG 13 -4.809 21.157 4.910 111 HB2 ARG 13 HB2 ARG 13 -2.891 19.949 3.853 112 HB3 ARG 13 HB1 ARG 13 -4.049 18.913 3.015 113 HG2 ARG 13 HG2 ARG 13 -5.027 20.842 1.893 114 HG3 ARG 13 HG1 ARG 13 -3.982 21.935 2.797 115 HD2 ARG 13 HD2 ARG 13 -2.775 21.774 0.828 116 HD3 ARG 13 HD1 ARG 13 -2.060 20.425 1.710 117 HE ARG 13 HE ARG 13 -4.016 19.101 0.464 118 HH11 ARG 13 HH21 ARG 13 -1.951 21.626 -0.709 119 HH12 ARG 13 HH22 ARG 13 -2.116 21.154 -2.366 120 HH21 ARG 13 HH11 ARG 13 -4.225 18.497 -1.699 121 HH22 ARG 13 HH12 ARG 13 -3.392 19.396 -2.922 122 H LEU 14 HN LEU 14 -6.154 17.975 4.041 123 HA LEU 14 HA LEU 14 -8.463 19.307 2.717 124 HB2 LEU 14 HB2 LEU 14 -7.761 16.366 3.001 125 HB3 LEU 14 HB1 LEU 14 -9.062 17.026 2.010 126 HG LEU 14 HG LEU 14 -6.116 17.666 1.655 127 HD11 LEU 14 HD11 LEU 14 -7.983 15.743 0.264 128 HD12 LEU 14 HD12 LEU 14 -6.392 15.420 0.952 129 HD13 LEU 14 HD13 LEU 14 -6.536 16.364 -0.530 130 HD21 LEU 14 HD21 LEU 14 -7.232 19.526 0.771 131 HD22 LEU 14 HD22 LEU 14 -8.649 18.587 0.304 132 HD23 LEU 14 HD23 LEU 14 -7.163 18.473 -0.639 133 H SER 15 HN SER 15 -7.563 18.352 5.776 134 HA SER 15 HA SER 15 -8.756 17.767 7.724 135 HB2 SER 15 HB2 SER 15 -9.487 20.103 7.316 136 HB3 SER 15 HB1 SER 15 -10.830 19.501 6.348 137 HG SER 15 HG SER 15 -10.951 18.160 8.565 138 H LEU 16 HN LEU 16 -8.953 15.490 6.967 139 HA LEU 16 HA LEU 16 -11.756 14.760 6.154 140 HB2 LEU 16 HB2 LEU 16 -9.217 13.121 5.906 141 HB3 LEU 16 HB1 LEU 16 -10.811 12.685 5.285 142 HG LEU 16 HG LEU 16 -9.211 15.117 4.440 143 HD11 LEU 16 HD11 LEU 16 -8.285 12.918 3.670 144 HD12 LEU 16 HD12 LEU 16 -8.848 13.935 2.345 145 HD13 LEU 16 HD13 LEU 16 -9.834 12.581 2.897 146 HD21 LEU 16 HD21 LEU 16 -11.954 14.071 3.745 147 HD22 LEU 16 HD22 LEU 16 -11.037 14.986 2.547 148 HD23 LEU 16 HD23 LEU 16 -11.450 15.726 4.090 149 H THR 17 HN THR 17 -12.942 13.578 7.572 150 HA THR 17 HA THR 17 -11.769 12.994 10.213 151 HB THR 17 HB THR 17 -13.987 12.628 10.950 152 HG1 THR 17 HG1 THR 17 -15.527 11.879 9.674 153 HG21 THR 17 HG21 THR 17 -15.162 14.583 10.240 154 HG22 THR 17 HG22 THR 17 -14.333 14.597 8.684 155 HG23 THR 17 HG23 THR 17 -13.447 14.979 10.162 156 H ALA 18 HN ALA 18 -12.006 10.885 11.209 157 HA ALA 18 HA ALA 18 -11.133 8.733 9.486 158 HB1 ALA 18 HB1 ALA 18 -10.342 8.697 11.741 159 HB2 ALA 18 HB2 ALA 18 -11.485 7.359 11.622 160 HB3 ALA 18 HB3 ALA 18 -11.972 8.871 12.389 161 H LYS 19 HN LYS 19 -14.193 9.585 11.057 162 HA LYS 19 HA LYS 19 -15.579 7.168 10.378 163 HB2 LYS 19 HB2 LYS 19 -16.359 8.827 12.070 164 HB3 LYS 19 HB1 LYS 19 -16.747 9.939 10.760 165 HG2 LYS 19 HG2 LYS 19 -18.295 8.258 9.799 166 HG3 LYS 19 HG1 LYS 19 -17.930 7.169 11.135 167 HD2 LYS 19 HD2 LYS 19 -19.004 9.960 11.588 168 HD3 LYS 19 HD1 LYS 19 -20.070 8.580 11.342 169 HE2 LYS 19 HE2 LYS 19 -18.836 7.437 13.258 170 HE3 LYS 19 HE1 LYS 19 -18.073 8.993 13.582 171 HZ1 LYS 19 HZ1 LYS 19 -20.429 8.212 14.595 172 HZ2 LYS 19 HZ2 LYS 19 -20.933 9.112 13.245 173 HZ3 LYS 19 HZ3 LYS 19 -19.945 9.829 14.427 174 H SER 20 HN SER 20 -15.470 10.356 8.741 175 HA SER 20 HA SER 20 -17.161 9.585 6.570 176 HB2 SER 20 HB2 SER 20 -16.581 11.942 7.064 177 HB3 SER 20 HB1 SER 20 -14.913 11.622 6.596 178 HG SER 20 HG SER 20 -15.939 10.851 4.551 179 H VAL 21 HN VAL 21 -13.623 9.541 6.946 180 HA VAL 21 HA VAL 21 -13.084 8.529 4.321 181 HB VAL 21 HB VAL 21 -11.477 8.356 6.885 182 HG11 VAL 21 HG11 VAL 21 -9.571 7.997 5.186 183 HG12 VAL 21 HG12 VAL 21 -10.838 7.579 4.033 184 HG13 VAL 21 HG13 VAL 21 -10.630 6.622 5.499 185 HG21 VAL 21 HG21 VAL 21 -10.318 10.275 6.072 186 HG22 VAL 21 HG22 VAL 21 -12.025 10.631 5.814 187 HG23 VAL 21 HG23 VAL 21 -11.019 10.112 4.462 188 H ALA 22 HN ALA 22 -13.512 6.879 7.466 189 HA ALA 22 HA ALA 22 -12.926 4.263 6.497 190 HB1 ALA 22 HB1 ALA 22 -14.584 5.249 8.817 191 HB2 ALA 22 HB2 ALA 22 -12.969 4.539 8.850 192 HB3 ALA 22 HB3 ALA 22 -14.370 3.530 8.487 193 H GLU 23 HN GLU 23 -16.047 6.025 6.653 194 HA GLU 23 HA GLU 23 -17.579 3.784 5.674 195 HB2 GLU 23 HB2 GLU 23 -18.119 6.760 5.698 196 HB3 GLU 23 HB1 GLU 23 -19.275 5.589 5.060 197 HG2 GLU 23 HG2 GLU 23 -19.318 4.427 7.225 198 HG3 GLU 23 HG1 GLU 23 -18.134 5.564 7.873 199 H GLU 24 HN GLU 24 -16.055 6.574 4.050 200 HA GLU 24 HA GLU 24 -16.964 5.846 1.407 201 HB2 GLU 24 HB2 GLU 24 -14.677 7.562 2.403 202 HB3 GLU 24 HB1 GLU 24 -15.016 7.339 0.688 203 HG2 GLU 24 HG2 GLU 24 -17.075 8.322 2.678 204 HG3 GLU 24 HG1 GLU 24 -16.075 9.399 1.703 205 H MET 25 HN MET 25 -13.964 5.218 3.217 206 HA MET 25 HA MET 25 -12.644 3.776 1.112 207 HB2 MET 25 HB2 MET 25 -12.319 3.843 4.113 208 HB3 MET 25 HB1 MET 25 -11.322 2.800 3.102 209 HG2 MET 25 HG2 MET 25 -11.595 5.786 2.676 210 HG3 MET 25 HG1 MET 25 -10.290 5.050 3.603 211 HE1 MET 25 HE1 MET 25 -8.847 3.370 2.932 212 HE2 MET 25 HE2 MET 25 -8.084 3.257 1.350 213 HE3 MET 25 HE3 MET 25 -9.507 2.282 1.702 214 H GLY 26 HN GLY 26 -14.779 2.768 3.765 215 HA2 GLY 26 HA2 GLY 26 -16.252 0.872 3.648 216 HA3 GLY 26 HA1 GLY 26 -15.291 0.227 2.316 217 H ILE 27 HN ILE 27 -13.754 1.431 5.213 218 HA ILE 27 HA ILE 27 -13.181 -1.381 6.095 219 HB ILE 27 HB ILE 27 -10.906 -0.636 6.701 220 HG12 ILE 27 HG12 ILE 27 -11.626 1.941 5.267 221 HG13 ILE 27 HG11 ILE 27 -11.501 1.792 7.019 222 HG21 ILE 27 HG21 ILE 27 -11.472 0.103 3.823 223 HG22 ILE 27 HG22 ILE 27 -11.508 -1.563 4.401 224 HG23 ILE 27 HG23 ILE 27 -10.013 -0.631 4.486 225 HD11 ILE 27 HD11 ILE 27 -9.302 1.429 4.976 226 HD12 ILE 27 HD12 ILE 27 -9.142 0.911 6.654 227 HD13 ILE 27 HD13 ILE 27 -9.386 2.617 6.278 228 H SER 28 HN SER 28 -12.504 -1.455 8.433 229 HA SER 28 HA SER 28 -14.389 0.067 10.023 230 HB2 SER 28 HB2 SER 28 -12.124 -1.772 10.845 231 HB3 SER 28 HB1 SER 28 -13.329 -1.111 11.946 232 HG SER 28 HG SER 28 -14.010 -2.558 9.609 233 H ARG 29 HN ARG 29 -13.821 1.522 11.757 234 HA ARG 29 HA ARG 29 -11.863 3.486 11.036 235 HB2 ARG 29 HB2 ARG 29 -13.289 3.012 13.677 236 HB3 ARG 29 HB1 ARG 29 -12.362 4.463 13.280 237 HG2 ARG 29 HG2 ARG 29 -13.838 4.930 11.386 238 HG3 ARG 29 HG1 ARG 29 -14.735 3.444 11.689 239 HD2 ARG 29 HD2 ARG 29 -16.058 5.127 12.691 240 HD3 ARG 29 HD1 ARG 29 -15.176 4.415 14.042 241 HE ARG 29 HE ARG 29 -13.550 6.506 13.247 242 HH11 ARG 29 HH21 ARG 29 -16.886 6.117 14.025 243 HH12 ARG 29 HH22 ARG 29 -17.054 7.706 14.690 244 HH21 ARG 29 HH11 ARG 29 -13.753 8.590 14.110 245 HH22 ARG 29 HH12 ARG 29 -15.282 9.105 14.739 246 H GLN 30 HN GLN 30 -11.819 0.716 13.221 247 HA GLN 30 HA GLN 30 -9.381 1.259 14.584 248 HB2 GLN 30 HB2 GLN 30 -10.641 -1.372 13.750 249 HB3 GLN 30 HB1 GLN 30 -9.259 -1.247 14.839 250 HG2 GLN 30 HG2 GLN 30 -11.913 0.131 15.328 251 HG3 GLN 30 HG1 GLN 30 -11.483 -1.436 16.013 252 HE21 GLN 30 HE21 GLN 30 -9.935 -1.486 17.745 253 HE22 GLN 30 HE22 GLN 30 -9.343 -0.076 18.480 254 H GLN 31 HN GLN 31 -10.019 -0.324 11.454 255 HA GLN 31 HA GLN 31 -7.311 -1.076 10.904 256 HB2 GLN 31 HB2 GLN 31 -9.616 -0.403 9.053 257 HB3 GLN 31 HB1 GLN 31 -8.074 -1.049 8.493 258 HG2 GLN 31 HG2 GLN 31 -8.375 -3.049 9.868 259 HG3 GLN 31 HG1 GLN 31 -9.880 -2.400 10.519 260 HE21 GLN 31 HE21 GLN 31 -8.667 -4.439 8.117 261 HE22 GLN 31 HE22 GLN 31 -10.002 -4.421 7.070 262 H LEU 32 HN LEU 32 -9.149 1.897 10.303 263 HA LEU 32 HA LEU 32 -7.172 3.229 8.734 264 HB2 LEU 32 HB2 LEU 32 -9.506 4.039 8.982 265 HB3 LEU 32 HB1 LEU 32 -9.182 4.423 10.671 266 HG LEU 32 HG LEU 32 -7.416 6.017 9.960 267 HD11 LEU 32 HD11 LEU 32 -7.628 6.629 7.394 268 HD12 LEU 32 HD12 LEU 32 -8.191 4.964 7.245 269 HD13 LEU 32 HD13 LEU 32 -6.586 5.300 7.895 270 HD21 LEU 32 HD21 LEU 32 -9.022 7.644 8.798 271 HD22 LEU 32 HD22 LEU 32 -9.561 6.981 10.341 272 HD23 LEU 32 HD23 LEU 32 -10.204 6.335 8.832 273 H CYS 33 HN CYS 33 -7.698 3.078 12.251 274 HA CYS 33 HA CYS 33 -5.620 4.897 12.986 275 HB2 CYS 33 HB2 CYS 33 -6.765 2.504 14.458 276 HB3 CYS 33 HB1 CYS 33 -5.678 3.689 15.186 277 HG CYS 33 HG CYS 33 -8.309 4.757 13.921 278 H ASN 34 HN ASN 34 -5.607 1.467 12.169 279 HA ASN 34 HA ASN 34 -2.972 0.847 13.066 280 HB2 ASN 34 HB2 ASN 34 -4.726 -0.804 12.270 281 HB3 ASN 34 HB1 ASN 34 -4.330 -0.315 10.623 282 HD21 ASN 34 HD21 ASN 34 -3.342 -2.344 10.011 283 HD22 ASN 34 HD22 ASN 34 -1.885 -2.883 10.696 284 H ILE 35 HN ILE 35 -4.165 2.243 10.025 285 HA ILE 35 HA ILE 35 -1.670 2.189 8.631 286 HB ILE 35 HB ILE 35 -4.039 4.068 8.400 287 HG12 ILE 35 HG12 ILE 35 -3.146 1.806 6.591 288 HG13 ILE 35 HG11 ILE 35 -4.329 1.596 7.882 289 HG21 ILE 35 HG21 ILE 35 -3.018 4.517 6.101 290 HG22 ILE 35 HG22 ILE 35 -1.539 3.779 6.717 291 HG23 ILE 35 HG23 ILE 35 -2.173 5.244 7.467 292 HD11 ILE 35 HD11 ILE 35 -4.575 3.540 5.566 293 HD12 ILE 35 HD12 ILE 35 -5.756 3.333 6.858 294 HD13 ILE 35 HD13 ILE 35 -5.451 2.017 5.724 295 H GLU 36 HN GLU 36 -3.152 4.641 10.757 296 HA GLU 36 HA GLU 36 -1.072 6.590 10.473 297 HB2 GLU 36 HB2 GLU 36 -3.022 6.042 12.727 298 HB3 GLU 36 HB1 GLU 36 -1.938 7.433 12.699 299 HG2 GLU 36 HG2 GLU 36 -2.938 8.230 10.625 300 HG3 GLU 36 HG1 GLU 36 -3.946 6.783 10.521 301 H GLN 37 HN GLN 37 -1.443 3.785 12.600 302 HA GLN 37 HA GLN 37 1.048 4.439 14.054 303 HB2 GLN 37 HB2 GLN 37 -0.881 2.106 14.240 304 HB3 GLN 37 HB1 GLN 37 0.544 2.296 15.262 305 HG2 GLN 37 HG2 GLN 37 -0.315 4.418 16.126 306 HG3 GLN 37 HG1 GLN 37 -1.711 4.315 15.051 307 HE21 GLN 37 HE21 GLN 37 -2.668 4.463 17.475 308 HE22 GLN 37 HE22 GLN 37 -3.026 2.962 18.181 309 H SER 38 HN SER 38 0.521 3.299 11.066 310 HA SER 38 HA SER 38 2.022 0.856 10.963 311 HB2 SER 38 HB2 SER 38 2.179 1.277 8.564 312 HB3 SER 38 HB1 SER 38 0.557 1.676 9.121 313 HG SER 38 HG SER 38 2.393 3.247 7.951 314 H GLU 39 HN GLU 39 4.227 0.632 10.081 315 HA GLU 39 HA GLU 39 6.015 2.854 10.962 316 HB2 GLU 39 HB2 GLU 39 7.742 0.905 10.916 317 HB3 GLU 39 HB1 GLU 39 6.590 0.987 12.245 318 HG2 GLU 39 HG2 GLU 39 5.977 -0.585 9.741 319 HG3 GLU 39 HG1 GLU 39 6.894 -1.283 11.071 320 H THR 40 HN THR 40 6.871 3.976 9.338 321 HA THR 40 HA THR 40 7.562 4.563 7.180 322 HB THR 40 HB THR 40 9.365 3.223 6.398 323 HG1 THR 40 HG1 THR 40 9.085 1.158 6.345 324 HG21 THR 40 HG21 THR 40 9.640 4.291 8.650 325 HG22 THR 40 HG22 THR 40 10.668 2.879 8.402 326 HG23 THR 40 HG23 THR 40 9.204 2.744 9.376 327 H ALA 41 HN ALA 41 7.873 3.325 4.839 328 HA ALA 41 HA ALA 41 5.123 2.517 4.169 329 HB1 ALA 41 HB1 ALA 41 6.006 2.598 1.808 330 HB2 ALA 41 HB2 ALA 41 7.571 3.063 2.472 331 HB3 ALA 41 HB3 ALA 41 6.174 4.116 2.690 332 HA PRO 42 HA PRO 42 6.206 -1.816 4.099 333 HB2 PRO 42 HB2 PRO 42 4.205 -2.835 2.587 334 HB3 PRO 42 HB1 PRO 42 3.897 -2.141 4.194 335 HG2 PRO 42 HG2 PRO 42 3.578 -0.860 1.508 336 HG3 PRO 42 HG1 PRO 42 2.442 -0.890 2.872 337 HD2 PRO 42 HD2 PRO 42 4.063 1.247 2.406 338 HD3 PRO 42 HD1 PRO 42 3.606 0.752 4.053 339 H VAL 43 HN VAL 43 6.981 -3.515 2.642 340 HA VAL 43 HA VAL 43 8.572 -2.552 0.474 341 HB VAL 43 HB VAL 43 8.886 -4.994 -0.038 342 HG11 VAL 43 HG11 VAL 43 10.206 -3.770 1.712 343 HG12 VAL 43 HG12 VAL 43 10.037 -5.495 2.041 344 HG13 VAL 43 HG13 VAL 43 9.045 -4.329 2.915 345 HG21 VAL 43 HG21 VAL 43 7.008 -5.383 2.314 346 HG22 VAL 43 HG22 VAL 43 7.791 -6.646 1.365 347 HG23 VAL 43 HG23 VAL 43 6.542 -5.642 0.633 348 H VAL 44 HN VAL 44 5.292 -3.797 0.619 349 HA VAL 44 HA VAL 44 4.947 -4.475 -2.127 350 HB VAL 44 HB VAL 44 2.968 -3.361 -0.115 351 HG11 VAL 44 HG11 VAL 44 2.017 -2.969 -2.266 352 HG12 VAL 44 HG12 VAL 44 1.297 -4.479 -1.705 353 HG13 VAL 44 HG13 VAL 44 2.606 -4.511 -2.888 354 HG21 VAL 44 HG21 VAL 44 4.098 -5.578 0.378 355 HG22 VAL 44 HG22 VAL 44 3.362 -6.203 -1.098 356 HG23 VAL 44 HG23 VAL 44 2.343 -5.665 0.237 357 H VAL 45 HN VAL 45 4.400 -1.387 -0.415 358 HA VAL 45 HA VAL 45 3.599 0.068 -2.758 359 HB VAL 45 HB VAL 45 4.761 0.978 -0.113 360 HG11 VAL 45 HG11 VAL 45 5.299 2.735 -1.633 361 HG12 VAL 45 HG12 VAL 45 3.785 3.234 -0.878 362 HG13 VAL 45 HG13 VAL 45 3.776 2.550 -2.503 363 HG21 VAL 45 HG21 VAL 45 1.955 1.383 -1.158 364 HG22 VAL 45 HG22 VAL 45 2.521 1.410 0.511 365 HG23 VAL 45 HG23 VAL 45 2.406 -0.120 -0.356 366 H LYS 46 HN LYS 46 6.751 -0.360 -1.155 367 HA LYS 46 HA LYS 46 8.231 1.391 -2.850 368 HB2 LYS 46 HB2 LYS 46 9.069 -1.112 -1.359 369 HB3 LYS 46 HB1 LYS 46 10.203 -0.024 -2.159 370 HG2 LYS 46 HG2 LYS 46 9.424 1.838 -0.749 371 HG3 LYS 46 HG1 LYS 46 8.272 0.762 0.043 372 HD2 LYS 46 HD2 LYS 46 10.133 -0.652 0.838 373 HD3 LYS 46 HD1 LYS 46 11.286 0.422 0.049 374 HE2 LYS 46 HE2 LYS 46 10.526 2.292 1.462 375 HE3 LYS 46 HE1 LYS 46 9.358 1.229 2.246 376 HZ1 LYS 46 HZ1 LYS 46 11.474 -0.209 2.672 377 HZ2 LYS 46 HZ2 LYS 46 11.107 1.101 3.688 378 HZ3 LYS 46 HZ3 LYS 46 12.283 1.269 2.475 379 H TYR 47 HN TYR 47 7.431 -2.066 -3.162 380 HA TYR 47 HA TYR 47 8.974 -2.579 -5.511 381 HB2 TYR 47 HB2 TYR 47 7.918 -4.367 -4.158 382 HB3 TYR 47 HB1 TYR 47 6.325 -3.799 -4.657 383 HD1 TYR 47 HD2 TYR 47 5.666 -3.905 -7.082 384 HD2 TYR 47 HD1 TYR 47 9.259 -5.727 -5.594 385 HE1 TYR 47 HE2 TYR 47 5.828 -5.279 -9.142 386 HE2 TYR 47 HE1 TYR 47 9.415 -7.100 -7.655 387 HH TYR 47 HH TYR 47 6.926 -6.888 -10.194 388 H ILE 48 HN ILE 48 5.625 -1.461 -5.078 389 HA ILE 48 HA ILE 48 4.955 -1.331 -7.848 390 HB ILE 48 HB ILE 48 3.925 0.236 -5.467 391 HG12 ILE 48 HG12 ILE 48 2.649 -2.028 -7.027 392 HG13 ILE 48 HG11 ILE 48 3.611 -2.290 -5.572 393 HG21 ILE 48 HG21 ILE 48 1.931 0.598 -7.049 394 HG22 ILE 48 HG22 ILE 48 3.028 0.143 -8.353 395 HG23 ILE 48 HG23 ILE 48 3.374 1.561 -7.364 396 HD11 ILE 48 HD11 ILE 48 1.104 -0.593 -5.767 397 HD12 ILE 48 HD12 ILE 48 2.082 -0.787 -4.315 398 HD13 ILE 48 HD13 ILE 48 1.228 -2.172 -4.992 399 H ALA 49 HN ALA 49 6.381 1.093 -5.646 400 HA ALA 49 HA ALA 49 6.423 3.272 -7.463 401 HB1 ALA 49 HB1 ALA 49 8.192 4.195 -6.082 402 HB2 ALA 49 HB2 ALA 49 8.582 2.599 -5.441 403 HB3 ALA 49 HB3 ALA 49 7.054 3.368 -5.018 404 H PHE 50 HN PHE 50 8.522 0.455 -7.146 405 HA PHE 50 HA PHE 50 10.625 1.336 -8.860 406 HB2 PHE 50 HB2 PHE 50 10.539 -0.756 -7.347 407 HB3 PHE 50 HB1 PHE 50 9.692 -1.534 -8.685 408 HD1 PHE 50 HD1 PHE 50 12.824 0.205 -7.717 409 HD2 PHE 50 HD2 PHE 50 10.866 -2.252 -10.644 410 HE1 PHE 50 HE1 PHE 50 14.993 -0.177 -8.845 411 HE2 PHE 50 HE2 PHE 50 13.039 -2.635 -11.774 412 HZ PHE 50 HZ PHE 50 15.105 -1.597 -10.875 413 H LEU 51 HN LEU 51 7.589 -0.417 -9.571 414 HA LEU 51 HA LEU 51 8.058 -0.741 -12.383 415 HB2 LEU 51 HB2 LEU 51 5.563 -0.602 -10.689 416 HB3 LEU 51 HB1 LEU 51 5.434 -0.693 -12.439 417 HG LEU 51 HG LEU 51 5.340 -2.910 -11.125 418 HD11 LEU 51 HD11 LEU 51 6.400 -4.127 -12.873 419 HD12 LEU 51 HD12 LEU 51 7.512 -2.809 -13.225 420 HD13 LEU 51 HD13 LEU 51 5.801 -2.647 -13.617 421 HD21 LEU 51 HD21 LEU 51 8.350 -2.617 -11.092 422 HD22 LEU 51 HD22 LEU 51 7.365 -3.877 -10.351 423 HD23 LEU 51 HD23 LEU 51 7.347 -2.245 -9.691 424 H ARG 52 HN ARG 52 6.611 1.932 -10.528 425 HA ARG 52 HA ARG 52 5.845 3.489 -12.809 426 HB2 ARG 52 HB2 ARG 52 4.890 4.252 -10.803 427 HB3 ARG 52 HB1 ARG 52 6.410 4.139 -9.922 428 HG2 ARG 52 HG2 ARG 52 7.269 6.115 -10.933 429 HG3 ARG 52 HG1 ARG 52 6.035 6.101 -12.191 430 HD2 ARG 52 HD2 ARG 52 5.217 6.331 -9.307 431 HD3 ARG 52 HD1 ARG 52 5.789 7.757 -10.169 432 HE ARG 52 HE ARG 52 3.949 6.989 -11.921 433 HH11 ARG 52 HH21 ARG 52 3.791 6.809 -8.457 434 HH12 ARG 52 HH22 ARG 52 2.071 6.977 -8.414 435 HH21 ARG 52 HH11 ARG 52 1.722 7.234 -11.847 436 HH22 ARG 52 HH12 ARG 52 0.906 7.221 -10.319 437 H SER 53 HN SER 53 8.878 3.246 -10.982 438 HA SER 53 HA SER 53 10.260 5.395 -12.219 439 HB2 SER 53 HB2 SER 53 11.095 4.048 -10.266 440 HB3 SER 53 HB1 SER 53 11.441 2.732 -11.383 441 HG SER 53 HG SER 53 13.206 3.736 -11.878 442 H LYS 54 HN LYS 54 9.207 2.366 -13.486 443 HA LYS 54 HA LYS 54 11.102 2.446 -15.766 444 HB2 LYS 54 HB2 LYS 54 8.804 0.553 -15.185 445 HB3 LYS 54 HB1 LYS 54 10.034 0.336 -16.427 446 HG2 LYS 54 HG2 LYS 54 10.649 0.531 -13.465 447 HG3 LYS 54 HG1 LYS 54 10.440 -0.993 -14.323 448 HD2 LYS 54 HD2 LYS 54 12.273 -0.177 -15.920 449 HD3 LYS 54 HD1 LYS 54 12.596 1.089 -14.737 450 HE2 LYS 54 HE2 LYS 54 13.064 -0.543 -13.019 451 HE3 LYS 54 HE1 LYS 54 12.595 -1.867 -14.084 452 HZ1 LYS 54 HZ1 LYS 54 14.573 -1.842 -15.071 453 HZ2 LYS 54 HZ2 LYS 54 15.105 -0.856 -13.795 454 HZ3 LYS 54 HZ3 LYS 54 14.572 -0.156 -15.248 455 H GLY 55 HN GLY 55 8.438 4.151 -15.015 456 HA2 GLY 55 HA2 GLY 55 7.160 5.549 -16.435 457 HA3 GLY 55 HA1 GLY 55 7.864 4.724 -17.826 458 H VAL 56 HN VAL 56 6.508 2.665 -15.396 459 HA VAL 56 HA VAL 56 4.560 1.641 -17.283 460 HB VAL 56 HB VAL 56 4.946 1.152 -14.318 461 HG11 VAL 56 HG11 VAL 56 3.030 -0.054 -16.324 462 HG12 VAL 56 HG12 VAL 56 2.661 0.626 -14.739 463 HG13 VAL 56 HG13 VAL 56 3.513 -0.913 -14.862 464 HG21 VAL 56 HG21 VAL 56 6.136 -0.780 -14.975 465 HG22 VAL 56 HG22 VAL 56 6.683 0.432 -16.128 466 HG23 VAL 56 HG23 VAL 56 5.469 -0.753 -16.606 467 H ASP 57 HN ASP 57 2.430 2.171 -17.519 468 HA ASP 57 HA ASP 57 1.453 4.607 -16.309 469 HB2 ASP 57 HB2 ASP 57 -0.738 3.852 -17.422 470 HB3 ASP 57 HB1 ASP 57 0.641 4.109 -18.493 471 H LEU 58 HN LEU 58 1.875 3.703 -14.047 472 HA LEU 58 HA LEU 58 0.225 1.656 -12.929 473 HB2 LEU 58 HB2 LEU 58 2.276 2.591 -11.851 474 HB3 LEU 58 HB1 LEU 58 1.398 4.087 -11.547 475 HG LEU 58 HG LEU 58 -0.284 2.783 -10.228 476 HD11 LEU 58 HD11 LEU 58 0.755 0.456 -9.468 477 HD12 LEU 58 HD12 LEU 58 1.543 0.532 -11.042 478 HD13 LEU 58 HD13 LEU 58 -0.216 0.563 -10.934 479 HD21 LEU 58 HD21 LEU 58 1.594 3.941 -9.130 480 HD22 LEU 58 HD22 LEU 58 2.602 2.511 -9.342 481 HD23 LEU 58 HD23 LEU 58 1.197 2.448 -8.278 482 H ASN 59 HN ASN 59 -0.208 5.184 -13.172 483 HA ASN 59 HA ASN 59 -2.587 5.385 -11.637 484 HB2 ASN 59 HB2 ASN 59 -2.999 7.422 -13.195 485 HB3 ASN 59 HB1 ASN 59 -1.540 7.420 -12.207 486 HD21 ASN 59 HD21 ASN 59 0.421 7.648 -13.304 487 HD22 ASN 59 HD22 ASN 59 0.614 7.473 -14.981 488 H ALA 60 HN ALA 60 -2.149 4.733 -15.114 489 HA ALA 60 HA ALA 60 -4.942 4.688 -15.740 490 HB1 ALA 60 HB1 ALA 60 -2.890 2.973 -17.138 491 HB2 ALA 60 HB2 ALA 60 -2.909 4.724 -17.344 492 HB3 ALA 60 HB3 ALA 60 -4.310 3.766 -17.820 493 H LEU 61 HN LEU 61 -2.723 2.263 -14.465 494 HA LEU 61 HA LEU 61 -4.351 -0.035 -14.844 495 HB2 LEU 61 HB2 LEU 61 -1.941 -0.017 -14.112 496 HB3 LEU 61 HB1 LEU 61 -2.481 0.528 -12.526 497 HG LEU 61 HG LEU 61 -4.044 -1.605 -12.638 498 HD11 LEU 61 HD11 LEU 61 -2.978 -3.460 -13.879 499 HD12 LEU 61 HD12 LEU 61 -1.809 -2.331 -14.559 500 HD13 LEU 61 HD13 LEU 61 -3.518 -2.188 -14.971 501 HD21 LEU 61 HD21 LEU 61 -2.409 -1.504 -10.925 502 HD22 LEU 61 HD22 LEU 61 -1.074 -1.543 -12.077 503 HD23 LEU 61 HD23 LEU 61 -2.030 -2.996 -11.785 504 H PHE 62 HN PHE 62 -4.142 2.158 -11.997 505 HA PHE 62 HA PHE 62 -6.268 0.787 -10.587 506 HB2 PHE 62 HB2 PHE 62 -4.961 3.490 -10.252 507 HB3 PHE 62 HB1 PHE 62 -6.333 3.007 -9.254 508 HD1 PHE 62 HD2 PHE 62 -6.159 1.135 -7.684 509 HD2 PHE 62 HD1 PHE 62 -2.790 2.409 -10.022 510 HE1 PHE 62 HE2 PHE 62 -4.647 -0.166 -6.210 511 HE2 PHE 62 HE1 PHE 62 -1.279 1.111 -8.546 512 HZ PHE 62 HZ PHE 62 -2.206 -0.177 -6.641 513 H ASP 63 HN ASP 63 -6.176 3.516 -12.829 514 HA ASP 63 HA ASP 63 -8.828 4.462 -12.423 515 HB2 ASP 63 HB2 ASP 63 -7.092 4.383 -14.904 516 HB3 ASP 63 HB1 ASP 63 -8.629 5.242 -14.824 517 H ARG 64 HN ARG 64 -7.520 1.790 -14.299 518 HA ARG 64 HA ARG 64 -9.901 1.115 -15.745 519 HB2 ARG 64 HB2 ARG 64 -7.543 0.301 -16.218 520 HB3 ARG 64 HB1 ARG 64 -7.727 -0.783 -14.840 521 HG2 ARG 64 HG2 ARG 64 -8.306 -2.022 -16.831 522 HG3 ARG 64 HG1 ARG 64 -9.788 -1.728 -15.921 523 HD2 ARG 64 HD2 ARG 64 -10.675 -0.420 -17.584 524 HD3 ARG 64 HD1 ARG 64 -9.140 0.397 -17.887 525 HE ARG 64 HE ARG 64 -9.405 -2.403 -18.832 526 HH11 ARG 64 HH21 ARG 64 -9.330 0.998 -19.507 527 HH12 ARG 64 HH22 ARG 64 -8.979 0.775 -21.186 528 HH21 ARG 64 HH11 ARG 64 -8.951 -2.683 -21.013 529 HH22 ARG 64 HH12 ARG 64 -8.769 -1.297 -22.036 530 H ILE 65 HN ILE 65 -8.627 0.049 -12.596 531 HA ILE 65 HA ILE 65 -10.567 -1.991 -12.115 532 HB ILE 65 HB ILE 65 -9.183 -0.273 -10.037 533 HG12 ILE 65 HG12 ILE 65 -7.487 -1.120 -11.541 534 HG13 ILE 65 HG11 ILE 65 -7.438 -2.081 -10.068 535 HG21 ILE 65 HG21 ILE 65 -9.352 -2.357 -8.674 536 HG22 ILE 65 HG22 ILE 65 -10.300 -3.089 -9.970 537 HG23 ILE 65 HG23 ILE 65 -10.927 -1.687 -9.103 538 HD11 ILE 65 HD11 ILE 65 -7.346 -3.705 -11.758 539 HD12 ILE 65 HD12 ILE 65 -8.494 -2.844 -12.781 540 HD13 ILE 65 HD13 ILE 65 -9.059 -3.683 -11.338 541 H ILE 66 HN ILE 66 -10.569 1.462 -11.189 542 HA ILE 66 HA ILE 66 -13.165 1.221 -9.888 543 HB ILE 66 HB ILE 66 -13.012 3.704 -9.724 544 HG12 ILE 66 HG12 ILE 66 -10.387 3.291 -11.182 545 HG13 ILE 66 HG11 ILE 66 -11.822 4.024 -11.898 546 HG21 ILE 66 HG21 ILE 66 -11.078 3.718 -8.233 547 HG22 ILE 66 HG22 ILE 66 -10.443 2.262 -8.998 548 HG23 ILE 66 HG23 ILE 66 -11.934 2.186 -8.058 549 HD11 ILE 66 HD11 ILE 66 -10.473 5.847 -11.154 550 HD12 ILE 66 HD12 ILE 66 -10.162 5.071 -9.600 551 HD13 ILE 66 HD13 ILE 66 -11.771 5.693 -9.970 552 H VAL 67 HN VAL 67 -15.139 2.095 -10.613 553 HA VAL 67 HA VAL 67 -16.812 2.497 -12.196 554 HB VAL 67 HB VAL 67 -14.569 3.894 -13.689 555 HG11 VAL 67 HG11 VAL 67 -16.569 5.313 -14.433 556 HG12 VAL 67 HG12 VAL 67 -17.587 4.016 -13.808 557 HG13 VAL 67 HG13 VAL 67 -16.460 3.694 -15.125 558 HG21 VAL 67 HG21 VAL 67 -16.430 4.815 -11.479 559 HG22 VAL 67 HG22 VAL 67 -15.494 5.921 -12.485 560 HG23 VAL 67 HG23 VAL 67 -14.668 4.767 -11.437 561 H ASN 68 HN ASN 68 -17.538 1.935 -14.397 562 HA ASN 68 HA ASN 68 -16.907 -0.644 -15.226 563 HB2 ASN 68 HB2 ASN 68 -17.907 1.727 -16.812 564 HB3 ASN 68 HB1 ASN 68 -17.752 0.125 -17.529 565 HD21 ASN 68 HD21 ASN 68 -19.586 -1.151 -17.344 566 HD22 ASN 68 HD22 ASN 68 -20.789 -0.971 -16.160 567 H LYS 69 HN LYS 69 -15.720 -1.379 -17.202 568 HA LYS 69 HA LYS 69 -13.012 -0.414 -17.212 569 HB2 LYS 69 HB2 LYS 69 -14.515 -2.201 -19.149 570 HB3 LYS 69 HB1 LYS 69 -12.776 -1.913 -19.225 571 HG2 LYS 69 HG2 LYS 69 -12.515 -2.790 -16.944 572 HG3 LYS 69 HG1 LYS 69 -14.256 -3.054 -16.837 573 HD2 LYS 69 HD2 LYS 69 -14.123 -4.609 -18.764 574 HD3 LYS 69 HD1 LYS 69 -12.373 -4.379 -18.811 575 HE2 LYS 69 HE2 LYS 69 -13.893 -5.400 -16.396 576 HE3 LYS 69 HE1 LYS 69 -13.064 -6.438 -17.557 577 HZ1 LYS 69 HZ1 LYS 69 -11.884 -5.546 -15.389 578 HZ2 LYS 69 HZ2 LYS 69 -11.546 -4.227 -16.404 579 HZ3 LYS 69 HZ3 LYS 69 -11.033 -5.788 -16.835 580 H LEU 70 HN LEU 70 -12.695 1.677 -17.874 581 HA LEU 70 HA LEU 70 -14.190 2.762 -20.172 582 HB2 LEU 70 HB2 LEU 70 -13.015 4.862 -19.631 583 HB3 LEU 70 HB1 LEU 70 -13.798 4.172 -18.212 584 HG LEU 70 HG LEU 70 -11.299 2.981 -18.073 585 HD11 LEU 70 HD11 LEU 70 -9.585 4.523 -18.600 586 HD12 LEU 70 HD12 LEU 70 -10.722 5.855 -18.808 587 HD13 LEU 70 HD13 LEU 70 -10.642 4.571 -20.009 588 HD21 LEU 70 HD21 LEU 70 -12.115 5.649 -16.883 589 HD22 LEU 70 HD22 LEU 70 -10.832 4.603 -16.276 590 HD23 LEU 70 HD23 LEU 70 -12.511 4.064 -16.221 591 H GLU 71 HN GLU 71 -13.402 2.734 -22.222 592 HA GLU 71 HA GLU 71 -10.505 2.799 -22.703 593 HB2 GLU 71 HB2 GLU 71 -10.733 0.795 -24.288 594 HB3 GLU 71 HB1 GLU 71 -10.673 0.455 -22.565 595 HG2 GLU 71 HG2 GLU 71 -12.488 -0.870 -23.108 596 HG3 GLU 71 HG1 GLU 71 -13.355 0.631 -22.824 597 H HIS 72 HN HIS 72 -13.547 2.092 -24.483 598 HA HIS 72 HA HIS 72 -14.207 2.906 -26.618 599 HB2 HIS 72 HB2 HIS 72 -13.513 5.516 -25.245 600 HB3 HIS 72 HB1 HIS 72 -14.730 5.259 -26.497 601 HD2 HIS 72 HD2 HIS 72 -14.695 5.525 -22.754 602 HE1 HIS 72 HE1 HIS 72 -17.924 2.934 -23.592 603 HE2 HIS 72 HE2 HIS 72 -16.819 4.348 -21.799 604 H HIS 73 HN HIS 73 -11.236 2.406 -26.354 605 HA HIS 73 HA HIS 73 -10.059 4.573 -27.984 606 HB2 HIS 73 HB2 HIS 73 -8.936 3.194 -26.032 607 HB3 HIS 73 HB1 HIS 73 -8.619 2.012 -27.299 608 HD2 HIS 73 HD2 HIS 73 -6.734 4.822 -25.813 609 HE1 HIS 73 HE1 HIS 73 -5.692 5.014 -29.902 610 HE2 HIS 73 HE2 HIS 73 -5.085 5.817 -27.572 611 H HIS 74 HN HIS 74 -9.931 4.500 -30.141 612 HA HIS 74 HA HIS 74 -9.804 1.908 -31.572 613 HB2 HIS 74 HB2 HIS 74 -11.615 2.501 -33.098 614 HB3 HIS 74 HB1 HIS 74 -12.235 2.525 -31.447 615 HD2 HIS 74 HD2 HIS 74 -11.024 5.203 -34.132 616 HE1 HIS 74 HE1 HIS 74 -13.581 7.095 -31.353 617 HE2 HIS 74 HE2 HIS 74 -12.254 7.412 -33.492 618 H HIS 75 HN HIS 75 -8.645 4.895 -31.003 619 HA HIS 75 HA HIS 75 -8.014 5.701 -33.758 620 HB2 HIS 75 HB2 HIS 75 -8.402 7.433 -32.078 621 HB3 HIS 75 HB1 HIS 75 -7.112 6.777 -31.070 622 HD2 HIS 75 HD2 HIS 75 -7.298 8.271 -34.772 623 HE1 HIS 75 HE1 HIS 75 -3.546 9.194 -33.067 624 HE2 HIS 75 HE2 HIS 75 -5.015 9.485 -35.113 625 H HIS 76 HN HIS 76 -5.561 6.277 -34.098 626 HA HIS 76 HA HIS 76 -4.099 3.786 -34.018 627 HB2 HIS 76 HB2 HIS 76 -3.080 6.573 -34.639 628 HB3 HIS 76 HB1 HIS 76 -2.296 5.054 -35.072 629 HD2 HIS 76 HD2 HIS 76 -4.272 3.377 -36.731 630 HE1 HIS 76 HE1 HIS 76 -5.774 6.885 -38.540 631 HE2 HIS 76 HE2 HIS 76 -5.669 4.356 -38.704 632 H HIS 77 HN HIS 77 -2.263 3.268 -32.768 633 HA HIS 77 HA HIS 77 -2.217 3.887 -30.064 634 HB2 HIS 77 HB2 HIS 77 0.138 3.252 -31.865 635 HB3 HIS 77 HB1 HIS 77 0.199 3.214 -30.103 636 HD2 HIS 77 HD2 HIS 77 -0.771 0.850 -28.977 637 HE1 HIS 77 HE1 HIS 77 -2.437 -0.789 -32.495 638 HE2 HIS 77 HE2 HIS 77 -1.913 -1.234 -30.053 639 H1 MET 1 HT1 MET 1 -9.521 -8.954 -12.604 640 H2 MET 1 HT2 MET 1 -10.142 -9.196 -14.167 641 H3 MET 1 HT3 MET 1 -9.952 -7.621 -13.559 642 HA MET 1 HA MET 1 -8.097 -9.213 -14.965 643 HB2 MET 1 HB2 MET 1 -8.703 -6.732 -15.176 644 HB3 MET 1 HB1 MET 1 -7.697 -6.470 -13.751 645 HG2 MET 1 HG2 MET 1 -6.295 -6.101 -15.667 646 HG3 MET 1 HG1 MET 1 -5.827 -7.654 -14.982 647 HE1 MET 1 HE1 MET 1 -5.119 -6.706 -17.915 648 HE2 MET 1 HE2 MET 1 -6.613 -5.780 -18.040 649 HE3 MET 1 HE3 MET 1 -6.291 -7.079 -19.185 650 H GLU 2 HN GLU 2 -8.503 -8.647 -11.608 651 HA GLU 2 HA GLU 2 -7.197 -9.166 -9.744 652 HB2 GLU 2 HB2 GLU 2 -5.891 -10.992 -11.784 653 HB3 GLU 2 HB1 GLU 2 -5.563 -11.046 -10.053 654 HG2 GLU 2 HG2 GLU 2 -7.937 -11.485 -9.596 655 HG3 GLU 2 HG1 GLU 2 -8.295 -11.393 -11.322 656 H LEU 3 HN LEU 3 -5.771 -7.810 -8.842 657 HA LEU 3 HA LEU 3 -3.972 -6.175 -10.331 658 HB2 LEU 3 HB2 LEU 3 -4.853 -5.563 -8.103 659 HB3 LEU 3 HB1 LEU 3 -3.931 -6.877 -7.378 660 HG LEU 3 HG LEU 3 -1.825 -5.813 -8.143 661 HD11 LEU 3 HD11 LEU 3 -3.774 -3.864 -9.364 662 HD12 LEU 3 HD12 LEU 3 -2.323 -4.577 -10.071 663 HD13 LEU 3 HD13 LEU 3 -2.177 -3.303 -8.864 664 HD21 LEU 3 HD21 LEU 3 -3.735 -4.097 -6.532 665 HD22 LEU 3 HD22 LEU 3 -2.007 -3.771 -6.654 666 HD23 LEU 3 HD23 LEU 3 -2.571 -5.269 -5.914 667 H SER 4 HN SER 4 -3.421 -9.155 -8.451 668 HA SER 4 HA SER 4 -0.589 -9.208 -8.660 669 HB2 SER 4 HB2 SER 4 -2.524 -11.539 -8.593 670 HB3 SER 4 HB1 SER 4 -0.794 -11.640 -8.271 671 HG SER 4 HG SER 4 -2.040 -9.676 -6.843 672 H ASN 5 HN ASN 5 -3.078 -10.447 -10.891 673 HA ASN 5 HA ASN 5 -1.278 -11.731 -12.697 674 HB2 ASN 5 HB2 ASN 5 -3.674 -12.150 -12.807 675 HB3 ASN 5 HB1 ASN 5 -3.982 -10.459 -13.206 676 HD21 ASN 5 HD21 ASN 5 -2.575 -13.480 -14.470 677 HD22 ASN 5 HD22 ASN 5 -2.574 -12.995 -16.097 678 H GLU 6 HN GLU 6 -2.502 -8.387 -12.597 679 HA GLU 6 HA GLU 6 -1.242 -7.573 -15.058 680 HB2 GLU 6 HB2 GLU 6 -2.423 -6.167 -12.680 681 HB3 GLU 6 HB1 GLU 6 -1.451 -5.223 -13.808 682 HG2 GLU 6 HG2 GLU 6 -3.601 -7.026 -14.896 683 HG3 GLU 6 HG1 GLU 6 -4.065 -5.483 -14.187 684 H LEU 7 HN LEU 7 -0.160 -7.646 -11.687 685 HA LEU 7 HA LEU 7 2.178 -6.064 -12.013 686 HB2 LEU 7 HB2 LEU 7 1.103 -7.027 -9.846 687 HB3 LEU 7 HB1 LEU 7 2.063 -8.464 -10.183 688 HG LEU 7 HG LEU 7 4.102 -6.973 -10.312 689 HD11 LEU 7 HD11 LEU 7 3.579 -4.767 -8.843 690 HD12 LEU 7 HD12 LEU 7 2.016 -4.925 -9.641 691 HD13 LEU 7 HD13 LEU 7 3.484 -4.766 -10.602 692 HD21 LEU 7 HD21 LEU 7 4.329 -6.832 -7.871 693 HD22 LEU 7 HD22 LEU 7 3.503 -8.327 -8.313 694 HD23 LEU 7 HD23 LEU 7 2.581 -6.961 -7.686 695 H LYS 8 HN LYS 8 1.694 -9.583 -12.399 696 HA LYS 8 HA LYS 8 4.436 -10.159 -13.047 697 HB2 LYS 8 HB2 LYS 8 1.894 -11.629 -13.790 698 HB3 LYS 8 HB1 LYS 8 3.521 -12.268 -14.022 699 HG2 LYS 8 HG2 LYS 8 3.897 -11.905 -11.538 700 HG3 LYS 8 HG1 LYS 8 2.168 -11.580 -11.405 701 HD2 LYS 8 HD2 LYS 8 3.408 -14.132 -12.481 702 HD3 LYS 8 HD1 LYS 8 2.649 -13.945 -10.901 703 HE2 LYS 8 HE2 LYS 8 0.563 -13.149 -12.234 704 HE3 LYS 8 HE1 LYS 8 1.358 -13.889 -13.625 705 HZ1 LYS 8 HZ1 LYS 8 1.218 -15.976 -12.712 706 HZ2 LYS 8 HZ2 LYS 8 -0.232 -15.286 -12.161 707 HZ3 LYS 8 HZ3 LYS 8 1.104 -15.406 -11.119 708 H VAL 9 HN VAL 9 1.614 -9.316 -15.046 709 HA VAL 9 HA VAL 9 2.798 -9.802 -17.582 710 HB VAL 9 HB VAL 9 0.724 -7.751 -16.749 711 HG11 VAL 9 HG11 VAL 9 0.149 -7.871 -19.247 712 HG12 VAL 9 HG12 VAL 9 1.734 -8.613 -19.467 713 HG13 VAL 9 HG13 VAL 9 1.609 -6.975 -18.827 714 HG21 VAL 9 HG21 VAL 9 0.338 -10.356 -18.242 715 HG22 VAL 9 HG22 VAL 9 -0.888 -9.366 -17.450 716 HG23 VAL 9 HG23 VAL 9 0.278 -10.268 -16.481 717 H GLU 10 HN GLU 10 2.759 -6.810 -15.612 718 HA GLU 10 HA GLU 10 4.275 -5.240 -17.474 719 HB2 GLU 10 HB2 GLU 10 4.086 -5.034 -14.452 720 HB3 GLU 10 HB1 GLU 10 4.745 -3.786 -15.509 721 HG2 GLU 10 HG2 GLU 10 1.965 -4.846 -16.011 722 HG3 GLU 10 HG1 GLU 10 2.225 -3.642 -14.751 723 H ARG 11 HN ARG 11 5.206 -7.354 -14.792 724 HA ARG 11 HA ARG 11 8.003 -6.777 -14.760 725 HB2 ARG 11 HB2 ARG 11 6.712 -8.134 -13.063 726 HB3 ARG 11 HB1 ARG 11 6.662 -9.446 -14.238 727 HG2 ARG 11 HG2 ARG 11 9.174 -9.393 -14.313 728 HG3 ARG 11 HG1 ARG 11 9.135 -8.217 -12.997 729 HD2 ARG 11 HD2 ARG 11 8.072 -11.053 -12.936 730 HD3 ARG 11 HD1 ARG 11 9.419 -10.399 -11.999 731 HE ARG 11 HE ARG 11 7.282 -8.792 -11.288 732 HH11 ARG 11 HH21 ARG 11 7.989 -12.169 -11.331 733 HH12 ARG 11 HH22 ARG 11 6.855 -12.550 -10.079 734 HH21 ARG 11 HH11 ARG 11 5.794 -9.273 -9.681 735 HH22 ARG 11 HH12 ARG 11 5.609 -10.910 -9.147 736 H ILE 12 HN ILE 12 6.104 -9.205 -16.506 737 HA ILE 12 HA ILE 12 8.287 -10.429 -17.903 738 HB ILE 12 HB ILE 12 5.319 -10.265 -18.516 739 HG12 ILE 12 HG12 ILE 12 6.941 -12.597 -17.465 740 HG13 ILE 12 HG11 ILE 12 6.186 -11.423 -16.388 741 HG21 ILE 12 HG21 ILE 12 6.390 -10.777 -20.591 742 HG22 ILE 12 HG22 ILE 12 5.873 -12.328 -19.930 743 HG23 ILE 12 HG23 ILE 12 7.561 -11.836 -19.806 744 HD11 ILE 12 HD11 ILE 12 4.663 -13.292 -16.650 745 HD12 ILE 12 HD12 ILE 12 4.787 -13.199 -18.407 746 HD13 ILE 12 HD13 ILE 12 3.987 -11.908 -17.510 747 H ARG 13 HN ARG 13 6.004 -7.836 -18.793 748 HA ARG 13 HA ARG 13 6.957 -7.463 -21.458 749 HB2 ARG 13 HB2 ARG 13 5.635 -5.573 -19.498 750 HB3 ARG 13 HB1 ARG 13 6.020 -5.110 -21.155 751 HG2 ARG 13 HG2 ARG 13 4.641 -6.944 -22.013 752 HG3 ARG 13 HG1 ARG 13 4.286 -7.471 -20.370 753 HD2 ARG 13 HD2 ARG 13 3.194 -5.316 -19.898 754 HD3 ARG 13 HD1 ARG 13 3.579 -4.762 -21.528 755 HE ARG 13 HE ARG 13 1.994 -7.246 -21.360 756 HH11 ARG 13 HH21 ARG 13 2.084 -3.806 -21.690 757 HH12 ARG 13 HH22 ARG 13 0.559 -3.719 -22.507 758 HH21 ARG 13 HH11 ARG 13 0.011 -7.140 -22.426 759 HH22 ARG 13 HH12 ARG 13 -0.612 -5.601 -22.921 760 H LEU 14 HN LEU 14 7.962 -6.032 -18.364 761 HA LEU 14 HA LEU 14 10.089 -4.477 -19.690 762 HB2 LEU 14 HB2 LEU 14 9.461 -4.907 -16.749 763 HB3 LEU 14 HB1 LEU 14 10.646 -3.764 -17.382 764 HG LEU 14 HG LEU 14 7.677 -3.714 -18.018 765 HD11 LEU 14 HD11 LEU 14 7.874 -1.533 -16.640 766 HD12 LEU 14 HD12 LEU 14 9.383 -2.209 -16.030 767 HD13 LEU 14 HD13 LEU 14 7.861 -3.056 -15.751 768 HD21 LEU 14 HD21 LEU 14 10.051 -2.063 -18.880 769 HD22 LEU 14 HD22 LEU 14 8.470 -1.293 -18.742 770 HD23 LEU 14 HD23 LEU 14 8.693 -2.647 -19.842 771 H SER 15 HN SER 15 9.642 -7.641 -18.642 772 HA SER 15 HA SER 15 11.125 -9.370 -18.003 773 HB2 SER 15 HB2 SER 15 13.180 -9.347 -19.577 774 HB3 SER 15 HB1 SER 15 11.585 -9.415 -20.323 775 HG SER 15 HG SER 15 13.096 -7.056 -19.850 776 H LEU 16 HN LEU 16 11.290 -7.389 -16.114 777 HA LEU 16 HA LEU 16 14.059 -6.492 -15.801 778 HB2 LEU 16 HB2 LEU 16 13.288 -5.612 -13.626 779 HB3 LEU 16 HB1 LEU 16 12.246 -5.118 -14.954 780 HG LEU 16 HG LEU 16 10.925 -7.374 -14.261 781 HD11 LEU 16 HD11 LEU 16 10.853 -7.349 -11.682 782 HD12 LEU 16 HD12 LEU 16 12.390 -6.499 -11.757 783 HD13 LEU 16 HD13 LEU 16 12.250 -8.122 -12.424 784 HD21 LEU 16 HD21 LEU 16 9.816 -5.252 -14.362 785 HD22 LEU 16 HD22 LEU 16 10.727 -4.635 -12.985 786 HD23 LEU 16 HD23 LEU 16 9.513 -5.889 -12.745 787 H THR 17 HN THR 17 15.401 -7.084 -13.920 788 HA THR 17 HA THR 17 15.104 -9.991 -13.259 789 HB THR 17 HB THR 17 17.533 -9.863 -12.715 790 HG1 THR 17 HG1 THR 17 16.972 -7.244 -12.900 791 HG21 THR 17 HG21 THR 17 16.666 -10.447 -15.006 792 HG22 THR 17 HG22 THR 17 18.287 -9.753 -15.005 793 HG23 THR 17 HG23 THR 17 16.903 -8.761 -15.464 794 H ALA 18 HN ALA 18 14.844 -10.607 -11.191 795 HA ALA 18 HA ALA 18 14.148 -8.721 -9.146 796 HB1 ALA 18 HB1 ALA 18 14.354 -10.809 -7.648 797 HB2 ALA 18 HB2 ALA 18 14.755 -11.684 -9.125 798 HB3 ALA 18 HB3 ALA 18 13.188 -10.894 -8.968 799 H LYS 19 HN LYS 19 17.155 -10.125 -10.164 800 HA LYS 19 HA LYS 19 18.668 -9.909 -7.774 801 HB2 LYS 19 HB2 LYS 19 19.516 -9.508 -10.661 802 HB3 LYS 19 HB1 LYS 19 20.609 -9.792 -9.313 803 HG2 LYS 19 HG2 LYS 19 19.527 -11.971 -8.888 804 HG3 LYS 19 HG1 LYS 19 18.442 -11.689 -10.249 805 HD2 LYS 19 HD2 LYS 19 20.388 -11.564 -11.769 806 HD3 LYS 19 HD1 LYS 19 21.465 -11.875 -10.407 807 HE2 LYS 19 HE2 LYS 19 20.347 -14.042 -10.021 808 HE3 LYS 19 HE1 LYS 19 19.282 -13.734 -11.392 809 HZ1 LYS 19 HZ1 LYS 19 20.868 -14.838 -12.505 810 HZ2 LYS 19 HZ2 LYS 19 22.073 -14.517 -11.352 811 HZ3 LYS 19 HZ3 LYS 19 21.665 -13.341 -12.508 812 H SER 20 HN SER 20 18.125 -7.568 -10.410 813 HA SER 20 HA SER 20 19.678 -5.479 -9.130 814 HB2 SER 20 HB2 SER 20 19.058 -5.706 -11.633 815 HB3 SER 20 HB1 SER 20 17.511 -5.000 -11.177 816 HG SER 20 HG SER 20 19.979 -3.842 -10.424 817 H VAL 21 HN VAL 21 16.200 -6.225 -9.315 818 HA VAL 21 HA VAL 21 15.298 -3.866 -8.000 819 HB VAL 21 HB VAL 21 14.086 -6.644 -8.046 820 HG11 VAL 21 HG11 VAL 21 11.956 -5.278 -7.591 821 HG12 VAL 21 HG12 VAL 21 13.034 -3.968 -7.109 822 HG13 VAL 21 HG13 VAL 21 13.060 -5.497 -6.234 823 HG21 VAL 21 HG21 VAL 21 14.151 -5.885 -10.280 824 HG22 VAL 21 HG22 VAL 21 13.877 -4.207 -9.818 825 HG23 VAL 21 HG23 VAL 21 12.556 -5.370 -9.734 826 H ALA 22 HN ALA 22 16.106 -7.078 -6.625 827 HA ALA 22 HA ALA 22 15.466 -6.336 -3.935 828 HB1 ALA 22 HB1 ALA 22 17.565 -8.370 -4.667 829 HB2 ALA 22 HB2 ALA 22 15.846 -8.683 -4.902 830 HB3 ALA 22 HB3 ALA 22 16.470 -8.369 -3.283 831 H GLU 23 HN GLU 23 18.492 -6.103 -5.802 832 HA GLU 23 HA GLU 23 20.123 -5.296 -3.571 833 HB2 GLU 23 HB2 GLU 23 20.363 -4.892 -6.560 834 HB3 GLU 23 HB1 GLU 23 21.583 -4.303 -5.431 835 HG2 GLU 23 HG2 GLU 23 20.648 -7.179 -5.459 836 HG3 GLU 23 HG1 GLU 23 22.020 -6.619 -6.419 837 H GLU 24 HN GLU 24 18.303 -3.446 -6.019 838 HA GLU 24 HA GLU 24 19.019 -0.870 -4.888 839 HB2 GLU 24 HB2 GLU 24 16.890 -1.755 -6.847 840 HB3 GLU 24 HB1 GLU 24 17.119 -0.069 -6.379 841 HG2 GLU 24 HG2 GLU 24 19.324 -0.013 -7.269 842 HG3 GLU 24 HG1 GLU 24 19.391 -1.770 -7.428 843 H MET 25 HN MET 25 16.192 -3.020 -4.605 844 HA MET 25 HA MET 25 14.604 -1.241 -3.008 845 HB2 MET 25 HB2 MET 25 14.637 -4.242 -3.352 846 HB3 MET 25 HB1 MET 25 13.492 -3.439 -2.282 847 HG2 MET 25 HG2 MET 25 13.822 -2.714 -5.202 848 HG3 MET 25 HG1 MET 25 12.621 -3.865 -4.620 849 HE1 MET 25 HE1 MET 25 11.215 -3.576 -2.823 850 HE2 MET 25 HE2 MET 25 9.977 -2.361 -3.108 851 HE3 MET 25 HE3 MET 25 11.129 -2.141 -1.795 852 H GLY 26 HN GLY 26 16.993 -3.743 -2.183 853 HA2 GLY 26 HA2 GLY 26 18.378 -3.708 -0.230 854 HA3 GLY 26 HA1 GLY 26 17.327 -2.478 0.471 855 H ILE 27 HN ILE 27 16.038 -5.427 -0.944 856 HA ILE 27 HA ILE 27 15.428 -6.462 1.810 857 HB ILE 27 HB ILE 27 13.239 -7.215 0.969 858 HG12 ILE 27 HG12 ILE 27 13.867 -5.624 -1.540 859 HG13 ILE 27 HG11 ILE 27 13.960 -7.383 -1.460 860 HG21 ILE 27 HG21 ILE 27 13.655 -4.273 0.388 861 HG22 ILE 27 HG22 ILE 27 13.541 -4.949 2.015 862 HG23 ILE 27 HG23 ILE 27 12.166 -5.055 0.916 863 HD11 ILE 27 HD11 ILE 27 11.576 -7.418 -0.681 864 HD12 ILE 27 HD12 ILE 27 11.780 -6.796 -2.321 865 HD13 ILE 27 HD13 ILE 27 11.503 -5.680 -0.982 866 H SER 28 HN SER 28 14.856 -8.835 1.742 867 HA SER 28 HA SER 28 16.922 -10.282 0.340 868 HB2 SER 28 HB2 SER 28 16.117 -11.137 2.463 869 HB3 SER 28 HB1 SER 28 14.466 -11.214 1.853 870 HG SER 28 HG SER 28 16.055 -13.164 1.823 871 H ARG 29 HN ARG 29 16.658 -11.744 -1.409 872 HA ARG 29 HA ARG 29 14.783 -10.938 -3.423 873 HB2 ARG 29 HB2 ARG 29 16.589 -13.354 -3.160 874 HB3 ARG 29 HB1 ARG 29 15.578 -13.068 -4.582 875 HG2 ARG 29 HG2 ARG 29 16.636 -10.877 -4.910 876 HG3 ARG 29 HG1 ARG 29 17.629 -11.125 -3.477 877 HD2 ARG 29 HD2 ARG 29 18.696 -13.069 -4.546 878 HD3 ARG 29 HD1 ARG 29 17.693 -12.838 -5.981 879 HE ARG 29 HE ARG 29 18.996 -10.381 -5.498 880 HH11 ARG 29 HH21 ARG 29 19.813 -13.663 -6.190 881 HH12 ARG 29 HH22 ARG 29 21.196 -13.247 -7.145 882 HH21 ARG 29 HH11 ARG 29 20.784 -9.829 -6.737 883 HH22 ARG 29 HH12 ARG 29 21.743 -11.077 -7.458 884 H GLN 30 HN GLN 30 14.794 -13.520 -1.035 885 HA GLN 30 HA GLN 30 12.568 -15.006 -1.977 886 HB2 GLN 30 HB2 GLN 30 14.240 -15.442 0.011 887 HB3 GLN 30 HB1 GLN 30 13.058 -14.554 0.970 888 HG2 GLN 30 HG2 GLN 30 12.444 -16.991 -0.729 889 HG3 GLN 30 HG1 GLN 30 12.643 -17.002 1.023 890 HE21 GLN 30 HE21 GLN 30 10.246 -17.078 -1.208 891 HE22 GLN 30 HE22 GLN 30 9.034 -16.224 -0.383 892 H GLN 31 HN GLN 31 12.739 -12.138 0.143 893 HA GLN 31 HA GLN 31 9.919 -12.000 0.673 894 HB2 GLN 31 HB2 GLN 31 12.068 -9.863 0.662 895 HB3 GLN 31 HB1 GLN 31 10.407 -9.564 1.173 896 HG2 GLN 31 HG2 GLN 31 10.603 -11.254 2.922 897 HG3 GLN 31 HG1 GLN 31 12.232 -11.658 2.384 898 HE21 GLN 31 HE21 GLN 31 10.574 -9.810 4.657 899 HE22 GLN 31 HE22 GLN 31 11.780 -8.662 4.991 900 H LEU 32 HN LEU 32 11.941 -10.799 -1.965 901 HA LEU 32 HA LEU 32 10.052 -9.040 -3.165 902 HB2 LEU 32 HB2 LEU 32 12.497 -9.362 -3.813 903 HB3 LEU 32 HB1 LEU 32 11.996 -10.834 -4.641 904 HG LEU 32 HG LEU 32 10.219 -9.235 -5.794 905 HD11 LEU 32 HD11 LEU 32 11.194 -6.961 -6.151 906 HD12 LEU 32 HD12 LEU 32 12.423 -7.329 -4.944 907 HD13 LEU 32 HD13 LEU 32 10.728 -7.241 -4.476 908 HD21 LEU 32 HD21 LEU 32 11.802 -8.838 -7.625 909 HD22 LEU 32 HD22 LEU 32 12.058 -10.447 -6.950 910 HD23 LEU 32 HD23 LEU 32 13.160 -9.134 -6.538 911 H CYS 33 HN CYS 33 10.588 -12.523 -3.550 912 HA CYS 33 HA CYS 33 8.577 -12.966 -5.535 913 HB2 CYS 33 HB2 CYS 33 9.913 -14.699 -3.454 914 HB3 CYS 33 HB1 CYS 33 8.603 -15.346 -4.448 915 HG CYS 33 HG CYS 33 10.436 -14.147 -6.385 916 H ASN 34 HN ASN 34 8.493 -12.843 -1.997 917 HA ASN 34 HA ASN 34 5.769 -13.731 -1.744 918 HB2 ASN 34 HB2 ASN 34 7.489 -13.692 0.105 919 HB3 ASN 34 HB1 ASN 34 7.281 -11.942 0.173 920 HD21 ASN 34 HD21 ASN 34 6.520 -14.096 2.196 921 HD22 ASN 34 HD22 ASN 34 4.866 -13.844 2.486 922 H ILE 35 HN ILE 35 7.213 -10.564 -2.373 923 HA ILE 35 HA ILE 35 4.950 -8.971 -1.675 924 HB ILE 35 HB ILE 35 7.091 -8.551 -3.778 925 HG12 ILE 35 HG12 ILE 35 6.691 -7.237 -1.070 926 HG13 ILE 35 HG11 ILE 35 7.741 -8.625 -1.328 927 HG21 ILE 35 HG21 ILE 35 5.264 -7.186 -4.478 928 HG22 ILE 35 HG22 ILE 35 6.320 -6.108 -3.568 929 HG23 ILE 35 HG23 ILE 35 4.857 -6.749 -2.820 930 HD11 ILE 35 HD11 ILE 35 9.274 -6.893 -1.552 931 HD12 ILE 35 HD12 ILE 35 8.086 -5.793 -2.243 932 HD13 ILE 35 HD13 ILE 35 8.775 -7.077 -3.232 933 H GLU 36 HN GLU 36 5.826 -10.535 -4.771 934 HA GLU 36 HA GLU 36 3.450 -9.578 -6.109 935 HB2 GLU 36 HB2 GLU 36 4.012 -11.421 -7.778 936 HB3 GLU 36 HB1 GLU 36 5.270 -10.220 -7.504 937 HG2 GLU 36 HG2 GLU 36 6.434 -11.720 -5.979 938 HG3 GLU 36 HG1 GLU 36 5.137 -12.902 -6.125 939 H GLN 37 HN GLN 37 4.234 -12.483 -4.245 940 HA GLN 37 HA GLN 37 1.539 -13.616 -4.753 941 HB2 GLN 37 HB2 GLN 37 3.937 -14.605 -3.188 942 HB3 GLN 37 HB1 GLN 37 2.382 -15.436 -3.175 943 HG2 GLN 37 HG2 GLN 37 2.475 -15.658 -5.629 944 HG3 GLN 37 HG1 GLN 37 4.026 -14.829 -5.644 945 HE21 GLN 37 HE21 GLN 37 5.483 -16.495 -6.195 946 HE22 GLN 37 HE22 GLN 37 5.623 -17.953 -5.338 947 H SER 38 HN SER 38 2.388 -11.104 -3.023 948 HA SER 38 HA SER 38 1.589 -11.753 -0.333 949 HB2 SER 38 HB2 SER 38 1.425 -9.324 -0.011 950 HB3 SER 38 HB1 SER 38 2.900 -9.734 -0.878 951 HG SER 38 HG SER 38 1.523 -7.960 -1.732 952 H GLU 39 HN GLU 39 -0.292 -12.769 -2.327 953 HA GLU 39 HA GLU 39 -2.598 -12.881 -2.709 954 HB2 GLU 39 HB2 GLU 39 -2.466 -11.716 0.079 955 HB3 GLU 39 HB1 GLU 39 -3.980 -12.198 -0.687 956 HG2 GLU 39 HG2 GLU 39 -3.252 -14.476 -0.892 957 HG3 GLU 39 HG1 GLU 39 -1.602 -14.054 -0.423 958 H THR 40 HN THR 40 -2.903 -9.952 -0.762 959 HA THR 40 HA THR 40 -3.520 -8.394 -3.253 960 HB THR 40 HB THR 40 -5.619 -9.157 -2.146 961 HG1 THR 40 HG1 THR 40 -6.421 -7.301 -2.670 962 HG21 THR 40 HG21 THR 40 -6.174 -8.444 0.073 963 HG22 THR 40 HG22 THR 40 -4.747 -7.412 0.163 964 HG23 THR 40 HG23 THR 40 -4.569 -9.167 0.166 965 H ALA 41 HN ALA 41 -3.567 -5.992 -2.756 966 HA ALA 41 HA ALA 41 -1.139 -5.316 -1.283 967 HB1 ALA 41 HB1 ALA 41 -1.325 -3.944 -3.153 968 HB2 ALA 41 HB2 ALA 41 -2.100 -2.894 -1.967 969 HB3 ALA 41 HB3 ALA 41 -3.082 -3.875 -3.050 970 HA PRO 42 HA PRO 42 -3.071 -4.233 2.555 971 HB2 PRO 42 HB2 PRO 42 -1.465 -2.238 3.477 972 HB3 PRO 42 HB1 PRO 42 -0.903 -3.918 3.341 973 HG2 PRO 42 HG2 PRO 42 -0.485 -1.637 1.445 974 HG3 PRO 42 HG1 PRO 42 0.695 -2.809 2.063 975 HD2 PRO 42 HD2 PRO 42 -0.437 -3.096 -0.383 976 HD3 PRO 42 HD1 PRO 42 -0.022 -4.501 0.622 977 H VAL 43 HN VAL 43 -4.287 -2.516 3.680 978 HA VAL 43 HA VAL 43 -5.899 -0.926 1.960 979 HB VAL 43 HB VAL 43 -6.603 0.231 4.093 980 HG11 VAL 43 HG11 VAL 43 -7.669 -1.740 5.025 981 HG12 VAL 43 HG12 VAL 43 -6.457 -2.790 4.291 982 HG13 VAL 43 HG13 VAL 43 -7.603 -1.919 3.272 983 HG21 VAL 43 HG21 VAL 43 -4.296 -0.022 5.150 984 HG22 VAL 43 HG22 VAL 43 -4.699 -1.719 5.416 985 HG23 VAL 43 HG23 VAL 43 -5.654 -0.454 6.188 986 H VAL 44 HN VAL 44 -2.750 -0.367 3.236 987 HA VAL 44 HA VAL 44 -2.709 2.474 3.362 988 HB VAL 44 HB VAL 44 -0.528 0.514 2.581 989 HG11 VAL 44 HG11 VAL 44 -0.461 3.481 3.178 990 HG12 VAL 44 HG12 VAL 44 0.144 2.654 1.743 991 HG13 VAL 44 HG13 VAL 44 0.973 2.459 3.287 992 HG21 VAL 44 HG21 VAL 44 -0.982 1.996 5.187 993 HG22 VAL 44 HG22 VAL 44 0.161 0.687 4.885 994 HG23 VAL 44 HG23 VAL 44 -1.572 0.360 4.893 995 H VAL 45 HN VAL 45 -2.105 0.256 0.632 996 HA VAL 45 HA VAL 45 -1.505 2.275 -1.296 997 HB VAL 45 HB VAL 45 -2.739 -0.478 -1.615 998 HG11 VAL 45 HG11 VAL 45 -1.917 -0.194 -4.015 999 HG12 VAL 45 HG12 VAL 45 -1.754 1.526 -3.661 1000 HG13 VAL 45 HG13 VAL 45 -3.339 0.756 -3.582 1001 HG21 VAL 45 HG21 VAL 45 0.065 0.500 -2.213 1002 HG22 VAL 45 HG22 VAL 45 -0.501 -1.170 -2.186 1003 HG23 VAL 45 HG23 VAL 45 -0.388 -0.252 -0.684 1004 H LYS 46 HN LYS 46 -4.588 0.741 -0.366 1005 HA LYS 46 HA LYS 46 -6.224 2.159 -2.240 1006 HB2 LYS 46 HB2 LYS 46 -6.871 1.002 0.487 1007 HB3 LYS 46 HB1 LYS 46 -8.083 1.611 -0.639 1008 HG2 LYS 46 HG2 LYS 46 -7.355 -0.021 -2.329 1009 HG3 LYS 46 HG1 LYS 46 -6.121 -0.625 -1.222 1010 HD2 LYS 46 HD2 LYS 46 -7.875 -1.271 0.389 1011 HD3 LYS 46 HD1 LYS 46 -9.112 -0.672 -0.718 1012 HE2 LYS 46 HE2 LYS 46 -8.388 -2.298 -2.420 1013 HE3 LYS 46 HE1 LYS 46 -7.139 -2.891 -1.327 1014 HZ1 LYS 46 HZ1 LYS 46 -9.459 -2.960 0.133 1015 HZ2 LYS 46 HZ2 LYS 46 -8.656 -4.290 -0.556 1016 HZ3 LYS 46 HZ3 LYS 46 -9.913 -3.521 -1.402 1017 H TYR 47 HN TYR 47 -5.184 2.906 1.076 1018 HA TYR 47 HA TYR 47 -6.764 5.238 1.465 1019 HB2 TYR 47 HB2 TYR 47 -5.434 4.135 3.261 1020 HB3 TYR 47 HB1 TYR 47 -3.956 4.709 2.489 1021 HD1 TYR 47 HD1 TYR 47 -7.009 5.710 4.297 1022 HD2 TYR 47 HD2 TYR 47 -3.313 7.056 2.572 1023 HE1 TYR 47 HE1 TYR 47 -7.259 7.887 5.455 1024 HE2 TYR 47 HE2 TYR 47 -3.570 9.235 3.730 1025 HH TYR 47 HH TYR 47 -4.702 10.206 5.586 1026 H ILE 48 HN ILE 48 -3.578 4.796 -0.044 1027 HA ILE 48 HA ILE 48 -3.026 7.562 -0.501 1028 HB ILE 48 HB ILE 48 -2.175 5.072 -2.009 1029 HG12 ILE 48 HG12 ILE 48 -0.620 6.845 -0.104 1030 HG13 ILE 48 HG11 ILE 48 -1.461 5.381 0.405 1031 HG21 ILE 48 HG21 ILE 48 -0.329 6.609 -2.853 1032 HG22 ILE 48 HG22 ILE 48 -1.316 7.959 -2.293 1033 HG23 ILE 48 HG23 ILE 48 -1.923 6.881 -3.551 1034 HD11 ILE 48 HD11 ILE 48 -0.121 4.152 -1.398 1035 HD12 ILE 48 HD12 ILE 48 0.800 4.718 -0.006 1036 HD13 ILE 48 HD13 ILE 48 0.859 5.612 -1.525 1037 H ALA 49 HN ALA 49 -4.698 5.113 -2.481 1038 HA ALA 49 HA ALA 49 -5.148 6.749 -4.763 1039 HB1 ALA 49 HB1 ALA 49 -6.802 4.495 -3.592 1040 HB2 ALA 49 HB2 ALA 49 -5.593 4.369 -4.870 1041 HB3 ALA 49 HB3 ALA 49 -7.109 5.219 -5.171 1042 H PHE 50 HN PHE 50 -6.890 6.465 -1.695 1043 HA PHE 50 HA PHE 50 -9.206 7.959 -2.418 1044 HB2 PHE 50 HB2 PHE 50 -8.696 6.604 -0.263 1045 HB3 PHE 50 HB1 PHE 50 -7.916 8.074 0.315 1046 HD1 PHE 50 HD2 PHE 50 -11.095 7.045 -1.401 1047 HD2 PHE 50 HD1 PHE 50 -9.240 9.558 1.550 1048 HE1 PHE 50 HE2 PHE 50 -13.313 7.954 -0.781 1049 HE2 PHE 50 HE1 PHE 50 -11.462 10.461 2.175 1050 HZ PHE 50 HZ PHE 50 -13.499 9.657 1.010 1051 H LEU 51 HN LEU 51 -6.153 9.047 -0.899 1052 HA LEU 51 HA LEU 51 -6.842 11.844 -0.938 1053 HB2 LEU 51 HB2 LEU 51 -4.264 10.302 -0.670 1054 HB3 LEU 51 HB1 LEU 51 -4.230 12.056 -0.807 1055 HG LEU 51 HG LEU 51 -4.256 11.124 1.566 1056 HD11 LEU 51 HD11 LEU 51 -5.089 13.471 0.793 1057 HD12 LEU 51 HD12 LEU 51 -5.507 12.914 2.408 1058 HD13 LEU 51 HD13 LEU 51 -6.699 12.831 1.115 1059 HD21 LEU 51 HD21 LEU 51 -6.262 10.221 2.467 1060 HD22 LEU 51 HD22 LEU 51 -5.979 9.343 0.961 1061 HD23 LEU 51 HD23 LEU 51 -7.185 10.631 1.022 1062 H ARG 52 HN ARG 52 -5.117 9.729 -3.196 1063 HA ARG 52 HA ARG 52 -4.285 11.763 -5.028 1064 HB2 ARG 52 HB2 ARG 52 -3.457 9.396 -5.033 1065 HB3 ARG 52 HB1 ARG 52 -5.025 8.891 -5.658 1066 HG2 ARG 52 HG2 ARG 52 -4.698 10.374 -7.625 1067 HG3 ARG 52 HG1 ARG 52 -3.101 10.804 -7.011 1068 HD2 ARG 52 HD2 ARG 52 -2.586 8.304 -7.004 1069 HD3 ARG 52 HD1 ARG 52 -4.061 8.096 -7.945 1070 HE ARG 52 HE ARG 52 -2.793 9.972 -9.430 1071 HH11 ARG 52 HH21 ARG 52 -1.724 7.049 -7.938 1072 HH12 ARG 52 HH22 ARG 52 -0.420 6.807 -9.049 1073 HH21 ARG 52 HH11 ARG 52 -1.084 9.672 -10.878 1074 HH22 ARG 52 HH12 ARG 52 -0.057 8.287 -10.708 1075 H SER 53 HN SER 53 -7.239 9.805 -4.805 1076 HA SER 53 HA SER 53 -8.478 10.615 -7.214 1077 HB2 SER 53 HB2 SER 53 -9.261 8.844 -5.525 1078 HB3 SER 53 HB1 SER 53 -9.964 10.177 -4.616 1079 HG SER 53 HG SER 53 -10.736 10.624 -7.014 1080 H LYS 54 HN LYS 54 -7.858 12.400 -4.319 1081 HA LYS 54 HA LYS 54 -9.885 14.464 -4.949 1082 HB2 LYS 54 HB2 LYS 54 -7.792 14.272 -2.762 1083 HB3 LYS 54 HB1 LYS 54 -8.989 15.562 -2.897 1084 HG2 LYS 54 HG2 LYS 54 -10.803 13.882 -2.760 1085 HG3 LYS 54 HG1 LYS 54 -9.597 12.606 -2.590 1086 HD2 LYS 54 HD2 LYS 54 -8.765 13.659 -0.522 1087 HD3 LYS 54 HD1 LYS 54 -9.965 14.941 -0.691 1088 HE2 LYS 54 HE2 LYS 54 -10.959 13.410 0.819 1089 HE3 LYS 54 HE1 LYS 54 -11.718 13.043 -0.731 1090 HZ1 LYS 54 HZ1 LYS 54 -11.066 10.967 -0.250 1091 HZ2 LYS 54 HZ2 LYS 54 -9.870 11.468 0.847 1092 HZ3 LYS 54 HZ3 LYS 54 -9.555 11.483 -0.823 1093 H GLY 55 HN GLY 55 -7.089 13.700 -6.343 1094 HA2 GLY 55 HA2 GLY 55 -5.806 15.003 -7.849 1095 HA3 GLY 55 HA1 GLY 55 -6.602 16.449 -7.230 1096 H VAL 56 HN VAL 56 -5.259 14.299 -4.871 1097 HA VAL 56 HA VAL 56 -3.481 16.362 -3.908 1098 HB VAL 56 HB VAL 56 -3.729 13.422 -3.228 1099 HG11 VAL 56 HG11 VAL 56 -2.445 14.169 -1.139 1100 HG12 VAL 56 HG12 VAL 56 -2.012 15.616 -2.048 1101 HG13 VAL 56 HG13 VAL 56 -1.498 14.029 -2.620 1102 HG21 VAL 56 HG21 VAL 56 -5.045 14.160 -1.401 1103 HG22 VAL 56 HG22 VAL 56 -5.609 15.143 -2.746 1104 HG23 VAL 56 HG23 VAL 56 -4.496 15.826 -1.560 1105 H ASP 57 HN ASP 57 -1.353 16.703 -4.345 1106 HA ASP 57 HA ASP 57 -0.142 15.602 -6.674 1107 HB2 ASP 57 HB2 ASP 57 1.163 16.963 -4.298 1108 HB3 ASP 57 HB1 ASP 57 1.916 16.716 -5.873 1109 H LEU 58 HN LEU 58 -0.626 13.234 -5.971 1110 HA LEU 58 HA LEU 58 0.939 12.002 -3.920 1111 HB2 LEU 58 HB2 LEU 58 -0.982 10.850 -4.870 1112 HB3 LEU 58 HB1 LEU 58 -0.239 10.848 -6.466 1113 HG LEU 58 HG LEU 58 1.567 9.383 -5.642 1114 HD11 LEU 58 HD11 LEU 58 0.143 9.801 -3.013 1115 HD12 LEU 58 HD12 LEU 58 1.862 9.956 -3.372 1116 HD13 LEU 58 HD13 LEU 58 1.122 8.363 -3.294 1117 HD21 LEU 58 HD21 LEU 58 0.086 7.395 -5.023 1118 HD22 LEU 58 HD22 LEU 58 -0.302 8.212 -6.536 1119 HD23 LEU 58 HD23 LEU 58 -1.273 8.515 -5.095 1120 H ASN 59 HN ASN 59 1.550 12.469 -7.403 1121 HA ASN 59 HA ASN 59 3.965 10.984 -7.541 1122 HB2 ASN 59 HB2 ASN 59 4.495 12.460 -9.505 1123 HB3 ASN 59 HB1 ASN 59 2.879 11.758 -9.567 1124 HD21 ASN 59 HD21 ASN 59 1.180 13.290 -8.308 1125 HD22 ASN 59 HD22 ASN 59 1.292 14.935 -8.711 1126 H ALA 60 HN ALA 60 3.410 14.395 -6.692 1127 HA ALA 60 HA ALA 60 6.189 15.062 -6.427 1128 HB1 ALA 60 HB1 ALA 60 4.157 16.647 -6.534 1129 HB2 ALA 60 HB2 ALA 60 5.445 17.071 -5.409 1130 HB3 ALA 60 HB3 ALA 60 3.966 16.318 -4.814 1131 H LEU 61 HN LEU 61 3.788 13.717 -4.200 1132 HA LEU 61 HA LEU 61 5.348 13.916 -1.822 1133 HB2 LEU 61 HB2 LEU 61 2.942 13.382 -1.796 1134 HB3 LEU 61 HB1 LEU 61 3.263 11.849 -2.603 1135 HG LEU 61 HG LEU 61 4.598 11.094 -0.679 1136 HD11 LEU 61 HD11 LEU 61 4.085 13.915 0.248 1137 HD12 LEU 61 HD12 LEU 61 5.581 12.982 0.289 1138 HD13 LEU 61 HD13 LEU 61 4.298 12.635 1.442 1139 HD21 LEU 61 HD21 LEU 61 2.050 10.866 -0.781 1140 HD22 LEU 61 HD22 LEU 61 1.983 12.220 0.349 1141 HD23 LEU 61 HD23 LEU 61 2.777 10.716 0.820 1142 H PHE 62 HN PHE 62 5.045 11.259 -4.197 1143 HA PHE 62 HA PHE 62 7.002 9.592 -2.865 1144 HB2 PHE 62 HB2 PHE 62 5.574 9.552 -5.504 1145 HB3 PHE 62 HB1 PHE 62 7.026 8.564 -5.348 1146 HD1 PHE 62 HD1 PHE 62 4.125 9.428 -3.108 1147 HD2 PHE 62 HD2 PHE 62 6.550 6.332 -4.841 1148 HE1 PHE 62 HE1 PHE 62 2.831 7.715 -1.868 1149 HE2 PHE 62 HE2 PHE 62 5.250 4.623 -3.604 1150 HZ PHE 62 HZ PHE 62 3.389 5.313 -2.118 1151 H ASP 63 HN ASP 63 7.155 12.072 -5.369 1152 HA ASP 63 HA ASP 63 9.797 11.569 -6.289 1153 HB2 ASP 63 HB2 ASP 63 8.141 13.189 -7.290 1154 HB3 ASP 63 HB1 ASP 63 8.518 14.293 -5.967 1155 H ARG 64 HN ARG 64 8.624 13.491 -3.531 1156 HA ARG 64 HA ARG 64 11.174 14.532 -2.747 1157 HB2 ARG 64 HB2 ARG 64 8.571 14.074 -1.295 1158 HB3 ARG 64 HB1 ARG 64 9.980 14.710 -0.446 1159 HG2 ARG 64 HG2 ARG 64 8.915 15.942 -3.005 1160 HG3 ARG 64 HG1 ARG 64 8.358 16.445 -1.414 1161 HD2 ARG 64 HD2 ARG 64 11.173 16.509 -1.203 1162 HD3 ARG 64 HD1 ARG 64 10.832 17.176 -2.796 1163 HE ARG 64 HE ARG 64 9.922 18.304 -0.201 1164 HH11 ARG 64 HH21 ARG 64 9.968 18.404 -3.668 1165 HH12 ARG 64 HH22 ARG 64 9.442 20.048 -3.742 1166 HH21 ARG 64 HH11 ARG 64 9.209 20.434 -0.317 1167 HH22 ARG 64 HH12 ARG 64 9.011 21.190 -1.862 1168 H ILE 65 HN ILE 65 9.501 11.503 -1.901 1169 HA ILE 65 HA ILE 65 11.282 10.742 0.196 1170 HB ILE 65 HB ILE 65 9.630 9.058 -1.706 1171 HG12 ILE 65 HG12 ILE 65 9.184 9.773 1.210 1172 HG13 ILE 65 HG11 ILE 65 8.471 10.674 -0.126 1173 HG21 ILE 65 HG21 ILE 65 11.343 7.613 -0.857 1174 HG22 ILE 65 HG22 ILE 65 9.924 7.318 0.147 1175 HG23 ILE 65 HG23 ILE 65 11.238 8.326 0.752 1176 HD11 ILE 65 HD11 ILE 65 6.792 9.121 0.487 1177 HD12 ILE 65 HD12 ILE 65 7.957 7.814 0.692 1178 HD13 ILE 65 HD13 ILE 65 7.552 8.390 -0.925 1179 H ILE 66 HN ILE 66 11.391 10.074 -3.308 1180 HA ILE 66 HA ILE 66 13.848 8.538 -3.083 1181 HB ILE 66 HB ILE 66 13.860 8.721 -5.586 1182 HG12 ILE 66 HG12 ILE 66 11.316 10.296 -5.089 1183 HG13 ILE 66 HG11 ILE 66 12.821 10.969 -5.718 1184 HG21 ILE 66 HG21 ILE 66 11.911 7.324 -5.886 1185 HG22 ILE 66 HG22 ILE 66 11.156 7.984 -4.435 1186 HG23 ILE 66 HG23 ILE 66 12.589 6.965 -4.297 1187 HD11 ILE 66 HD11 ILE 66 12.660 9.223 -7.578 1188 HD12 ILE 66 HD12 ILE 66 11.469 10.521 -7.635 1189 HD13 ILE 66 HD13 ILE 66 11.010 8.929 -7.027 1190 H VAL 67 HN VAL 67 15.931 9.211 -3.419 1191 HA VAL 67 HA VAL 67 16.799 11.741 -2.666 1192 HB VAL 67 HB VAL 67 18.216 9.696 -2.914 1193 HG11 VAL 67 HG11 VAL 67 18.348 10.444 -5.842 1194 HG12 VAL 67 HG12 VAL 67 17.288 9.180 -5.221 1195 HG13 VAL 67 HG13 VAL 67 19.038 9.023 -5.061 1196 HG21 VAL 67 HG21 VAL 67 20.193 10.900 -3.185 1197 HG22 VAL 67 HG22 VAL 67 19.068 12.229 -2.916 1198 HG23 VAL 67 HG23 VAL 67 19.580 11.824 -4.555 1199 H ASN 68 HN ASN 68 18.326 13.073 -4.356 1200 HA ASN 68 HA ASN 68 18.307 14.654 -6.060 1201 HB2 ASN 68 HB2 ASN 68 17.935 12.249 -7.269 1202 HB3 ASN 68 HB1 ASN 68 16.432 13.034 -7.745 1203 HD21 ASN 68 HD21 ASN 68 18.840 12.338 -9.396 1204 HD22 ASN 68 HD22 ASN 68 19.334 13.794 -10.112 1205 H LYS 69 HN LYS 69 16.481 15.091 -4.000 1206 HA LYS 69 HA LYS 69 13.776 15.459 -4.772 1207 HB2 LYS 69 HB2 LYS 69 15.414 17.139 -2.847 1208 HB3 LYS 69 HB1 LYS 69 13.654 17.093 -2.928 1209 HG2 LYS 69 HG2 LYS 69 13.806 15.438 -1.345 1210 HG3 LYS 69 HG1 LYS 69 14.259 14.394 -2.689 1211 HD2 LYS 69 HD2 LYS 69 16.010 14.030 -1.173 1212 HD3 LYS 69 HD1 LYS 69 16.690 15.275 -2.220 1213 HE2 LYS 69 HE2 LYS 69 16.079 17.013 -0.608 1214 HE3 LYS 69 HE1 LYS 69 15.296 15.814 0.421 1215 HZ1 LYS 69 HZ1 LYS 69 17.681 14.713 0.173 1216 HZ2 LYS 69 HZ2 LYS 69 17.312 15.827 1.401 1217 HZ3 LYS 69 HZ3 LYS 69 18.129 16.339 0.002 1218 H LEU 70 HN LEU 70 12.667 17.433 -5.411 1219 HA LEU 70 HA LEU 70 13.977 18.809 -7.571 1220 HB2 LEU 70 HB2 LEU 70 11.462 19.656 -6.099 1221 HB3 LEU 70 HB1 LEU 70 11.932 20.102 -7.740 1222 HG LEU 70 HG LEU 70 11.369 17.273 -6.803 1223 HD11 LEU 70 HD11 LEU 70 9.310 17.457 -8.107 1224 HD12 LEU 70 HD12 LEU 70 9.723 19.106 -8.574 1225 HD13 LEU 70 HD13 LEU 70 9.352 18.734 -6.891 1226 HD21 LEU 70 HD21 LEU 70 11.284 17.012 -9.420 1227 HD22 LEU 70 HD22 LEU 70 12.850 17.047 -8.613 1228 HD23 LEU 70 HD23 LEU 70 12.246 18.493 -9.422 1229 H GLU 71 HN GLU 71 14.918 20.852 -7.632 1230 HA GLU 71 HA GLU 71 15.546 22.076 -4.986 1231 HB2 GLU 71 HB2 GLU 71 16.756 22.464 -7.738 1232 HB3 GLU 71 HB1 GLU 71 17.269 23.338 -6.295 1233 HG2 GLU 71 HG2 GLU 71 17.829 21.214 -5.189 1234 HG3 GLU 71 HG1 GLU 71 17.292 20.323 -6.613 1235 H HIS 72 HN HIS 72 16.115 24.684 -5.919 1236 HA HIS 72 HA HIS 72 13.387 25.758 -6.009 1237 HB2 HIS 72 HB2 HIS 72 15.436 27.806 -6.379 1238 HB3 HIS 72 HB1 HIS 72 14.366 27.560 -5.002 1239 HD2 HIS 72 HD2 HIS 72 18.045 26.796 -6.064 1240 HE1 HIS 72 HE1 HIS 72 17.522 25.333 -2.138 1241 HE2 HIS 72 HE2 HIS 72 19.221 25.798 -3.963 1242 H HIS 73 HN HIS 73 12.318 26.122 -7.888 1243 HA HIS 73 HA HIS 73 13.826 26.186 -10.440 1244 HB2 HIS 73 HB2 HIS 73 11.697 24.841 -10.140 1245 HB3 HIS 73 HB1 HIS 73 10.830 26.374 -10.037 1246 HD2 HIS 73 HD2 HIS 73 9.670 25.530 -12.632 1247 HE1 HIS 73 HE1 HIS 73 13.175 26.508 -14.777 1248 HE2 HIS 73 HE2 HIS 73 10.713 25.933 -14.988 1249 H HIS 74 HN HIS 74 13.001 28.373 -8.133 1250 HA HIS 74 HA HIS 74 13.018 30.707 -8.106 1251 HB2 HIS 74 HB2 HIS 74 13.457 30.780 -11.089 1252 HB3 HIS 74 HB1 HIS 74 14.056 31.877 -9.848 1253 HD2 HIS 74 HD2 HIS 74 15.887 29.766 -12.025 1254 HE1 HIS 74 HE1 HIS 74 17.437 28.531 -8.296 1255 HE2 HIS 74 HE2 HIS 74 17.820 28.513 -10.803 1256 H HIS 75 HN HIS 75 10.677 28.888 -9.217 1257 HA HIS 75 HA HIS 75 9.005 31.148 -10.290 1258 HB2 HIS 75 HB2 HIS 75 8.937 28.165 -10.754 1259 HB3 HIS 75 HB1 HIS 75 7.502 29.146 -11.031 1260 HD2 HIS 75 HD2 HIS 75 8.911 31.734 -12.538 1261 HE1 HIS 75 HE1 HIS 75 10.469 28.854 -15.205 1262 HE2 HIS 75 HE2 HIS 75 9.996 31.325 -14.872 1263 H HIS 76 HN HIS 76 7.259 31.754 -9.090 1264 HA HIS 76 HA HIS 76 6.956 30.858 -6.393 1265 HB2 HIS 76 HB2 HIS 76 5.031 32.365 -8.187 1266 HB3 HIS 76 HB1 HIS 76 4.842 32.183 -6.444 1267 HD2 HIS 76 HD2 HIS 76 7.943 32.836 -5.519 1268 HE1 HIS 76 HE1 HIS 76 7.444 36.435 -7.675 1269 HE2 HIS 76 HE2 HIS 76 8.847 35.250 -5.923 1270 H HIS 77 HN HIS 77 4.151 30.783 -8.533 1271 HA HIS 77 HA HIS 77 3.824 27.995 -8.824 1272 HB2 HIS 77 HB2 HIS 77 1.925 27.920 -6.901 1273 HB3 HIS 77 HB1 HIS 77 3.599 27.474 -6.575 1274 HD2 HIS 77 HD2 HIS 77 4.182 28.655 -4.149 1275 HE1 HIS 77 HE1 HIS 77 2.471 32.442 -4.898 1276 HE2 HIS 77 HE2 HIS 77 3.803 31.067 -3.233 Start of MODEL 2 1 H1 MET 1 HT1 MET 1 6.074 11.732 15.238 2 H2 MET 1 HT2 MET 1 7.261 12.948 15.261 3 H3 MET 1 HT3 MET 1 7.436 11.604 14.237 4 HA MET 1 HA MET 1 5.029 12.600 13.487 5 HB2 MET 1 HB2 MET 1 6.970 14.886 13.953 6 HB3 MET 1 HB1 MET 1 5.389 15.002 13.180 7 HG2 MET 1 HG2 MET 1 5.899 14.158 16.048 8 HG3 MET 1 HG1 MET 1 5.258 15.717 15.535 9 HE1 MET 1 HE1 MET 1 1.865 15.217 14.263 10 HE2 MET 1 HE2 MET 1 3.048 14.677 13.075 11 HE3 MET 1 HE3 MET 1 3.420 16.047 14.117 12 H GLU 2 HN GLU 2 5.153 12.046 11.384 13 HA GLU 2 HA GLU 2 7.163 12.988 9.582 14 HB2 GLU 2 HB2 GLU 2 8.230 10.717 9.125 15 HB3 GLU 2 HB1 GLU 2 8.721 11.502 10.622 16 HG2 GLU 2 HG2 GLU 2 6.605 10.044 11.559 17 HG3 GLU 2 HG1 GLU 2 7.100 9.015 10.225 18 H LEU 3 HN LEU 3 6.655 9.798 8.745 19 HA LEU 3 HA LEU 3 5.125 10.145 6.498 20 HB2 LEU 3 HB2 LEU 3 6.119 7.966 7.379 21 HB3 LEU 3 HB1 LEU 3 4.686 7.825 8.396 22 HG LEU 3 HG LEU 3 3.382 8.181 6.121 23 HD11 LEU 3 HD11 LEU 3 4.608 7.134 4.213 24 HD12 LEU 3 HD12 LEU 3 6.076 7.134 5.188 25 HD13 LEU 3 HD13 LEU 3 5.332 8.661 4.717 26 HD21 LEU 3 HD21 LEU 3 4.811 5.620 6.891 27 HD22 LEU 3 HD22 LEU 3 3.485 5.699 5.732 28 HD23 LEU 3 HD23 LEU 3 3.210 6.140 7.418 29 H SER 4 HN SER 4 3.909 9.910 9.824 30 HA SER 4 HA SER 4 1.113 9.996 8.970 31 HB2 SER 4 HB2 SER 4 2.305 10.508 11.716 32 HB3 SER 4 HB1 SER 4 0.628 10.106 11.353 33 HG SER 4 HG SER 4 2.661 8.408 10.437 34 H ASN 5 HN ASN 5 3.558 12.317 10.042 35 HA ASN 5 HA ASN 5 1.815 14.516 10.567 36 HB2 ASN 5 HB2 ASN 5 4.289 14.326 11.123 37 HB3 ASN 5 HB1 ASN 5 4.614 14.697 9.431 38 HD21 ASN 5 HD21 ASN 5 2.459 16.027 12.021 39 HD22 ASN 5 HD22 ASN 5 2.830 17.650 11.688 40 H GLU 6 HN GLU 6 3.563 13.596 7.598 41 HA GLU 6 HA GLU 6 2.513 15.772 6.036 42 HB2 GLU 6 HB2 GLU 6 3.126 13.924 4.129 43 HB3 GLU 6 HB1 GLU 6 4.351 14.890 4.945 44 HG2 GLU 6 HG2 GLU 6 4.880 13.144 6.462 45 HG3 GLU 6 HG1 GLU 6 3.440 12.231 6.021 46 H LEU 7 HN LEU 7 1.522 12.359 6.424 47 HA LEU 7 HA LEU 7 -0.679 12.494 4.594 48 HB2 LEU 7 HB2 LEU 7 -0.145 10.746 7.010 49 HB3 LEU 7 HB1 LEU 7 -1.504 10.491 5.916 50 HG LEU 7 HG LEU 7 1.395 10.583 5.020 51 HD11 LEU 7 HD11 LEU 7 1.206 8.111 4.846 52 HD12 LEU 7 HD12 LEU 7 -0.382 8.197 5.610 53 HD13 LEU 7 HD13 LEU 7 1.058 8.676 6.510 54 HD21 LEU 7 HD21 LEU 7 0.188 9.216 3.082 55 HD22 LEU 7 HD22 LEU 7 0.169 10.973 3.082 56 HD23 LEU 7 HD23 LEU 7 -1.238 10.081 3.656 57 H LYS 8 HN LYS 8 -0.529 12.950 8.127 58 HA LYS 8 HA LYS 8 -3.328 13.437 8.471 59 HB2 LYS 8 HB2 LYS 8 -1.737 12.853 10.300 60 HB3 LYS 8 HB1 LYS 8 -1.022 14.458 10.152 61 HG2 LYS 8 HG2 LYS 8 -3.171 15.496 10.696 62 HG3 LYS 8 HG1 LYS 8 -3.939 13.909 10.774 63 HD2 LYS 8 HD2 LYS 8 -2.424 13.273 12.622 64 HD3 LYS 8 HD1 LYS 8 -1.680 14.870 12.554 65 HE2 LYS 8 HE2 LYS 8 -3.847 15.914 13.079 66 HE3 LYS 8 HE1 LYS 8 -4.607 14.323 13.130 67 HZ1 LYS 8 HZ1 LYS 8 -4.008 14.187 15.242 68 HZ2 LYS 8 HZ2 LYS 8 -3.165 15.660 15.152 69 HZ3 LYS 8 HZ3 LYS 8 -2.378 14.202 14.774 70 H VAL 9 HN VAL 9 -0.600 15.566 7.734 71 HA VAL 9 HA VAL 9 -1.955 18.040 8.110 72 HB VAL 9 HB VAL 9 0.377 17.201 6.381 73 HG11 VAL 9 HG11 VAL 9 -0.977 19.898 6.563 74 HG12 VAL 9 HG12 VAL 9 -0.527 18.990 5.121 75 HG13 VAL 9 HG13 VAL 9 0.724 19.738 6.114 76 HG21 VAL 9 HG21 VAL 9 1.712 18.133 8.057 77 HG22 VAL 9 HG22 VAL 9 0.365 17.542 9.025 78 HG23 VAL 9 HG23 VAL 9 0.456 19.249 8.594 79 H GLU 10 HN GLU 10 -1.701 15.933 5.215 80 HA GLU 10 HA GLU 10 -3.078 17.690 3.451 81 HB2 GLU 10 HB2 GLU 10 -2.756 14.681 3.570 82 HB3 GLU 10 HB1 GLU 10 -3.535 15.508 2.217 83 HG2 GLU 10 HG2 GLU 10 -1.548 16.658 1.624 84 HG3 GLU 10 HG1 GLU 10 -0.783 16.320 3.178 85 H ARG 11 HN ARG 11 -4.217 15.260 5.783 86 HA ARG 11 HA ARG 11 -6.957 15.261 4.968 87 HB2 ARG 11 HB2 ARG 11 -5.751 14.851 7.722 88 HB3 ARG 11 HB1 ARG 11 -7.418 14.480 7.291 89 HG2 ARG 11 HG2 ARG 11 -6.448 12.979 5.451 90 HG3 ARG 11 HG1 ARG 11 -4.897 13.170 6.269 91 HD2 ARG 11 HD2 ARG 11 -7.319 11.671 7.142 92 HD3 ARG 11 HD1 ARG 11 -5.617 11.311 7.430 93 HE ARG 11 HE ARG 11 -5.889 13.458 9.028 94 HH11 ARG 11 HH21 ARG 11 -7.983 10.754 8.480 95 HH12 ARG 11 HH22 ARG 11 -8.708 10.836 10.049 96 HH21 ARG 11 HH11 ARG 11 -6.834 13.561 11.080 97 HH22 ARG 11 HH12 ARG 11 -8.059 12.417 11.517 98 H ILE 12 HN ILE 12 -5.186 17.299 7.312 99 HA ILE 12 HA ILE 12 -7.440 18.744 8.285 100 HB ILE 12 HB ILE 12 -4.549 19.598 7.959 101 HG12 ILE 12 HG12 ILE 12 -6.026 18.610 10.419 102 HG13 ILE 12 HG11 ILE 12 -5.053 17.562 9.386 103 HG21 ILE 12 HG21 ILE 12 -6.868 20.828 9.464 104 HG22 ILE 12 HG22 ILE 12 -5.848 21.589 8.245 105 HG23 ILE 12 HG23 ILE 12 -5.186 21.205 9.832 106 HD11 ILE 12 HD11 ILE 12 -4.117 19.945 11.001 107 HD12 ILE 12 HD12 ILE 12 -3.127 19.188 9.756 108 HD13 ILE 12 HD13 ILE 12 -3.617 18.264 11.175 109 H ARG 13 HN ARG 13 -5.122 19.619 5.699 110 HA ARG 13 HA ARG 13 -6.562 21.978 4.928 111 HB2 ARG 13 HB2 ARG 13 -4.480 20.284 3.543 112 HB3 ARG 13 HB1 ARG 13 -5.197 21.697 2.768 113 HG2 ARG 13 HG2 ARG 13 -4.519 23.031 4.841 114 HG3 ARG 13 HG1 ARG 13 -3.595 21.615 5.342 115 HD2 ARG 13 HD2 ARG 13 -3.172 22.719 2.575 116 HD3 ARG 13 HD1 ARG 13 -2.427 23.531 3.947 117 HE ARG 13 HE ARG 13 -1.944 20.651 3.256 118 HH11 ARG 13 HH21 ARG 13 -0.889 23.714 4.553 119 HH12 ARG 13 HH22 ARG 13 0.720 23.156 4.847 120 HH21 ARG 13 HH11 ARG 13 0.164 19.969 3.648 121 HH22 ARG 13 HH12 ARG 13 1.310 21.067 4.345 122 H LEU 14 HN LEU 14 -6.649 18.624 3.803 123 HA LEU 14 HA LEU 14 -8.570 19.272 1.688 124 HB2 LEU 14 HB2 LEU 14 -7.575 16.634 2.801 125 HB3 LEU 14 HB1 LEU 14 -8.620 16.792 1.394 126 HG LEU 14 HG LEU 14 -5.895 18.103 1.619 127 HD11 LEU 14 HD11 LEU 14 -5.002 16.310 0.299 128 HD12 LEU 14 HD12 LEU 14 -6.604 15.621 0.035 129 HD13 LEU 14 HD13 LEU 14 -5.871 15.560 1.637 130 HD21 LEU 14 HD21 LEU 14 -7.998 17.904 -0.534 131 HD22 LEU 14 HD22 LEU 14 -6.302 18.005 -1.000 132 HD23 LEU 14 HD23 LEU 14 -7.029 19.292 -0.046 133 H SER 15 HN SER 15 -8.754 19.051 4.978 134 HA SER 15 HA SER 15 -10.504 18.739 6.496 135 HB2 SER 15 HB2 SER 15 -11.522 20.542 5.209 136 HB3 SER 15 HB1 SER 15 -12.086 19.401 3.994 137 HG SER 15 HG SER 15 -13.476 18.527 5.472 138 H LEU 16 HN LEU 16 -9.812 16.392 6.434 139 HA LEU 16 HA LEU 16 -11.965 14.636 5.292 140 HB2 LEU 16 HB2 LEU 16 -9.003 14.305 5.579 141 HB3 LEU 16 HB1 LEU 16 -9.993 12.864 5.797 142 HG LEU 16 HG LEU 16 -11.017 13.187 3.624 143 HD11 LEU 16 HD11 LEU 16 -9.897 15.047 2.167 144 HD12 LEU 16 HD12 LEU 16 -9.525 15.791 3.721 145 HD13 LEU 16 HD13 LEU 16 -11.199 15.476 3.269 146 HD21 LEU 16 HD21 LEU 16 -7.995 13.362 3.669 147 HD22 LEU 16 HD22 LEU 16 -8.907 13.017 2.199 148 HD23 LEU 16 HD23 LEU 16 -8.990 11.909 3.570 149 H THR 17 HN THR 17 -12.938 13.176 6.615 150 HA THR 17 HA THR 17 -12.275 13.334 9.545 151 HB THR 17 HB THR 17 -14.670 12.966 9.961 152 HG1 THR 17 HG1 THR 17 -15.413 11.908 8.231 153 HG21 THR 17 HG21 THR 17 -14.057 15.247 8.068 154 HG22 THR 17 HG22 THR 17 -13.872 15.262 9.821 155 HG23 THR 17 HG23 THR 17 -15.480 15.159 9.106 156 H ALA 18 HN ALA 18 -12.533 11.377 10.725 157 HA ALA 18 HA ALA 18 -11.667 9.012 9.386 158 HB1 ALA 18 HB1 ALA 18 -12.252 7.907 11.565 159 HB2 ALA 18 HB2 ALA 18 -12.983 9.425 12.085 160 HB3 ALA 18 HB3 ALA 18 -11.253 9.348 11.755 161 H LYS 19 HN LYS 19 -14.871 10.120 10.435 162 HA LYS 19 HA LYS 19 -16.255 7.688 9.803 163 HB2 LYS 19 HB2 LYS 19 -17.052 9.712 11.197 164 HB3 LYS 19 HB1 LYS 19 -17.479 10.447 9.653 165 HG2 LYS 19 HG2 LYS 19 -19.483 9.378 10.160 166 HG3 LYS 19 HG1 LYS 19 -18.684 8.114 9.230 167 HD2 LYS 19 HD2 LYS 19 -19.357 6.910 11.108 168 HD3 LYS 19 HD1 LYS 19 -17.734 7.388 11.601 169 HE2 LYS 19 HE2 LYS 19 -18.665 9.315 12.828 170 HE3 LYS 19 HE1 LYS 19 -20.290 8.865 12.312 171 HZ1 LYS 19 HZ1 LYS 19 -19.893 8.025 14.505 172 HZ2 LYS 19 HZ2 LYS 19 -18.462 7.254 14.009 173 HZ3 LYS 19 HZ3 LYS 19 -19.965 6.714 13.431 174 H SER 20 HN SER 20 -15.791 10.704 7.933 175 HA SER 20 HA SER 20 -17.284 9.868 5.655 176 HB2 SER 20 HB2 SER 20 -16.594 12.205 6.069 177 HB3 SER 20 HB1 SER 20 -14.913 11.756 5.795 178 HG SER 20 HG SER 20 -16.176 10.822 3.743 179 H VAL 21 HN VAL 21 -13.776 9.670 6.325 180 HA VAL 21 HA VAL 21 -13.158 8.369 3.833 181 HB VAL 21 HB VAL 21 -11.673 8.464 6.475 182 HG11 VAL 21 HG11 VAL 21 -10.911 7.351 3.770 183 HG12 VAL 21 HG12 VAL 21 -10.821 6.555 5.341 184 HG13 VAL 21 HG13 VAL 21 -9.698 7.858 4.947 185 HG21 VAL 21 HG21 VAL 21 -11.166 9.935 3.869 186 HG22 VAL 21 HG22 VAL 21 -10.357 10.197 5.414 187 HG23 VAL 21 HG23 VAL 21 -12.057 10.627 5.225 188 H ALA 22 HN ALA 22 -13.734 7.135 7.132 189 HA ALA 22 HA ALA 22 -13.284 4.381 6.504 190 HB1 ALA 22 HB1 ALA 22 -13.339 5.232 8.810 191 HB2 ALA 22 HB2 ALA 22 -14.523 3.941 8.600 192 HB3 ALA 22 HB3 ALA 22 -15.047 5.626 8.634 193 H GLU 23 HN GLU 23 -16.313 6.273 6.696 194 HA GLU 23 HA GLU 23 -17.975 4.068 5.891 195 HB2 GLU 23 HB2 GLU 23 -18.915 5.957 7.096 196 HB3 GLU 23 HB1 GLU 23 -18.432 7.066 5.814 197 HG2 GLU 23 HG2 GLU 23 -20.167 6.446 4.425 198 HG3 GLU 23 HG1 GLU 23 -20.142 4.765 4.953 199 H GLU 24 HN GLU 24 -16.282 6.622 4.127 200 HA GLU 24 HA GLU 24 -17.532 6.023 1.583 201 HB2 GLU 24 HB2 GLU 24 -16.517 8.205 2.020 202 HB3 GLU 24 HB1 GLU 24 -14.941 7.454 2.252 203 HG2 GLU 24 HG2 GLU 24 -16.430 6.993 -0.332 204 HG3 GLU 24 HG1 GLU 24 -15.564 8.509 -0.090 205 H MET 25 HN MET 25 -14.295 5.287 2.933 206 HA MET 25 HA MET 25 -13.491 3.645 0.727 207 HB2 MET 25 HB2 MET 25 -12.566 3.842 3.596 208 HB3 MET 25 HB1 MET 25 -11.825 2.728 2.447 209 HG2 MET 25 HG2 MET 25 -11.291 4.606 0.950 210 HG3 MET 25 HG1 MET 25 -12.065 5.726 2.069 211 HE1 MET 25 HE1 MET 25 -9.597 3.080 1.451 212 HE2 MET 25 HE2 MET 25 -9.580 2.578 3.139 213 HE3 MET 25 HE3 MET 25 -8.183 3.410 2.462 214 H GLY 26 HN GLY 26 -15.076 2.911 3.826 215 HA2 GLY 26 HA2 GLY 26 -16.672 1.092 4.044 216 HA3 GLY 26 HA1 GLY 26 -15.872 0.258 2.710 217 H ILE 27 HN ILE 27 -14.166 1.769 5.428 218 HA ILE 27 HA ILE 27 -13.427 -0.969 6.420 219 HB ILE 27 HB ILE 27 -11.171 -0.079 6.914 220 HG12 ILE 27 HG12 ILE 27 -12.021 2.336 5.292 221 HG13 ILE 27 HG11 ILE 27 -11.911 2.339 7.049 222 HG21 ILE 27 HG21 ILE 27 -10.349 -0.259 4.691 223 HG22 ILE 27 HG22 ILE 27 -11.827 0.418 4.007 224 HG23 ILE 27 HG23 ILE 27 -11.841 -1.201 4.704 225 HD11 ILE 27 HD11 ILE 27 -9.852 3.206 5.867 226 HD12 ILE 27 HD12 ILE 27 -9.601 1.575 5.251 227 HD13 ILE 27 HD13 ILE 27 -9.555 1.878 6.987 228 H SER 28 HN SER 28 -12.736 -0.988 8.692 229 HA SER 28 HA SER 28 -14.548 0.571 10.327 230 HB2 SER 28 HB2 SER 28 -14.043 -1.703 10.973 231 HB3 SER 28 HB1 SER 28 -12.316 -1.361 11.002 232 HG SER 28 HG SER 28 -14.093 0.148 12.579 233 H ARG 29 HN ARG 29 -13.848 1.933 12.132 234 HA ARG 29 HA ARG 29 -11.940 3.932 11.385 235 HB2 ARG 29 HB2 ARG 29 -13.255 3.264 14.032 236 HB3 ARG 29 HB1 ARG 29 -12.236 4.682 13.790 237 HG2 ARG 29 HG2 ARG 29 -13.775 5.308 11.852 238 HG3 ARG 29 HG1 ARG 29 -14.860 4.036 12.421 239 HD2 ARG 29 HD2 ARG 29 -15.620 6.057 13.446 240 HD3 ARG 29 HD1 ARG 29 -14.773 5.164 14.709 241 HE ARG 29 HE ARG 29 -13.633 7.493 13.207 242 HH11 ARG 29 HH21 ARG 29 -13.639 5.345 15.948 243 HH12 ARG 29 HH22 ARG 29 -12.490 6.290 16.827 244 HH21 ARG 29 HH11 ARG 29 -12.135 8.689 14.363 245 HH22 ARG 29 HH12 ARG 29 -11.643 8.166 15.939 246 H GLN 30 HN GLN 30 -11.742 1.084 13.495 247 HA GLN 30 HA GLN 30 -9.229 1.604 14.695 248 HB2 GLN 30 HB2 GLN 30 -10.706 -0.270 15.348 249 HB3 GLN 30 HB1 GLN 30 -10.373 -1.062 13.808 250 HG2 GLN 30 HG2 GLN 30 -8.017 -1.260 14.358 251 HG3 GLN 30 HG1 GLN 30 -8.243 -0.325 15.836 252 HE21 GLN 30 HE21 GLN 30 -8.402 -1.627 17.654 253 HE22 GLN 30 HE22 GLN 30 -9.044 -3.197 17.684 254 H GLN 31 HN GLN 31 -10.026 0.123 11.560 255 HA GLN 31 HA GLN 31 -7.327 -0.531 10.840 256 HB2 GLN 31 HB2 GLN 31 -9.324 -1.456 9.689 257 HB3 GLN 31 HB1 GLN 31 -9.679 0.146 9.043 258 HG2 GLN 31 HG2 GLN 31 -7.593 0.175 7.806 259 HG3 GLN 31 HG1 GLN 31 -7.079 -1.337 8.558 260 HE21 GLN 31 HE21 GLN 31 -7.313 -1.109 5.713 261 HE22 GLN 31 HE22 GLN 31 -8.595 -2.097 5.199 262 H LEU 32 HN LEU 32 -9.332 2.364 10.376 263 HA LEU 32 HA LEU 32 -7.512 3.774 8.690 264 HB2 LEU 32 HB2 LEU 32 -9.880 4.445 9.073 265 HB3 LEU 32 HB1 LEU 32 -9.460 4.908 10.721 266 HG LEU 32 HG LEU 32 -7.828 6.555 9.827 267 HD11 LEU 32 HD11 LEU 32 -7.115 5.854 7.727 268 HD12 LEU 32 HD12 LEU 32 -8.295 7.075 7.265 269 HD13 LEU 32 HD13 LEU 32 -8.729 5.365 7.214 270 HD21 LEU 32 HD21 LEU 32 -9.478 8.178 9.128 271 HD22 LEU 32 HD22 LEU 32 -10.238 7.119 10.315 272 HD23 LEU 32 HD23 LEU 32 -10.577 6.905 8.599 273 H CYS 33 HN CYS 33 -7.853 3.665 12.225 274 HA CYS 33 HA CYS 33 -5.839 5.604 12.806 275 HB2 CYS 33 HB2 CYS 33 -6.862 3.237 14.397 276 HB3 CYS 33 HB1 CYS 33 -5.804 4.485 15.055 277 HG CYS 33 HG CYS 33 -7.781 6.228 14.365 278 H ASN 34 HN ASN 34 -5.695 2.117 12.232 279 HA ASN 34 HA ASN 34 -2.975 1.727 13.021 280 HB2 ASN 34 HB2 ASN 34 -4.866 0.269 11.171 281 HB3 ASN 34 HB1 ASN 34 -3.182 -0.237 11.304 282 HD21 ASN 34 HD21 ASN 34 -5.604 0.885 13.749 283 HD22 ASN 34 HD22 ASN 34 -5.392 -0.449 14.778 284 H ILE 35 HN ILE 35 -4.454 2.807 9.987 285 HA ILE 35 HA ILE 35 -2.124 2.639 8.355 286 HB ILE 35 HB ILE 35 -4.487 4.538 8.255 287 HG12 ILE 35 HG12 ILE 35 -3.787 2.092 6.611 288 HG13 ILE 35 HG11 ILE 35 -4.915 2.092 7.963 289 HG21 ILE 35 HG21 ILE 35 -2.722 5.633 7.053 290 HG22 ILE 35 HG22 ILE 35 -3.716 4.843 5.833 291 HG23 ILE 35 HG23 ILE 35 -2.186 4.119 6.326 292 HD11 ILE 35 HD11 ILE 35 -5.192 3.620 5.362 293 HD12 ILE 35 HD12 ILE 35 -6.242 3.865 6.753 294 HD13 ILE 35 HD13 ILE 35 -6.213 2.300 5.936 295 H GLU 36 HN GLU 36 -3.358 5.272 10.425 296 HA GLU 36 HA GLU 36 -1.286 7.115 9.738 297 HB2 GLU 36 HB2 GLU 36 -3.061 6.829 12.166 298 HB3 GLU 36 HB1 GLU 36 -1.839 8.093 12.075 299 HG2 GLU 36 HG2 GLU 36 -4.092 7.681 10.074 300 HG3 GLU 36 HG1 GLU 36 -4.051 8.912 11.331 301 H GLN 37 HN GLN 37 -1.461 4.508 12.110 302 HA GLN 37 HA GLN 37 1.298 5.148 13.037 303 HB2 GLN 37 HB2 GLN 37 -0.793 3.187 14.033 304 HB3 GLN 37 HB1 GLN 37 0.819 3.365 14.730 305 HG2 GLN 37 HG2 GLN 37 -1.194 5.624 14.484 306 HG3 GLN 37 HG1 GLN 37 -0.930 4.687 15.952 307 HE21 GLN 37 HE21 GLN 37 1.005 5.100 17.183 308 HE22 GLN 37 HE22 GLN 37 2.065 6.373 16.812 309 H SER 38 HN SER 38 0.959 4.232 10.347 310 HA SER 38 HA SER 38 1.420 1.388 10.155 311 HB2 SER 38 HB2 SER 38 2.119 1.910 7.833 312 HB3 SER 38 HB1 SER 38 0.601 2.707 8.241 313 HG SER 38 HG SER 38 2.501 3.938 7.234 314 H GLU 39 HN GLU 39 3.346 3.990 11.176 315 HA GLU 39 HA GLU 39 5.614 4.200 11.668 316 HB2 GLU 39 HB2 GLU 39 5.074 2.232 13.079 317 HB3 GLU 39 HB1 GLU 39 5.449 1.170 11.724 318 HG2 GLU 39 HG2 GLU 39 7.381 1.311 13.219 319 HG3 GLU 39 HG1 GLU 39 7.774 2.086 11.688 320 H THR 40 HN THR 40 6.056 1.096 10.018 321 HA THR 40 HA THR 40 7.915 2.476 8.148 322 HB THR 40 HB THR 40 8.694 0.474 9.404 323 HG1 THR 40 HG1 THR 40 8.426 0.181 6.598 324 HG21 THR 40 HG21 THR 40 7.767 -1.676 9.047 325 HG22 THR 40 HG22 THR 40 6.823 -1.128 7.662 326 HG23 THR 40 HG23 THR 40 6.372 -0.622 9.290 327 H ALA 41 HN ALA 41 7.834 1.940 5.846 328 HA ALA 41 HA ALA 41 5.033 1.647 4.918 329 HB1 ALA 41 HB1 ALA 41 5.738 2.691 2.900 330 HB2 ALA 41 HB2 ALA 41 7.440 2.404 3.267 331 HB3 ALA 41 HB3 ALA 41 6.522 3.579 4.208 332 HA PRO 42 HA PRO 42 5.893 -2.691 3.836 333 HB2 PRO 42 HB2 PRO 42 3.970 -2.064 1.622 334 HB3 PRO 42 HB1 PRO 42 3.982 -3.442 2.741 335 HG2 PRO 42 HG2 PRO 42 2.284 -1.385 3.011 336 HG3 PRO 42 HG1 PRO 42 2.951 -2.250 4.409 337 HD2 PRO 42 HD2 PRO 42 3.577 0.487 3.425 338 HD3 PRO 42 HD1 PRO 42 3.748 -0.202 5.055 339 H VAL 43 HN VAL 43 7.189 -3.760 2.322 340 HA VAL 43 HA VAL 43 8.812 -2.195 0.540 341 HB VAL 43 HB VAL 43 9.665 -4.424 -0.218 342 HG11 VAL 43 HG11 VAL 43 10.732 -3.528 1.718 343 HG12 VAL 43 HG12 VAL 43 10.334 -5.192 2.145 344 HG13 VAL 43 HG13 VAL 43 9.333 -3.867 2.738 345 HG21 VAL 43 HG21 VAL 43 7.460 -5.603 -0.041 346 HG22 VAL 43 HG22 VAL 43 7.587 -5.500 1.715 347 HG23 VAL 43 HG23 VAL 43 8.758 -6.450 0.799 348 H VAL 44 HN VAL 44 5.859 -4.045 0.139 349 HA VAL 44 HA VAL 44 5.891 -4.251 -2.709 350 HB VAL 44 HB VAL 44 4.341 -5.569 -1.384 351 HG11 VAL 44 HG11 VAL 44 3.177 -2.887 -0.589 352 HG12 VAL 44 HG12 VAL 44 3.994 -4.038 0.466 353 HG13 VAL 44 HG13 VAL 44 2.431 -4.445 -0.235 354 HG21 VAL 44 HG21 VAL 44 2.350 -5.249 -2.672 355 HG22 VAL 44 HG22 VAL 44 3.685 -4.744 -3.709 356 HG23 VAL 44 HG23 VAL 44 2.691 -3.534 -2.897 357 H VAL 45 HN VAL 45 4.948 -1.641 -0.529 358 HA VAL 45 HA VAL 45 3.558 -0.028 -2.423 359 HB VAL 45 HB VAL 45 5.154 0.641 0.058 360 HG11 VAL 45 HG11 VAL 45 3.897 2.866 -0.106 361 HG12 VAL 45 HG12 VAL 45 3.594 2.450 -1.795 362 HG13 VAL 45 HG13 VAL 45 5.249 2.643 -1.218 363 HG21 VAL 45 HG21 VAL 45 3.064 0.739 1.145 364 HG22 VAL 45 HG22 VAL 45 2.900 -0.658 0.083 365 HG23 VAL 45 HG23 VAL 45 2.173 0.884 -0.369 366 H LYS 46 HN LYS 46 6.996 -0.079 -1.458 367 HA LYS 46 HA LYS 46 7.843 1.967 -3.277 368 HB2 LYS 46 HB2 LYS 46 9.352 -0.322 -1.985 369 HB3 LYS 46 HB1 LYS 46 10.123 0.962 -2.916 370 HG2 LYS 46 HG2 LYS 46 9.210 2.650 -1.373 371 HG3 LYS 46 HG1 LYS 46 8.413 1.377 -0.445 372 HD2 LYS 46 HD2 LYS 46 10.598 0.358 0.053 373 HD3 LYS 46 HD1 LYS 46 11.403 1.619 -0.879 374 HE2 LYS 46 HE2 LYS 46 10.525 3.331 0.652 375 HE3 LYS 46 HE1 LYS 46 9.688 2.085 1.579 376 HZ1 LYS 46 HZ1 LYS 46 12.345 2.932 1.819 377 HZ2 LYS 46 HZ2 LYS 46 12.360 1.316 1.295 378 HZ3 LYS 46 HZ3 LYS 46 11.537 1.744 2.718 379 H TYR 47 HN TYR 47 7.473 -1.535 -3.583 380 HA TYR 47 HA TYR 47 8.840 -1.941 -6.018 381 HB2 TYR 47 HB2 TYR 47 7.797 -3.736 -4.603 382 HB3 TYR 47 HB1 TYR 47 6.213 -3.218 -5.181 383 HD1 TYR 47 HD1 TYR 47 9.459 -4.697 -6.177 384 HD2 TYR 47 HD2 TYR 47 5.464 -3.726 -7.421 385 HE1 TYR 47 HE1 TYR 47 9.753 -6.076 -8.217 386 HE2 TYR 47 HE2 TYR 47 5.763 -5.114 -9.455 387 HH TYR 47 HH TYR 47 7.456 -7.265 -9.988 388 H ILE 48 HN ILE 48 5.539 -0.804 -5.381 389 HA ILE 48 HA ILE 48 4.704 -0.612 -8.109 390 HB ILE 48 HB ILE 48 3.872 0.922 -5.627 391 HG12 ILE 48 HG12 ILE 48 2.450 -1.306 -7.119 392 HG13 ILE 48 HG11 ILE 48 3.498 -1.587 -5.727 393 HG21 ILE 48 HG21 ILE 48 3.180 2.319 -7.387 394 HG22 ILE 48 HG22 ILE 48 1.766 1.307 -7.102 395 HG23 ILE 48 HG23 ILE 48 2.839 0.962 -8.458 396 HD11 ILE 48 HD11 ILE 48 2.079 -0.028 -4.390 397 HD12 ILE 48 HD12 ILE 48 1.183 -1.435 -4.965 398 HD13 ILE 48 HD13 ILE 48 0.994 0.123 -5.771 399 H ALA 49 HN ALA 49 6.254 1.733 -5.904 400 HA ALA 49 HA ALA 49 6.262 3.939 -7.717 401 HB1 ALA 49 HB1 ALA 49 8.251 3.245 -5.530 402 HB2 ALA 49 HB2 ALA 49 6.770 4.178 -5.319 403 HB3 ALA 49 HB3 ALA 49 8.086 4.824 -6.298 404 H PHE 50 HN PHE 50 8.484 1.225 -7.287 405 HA PHE 50 HA PHE 50 10.606 2.145 -8.938 406 HB2 PHE 50 HB2 PHE 50 10.729 0.147 -7.469 407 HB3 PHE 50 HB1 PHE 50 9.619 -0.698 -8.548 408 HD1 PHE 50 HD2 PHE 50 12.991 0.830 -8.279 409 HD2 PHE 50 HD1 PHE 50 10.357 -1.603 -10.644 410 HE1 PHE 50 HE2 PHE 50 14.898 0.161 -9.717 411 HE2 PHE 50 HE1 PHE 50 12.263 -2.272 -12.081 412 HZ PHE 50 HZ PHE 50 14.535 -1.391 -11.618 413 H LEU 51 HN LEU 51 7.671 0.278 -9.755 414 HA LEU 51 HA LEU 51 8.257 -0.058 -12.528 415 HB2 LEU 51 HB2 LEU 51 5.626 0.126 -11.037 416 HB3 LEU 51 HB1 LEU 51 5.748 -0.319 -12.739 417 HG LEU 51 HG LEU 51 7.165 -1.779 -10.489 418 HD11 LEU 51 HD11 LEU 51 4.907 -2.248 -10.088 419 HD12 LEU 51 HD12 LEU 51 5.379 -3.570 -11.152 420 HD13 LEU 51 HD13 LEU 51 4.482 -2.198 -11.799 421 HD21 LEU 51 HD21 LEU 51 7.006 -2.134 -13.475 422 HD22 LEU 51 HD22 LEU 51 7.109 -3.575 -12.464 423 HD23 LEU 51 HD23 LEU 51 8.378 -2.358 -12.391 424 H ARG 52 HN ARG 52 6.562 2.531 -10.773 425 HA ARG 52 HA ARG 52 5.788 4.014 -13.084 426 HB2 ARG 52 HB2 ARG 52 6.333 4.849 -10.226 427 HB3 ARG 52 HB1 ARG 52 5.773 5.984 -11.454 428 HG2 ARG 52 HG2 ARG 52 3.850 4.325 -11.889 429 HG3 ARG 52 HG1 ARG 52 4.348 3.528 -10.399 430 HD2 ARG 52 HD2 ARG 52 3.731 6.488 -10.495 431 HD3 ARG 52 HD1 ARG 52 2.481 5.280 -10.203 432 HE ARG 52 HE ARG 52 4.702 4.882 -8.412 433 HH11 ARG 52 HH21 ARG 52 1.969 6.864 -9.118 434 HH12 ARG 52 HH22 ARG 52 1.711 7.329 -7.470 435 HH21 ARG 52 HH11 ARG 52 4.376 5.475 -6.252 436 HH22 ARG 52 HH12 ARG 52 3.074 6.543 -5.847 437 H SER 53 HN SER 53 8.812 3.830 -11.291 438 HA SER 53 HA SER 53 10.082 6.145 -12.320 439 HB2 SER 53 HB2 SER 53 10.924 4.489 -10.540 440 HB3 SER 53 HB1 SER 53 11.489 3.504 -11.884 441 HG SER 53 HG SER 53 12.285 6.086 -11.078 442 H LYS 54 HN LYS 54 9.207 3.167 -13.866 443 HA LYS 54 HA LYS 54 10.977 3.718 -16.199 444 HB2 LYS 54 HB2 LYS 54 9.362 1.359 -15.243 445 HB3 LYS 54 HB1 LYS 54 9.784 1.473 -16.949 446 HG2 LYS 54 HG2 LYS 54 11.499 0.176 -15.821 447 HG3 LYS 54 HG1 LYS 54 12.195 1.730 -16.275 448 HD2 LYS 54 HD2 LYS 54 11.889 2.580 -14.013 449 HD3 LYS 54 HD1 LYS 54 11.048 1.103 -13.540 450 HE2 LYS 54 HE2 LYS 54 13.080 -0.210 -13.969 451 HE3 LYS 54 HE1 LYS 54 13.926 1.248 -14.489 452 HZ1 LYS 54 HZ1 LYS 54 14.347 0.602 -12.147 453 HZ2 LYS 54 HZ2 LYS 54 12.712 0.910 -11.804 454 HZ3 LYS 54 HZ3 LYS 54 13.726 2.170 -12.323 455 H GLY 55 HN GLY 55 8.069 4.768 -15.114 456 HA2 GLY 55 HA2 GLY 55 6.494 6.076 -16.314 457 HA3 GLY 55 HA1 GLY 55 7.198 5.494 -17.823 458 H VAL 56 HN VAL 56 6.299 3.157 -15.378 459 HA VAL 56 HA VAL 56 4.548 1.804 -17.219 460 HB VAL 56 HB VAL 56 4.989 1.494 -14.236 461 HG11 VAL 56 HG11 VAL 56 2.784 0.646 -14.606 462 HG12 VAL 56 HG12 VAL 56 3.841 -0.764 -14.659 463 HG13 VAL 56 HG13 VAL 56 3.237 -0.057 -16.159 464 HG21 VAL 56 HG21 VAL 56 5.863 -0.056 -16.693 465 HG22 VAL 56 HG22 VAL 56 6.138 -0.590 -15.037 466 HG23 VAL 56 HG23 VAL 56 6.898 0.890 -15.623 467 H ASP 57 HN ASP 57 2.332 1.920 -17.455 468 HA ASP 57 HA ASP 57 0.997 4.250 -16.344 469 HB2 ASP 57 HB2 ASP 57 0.643 3.052 -18.648 470 HB3 ASP 57 HB1 ASP 57 -0.428 1.984 -17.745 471 H LEU 58 HN LEU 58 1.033 3.856 -14.077 472 HA LEU 58 HA LEU 58 -0.182 1.455 -12.949 473 HB2 LEU 58 HB2 LEU 58 1.672 2.867 -11.895 474 HB3 LEU 58 HB1 LEU 58 0.431 4.068 -11.556 475 HG LEU 58 HG LEU 58 -0.875 2.139 -10.425 476 HD11 LEU 58 HD11 LEU 58 1.848 0.879 -10.802 477 HD12 LEU 58 HD12 LEU 58 0.258 0.176 -11.077 478 HD13 LEU 58 HD13 LEU 58 0.828 0.436 -9.438 479 HD21 LEU 58 HD21 LEU 58 0.237 2.551 -8.318 480 HD22 LEU 58 HD22 LEU 58 0.322 4.033 -9.263 481 HD23 LEU 58 HD23 LEU 58 1.735 2.987 -9.136 482 H ASN 59 HN ASN 59 -1.198 4.694 -13.795 483 HA ASN 59 HA ASN 59 -3.539 4.883 -12.194 484 HB2 ASN 59 HB2 ASN 59 -2.685 6.085 -14.823 485 HB3 ASN 59 HB1 ASN 59 -4.291 6.414 -14.174 486 HD21 ASN 59 HD21 ASN 59 -0.805 6.637 -13.311 487 HD22 ASN 59 HD22 ASN 59 -0.998 7.937 -12.238 488 H ALA 60 HN ALA 60 -3.060 3.488 -15.448 489 HA ALA 60 HA ALA 60 -5.827 2.900 -15.904 490 HB1 ALA 60 HB1 ALA 60 -3.320 1.537 -16.939 491 HB2 ALA 60 HB2 ALA 60 -4.213 2.838 -17.730 492 HB3 ALA 60 HB3 ALA 60 -4.947 1.244 -17.556 493 H LEU 61 HN LEU 61 -3.199 1.076 -14.364 494 HA LEU 61 HA LEU 61 -4.671 -1.346 -13.975 495 HB2 LEU 61 HB2 LEU 61 -2.235 -1.257 -13.750 496 HB3 LEU 61 HB1 LEU 61 -2.376 -0.144 -12.392 497 HG LEU 61 HG LEU 61 -3.505 -1.858 -11.058 498 HD11 LEU 61 HD11 LEU 61 -3.436 -4.258 -12.124 499 HD12 LEU 61 HD12 LEU 61 -3.424 -3.384 -13.656 500 HD13 LEU 61 HD13 LEU 61 -4.765 -3.174 -12.530 501 HD21 LEU 61 HD21 LEU 61 -1.610 -3.549 -11.004 502 HD22 LEU 61 HD22 LEU 61 -1.116 -1.861 -10.877 503 HD23 LEU 61 HD23 LEU 61 -0.937 -2.720 -12.408 504 H PHE 62 HN PHE 62 -4.137 1.471 -11.862 505 HA PHE 62 HA PHE 62 -5.730 0.463 -9.686 506 HB2 PHE 62 HB2 PHE 62 -4.549 3.117 -10.465 507 HB3 PHE 62 HB1 PHE 62 -5.768 3.093 -9.192 508 HD1 PHE 62 HD2 PHE 62 -2.938 0.800 -10.143 509 HD2 PHE 62 HD1 PHE 62 -4.774 3.186 -7.076 510 HE1 PHE 62 HE2 PHE 62 -1.233 0.037 -8.521 511 HE2 PHE 62 HE1 PHE 62 -3.056 2.425 -5.459 512 HZ PHE 62 HZ PHE 62 -1.283 0.850 -6.183 513 H ASP 63 HN ASP 63 -6.440 2.503 -12.496 514 HA ASP 63 HA ASP 63 -9.046 3.319 -11.724 515 HB2 ASP 63 HB2 ASP 63 -7.820 2.791 -14.442 516 HB3 ASP 63 HB1 ASP 63 -9.418 3.508 -14.226 517 H ARG 64 HN ARG 64 -7.990 0.423 -13.552 518 HA ARG 64 HA ARG 64 -10.647 -0.650 -13.843 519 HB2 ARG 64 HB2 ARG 64 -8.876 -1.433 -15.295 520 HB3 ARG 64 HB1 ARG 64 -7.910 -1.954 -13.916 521 HG2 ARG 64 HG2 ARG 64 -9.508 -3.691 -13.362 522 HG3 ARG 64 HG1 ARG 64 -10.649 -3.094 -14.568 523 HD2 ARG 64 HD2 ARG 64 -9.438 -3.985 -16.341 524 HD3 ARG 64 HD1 ARG 64 -7.895 -3.856 -15.496 525 HE ARG 64 HE ARG 64 -8.270 -5.994 -14.581 526 HH11 ARG 64 HH21 ARG 64 -11.175 -4.673 -15.909 527 HH12 ARG 64 HH22 ARG 64 -12.069 -6.145 -15.731 528 HH21 ARG 64 HH11 ARG 64 -9.415 -7.896 -14.343 529 HH22 ARG 64 HH12 ARG 64 -11.070 -7.975 -14.845 530 H ILE 65 HN ILE 65 -8.051 -1.208 -11.468 531 HA ILE 65 HA ILE 65 -9.460 -3.191 -9.964 532 HB ILE 65 HB ILE 65 -7.267 -1.255 -9.178 533 HG12 ILE 65 HG12 ILE 65 -7.160 -4.240 -9.720 534 HG13 ILE 65 HG11 ILE 65 -6.820 -3.023 -10.951 535 HG21 ILE 65 HG21 ILE 65 -8.561 -3.533 -7.666 536 HG22 ILE 65 HG22 ILE 65 -8.307 -1.875 -7.127 537 HG23 ILE 65 HG23 ILE 65 -6.933 -2.966 -7.292 538 HD11 ILE 65 HD11 ILE 65 -5.092 -2.058 -9.336 539 HD12 ILE 65 HD12 ILE 65 -4.699 -3.633 -10.023 540 HD13 ILE 65 HD13 ILE 65 -5.313 -3.519 -8.373 541 H ILE 66 HN ILE 66 -9.249 0.357 -9.602 542 HA ILE 66 HA ILE 66 -10.924 0.370 -7.237 543 HB ILE 66 HB ILE 66 -10.107 2.572 -9.153 544 HG12 ILE 66 HG12 ILE 66 -9.200 1.990 -6.320 545 HG13 ILE 66 HG11 ILE 66 -8.341 1.411 -7.748 546 HG21 ILE 66 HG21 ILE 66 -11.692 2.626 -6.579 547 HG22 ILE 66 HG22 ILE 66 -12.120 3.335 -8.135 548 HG23 ILE 66 HG23 ILE 66 -10.824 4.042 -7.174 549 HD11 ILE 66 HD11 ILE 66 -7.328 3.499 -6.998 550 HD12 ILE 66 HD12 ILE 66 -8.897 4.305 -7.033 551 HD13 ILE 66 HD13 ILE 66 -8.145 3.771 -8.537 552 H VAL 67 HN VAL 67 -13.086 0.138 -7.196 553 HA VAL 67 HA VAL 67 -14.774 1.298 -9.283 554 HB VAL 67 HB VAL 67 -15.942 -0.909 -9.726 555 HG11 VAL 67 HG11 VAL 67 -14.175 0.202 -11.232 556 HG12 VAL 67 HG12 VAL 67 -14.476 -1.515 -11.490 557 HG13 VAL 67 HG13 VAL 67 -13.049 -0.995 -10.595 558 HG21 VAL 67 HG21 VAL 67 -13.514 -1.923 -8.225 559 HG22 VAL 67 HG22 VAL 67 -14.386 -2.935 -9.373 560 HG23 VAL 67 HG23 VAL 67 -15.210 -2.311 -7.947 561 H ASN 68 HN ASN 68 -16.278 2.280 -8.055 562 HA ASN 68 HA ASN 68 -16.839 1.478 -5.340 563 HB2 ASN 68 HB2 ASN 68 -17.015 3.812 -6.092 564 HB3 ASN 68 HB1 ASN 68 -18.324 3.370 -7.188 565 HD21 ASN 68 HD21 ASN 68 -18.021 4.984 -4.445 566 HD22 ASN 68 HD22 ASN 68 -19.387 4.463 -3.583 567 H LYS 69 HN LYS 69 -17.974 -0.343 -4.893 568 HA LYS 69 HA LYS 69 -19.992 -1.357 -6.792 569 HB2 LYS 69 HB2 LYS 69 -18.894 -2.425 -4.179 570 HB3 LYS 69 HB1 LYS 69 -20.109 -3.258 -5.152 571 HG2 LYS 69 HG2 LYS 69 -18.566 -3.312 -7.064 572 HG3 LYS 69 HG1 LYS 69 -17.353 -2.445 -6.121 573 HD2 LYS 69 HD2 LYS 69 -17.337 -4.310 -4.476 574 HD3 LYS 69 HD1 LYS 69 -18.480 -5.188 -5.493 575 HE2 LYS 69 HE2 LYS 69 -15.720 -4.268 -6.354 576 HE3 LYS 69 HE1 LYS 69 -16.153 -5.920 -5.918 577 HZ1 LYS 69 HZ1 LYS 69 -16.568 -6.117 -8.095 578 HZ2 LYS 69 HZ2 LYS 69 -16.710 -4.442 -8.339 579 HZ3 LYS 69 HZ3 LYS 69 -18.027 -5.330 -7.737 580 H LEU 70 HN LEU 70 -22.202 -1.687 -6.215 581 HA LEU 70 HA LEU 70 -23.254 0.310 -4.321 582 HB2 LEU 70 HB2 LEU 70 -24.674 -1.689 -6.111 583 HB3 LEU 70 HB1 LEU 70 -25.440 -0.356 -5.247 584 HG LEU 70 HG LEU 70 -23.281 -0.053 -7.357 585 HD11 LEU 70 HD11 LEU 70 -26.231 0.620 -7.529 586 HD12 LEU 70 HD12 LEU 70 -25.518 -0.852 -8.191 587 HD13 LEU 70 HD13 LEU 70 -25.039 0.723 -8.825 588 HD21 LEU 70 HD21 LEU 70 -24.776 1.882 -5.592 589 HD22 LEU 70 HD22 LEU 70 -24.261 2.396 -7.199 590 HD23 LEU 70 HD23 LEU 70 -23.067 1.862 -6.023 591 H GLU 71 HN GLU 71 -22.199 -2.865 -4.125 592 HA GLU 71 HA GLU 71 -24.231 -3.738 -2.165 593 HB2 GLU 71 HB2 GLU 71 -21.932 -5.014 -3.610 594 HB3 GLU 71 HB1 GLU 71 -22.414 -5.723 -2.070 595 HG2 GLU 71 HG2 GLU 71 -24.412 -5.127 -4.268 596 HG3 GLU 71 HG1 GLU 71 -23.569 -6.673 -4.144 597 H HIS 72 HN HIS 72 -24.053 -3.201 -0.082 598 HA HIS 72 HA HIS 72 -21.488 -2.200 0.993 599 HB2 HIS 72 HB2 HIS 72 -23.084 -1.988 3.109 600 HB3 HIS 72 HB1 HIS 72 -23.226 -0.852 1.770 601 HD2 HIS 72 HD2 HIS 72 -26.051 -0.650 2.442 602 HE1 HIS 72 HE1 HIS 72 -27.015 -4.474 0.932 603 HE2 HIS 72 HE2 HIS 72 -27.971 -2.273 1.751 604 H HIS 73 HN HIS 73 -23.760 -4.015 2.944 605 HA HIS 73 HA HIS 73 -23.372 -5.825 4.388 606 HB2 HIS 73 HB2 HIS 73 -22.023 -6.853 1.876 607 HB3 HIS 73 HB1 HIS 73 -22.542 -7.843 3.239 608 HD2 HIS 73 HD2 HIS 73 -24.072 -6.068 0.137 609 HE1 HIS 73 HE1 HIS 73 -27.244 -7.897 2.240 610 HE2 HIS 73 HE2 HIS 73 -26.600 -6.704 0.095 611 H HIS 74 HN HIS 74 -20.667 -7.304 3.193 612 HA HIS 74 HA HIS 74 -18.563 -7.620 4.197 613 HB2 HIS 74 HB2 HIS 74 -18.425 -4.602 4.167 614 HB3 HIS 74 HB1 HIS 74 -17.114 -5.759 3.937 615 HD2 HIS 74 HD2 HIS 74 -19.561 -7.326 1.729 616 HE1 HIS 74 HE1 HIS 74 -18.087 -4.186 -0.674 617 HE2 HIS 74 HE2 HIS 74 -19.413 -6.347 -0.678 618 H HIS 75 HN HIS 75 -20.497 -7.823 6.089 619 HA HIS 75 HA HIS 75 -20.308 -5.991 8.279 620 HB2 HIS 75 HB2 HIS 75 -22.098 -7.776 7.860 621 HB3 HIS 75 HB1 HIS 75 -20.942 -8.944 8.500 622 HD2 HIS 75 HD2 HIS 75 -22.294 -5.445 9.880 623 HE1 HIS 75 HE1 HIS 75 -22.022 -8.199 13.070 624 HE2 HIS 75 HE2 HIS 75 -22.657 -5.826 12.433 625 H HIS 76 HN HIS 76 -18.642 -9.080 7.596 626 HA HIS 76 HA HIS 76 -16.656 -8.379 9.742 627 HB2 HIS 76 HB2 HIS 76 -18.150 -10.396 10.193 628 HB3 HIS 76 HB1 HIS 76 -17.355 -11.181 8.828 629 HD2 HIS 76 HD2 HIS 76 -15.506 -12.862 10.043 630 HE1 HIS 76 HE1 HIS 76 -13.944 -10.093 12.824 631 HE2 HIS 76 HE2 HIS 76 -13.719 -12.444 11.898 632 H HIS 77 HN HIS 77 -14.618 -8.146 9.039 633 HA HIS 77 HA HIS 77 -12.749 -8.176 7.639 634 HB2 HIS 77 HB2 HIS 77 -13.205 -10.700 7.904 635 HB3 HIS 77 HB1 HIS 77 -13.949 -10.612 6.307 636 HD2 HIS 77 HD2 HIS 77 -10.454 -10.996 7.803 637 HE1 HIS 77 HE1 HIS 77 -9.869 -9.761 3.806 638 HE2 HIS 77 HE2 HIS 77 -8.726 -10.686 5.873 639 H1 MET 1 HT1 MET 1 -6.150 -15.859 -9.766 640 H2 MET 1 HT2 MET 1 -4.645 -16.464 -10.267 641 H3 MET 1 HT3 MET 1 -6.065 -16.934 -11.076 642 HA MET 1 HA MET 1 -4.381 -14.807 -11.682 643 HB2 MET 1 HB2 MET 1 -5.931 -16.366 -13.102 644 HB3 MET 1 HB1 MET 1 -7.173 -15.157 -12.784 645 HG2 MET 1 HG2 MET 1 -4.456 -14.551 -14.000 646 HG3 MET 1 HG1 MET 1 -5.946 -14.744 -14.924 647 HE1 MET 1 HE1 MET 1 -5.375 -12.721 -15.980 648 HE2 MET 1 HE2 MET 1 -5.896 -11.123 -15.451 649 HE3 MET 1 HE3 MET 1 -7.093 -12.384 -15.735 650 H GLU 2 HN GLU 2 -4.348 -12.785 -10.799 651 HA GLU 2 HA GLU 2 -6.715 -11.160 -10.637 652 HB2 GLU 2 HB2 GLU 2 -6.891 -10.948 -8.218 653 HB3 GLU 2 HB1 GLU 2 -7.143 -12.625 -8.680 654 HG2 GLU 2 HG2 GLU 2 -4.467 -12.710 -8.288 655 HG3 GLU 2 HG1 GLU 2 -4.855 -11.385 -7.193 656 H LEU 3 HN LEU 3 -5.512 -9.809 -8.158 657 HA LEU 3 HA LEU 3 -4.107 -7.726 -9.308 658 HB2 LEU 3 HB2 LEU 3 -4.854 -7.830 -6.932 659 HB3 LEU 3 HB1 LEU 3 -3.546 -8.959 -6.591 660 HG LEU 3 HG LEU 3 -1.900 -7.231 -7.297 661 HD11 LEU 3 HD11 LEU 3 -4.431 -5.687 -7.822 662 HD12 LEU 3 HD12 LEU 3 -2.963 -5.788 -8.793 663 HD13 LEU 3 HD13 LEU 3 -2.977 -4.820 -7.324 664 HD21 LEU 3 HD21 LEU 3 -3.882 -6.480 -5.128 665 HD22 LEU 3 HD22 LEU 3 -2.317 -5.692 -5.332 666 HD23 LEU 3 HD23 LEU 3 -2.395 -7.409 -4.939 667 H SER 4 HN SER 4 -2.720 -10.782 -8.084 668 HA SER 4 HA SER 4 0.006 -10.105 -8.588 669 HB2 SER 4 HB2 SER 4 -0.952 -12.077 -7.248 670 HB3 SER 4 HB1 SER 4 -1.134 -12.895 -8.797 671 HG SER 4 HG SER 4 1.245 -11.865 -7.631 672 H ASN 5 HN ASN 5 -2.493 -11.527 -10.643 673 HA ASN 5 HA ASN 5 -0.825 -12.282 -12.824 674 HB2 ASN 5 HB2 ASN 5 -3.266 -12.886 -12.428 675 HB3 ASN 5 HB1 ASN 5 -3.675 -11.280 -13.031 676 HD21 ASN 5 HD21 ASN 5 -3.550 -10.922 -15.317 677 HD22 ASN 5 HD22 ASN 5 -3.107 -12.130 -16.424 678 H GLU 6 HN GLU 6 -2.443 -9.232 -12.046 679 HA GLU 6 HA GLU 6 -1.767 -7.909 -14.518 680 HB2 GLU 6 HB2 GLU 6 -2.193 -6.419 -11.921 681 HB3 GLU 6 HB1 GLU 6 -2.684 -5.963 -13.548 682 HG2 GLU 6 HG2 GLU 6 -3.897 -8.293 -12.023 683 HG3 GLU 6 HG1 GLU 6 -4.580 -6.678 -12.055 684 H LEU 7 HN LEU 7 -0.291 -7.960 -11.284 685 HA LEU 7 HA LEU 7 1.803 -6.108 -11.843 686 HB2 LEU 7 HB2 LEU 7 1.021 -7.109 -9.579 687 HB3 LEU 7 HB1 LEU 7 2.084 -8.461 -9.966 688 HG LEU 7 HG LEU 7 3.865 -6.544 -10.416 689 HD11 LEU 7 HD11 LEU 7 1.907 -5.214 -8.515 690 HD12 LEU 7 HD12 LEU 7 2.331 -4.650 -10.130 691 HD13 LEU 7 HD13 LEU 7 3.539 -4.639 -8.847 692 HD21 LEU 7 HD21 LEU 7 2.939 -7.518 -7.703 693 HD22 LEU 7 HD22 LEU 7 4.429 -6.603 -7.931 694 HD23 LEU 7 HD23 LEU 7 4.234 -8.176 -8.704 695 H LYS 8 HN LYS 8 1.615 -9.631 -12.199 696 HA LYS 8 HA LYS 8 4.331 -10.078 -12.908 697 HB2 LYS 8 HB2 LYS 8 1.777 -11.532 -13.630 698 HB3 LYS 8 HB1 LYS 8 3.380 -12.146 -14.036 699 HG2 LYS 8 HG2 LYS 8 2.799 -11.339 -11.188 700 HG3 LYS 8 HG1 LYS 8 2.197 -12.887 -11.774 701 HD2 LYS 8 HD2 LYS 8 5.078 -12.225 -12.327 702 HD3 LYS 8 HD1 LYS 8 4.637 -12.655 -10.675 703 HE2 LYS 8 HE2 LYS 8 5.335 -14.550 -12.358 704 HE3 LYS 8 HE1 LYS 8 3.976 -14.819 -11.266 705 HZ1 LYS 8 HZ1 LYS 8 2.966 -15.356 -13.193 706 HZ2 LYS 8 HZ2 LYS 8 3.997 -14.399 -14.147 707 HZ3 LYS 8 HZ3 LYS 8 2.720 -13.681 -13.289 708 H VAL 9 HN VAL 9 1.505 -9.245 -14.898 709 HA VAL 9 HA VAL 9 2.769 -9.522 -17.434 710 HB VAL 9 HB VAL 9 0.545 -7.686 -16.496 711 HG11 VAL 9 HG11 VAL 9 0.017 -7.654 -19.010 712 HG12 VAL 9 HG12 VAL 9 1.669 -8.223 -19.248 713 HG13 VAL 9 HG13 VAL 9 1.377 -6.667 -18.473 714 HG21 VAL 9 HG21 VAL 9 0.304 -10.259 -16.452 715 HG22 VAL 9 HG22 VAL 9 0.345 -10.169 -18.214 716 HG23 VAL 9 HG23 VAL 9 -0.935 -9.351 -17.317 717 H GLU 10 HN GLU 10 2.533 -6.717 -15.230 718 HA GLU 10 HA GLU 10 3.807 -4.795 -16.857 719 HB2 GLU 10 HB2 GLU 10 3.915 -5.198 -13.853 720 HB3 GLU 10 HB1 GLU 10 4.506 -3.756 -14.674 721 HG2 GLU 10 HG2 GLU 10 1.663 -4.783 -14.913 722 HG3 GLU 10 HG1 GLU 10 2.168 -3.529 -13.778 723 H ARG 11 HN ARG 11 5.305 -7.009 -14.473 724 HA ARG 11 HA ARG 11 8.001 -6.201 -14.993 725 HB2 ARG 11 HB2 ARG 11 7.222 -7.453 -12.970 726 HB3 ARG 11 HB1 ARG 11 7.003 -8.881 -13.982 727 HG2 ARG 11 HG2 ARG 11 9.431 -8.727 -14.627 728 HG3 ARG 11 HG1 ARG 11 9.604 -7.407 -13.474 729 HD2 ARG 11 HD2 ARG 11 9.656 -8.837 -11.687 730 HD3 ARG 11 HD1 ARG 11 8.349 -9.837 -12.329 731 HE ARG 11 HE ARG 11 10.754 -10.207 -13.879 732 HH11 ARG 11 HH21 ARG 11 9.204 -10.918 -10.887 733 HH12 ARG 11 HH22 ARG 11 10.042 -12.416 -10.656 734 HH21 ARG 11 HH11 ARG 11 11.852 -12.162 -13.604 735 HH22 ARG 11 HH12 ARG 11 11.544 -13.123 -12.195 736 H ILE 12 HN ILE 12 6.033 -8.879 -16.299 737 HA ILE 12 HA ILE 12 8.105 -10.063 -17.869 738 HB ILE 12 HB ILE 12 5.091 -10.044 -18.222 739 HG12 ILE 12 HG12 ILE 12 6.914 -12.274 -17.283 740 HG13 ILE 12 HG11 ILE 12 6.182 -11.119 -16.167 741 HG21 ILE 12 HG21 ILE 12 5.635 -12.135 -19.638 742 HG22 ILE 12 HG22 ILE 12 7.278 -11.498 -19.726 743 HG23 ILE 12 HG23 ILE 12 5.934 -10.564 -20.382 744 HD11 ILE 12 HD11 ILE 12 4.818 -13.187 -16.397 745 HD12 ILE 12 HD12 ILE 12 4.641 -12.853 -18.120 746 HD13 ILE 12 HD13 ILE 12 3.946 -11.751 -16.932 747 H ARG 13 HN ARG 13 5.692 -7.573 -18.640 748 HA ARG 13 HA ARG 13 6.264 -7.310 -21.390 749 HB2 ARG 13 HB2 ARG 13 4.496 -6.148 -19.752 750 HB3 ARG 13 HB1 ARG 13 5.695 -4.856 -19.742 751 HG2 ARG 13 HG2 ARG 13 5.611 -5.220 -22.390 752 HG3 ARG 13 HG1 ARG 13 4.027 -5.896 -22.020 753 HD2 ARG 13 HD2 ARG 13 3.943 -3.578 -20.539 754 HD3 ARG 13 HD1 ARG 13 4.925 -3.081 -21.921 755 HE ARG 13 HE ARG 13 2.309 -4.461 -22.349 756 HH11 ARG 13 HH21 ARG 13 4.424 -1.742 -22.826 757 HH12 ARG 13 HH22 ARG 13 3.356 -0.970 -23.945 758 HH21 ARG 13 HH11 ARG 13 0.933 -3.434 -23.774 759 HH22 ARG 13 HH12 ARG 13 1.388 -1.918 -24.476 760 H LEU 14 HN LEU 14 7.763 -5.701 -18.578 761 HA LEU 14 HA LEU 14 9.729 -4.351 -20.301 762 HB2 LEU 14 HB2 LEU 14 9.503 -4.526 -17.276 763 HB3 LEU 14 HB1 LEU 14 10.588 -3.455 -18.160 764 HG LEU 14 HG LEU 14 7.557 -3.422 -18.363 765 HD11 LEU 14 HD11 LEU 14 8.168 -2.589 -16.201 766 HD12 LEU 14 HD12 LEU 14 7.870 -1.172 -17.209 767 HD13 LEU 14 HD13 LEU 14 9.525 -1.677 -16.862 768 HD21 LEU 14 HD21 LEU 14 8.275 -2.544 -20.409 769 HD22 LEU 14 HD22 LEU 14 9.764 -1.888 -19.729 770 HD23 LEU 14 HD23 LEU 14 8.224 -1.087 -19.422 771 H SER 15 HN SER 15 9.338 -7.406 -19.031 772 HA SER 15 HA SER 15 10.794 -9.194 -18.601 773 HB2 SER 15 HB2 SER 15 11.241 -9.225 -20.902 774 HB3 SER 15 HB1 SER 15 12.049 -7.661 -20.865 775 HG SER 15 HG SER 15 13.845 -8.596 -20.195 776 H LEU 16 HN LEU 16 11.157 -8.041 -16.419 777 HA LEU 16 HA LEU 16 14.008 -7.114 -16.156 778 HB2 LEU 16 HB2 LEU 16 11.654 -6.698 -14.294 779 HB3 LEU 16 HB1 LEU 16 13.278 -6.054 -14.065 780 HG LEU 16 HG LEU 16 11.484 -5.445 -16.428 781 HD11 LEU 16 HD11 LEU 16 10.809 -4.505 -14.147 782 HD12 LEU 16 HD12 LEU 16 11.066 -3.322 -15.428 783 HD13 LEU 16 HD13 LEU 16 12.307 -3.574 -14.201 784 HD21 LEU 16 HD21 LEU 16 14.299 -4.672 -15.676 785 HD22 LEU 16 HD22 LEU 16 13.309 -3.535 -16.591 786 HD23 LEU 16 HD23 LEU 16 13.653 -5.129 -17.251 787 H THR 17 HN THR 17 15.384 -8.289 -14.926 788 HA THR 17 HA THR 17 14.554 -10.937 -14.059 789 HB THR 17 HB THR 17 16.980 -10.970 -13.186 790 HG1 THR 17 HG1 THR 17 17.178 -8.703 -13.034 791 HG21 THR 17 HG21 THR 17 16.406 -10.341 -16.096 792 HG22 THR 17 HG22 THR 17 16.342 -11.934 -15.343 793 HG23 THR 17 HG23 THR 17 17.885 -11.094 -15.498 794 H ALA 18 HN ALA 18 14.543 -11.730 -11.908 795 HA ALA 18 HA ALA 18 13.521 -9.936 -9.916 796 HB1 ALA 18 HB1 ALA 18 12.837 -12.212 -9.803 797 HB2 ALA 18 HB2 ALA 18 13.893 -11.985 -8.408 798 HB3 ALA 18 HB3 ALA 18 14.498 -12.796 -9.853 799 H LYS 19 HN LYS 19 16.705 -11.415 -10.437 800 HA LYS 19 HA LYS 19 17.898 -10.532 -7.993 801 HB2 LYS 19 HB2 LYS 19 18.849 -12.257 -9.525 802 HB3 LYS 19 HB1 LYS 19 19.243 -10.980 -10.673 803 HG2 LYS 19 HG2 LYS 19 20.653 -9.876 -8.977 804 HG3 LYS 19 HG1 LYS 19 20.270 -11.151 -7.822 805 HD2 LYS 19 HD2 LYS 19 21.498 -11.769 -10.514 806 HD3 LYS 19 HD1 LYS 19 22.495 -11.352 -9.123 807 HE2 LYS 19 HE2 LYS 19 21.313 -13.224 -7.859 808 HE3 LYS 19 HE1 LYS 19 20.618 -13.715 -9.403 809 HZ1 LYS 19 HZ1 LYS 19 23.518 -13.294 -9.191 810 HZ2 LYS 19 HZ2 LYS 19 22.650 -14.309 -10.241 811 HZ3 LYS 19 HZ3 LYS 19 22.845 -14.737 -8.608 812 H SER 20 HN SER 20 17.764 -9.041 -11.229 813 HA SER 20 HA SER 20 19.419 -6.808 -10.670 814 HB2 SER 20 HB2 SER 20 18.230 -5.740 -12.563 815 HB3 SER 20 HB1 SER 20 18.675 -7.405 -12.931 816 HG SER 20 HG SER 20 16.162 -6.312 -12.279 817 H VAL 21 HN VAL 21 15.888 -7.196 -10.298 818 HA VAL 21 HA VAL 21 15.453 -4.529 -9.307 819 HB VAL 21 HB VAL 21 13.847 -7.082 -8.986 820 HG11 VAL 21 HG11 VAL 21 13.253 -4.215 -8.226 821 HG12 VAL 21 HG12 VAL 21 13.155 -5.651 -7.208 822 HG13 VAL 21 HG13 VAL 21 11.977 -5.402 -8.496 823 HG21 VAL 21 HG21 VAL 21 13.303 -4.677 -10.743 824 HG22 VAL 21 HG22 VAL 21 12.547 -6.269 -10.817 825 HG23 VAL 21 HG23 VAL 21 14.229 -6.068 -11.306 826 H ALA 22 HN ALA 22 15.983 -7.661 -7.691 827 HA ALA 22 HA ALA 22 15.620 -6.767 -5.020 828 HB1 ALA 22 HB1 ALA 22 17.334 -8.969 -6.188 829 HB2 ALA 22 HB2 ALA 22 15.724 -9.117 -5.480 830 HB3 ALA 22 HB3 ALA 22 17.107 -8.735 -4.455 831 H GLU 23 HN GLU 23 18.628 -6.965 -6.963 832 HA GLU 23 HA GLU 23 20.305 -5.949 -4.871 833 HB2 GLU 23 HB2 GLU 23 20.642 -5.941 -7.883 834 HB3 GLU 23 HB1 GLU 23 21.910 -5.469 -6.749 835 HG2 GLU 23 HG2 GLU 23 21.637 -7.734 -5.648 836 HG3 GLU 23 HG1 GLU 23 20.574 -8.179 -6.983 837 H GLU 24 HN GLU 24 18.458 -4.377 -7.460 838 HA GLU 24 HA GLU 24 19.513 -1.730 -6.957 839 HB2 GLU 24 HB2 GLU 24 17.042 -2.766 -8.362 840 HB3 GLU 24 HB1 GLU 24 17.385 -1.043 -8.222 841 HG2 GLU 24 HG2 GLU 24 19.566 -1.388 -9.337 842 HG3 GLU 24 HG1 GLU 24 19.211 -3.112 -9.487 843 H MET 25 HN MET 25 16.561 -3.438 -5.951 844 HA MET 25 HA MET 25 15.441 -1.283 -4.442 845 HB2 MET 25 HB2 MET 25 15.095 -4.281 -4.427 846 HB3 MET 25 HB1 MET 25 14.243 -3.266 -3.264 847 HG2 MET 25 HG2 MET 25 14.142 -2.802 -6.253 848 HG3 MET 25 HG1 MET 25 12.947 -3.765 -5.388 849 HE1 MET 25 HE1 MET 25 10.872 -1.473 -3.379 850 HE2 MET 25 HE2 MET 25 12.287 -2.180 -2.607 851 HE3 MET 25 HE3 MET 25 11.392 -3.107 -3.808 852 H GLY 26 HN GLY 26 17.654 -3.930 -3.574 853 HA2 GLY 26 HA2 GLY 26 19.350 -3.653 -1.857 854 HA3 GLY 26 HA1 GLY 26 18.327 -2.450 -1.068 855 H ILE 27 HN ILE 27 16.772 -5.321 -2.240 856 HA ILE 27 HA ILE 27 16.666 -6.422 0.556 857 HB ILE 27 HB ILE 27 14.367 -7.191 0.020 858 HG12 ILE 27 HG12 ILE 27 14.624 -5.401 -2.411 859 HG13 ILE 27 HG11 ILE 27 14.690 -7.160 -2.478 860 HG21 ILE 27 HG21 ILE 27 14.806 -5.059 1.225 861 HG22 ILE 27 HG22 ILE 27 13.305 -5.020 0.298 862 HG23 ILE 27 HG23 ILE 27 14.747 -4.205 -0.317 863 HD11 ILE 27 HD11 ILE 27 12.412 -6.282 -2.959 864 HD12 ILE 27 HD12 ILE 27 12.371 -5.575 -1.343 865 HD13 ILE 27 HD13 ILE 27 12.449 -7.326 -1.539 866 H SER 28 HN SER 28 16.167 -8.760 0.623 867 HA SER 28 HA SER 28 17.883 -10.193 -1.222 868 HB2 SER 28 HB2 SER 28 17.348 -12.134 0.147 869 HB3 SER 28 HB1 SER 28 17.641 -10.754 1.203 870 HG SER 28 HG SER 28 15.288 -10.448 1.095 871 H ARG 29 HN ARG 29 17.094 -12.207 -2.332 872 HA ARG 29 HA ARG 29 14.966 -11.645 -4.157 873 HB2 ARG 29 HB2 ARG 29 16.418 -14.207 -3.439 874 HB3 ARG 29 HB1 ARG 29 15.232 -14.105 -4.741 875 HG2 ARG 29 HG2 ARG 29 16.564 -12.414 -5.885 876 HG3 ARG 29 HG1 ARG 29 17.706 -12.362 -4.543 877 HD2 ARG 29 HD2 ARG 29 18.608 -13.748 -6.354 878 HD3 ARG 29 HD1 ARG 29 18.260 -14.751 -4.946 879 HE ARG 29 HE ARG 29 15.974 -14.728 -6.666 880 HH11 ARG 29 HH21 ARG 29 19.233 -15.854 -6.451 881 HH12 ARG 29 HH22 ARG 29 18.951 -17.252 -7.435 882 HH21 ARG 29 HH11 ARG 29 15.596 -16.549 -7.948 883 HH22 ARG 29 HH12 ARG 29 16.896 -17.644 -8.282 884 H GLN 30 HN GLN 30 15.112 -13.489 -1.133 885 HA GLN 30 HA GLN 30 12.608 -14.802 -1.283 886 HB2 GLN 30 HB2 GLN 30 14.037 -13.624 1.121 887 HB3 GLN 30 HB1 GLN 30 12.684 -14.751 1.213 888 HG2 GLN 30 HG2 GLN 30 15.290 -15.339 -0.223 889 HG3 GLN 30 HG1 GLN 30 14.924 -15.863 1.420 890 HE21 GLN 30 HE21 GLN 30 12.160 -16.547 1.063 891 HE22 GLN 30 HE22 GLN 30 12.074 -17.887 0.026 892 H GLN 31 HN GLN 31 13.408 -11.536 -0.090 893 HA GLN 31 HA GLN 31 10.729 -10.837 0.669 894 HB2 GLN 31 HB2 GLN 31 13.132 -9.175 -0.128 895 HB3 GLN 31 HB1 GLN 31 11.622 -8.472 0.448 896 HG2 GLN 31 HG2 GLN 31 13.177 -10.546 2.009 897 HG3 GLN 31 HG1 GLN 31 13.395 -8.809 2.229 898 HE21 GLN 31 HE21 GLN 31 12.444 -10.321 4.394 899 HE22 GLN 31 HE22 GLN 31 10.813 -9.950 4.671 900 H LEU 32 HN LEU 32 12.618 -10.293 -2.305 901 HA LEU 32 HA LEU 32 10.591 -8.837 -3.691 902 HB2 LEU 32 HB2 LEU 32 13.001 -8.953 -4.367 903 HB3 LEU 32 HB1 LEU 32 12.741 -10.621 -4.872 904 HG LEU 32 HG LEU 32 10.994 -9.847 -6.463 905 HD11 LEU 32 HD11 LEU 32 11.263 -7.222 -6.909 906 HD12 LEU 32 HD12 LEU 32 11.644 -7.207 -5.190 907 HD13 LEU 32 HD13 LEU 32 10.095 -7.839 -5.747 908 HD21 LEU 32 HD21 LEU 32 13.629 -8.384 -6.807 909 HD22 LEU 32 HD22 LEU 32 12.540 -8.909 -8.087 910 HD23 LEU 32 HD23 LEU 32 13.400 -10.104 -7.117 911 H CYS 33 HN CYS 33 11.374 -12.297 -3.577 912 HA CYS 33 HA CYS 33 9.447 -13.151 -5.501 913 HB2 CYS 33 HB2 CYS 33 10.657 -14.577 -3.115 914 HB3 CYS 33 HB1 CYS 33 9.686 -15.373 -4.355 915 HG CYS 33 HG CYS 33 11.561 -14.469 -6.109 916 H ASN 34 HN ASN 34 9.228 -12.543 -2.020 917 HA ASN 34 HA ASN 34 6.631 -13.677 -1.649 918 HB2 ASN 34 HB2 ASN 34 7.901 -11.328 -0.195 919 HB3 ASN 34 HB1 ASN 34 6.548 -12.304 0.383 920 HD21 ASN 34 HD21 ASN 34 9.208 -12.071 1.698 921 HD22 ASN 34 HD22 ASN 34 9.867 -13.635 1.720 922 H ILE 35 HN ILE 35 7.738 -10.468 -2.711 923 HA ILE 35 HA ILE 35 5.136 -9.244 -2.815 924 HB ILE 35 HB ILE 35 7.686 -8.689 -4.374 925 HG12 ILE 35 HG12 ILE 35 6.403 -7.153 -2.094 926 HG13 ILE 35 HG11 ILE 35 7.672 -8.356 -1.861 927 HG21 ILE 35 HG21 ILE 35 5.908 -7.799 -5.700 928 HG22 ILE 35 HG22 ILE 35 6.539 -6.438 -4.774 929 HG23 ILE 35 HG23 ILE 35 5.040 -7.222 -4.279 930 HD11 ILE 35 HD11 ILE 35 7.872 -5.801 -3.481 931 HD12 ILE 35 HD12 ILE 35 9.117 -7.047 -3.444 932 HD13 ILE 35 HD13 ILE 35 8.713 -6.165 -1.973 933 H GLU 36 HN GLU 36 7.090 -11.018 -5.205 934 HA GLU 36 HA GLU 36 5.165 -10.797 -7.343 935 HB2 GLU 36 HB2 GLU 36 7.459 -12.715 -6.839 936 HB3 GLU 36 HB1 GLU 36 6.500 -12.718 -8.321 937 HG2 GLU 36 HG2 GLU 36 7.149 -10.439 -8.822 938 HG3 GLU 36 HG1 GLU 36 7.952 -10.274 -7.260 939 H GLN 37 HN GLN 37 5.240 -12.577 -4.465 940 HA GLN 37 HA GLN 37 3.302 -14.619 -5.495 941 HB2 GLN 37 HB2 GLN 37 5.348 -15.468 -4.346 942 HB3 GLN 37 HB1 GLN 37 4.888 -14.562 -2.908 943 HG2 GLN 37 HG2 GLN 37 2.904 -15.862 -2.610 944 HG3 GLN 37 HG1 GLN 37 3.085 -16.621 -4.191 945 HE21 GLN 37 HE21 GLN 37 2.896 -18.234 -1.873 946 HE22 GLN 37 HE22 GLN 37 4.397 -18.969 -1.581 947 H SER 38 HN SER 38 3.509 -11.689 -3.844 948 HA SER 38 HA SER 38 1.635 -11.970 -1.747 949 HB2 SER 38 HB2 SER 38 2.980 -9.949 -2.015 950 HB3 SER 38 HB1 SER 38 2.177 -9.587 -3.540 951 HG SER 38 HG SER 38 0.184 -9.599 -2.254 952 H GLU 39 HN GLU 39 -0.599 -11.768 -1.652 953 HA GLU 39 HA GLU 39 -2.078 -11.830 -4.269 954 HB2 GLU 39 HB2 GLU 39 -3.079 -13.055 -1.692 955 HB3 GLU 39 HB1 GLU 39 -3.588 -13.395 -3.347 956 HG2 GLU 39 HG2 GLU 39 -1.310 -14.332 -3.801 957 HG3 GLU 39 HG1 GLU 39 -0.922 -14.099 -2.095 958 H THR 40 HN THR 40 -2.176 -10.802 -0.857 959 HA THR 40 HA THR 40 -4.361 -8.865 -1.560 960 HB THR 40 HB THR 40 -3.549 -10.053 1.112 961 HG1 THR 40 HG1 THR 40 -5.275 -11.277 0.853 962 HG21 THR 40 HG21 THR 40 -5.728 -8.847 1.805 963 HG22 THR 40 HG22 THR 40 -5.508 -7.887 0.342 964 HG23 THR 40 HG23 THR 40 -4.281 -7.859 1.610 965 H ALA 41 HN ALA 41 -3.814 -6.764 -1.596 966 HA ALA 41 HA ALA 41 -1.140 -5.959 -0.603 967 HB1 ALA 41 HB1 ALA 41 -3.200 -4.738 -2.435 968 HB2 ALA 41 HB2 ALA 41 -1.518 -5.143 -2.778 969 HB3 ALA 41 HB3 ALA 41 -1.899 -3.747 -1.770 970 HA PRO 42 HA PRO 42 -2.796 -4.008 3.026 971 HB2 PRO 42 HB2 PRO 42 -1.094 -1.832 3.269 972 HB3 PRO 42 HB1 PRO 42 -0.671 -3.489 3.736 973 HG2 PRO 42 HG2 PRO 42 0.036 -1.984 1.259 974 HG3 PRO 42 HG1 PRO 42 1.004 -3.129 2.200 975 HD2 PRO 42 HD2 PRO 42 -0.216 -3.817 -0.143 976 HD3 PRO 42 HD1 PRO 42 0.069 -4.981 1.169 977 H VAL 43 HN VAL 43 -4.075 -2.209 3.741 978 HA VAL 43 HA VAL 43 -5.619 -0.903 1.721 979 HB VAL 43 HB VAL 43 -6.435 -1.375 4.024 980 HG11 VAL 43 HG11 VAL 43 -4.655 0.933 4.822 981 HG12 VAL 43 HG12 VAL 43 -4.293 -0.758 5.157 982 HG13 VAL 43 HG13 VAL 43 -5.712 0.003 5.880 983 HG21 VAL 43 HG21 VAL 43 -6.436 1.579 3.355 984 HG22 VAL 43 HG22 VAL 43 -7.635 0.721 4.321 985 HG23 VAL 43 HG23 VAL 43 -7.488 0.385 2.596 986 H VAL 44 HN VAL 44 -2.768 0.083 3.535 987 HA VAL 44 HA VAL 44 -2.668 2.818 3.330 988 HB VAL 44 HB VAL 44 -0.262 2.653 3.177 989 HG11 VAL 44 HG11 VAL 44 -1.288 0.132 4.523 990 HG12 VAL 44 HG12 VAL 44 -1.360 1.740 5.241 991 HG13 VAL 44 HG13 VAL 44 0.201 0.995 4.901 992 HG21 VAL 44 HG21 VAL 44 0.170 1.312 1.296 993 HG22 VAL 44 HG22 VAL 44 -0.906 0.027 1.842 994 HG23 VAL 44 HG23 VAL 44 0.660 0.256 2.620 995 H VAL 45 HN VAL 45 -2.215 0.529 0.654 996 HA VAL 45 HA VAL 45 -1.474 2.462 -1.326 997 HB VAL 45 HB VAL 45 -2.880 -0.215 -1.574 998 HG11 VAL 45 HG11 VAL 45 -1.961 -0.063 -3.954 999 HG12 VAL 45 HG12 VAL 45 -1.725 1.659 -3.646 1000 HG13 VAL 45 HG13 VAL 45 -3.347 0.966 -3.589 1001 HG21 VAL 45 HG21 VAL 45 0.016 0.651 -1.843 1002 HG22 VAL 45 HG22 VAL 45 -0.586 -0.942 -2.301 1003 HG23 VAL 45 HG23 VAL 45 -0.658 -0.424 -0.618 1004 H LYS 46 HN LYS 46 -4.630 1.096 -0.371 1005 HA LYS 46 HA LYS 46 -6.187 2.539 -2.290 1006 HB2 LYS 46 HB2 LYS 46 -6.921 1.460 0.450 1007 HB3 LYS 46 HB1 LYS 46 -8.086 2.068 -0.727 1008 HG2 LYS 46 HG2 LYS 46 -7.334 0.363 -2.354 1009 HG3 LYS 46 HG1 LYS 46 -6.179 -0.254 -1.170 1010 HD2 LYS 46 HD2 LYS 46 -8.033 -0.775 0.375 1011 HD3 LYS 46 HD1 LYS 46 -9.191 -0.163 -0.807 1012 HE2 LYS 46 HE2 LYS 46 -8.467 -1.869 -2.420 1013 HE3 LYS 46 HE1 LYS 46 -7.287 -2.476 -1.260 1014 HZ1 LYS 46 HZ1 LYS 46 -10.239 -2.534 -1.051 1015 HZ2 LYS 46 HZ2 LYS 46 -9.224 -2.819 0.280 1016 HZ3 LYS 46 HZ3 LYS 46 -9.170 -3.849 -1.070 1017 H TYR 47 HN TYR 47 -5.141 3.311 1.012 1018 HA TYR 47 HA TYR 47 -6.650 5.690 1.372 1019 HB2 TYR 47 HB2 TYR 47 -5.338 4.490 3.143 1020 HB3 TYR 47 HB1 TYR 47 -3.860 5.116 2.414 1021 HD1 TYR 47 HD2 TYR 47 -6.988 6.023 4.165 1022 HD2 TYR 47 HD1 TYR 47 -3.229 7.436 2.641 1023 HE1 TYR 47 HE2 TYR 47 -7.286 8.148 5.403 1024 HE2 TYR 47 HE1 TYR 47 -3.527 9.563 3.881 1025 HH TYR 47 HH TYR 47 -4.726 10.507 5.643 1026 H ILE 48 HN ILE 48 -3.455 5.149 -0.107 1027 HA ILE 48 HA ILE 48 -2.827 7.897 -0.575 1028 HB ILE 48 HB ILE 48 -2.038 5.377 -2.075 1029 HG12 ILE 48 HG12 ILE 48 -0.433 7.105 -0.170 1030 HG13 ILE 48 HG11 ILE 48 -1.334 5.679 0.347 1031 HG21 ILE 48 HG21 ILE 48 -1.187 8.254 -2.413 1032 HG22 ILE 48 HG22 ILE 48 -1.683 7.106 -3.651 1033 HG23 ILE 48 HG23 ILE 48 -0.117 6.926 -2.862 1034 HD11 ILE 48 HD11 ILE 48 -0.054 4.343 -1.362 1035 HD12 ILE 48 HD12 ILE 48 0.951 5.000 -0.069 1036 HD13 ILE 48 HD13 ILE 48 0.939 5.771 -1.655 1037 H ALA 49 HN ALA 49 -4.560 5.474 -2.526 1038 HA ALA 49 HA ALA 49 -4.976 7.073 -4.820 1039 HB1 ALA 49 HB1 ALA 49 -6.913 5.602 -5.262 1040 HB2 ALA 49 HB2 ALA 49 -6.801 4.975 -3.618 1041 HB3 ALA 49 HB3 ALA 49 -5.495 4.677 -4.764 1042 H PHE 50 HN PHE 50 -6.649 6.999 -1.706 1043 HA PHE 50 HA PHE 50 -8.939 8.529 -2.451 1044 HB2 PHE 50 HB2 PHE 50 -8.485 7.277 -0.257 1045 HB3 PHE 50 HB1 PHE 50 -7.536 8.684 0.227 1046 HD1 PHE 50 HD1 PHE 50 -10.870 7.869 -1.279 1047 HD2 PHE 50 HD2 PHE 50 -8.648 10.388 1.392 1048 HE1 PHE 50 HE1 PHE 50 -12.965 9.021 -0.625 1049 HE2 PHE 50 HE2 PHE 50 -10.739 11.542 2.040 1050 HZ PHE 50 HZ PHE 50 -12.900 10.861 1.036 1051 H LEU 51 HN LEU 51 -5.822 9.579 -1.009 1052 HA LEU 51 HA LEU 51 -6.394 12.399 -1.319 1053 HB2 LEU 51 HB2 LEU 51 -3.997 10.750 -0.617 1054 HB3 LEU 51 HB1 LEU 51 -3.676 12.370 -1.228 1055 HG LEU 51 HG LEU 51 -5.175 13.312 0.508 1056 HD11 LEU 51 HD11 LEU 51 -5.450 10.407 1.266 1057 HD12 LEU 51 HD12 LEU 51 -6.725 11.588 0.966 1058 HD13 LEU 51 HD13 LEU 51 -5.740 11.706 2.429 1059 HD21 LEU 51 HD21 LEU 51 -3.721 12.688 2.481 1060 HD22 LEU 51 HD22 LEU 51 -2.834 13.204 1.045 1061 HD23 LEU 51 HD23 LEU 51 -2.950 11.490 1.443 1062 H ARG 52 HN ARG 52 -4.766 9.977 -3.310 1063 HA ARG 52 HA ARG 52 -3.701 11.710 -5.287 1064 HB2 ARG 52 HB2 ARG 52 -3.477 9.105 -4.914 1065 HB3 ARG 52 HB1 ARG 52 -4.856 9.019 -6.010 1066 HG2 ARG 52 HG2 ARG 52 -3.558 10.422 -7.644 1067 HG3 ARG 52 HG1 ARG 52 -2.159 10.277 -6.575 1068 HD2 ARG 52 HD2 ARG 52 -2.438 7.763 -6.714 1069 HD3 ARG 52 HD1 ARG 52 -3.632 8.047 -7.984 1070 HE ARG 52 HE ARG 52 -0.966 9.278 -8.358 1071 HH11 ARG 52 HH21 ARG 52 -3.239 6.774 -9.110 1072 HH12 ARG 52 HH22 ARG 52 -2.422 6.304 -10.561 1073 HH21 ARG 52 HH11 ARG 52 0.101 8.657 -10.229 1074 HH22 ARG 52 HH12 ARG 52 -0.529 7.358 -11.186 1075 H SER 53 HN SER 53 -6.927 10.307 -4.891 1076 HA SER 53 HA SER 53 -8.046 10.944 -7.391 1077 HB2 SER 53 HB2 SER 53 -9.075 9.694 -5.361 1078 HB3 SER 53 HB1 SER 53 -9.573 11.288 -4.805 1079 HG SER 53 HG SER 53 -11.051 10.023 -6.233 1080 H LYS 54 HN LYS 54 -7.481 13.003 -4.568 1081 HA LYS 54 HA LYS 54 -8.838 15.283 -5.828 1082 HB2 LYS 54 HB2 LYS 54 -7.255 14.962 -3.268 1083 HB3 LYS 54 HB1 LYS 54 -7.961 16.495 -3.784 1084 HG2 LYS 54 HG2 LYS 54 -10.195 15.422 -3.861 1085 HG3 LYS 54 HG1 LYS 54 -9.475 13.911 -3.305 1086 HD2 LYS 54 HD2 LYS 54 -8.746 15.003 -1.228 1087 HD3 LYS 54 HD1 LYS 54 -9.430 16.532 -1.782 1088 HE2 LYS 54 HE2 LYS 54 -11.670 15.488 -1.880 1089 HE3 LYS 54 HE1 LYS 54 -10.982 13.972 -1.297 1090 HZ1 LYS 54 HZ1 LYS 54 -11.463 14.783 0.710 1091 HZ2 LYS 54 HZ2 LYS 54 -11.623 16.379 0.149 1092 HZ3 LYS 54 HZ3 LYS 54 -10.086 15.753 0.510 1093 H GLY 55 HN GLY 55 -6.162 13.820 -6.711 1094 HA2 GLY 55 HA2 GLY 55 -4.334 14.532 -7.998 1095 HA3 GLY 55 HA1 GLY 55 -5.009 16.160 -7.938 1096 H VAL 56 HN VAL 56 -4.270 14.364 -4.992 1097 HA VAL 56 HA VAL 56 -2.637 16.539 -4.040 1098 HB VAL 56 HB VAL 56 -2.949 13.706 -3.005 1099 HG11 VAL 56 HG11 VAL 56 -0.935 14.512 -2.040 1100 HG12 VAL 56 HG12 VAL 56 -2.170 14.877 -0.836 1101 HG13 VAL 56 HG13 VAL 56 -1.565 16.152 -1.893 1102 HG21 VAL 56 HG21 VAL 56 -4.607 14.611 -1.550 1103 HG22 VAL 56 HG22 VAL 56 -4.972 15.281 -3.138 1104 HG23 VAL 56 HG23 VAL 56 -4.145 16.269 -1.936 1105 H ASP 57 HN ASP 57 -0.461 16.840 -4.226 1106 HA ASP 57 HA ASP 57 1.040 15.074 -6.000 1107 HB2 ASP 57 HB2 ASP 57 2.252 17.299 -4.355 1108 HB3 ASP 57 HB1 ASP 57 2.670 16.767 -5.988 1109 H LEU 58 HN LEU 58 0.702 13.192 -4.461 1110 HA LEU 58 HA LEU 58 2.369 13.217 -2.027 1111 HB2 LEU 58 HB2 LEU 58 0.036 12.019 -2.461 1112 HB3 LEU 58 HB1 LEU 58 1.043 10.745 -3.146 1113 HG LEU 58 HG LEU 58 2.394 10.889 -0.944 1114 HD11 LEU 58 HD11 LEU 58 0.723 13.060 -0.447 1115 HD12 LEU 58 HD12 LEU 58 1.707 12.223 0.743 1116 HD13 LEU 58 HD13 LEU 58 0.016 11.783 0.542 1117 HD21 LEU 58 HD21 LEU 58 0.934 8.999 -1.485 1118 HD22 LEU 58 HD22 LEU 58 -0.478 9.910 -0.950 1119 HD23 LEU 58 HD23 LEU 58 0.743 9.416 0.219 1120 H ASN 59 HN ASN 59 2.784 12.677 -5.308 1121 HA ASN 59 HA ASN 59 4.601 10.466 -5.335 1122 HB2 ASN 59 HB2 ASN 59 4.757 12.843 -7.208 1123 HB3 ASN 59 HB1 ASN 59 5.112 11.149 -7.548 1124 HD21 ASN 59 HD21 ASN 59 3.505 10.527 -9.041 1125 HD22 ASN 59 HD22 ASN 59 1.843 10.780 -8.811 1126 H ALA 60 HN ALA 60 5.085 13.978 -5.015 1127 HA ALA 60 HA ALA 60 7.948 13.911 -4.952 1128 HB1 ALA 60 HB1 ALA 60 6.630 15.967 -5.371 1129 HB2 ALA 60 HB2 ALA 60 7.761 16.186 -4.035 1130 HB3 ALA 60 HB3 ALA 60 6.047 15.925 -3.708 1131 H LEU 61 HN LEU 61 5.486 13.745 -2.395 1132 HA LEU 61 HA LEU 61 7.287 13.885 -0.188 1133 HB2 LEU 61 HB2 LEU 61 4.579 12.578 -0.525 1134 HB3 LEU 61 HB1 LEU 61 5.417 12.649 1.025 1135 HG LEU 61 HG LEU 61 4.752 15.081 -0.668 1136 HD11 LEU 61 HD11 LEU 61 3.273 13.733 1.593 1137 HD12 LEU 61 HD12 LEU 61 2.657 14.254 0.027 1138 HD13 LEU 61 HD13 LEU 61 3.061 15.451 1.252 1139 HD21 LEU 61 HD21 LEU 61 5.077 16.076 1.802 1140 HD22 LEU 61 HD22 LEU 61 6.449 15.835 0.729 1141 HD23 LEU 61 HD23 LEU 61 6.102 14.650 1.986 1142 H PHE 62 HN PHE 62 6.058 11.120 -2.057 1143 HA PHE 62 HA PHE 62 7.398 9.124 -0.488 1144 HB2 PHE 62 HB2 PHE 62 5.967 9.288 -3.086 1145 HB3 PHE 62 HB1 PHE 62 7.164 7.995 -3.008 1146 HD1 PHE 62 HD1 PHE 62 4.086 9.365 -1.454 1147 HD2 PHE 62 HD2 PHE 62 6.859 6.095 -1.584 1148 HE1 PHE 62 HE1 PHE 62 2.530 7.986 -0.102 1149 HE2 PHE 62 HE2 PHE 62 5.306 4.725 -0.230 1150 HZ PHE 62 HZ PHE 62 3.136 5.667 0.508 1151 H ASP 63 HN ASP 63 8.384 10.997 -3.351 1152 HA ASP 63 HA ASP 63 10.809 9.607 -3.867 1153 HB2 ASP 63 HB2 ASP 63 9.717 11.429 -5.284 1154 HB3 ASP 63 HB1 ASP 63 10.427 12.596 -4.168 1155 H ARG 64 HN ARG 64 9.989 12.098 -1.498 1156 HA ARG 64 HA ARG 64 12.649 12.718 -0.647 1157 HB2 ARG 64 HB2 ARG 64 10.558 13.972 0.014 1158 HB3 ARG 64 HB1 ARG 64 10.139 12.619 1.066 1159 HG2 ARG 64 HG2 ARG 64 12.311 12.926 2.265 1160 HG3 ARG 64 HG1 ARG 64 12.632 14.342 1.263 1161 HD2 ARG 64 HD2 ARG 64 10.401 15.271 2.080 1162 HD3 ARG 64 HD1 ARG 64 10.392 13.966 3.265 1163 HE ARG 64 HE ARG 64 12.189 16.304 3.267 1164 HH11 ARG 64 HH21 ARG 64 11.415 13.163 4.495 1165 HH12 ARG 64 HH22 ARG 64 12.356 13.362 5.934 1166 HH21 ARG 64 HH11 ARG 64 13.411 16.564 5.129 1167 HH22 ARG 64 HH12 ARG 64 13.485 15.283 6.293 1168 H ILE 65 HN ILE 65 10.303 10.253 0.339 1169 HA ILE 65 HA ILE 65 11.877 9.085 2.429 1170 HB ILE 65 HB ILE 65 9.828 7.713 0.664 1171 HG12 ILE 65 HG12 ILE 65 8.829 9.757 1.490 1172 HG13 ILE 65 HG11 ILE 65 8.196 8.418 2.440 1173 HG21 ILE 65 HG21 ILE 65 9.437 6.340 2.670 1174 HG22 ILE 65 HG22 ILE 65 10.688 7.235 3.535 1175 HG23 ILE 65 HG23 ILE 65 11.118 6.228 2.152 1176 HD11 ILE 65 HD11 ILE 65 8.728 10.005 4.076 1177 HD12 ILE 65 HD12 ILE 65 10.191 10.521 3.239 1178 HD13 ILE 65 HD13 ILE 65 10.157 8.971 4.077 1179 H ILE 66 HN ILE 66 11.524 8.288 -1.046 1180 HA ILE 66 HA ILE 66 13.244 5.996 -0.959 1181 HB ILE 66 HB ILE 66 12.552 7.854 -3.257 1182 HG12 ILE 66 HG12 ILE 66 11.459 5.115 -2.559 1183 HG13 ILE 66 HG11 ILE 66 10.678 6.619 -2.069 1184 HG21 ILE 66 HG21 ILE 66 14.525 6.653 -3.891 1185 HG22 ILE 66 HG22 ILE 66 13.174 5.783 -4.618 1186 HG23 ILE 66 HG23 ILE 66 13.935 5.164 -3.153 1187 HD11 ILE 66 HD11 ILE 66 9.670 5.803 -4.145 1188 HD12 ILE 66 HD12 ILE 66 11.255 5.753 -4.918 1189 HD13 ILE 66 HD13 ILE 66 10.546 7.301 -4.457 1190 H VAL 67 HN VAL 67 15.104 6.667 0.276 1191 HA VAL 67 HA VAL 67 16.846 8.743 -0.979 1192 HB VAL 67 HB VAL 67 18.149 8.495 1.180 1193 HG11 VAL 67 HG11 VAL 67 16.384 10.247 0.734 1194 HG12 VAL 67 HG12 VAL 67 16.571 9.838 2.439 1195 HG13 VAL 67 HG13 VAL 67 15.215 9.186 1.519 1196 HG21 VAL 67 HG21 VAL 67 15.688 6.941 2.032 1197 HG22 VAL 67 HG22 VAL 67 17.101 7.315 3.019 1198 HG23 VAL 67 HG23 VAL 67 17.241 6.190 1.668 1199 H ASN 68 HN ASN 68 18.896 8.276 -1.693 1200 HA ASN 68 HA ASN 68 19.523 5.933 -2.973 1201 HB2 ASN 68 HB2 ASN 68 20.851 7.996 -3.137 1202 HB3 ASN 68 HB1 ASN 68 21.477 7.730 -1.509 1203 HD21 ASN 68 HD21 ASN 68 21.737 6.720 -4.866 1204 HD22 ASN 68 HD22 ASN 68 23.057 5.675 -4.644 1205 H LYS 69 HN LYS 69 20.341 3.932 -2.460 1206 HA LYS 69 HA LYS 69 20.036 2.893 0.171 1207 HB2 LYS 69 HB2 LYS 69 19.981 1.531 -1.915 1208 HB3 LYS 69 HB1 LYS 69 21.722 1.767 -2.085 1209 HG2 LYS 69 HG2 LYS 69 22.092 0.677 0.094 1210 HG3 LYS 69 HG1 LYS 69 20.352 0.459 0.285 1211 HD2 LYS 69 HD2 LYS 69 20.302 -0.927 -1.758 1212 HD3 LYS 69 HD1 LYS 69 22.046 -0.722 -1.937 1213 HE2 LYS 69 HE2 LYS 69 22.393 -1.786 0.266 1214 HE3 LYS 69 HE1 LYS 69 20.651 -2.008 0.430 1215 HZ1 LYS 69 HZ1 LYS 69 21.213 -3.051 -2.016 1216 HZ2 LYS 69 HZ2 LYS 69 20.976 -3.940 -0.587 1217 HZ3 LYS 69 HZ3 LYS 69 22.548 -3.529 -1.082 1218 H LEU 70 HN LEU 70 21.460 2.615 1.838 1219 HA LEU 70 HA LEU 70 23.815 4.262 1.962 1220 HB2 LEU 70 HB2 LEU 70 22.986 1.983 3.777 1221 HB3 LEU 70 HB1 LEU 70 24.123 3.273 4.172 1222 HG LEU 70 HG LEU 70 21.188 3.646 3.504 1223 HD11 LEU 70 HD11 LEU 70 22.738 3.720 6.103 1224 HD12 LEU 70 HD12 LEU 70 21.386 2.669 5.683 1225 HD13 LEU 70 HD13 LEU 70 21.117 4.393 5.929 1226 HD21 LEU 70 HD21 LEU 70 23.457 5.564 4.042 1227 HD22 LEU 70 HD22 LEU 70 21.812 6.005 4.502 1228 HD23 LEU 70 HD23 LEU 70 22.190 5.656 2.818 1229 H GLU 71 HN GLU 71 25.972 3.318 2.641 1230 HA GLU 71 HA GLU 71 27.027 1.701 0.563 1231 HB2 GLU 71 HB2 GLU 71 28.157 3.322 2.320 1232 HB3 GLU 71 HB1 GLU 71 28.362 1.848 3.262 1233 HG2 GLU 71 HG2 GLU 71 30.356 2.039 1.975 1234 HG3 GLU 71 HG1 GLU 71 29.391 0.830 1.126 1235 H HIS 72 HN HIS 72 28.650 0.000 2.525 1236 HA HIS 72 HA HIS 72 26.816 -2.310 2.451 1237 HB2 HIS 72 HB2 HIS 72 29.759 -1.874 2.672 1238 HB3 HIS 72 HB1 HIS 72 29.147 -3.284 3.531 1239 HD2 HIS 72 HD2 HIS 72 29.032 -1.915 -0.214 1240 HE1 HIS 72 HE1 HIS 72 28.498 -6.105 -0.242 1241 HE2 HIS 72 HE2 HIS 72 28.747 -4.042 -1.697 1242 H HIS 73 HN HIS 73 25.458 -2.480 4.113 1243 HA HIS 73 HA HIS 73 26.400 -2.915 6.775 1244 HB2 HIS 73 HB2 HIS 73 26.500 -0.308 6.467 1245 HB3 HIS 73 HB1 HIS 73 24.745 -0.389 6.587 1246 HD2 HIS 73 HD2 HIS 73 23.872 -1.718 9.124 1247 HE1 HIS 73 HE1 HIS 73 27.450 -0.683 11.115 1248 HE2 HIS 73 HE2 HIS 73 25.082 -1.537 11.429 1249 H HIS 74 HN HIS 74 24.888 -4.536 5.311 1250 HA HIS 74 HA HIS 74 22.185 -4.284 6.549 1251 HB2 HIS 74 HB2 HIS 74 22.582 -3.826 3.854 1252 HB3 HIS 74 HB1 HIS 74 22.248 -5.553 3.841 1253 HD2 HIS 74 HD2 HIS 74 19.746 -4.302 2.546 1254 HE1 HIS 74 HE1 HIS 74 18.016 -3.685 6.350 1255 HE2 HIS 74 HE2 HIS 74 17.555 -3.764 3.858 1256 H HIS 75 HN HIS 75 24.368 -5.771 7.520 1257 HA HIS 75 HA HIS 75 23.422 -8.583 7.036 1258 HB2 HIS 75 HB2 HIS 75 25.747 -9.276 7.601 1259 HB3 HIS 75 HB1 HIS 75 25.669 -8.298 6.137 1260 HD2 HIS 75 HD2 HIS 75 27.630 -8.322 9.372 1261 HE1 HIS 75 HE1 HIS 75 27.793 -4.331 8.003 1262 HE2 HIS 75 HE2 HIS 75 28.780 -5.998 9.639 1263 H HIS 76 HN HIS 76 22.200 -9.056 8.800 1264 HA HIS 76 HA HIS 76 23.402 -9.234 11.397 1265 HB2 HIS 76 HB2 HIS 76 23.015 -6.751 11.309 1266 HB3 HIS 76 HB1 HIS 76 21.292 -7.066 11.131 1267 HD2 HIS 76 HD2 HIS 76 19.970 -7.632 13.536 1268 HE1 HIS 76 HE1 HIS 76 23.409 -7.961 15.969 1269 HE2 HIS 76 HE2 HIS 76 20.873 -7.923 15.968 1270 H HIS 77 HN HIS 77 20.039 -8.259 10.836 1271 HA HIS 77 HA HIS 77 18.078 -9.413 11.446 1272 HB2 HIS 77 HB2 HIS 77 19.520 -11.187 9.472 1273 HB3 HIS 77 HB1 HIS 77 17.924 -11.614 10.089 1274 HD2 HIS 77 HD2 HIS 77 15.797 -10.062 9.072 1275 HE1 HIS 77 HE1 HIS 77 18.144 -7.567 6.601 1276 HE2 HIS 77 HE2 HIS 77 15.774 -8.226 7.219 Start of MODEL 3 1 H1 MET 1 HT1 MET 1 8.555 14.792 7.711 2 H2 MET 1 HT2 MET 1 8.125 13.467 8.683 3 H3 MET 1 HT3 MET 1 7.707 13.487 7.037 4 HA MET 1 HA MET 1 10.278 13.722 6.712 5 HB2 MET 1 HB2 MET 1 10.266 11.938 9.136 6 HB3 MET 1 HB1 MET 1 11.592 12.871 8.439 7 HG2 MET 1 HG2 MET 1 9.262 13.896 10.067 8 HG3 MET 1 HG1 MET 1 10.977 13.979 10.467 9 HE1 MET 1 HE1 MET 1 9.020 17.475 9.428 10 HE2 MET 1 HE2 MET 1 8.921 16.177 10.614 11 HE3 MET 1 HE3 MET 1 8.044 16.038 9.092 12 H GLU 2 HN GLU 2 8.726 10.994 8.419 13 HA GLU 2 HA GLU 2 9.410 9.161 6.254 14 HB2 GLU 2 HB2 GLU 2 7.758 8.852 8.772 15 HB3 GLU 2 HB1 GLU 2 8.068 7.531 7.644 16 HG2 GLU 2 HG2 GLU 2 10.480 7.775 7.974 17 HG3 GLU 2 HG1 GLU 2 10.214 9.158 9.037 18 H LEU 3 HN LEU 3 7.653 7.779 5.259 19 HA LEU 3 HA LEU 3 5.772 9.415 3.872 20 HB2 LEU 3 HB2 LEU 3 6.563 7.295 2.940 21 HB3 LEU 3 HB1 LEU 3 5.837 6.405 4.275 22 HG LEU 3 HG LEU 3 3.598 7.085 3.562 23 HD11 LEU 3 HD11 LEU 3 5.161 8.783 1.622 24 HD12 LEU 3 HD12 LEU 3 3.797 9.235 2.646 25 HD13 LEU 3 HD13 LEU 3 3.530 8.249 1.211 26 HD21 LEU 3 HD21 LEU 3 4.341 5.067 2.538 27 HD22 LEU 3 HD22 LEU 3 5.408 5.930 1.430 28 HD23 LEU 3 HD23 LEU 3 3.660 6.027 1.225 29 H SER 4 HN SER 4 5.364 7.188 6.624 30 HA SER 4 HA SER 4 2.540 7.493 6.879 31 HB2 SER 4 HB2 SER 4 4.591 6.943 9.045 32 HB3 SER 4 HB1 SER 4 2.855 6.683 9.190 33 HG SER 4 HG SER 4 3.353 5.440 7.067 34 H ASN 5 HN ASN 5 5.219 9.317 8.367 35 HA ASN 5 HA ASN 5 3.592 11.009 9.994 36 HB2 ASN 5 HB2 ASN 5 5.977 10.890 10.374 37 HB3 ASN 5 HB1 ASN 5 6.315 11.448 8.737 38 HD21 ASN 5 HD21 ASN 5 5.891 13.730 8.241 39 HD22 ASN 5 HD22 ASN 5 5.722 14.874 9.484 40 H GLU 6 HN GLU 6 4.933 11.549 6.728 41 HA GLU 6 HA GLU 6 3.626 14.103 6.434 42 HB2 GLU 6 HB2 GLU 6 5.671 12.985 5.126 43 HB3 GLU 6 HB1 GLU 6 4.390 12.475 4.027 44 HG2 GLU 6 HG2 GLU 6 3.681 15.081 4.316 45 HG3 GLU 6 HG1 GLU 6 5.412 15.233 4.613 46 H LEU 7 HN LEU 7 2.779 10.794 5.481 47 HA LEU 7 HA LEU 7 0.543 11.415 3.843 48 HB2 LEU 7 HB2 LEU 7 1.486 9.134 4.032 49 HB3 LEU 7 HB1 LEU 7 0.940 9.044 5.704 50 HG LEU 7 HG LEU 7 -1.405 9.263 4.954 51 HD11 LEU 7 HD11 LEU 7 -0.058 9.586 2.278 52 HD12 LEU 7 HD12 LEU 7 -1.398 10.503 2.967 53 HD13 LEU 7 HD13 LEU 7 -1.669 8.873 2.358 54 HD21 LEU 7 HD21 LEU 7 -1.612 7.042 4.083 55 HD22 LEU 7 HD22 LEU 7 -0.173 7.035 5.103 56 HD23 LEU 7 HD23 LEU 7 -0.011 7.111 3.348 57 H LYS 8 HN LYS 8 0.796 10.917 7.351 58 HA LYS 8 HA LYS 8 -1.979 11.221 7.949 59 HB2 LYS 8 HB2 LYS 8 -0.238 10.374 9.543 60 HB3 LYS 8 HB1 LYS 8 0.384 12.019 9.669 61 HG2 LYS 8 HG2 LYS 8 -1.742 12.805 10.556 62 HG3 LYS 8 HG1 LYS 8 -2.466 11.217 10.311 63 HD2 LYS 8 HD2 LYS 8 -1.868 11.326 12.630 64 HD3 LYS 8 HD1 LYS 8 -0.682 10.279 11.855 65 HE2 LYS 8 HE2 LYS 8 0.993 11.956 11.893 66 HE3 LYS 8 HE1 LYS 8 -0.177 13.239 12.203 67 HZ1 LYS 8 HZ1 LYS 8 -0.381 12.652 14.384 68 HZ2 LYS 8 HZ2 LYS 8 1.251 12.259 14.120 69 HZ3 LYS 8 HZ3 LYS 8 0.069 11.038 14.122 70 H VAL 9 HN VAL 9 0.666 13.579 7.650 71 HA VAL 9 HA VAL 9 -0.789 15.877 8.492 72 HB VAL 9 HB VAL 9 1.497 15.600 6.517 73 HG11 VAL 9 HG11 VAL 9 0.145 18.046 7.688 74 HG12 VAL 9 HG12 VAL 9 0.460 17.695 5.988 75 HG13 VAL 9 HG13 VAL 9 1.796 18.092 7.069 76 HG21 VAL 9 HG21 VAL 9 2.896 16.175 8.370 77 HG22 VAL 9 HG22 VAL 9 1.778 14.957 8.985 78 HG23 VAL 9 HG23 VAL 9 1.514 16.662 9.352 79 H GLU 10 HN GLU 10 -0.357 14.507 5.194 80 HA GLU 10 HA GLU 10 -1.794 16.493 3.809 81 HB2 GLU 10 HB2 GLU 10 -1.394 13.546 3.296 82 HB3 GLU 10 HB1 GLU 10 -2.411 14.504 2.224 83 HG2 GLU 10 HG2 GLU 10 -0.296 14.617 1.208 84 HG3 GLU 10 HG1 GLU 10 -0.392 16.134 2.091 85 H ARG 11 HN ARG 11 -3.034 13.594 5.440 86 HA ARG 11 HA ARG 11 -5.741 13.883 4.624 87 HB2 ARG 11 HB2 ARG 11 -4.657 11.920 5.852 88 HB3 ARG 11 HB1 ARG 11 -4.859 12.851 7.333 89 HG2 ARG 11 HG2 ARG 11 -7.235 12.841 7.151 90 HG3 ARG 11 HG1 ARG 11 -7.187 12.294 5.477 91 HD2 ARG 11 HD2 ARG 11 -7.724 10.332 6.654 92 HD3 ARG 11 HD1 ARG 11 -5.990 10.190 6.427 93 HE ARG 11 HE ARG 11 -5.654 10.638 8.758 94 HH11 ARG 11 HH21 ARG 11 -8.968 10.810 7.764 95 HH12 ARG 11 HH22 ARG 11 -9.586 10.712 9.376 96 HH21 ARG 11 HH11 ARG 11 -6.467 10.501 10.859 97 HH22 ARG 11 HH12 ARG 11 -8.179 10.541 11.120 98 H ILE 12 HN ILE 12 -4.057 15.173 7.476 99 HA ILE 12 HA ILE 12 -6.384 16.655 8.411 100 HB ILE 12 HB ILE 12 -3.452 16.984 9.119 101 HG12 ILE 12 HG12 ILE 12 -5.574 15.460 10.649 102 HG13 ILE 12 HG11 ILE 12 -4.522 14.675 9.472 103 HG21 ILE 12 HG21 ILE 12 -6.026 17.885 10.444 104 HG22 ILE 12 HG22 ILE 12 -4.744 18.914 9.806 105 HG23 ILE 12 HG23 ILE 12 -4.450 17.926 11.237 106 HD11 ILE 12 HD11 ILE 12 -2.565 15.177 10.717 107 HD12 ILE 12 HD12 ILE 12 -3.739 14.631 11.916 108 HD13 ILE 12 HD13 ILE 12 -3.411 16.354 11.723 109 H ARG 13 HN ARG 13 -3.722 17.250 6.252 110 HA ARG 13 HA ARG 13 -3.733 20.102 6.230 111 HB2 ARG 13 HB2 ARG 13 -2.035 18.466 5.198 112 HB3 ARG 13 HB1 ARG 13 -3.148 18.344 3.840 113 HG2 ARG 13 HG2 ARG 13 -2.751 20.523 3.132 114 HG3 ARG 13 HG1 ARG 13 -2.320 21.088 4.743 115 HD2 ARG 13 HD2 ARG 13 -0.161 20.135 4.639 116 HD3 ARG 13 HD1 ARG 13 -0.586 19.094 3.280 117 HE ARG 13 HE ARG 13 -0.920 21.718 2.375 118 HH11 ARG 13 HH21 ARG 13 1.580 19.756 3.713 119 HH12 ARG 13 HH22 ARG 13 2.846 20.532 2.820 120 HH21 ARG 13 HH11 ARG 13 0.717 22.734 1.196 121 HH22 ARG 13 HH12 ARG 13 2.358 22.216 1.396 122 H LEU 14 HN LEU 14 -5.547 17.724 4.313 123 HA LEU 14 HA LEU 14 -7.023 19.861 2.907 124 HB2 LEU 14 HB2 LEU 14 -7.395 16.849 2.862 125 HB3 LEU 14 HB1 LEU 14 -8.143 18.000 1.757 126 HG LEU 14 HG LEU 14 -5.155 17.595 2.080 127 HD11 LEU 14 HD11 LEU 14 -5.199 16.367 0.052 128 HD12 LEU 14 HD12 LEU 14 -6.862 16.840 -0.296 129 HD13 LEU 14 HD13 LEU 14 -6.521 15.703 1.010 130 HD21 LEU 14 HD21 LEU 14 -5.326 18.891 -0.225 131 HD22 LEU 14 HD22 LEU 14 -5.369 19.788 1.289 132 HD23 LEU 14 HD23 LEU 14 -6.869 19.445 0.428 133 H SER 15 HN SER 15 -7.188 18.500 5.918 134 HA SER 15 HA SER 15 -8.825 18.550 7.587 135 HB2 SER 15 HB2 SER 15 -10.439 20.229 7.469 136 HB3 SER 15 HB1 SER 15 -9.253 20.811 6.305 137 HG SER 15 HG SER 15 -10.803 19.192 4.978 138 H LEU 16 HN LEU 16 -8.831 16.178 6.811 139 HA LEU 16 HA LEU 16 -11.570 15.430 5.826 140 HB2 LEU 16 HB2 LEU 16 -8.992 13.847 5.634 141 HB3 LEU 16 HB1 LEU 16 -10.563 13.360 4.996 142 HG LEU 16 HG LEU 16 -9.047 15.848 4.165 143 HD11 LEU 16 HD11 LEU 16 -9.341 13.111 2.914 144 HD12 LEU 16 HD12 LEU 16 -7.853 13.985 3.281 145 HD13 LEU 16 HD13 LEU 16 -8.895 14.530 1.966 146 HD21 LEU 16 HD21 LEU 16 -11.288 16.361 3.733 147 HD22 LEU 16 HD22 LEU 16 -11.727 14.678 3.441 148 HD23 LEU 16 HD23 LEU 16 -10.828 15.581 2.223 149 H THR 17 HN THR 17 -12.794 14.192 7.146 150 HA THR 17 HA THR 17 -11.794 13.646 9.854 151 HB THR 17 HB THR 17 -14.177 12.783 10.158 152 HG1 THR 17 HG1 THR 17 -14.547 12.345 7.953 153 HG21 THR 17 HG21 THR 17 -13.624 15.598 9.195 154 HG22 THR 17 HG22 THR 17 -13.629 15.016 10.861 155 HG23 THR 17 HG23 THR 17 -15.140 15.116 9.957 156 H ALA 18 HN ALA 18 -11.908 11.552 10.846 157 HA ALA 18 HA ALA 18 -10.905 9.429 9.148 158 HB1 ALA 18 HB1 ALA 18 -11.649 9.602 12.072 159 HB2 ALA 18 HB2 ALA 18 -10.041 9.465 11.363 160 HB3 ALA 18 HB3 ALA 18 -11.137 8.084 11.337 161 H LYS 19 HN LYS 19 -13.979 10.072 10.791 162 HA LYS 19 HA LYS 19 -15.209 7.563 10.217 163 HB2 LYS 19 HB2 LYS 19 -17.249 8.618 10.872 164 HB3 LYS 19 HB1 LYS 19 -15.990 9.353 11.856 165 HG2 LYS 19 HG2 LYS 19 -15.861 11.172 10.051 166 HG3 LYS 19 HG1 LYS 19 -17.364 10.506 9.423 167 HD2 LYS 19 HD2 LYS 19 -18.304 12.037 10.869 168 HD3 LYS 19 HD1 LYS 19 -18.065 10.743 12.040 169 HE2 LYS 19 HE2 LYS 19 -16.339 13.180 11.567 170 HE3 LYS 19 HE1 LYS 19 -17.136 12.682 13.059 171 HZ1 LYS 19 HZ1 LYS 19 -15.669 10.817 13.234 172 HZ2 LYS 19 HZ2 LYS 19 -14.726 12.214 13.018 173 HZ3 LYS 19 HZ3 LYS 19 -14.976 11.145 11.721 174 H SER 20 HN SER 20 -15.222 10.650 8.441 175 HA SER 20 HA SER 20 -16.991 9.833 6.364 176 HB2 SER 20 HB2 SER 20 -15.972 11.690 5.071 177 HB3 SER 20 HB1 SER 20 -16.348 12.184 6.720 178 HG SER 20 HG SER 20 -13.826 11.367 5.685 179 H VAL 21 HN VAL 21 -13.435 9.734 6.569 180 HA VAL 21 HA VAL 21 -13.076 8.526 3.981 181 HB VAL 21 HB VAL 21 -11.276 8.528 6.423 182 HG11 VAL 21 HG11 VAL 21 -10.571 6.751 4.968 183 HG12 VAL 21 HG12 VAL 21 -9.494 8.114 4.655 184 HG13 VAL 21 HG13 VAL 21 -10.806 7.749 3.534 185 HG21 VAL 21 HG21 VAL 21 -11.980 10.750 5.349 186 HG22 VAL 21 HG22 VAL 21 -11.096 10.220 3.919 187 HG23 VAL 21 HG23 VAL 21 -10.245 10.452 5.446 188 H ALA 22 HN ALA 22 -13.193 7.172 7.270 189 HA ALA 22 HA ALA 22 -12.699 4.467 6.515 190 HB1 ALA 22 HB1 ALA 22 -12.651 5.428 8.864 191 HB2 ALA 22 HB2 ALA 22 -13.474 3.875 8.710 192 HB3 ALA 22 HB3 ALA 22 -14.412 5.363 8.844 193 H GLU 23 HN GLU 23 -15.754 6.261 6.865 194 HA GLU 23 HA GLU 23 -17.435 3.983 6.342 195 HB2 GLU 23 HB2 GLU 23 -18.162 6.159 7.400 196 HB3 GLU 23 HB1 GLU 23 -18.081 6.890 5.798 197 HG2 GLU 23 HG2 GLU 23 -19.683 5.158 4.976 198 HG3 GLU 23 HG1 GLU 23 -19.827 4.560 6.631 199 H GLU 24 HN GLU 24 -16.241 6.608 4.247 200 HA GLU 24 HA GLU 24 -17.503 5.610 1.857 201 HB2 GLU 24 HB2 GLU 24 -15.177 7.487 2.312 202 HB3 GLU 24 HB1 GLU 24 -15.828 7.132 0.711 203 HG2 GLU 24 HG2 GLU 24 -18.011 7.971 1.351 204 HG3 GLU 24 HG1 GLU 24 -17.486 8.179 3.021 205 H MET 25 HN MET 25 -14.322 5.111 3.316 206 HA MET 25 HA MET 25 -13.139 3.696 1.127 207 HB2 MET 25 HB2 MET 25 -12.646 3.764 4.103 208 HB3 MET 25 HB1 MET 25 -11.755 2.636 3.082 209 HG2 MET 25 HG2 MET 25 -11.904 5.606 2.525 210 HG3 MET 25 HG1 MET 25 -10.607 4.869 3.464 211 HE1 MET 25 HE1 MET 25 -9.328 3.038 2.873 212 HE2 MET 25 HE2 MET 25 -8.548 2.844 1.306 213 HE3 MET 25 HE3 MET 25 -10.019 1.945 1.665 214 H GLY 26 HN GLY 26 -15.196 2.649 3.807 215 HA2 GLY 26 HA2 GLY 26 -16.707 0.758 3.585 216 HA3 GLY 26 HA1 GLY 26 -15.624 0.060 2.380 217 H ILE 27 HN ILE 27 -14.187 1.427 5.203 218 HA ILE 27 HA ILE 27 -13.792 -1.305 6.377 219 HB ILE 27 HB ILE 27 -11.514 -0.589 7.019 220 HG12 ILE 27 HG12 ILE 27 -12.069 1.840 5.287 221 HG13 ILE 27 HG11 ILE 27 -12.003 1.875 7.048 222 HG21 ILE 27 HG21 ILE 27 -11.985 -0.194 4.055 223 HG22 ILE 27 HG22 ILE 27 -12.015 -1.771 4.845 224 HG23 ILE 27 HG23 ILE 27 -10.530 -0.819 4.832 225 HD11 ILE 27 HD11 ILE 27 -9.839 2.553 6.083 226 HD12 ILE 27 HD12 ILE 27 -9.742 1.020 5.217 227 HD13 ILE 27 HD13 ILE 27 -9.680 1.042 6.979 228 H SER 28 HN SER 28 -13.304 -1.260 8.695 229 HA SER 28 HA SER 28 -15.153 0.414 10.129 230 HB2 SER 28 HB2 SER 28 -14.638 -1.827 10.925 231 HB3 SER 28 HB1 SER 28 -12.935 -1.412 11.092 232 HG SER 28 HG SER 28 -13.366 -0.325 12.866 233 H ARG 29 HN ARG 29 -14.656 1.948 11.772 234 HA ARG 29 HA ARG 29 -12.674 3.883 11.073 235 HB2 ARG 29 HB2 ARG 29 -14.379 3.435 13.531 236 HB3 ARG 29 HB1 ARG 29 -13.206 4.751 13.459 237 HG2 ARG 29 HG2 ARG 29 -14.295 5.757 11.593 238 HG3 ARG 29 HG1 ARG 29 -15.275 4.322 11.299 239 HD2 ARG 29 HD2 ARG 29 -15.470 5.882 13.881 240 HD3 ARG 29 HD1 ARG 29 -16.437 6.295 12.465 241 HE ARG 29 HE ARG 29 -16.901 4.039 14.223 242 HH11 ARG 29 HH21 ARG 29 -16.999 5.175 10.972 243 HH12 ARG 29 HH22 ARG 29 -18.296 4.130 10.498 244 HH21 ARG 29 HH11 ARG 29 -18.612 2.666 13.625 245 HH22 ARG 29 HH12 ARG 29 -19.209 2.711 11.999 246 H GLN 30 HN GLN 30 -12.687 1.206 13.371 247 HA GLN 30 HA GLN 30 -10.254 1.861 14.724 248 HB2 GLN 30 HB2 GLN 30 -11.857 0.123 15.507 249 HB3 GLN 30 HB1 GLN 30 -11.395 -0.890 14.139 250 HG2 GLN 30 HG2 GLN 30 -9.103 -1.009 14.933 251 HG3 GLN 30 HG1 GLN 30 -9.456 0.137 16.228 252 HE21 GLN 30 HE21 GLN 30 -8.475 -2.450 16.865 253 HE22 GLN 30 HE22 GLN 30 -9.710 -3.334 17.624 254 H GLN 31 HN GLN 31 -10.911 0.015 11.764 255 HA GLN 31 HA GLN 31 -8.221 -0.861 11.306 256 HB2 GLN 31 HB2 GLN 31 -10.240 -1.762 10.123 257 HB3 GLN 31 HB1 GLN 31 -10.363 -0.240 9.243 258 HG2 GLN 31 HG2 GLN 31 -9.187 -1.848 7.850 259 HG3 GLN 31 HG1 GLN 31 -8.039 -0.617 8.375 260 HE21 GLN 31 HE21 GLN 31 -6.133 -1.915 8.427 261 HE22 GLN 31 HE22 GLN 31 -5.953 -3.258 9.449 262 H LEU 32 HN LEU 32 -9.999 2.038 10.287 263 HA LEU 32 HA LEU 32 -7.911 3.150 8.688 264 HB2 LEU 32 HB2 LEU 32 -10.187 4.007 8.541 265 HB3 LEU 32 HB1 LEU 32 -10.151 4.491 10.234 266 HG LEU 32 HG LEU 32 -8.422 6.147 9.772 267 HD11 LEU 32 HD11 LEU 32 -7.897 6.524 7.257 268 HD12 LEU 32 HD12 LEU 32 -8.457 4.867 7.034 269 HD13 LEU 32 HD13 LEU 32 -7.072 5.203 8.076 270 HD21 LEU 32 HD21 LEU 32 -10.687 6.234 7.757 271 HD22 LEU 32 HD22 LEU 32 -9.717 7.621 8.250 272 HD23 LEU 32 HD23 LEU 32 -10.759 6.812 9.420 273 H CYS 33 HN CYS 33 -8.682 3.426 12.135 274 HA CYS 33 HA CYS 33 -6.752 5.402 12.813 275 HB2 CYS 33 HB2 CYS 33 -7.820 3.079 14.448 276 HB3 CYS 33 HB1 CYS 33 -6.887 4.420 15.113 277 HG CYS 33 HG CYS 33 -9.068 5.746 13.715 278 H ASN 34 HN ASN 34 -6.465 1.895 12.428 279 HA ASN 34 HA ASN 34 -3.831 1.610 13.490 280 HB2 ASN 34 HB2 ASN 34 -5.433 -0.260 12.860 281 HB3 ASN 34 HB1 ASN 34 -4.995 0.033 11.178 282 HD21 ASN 34 HD21 ASN 34 -4.340 -2.453 11.944 283 HD22 ASN 34 HD22 ASN 34 -2.689 -2.608 12.304 284 H ILE 35 HN ILE 35 -4.991 2.425 10.238 285 HA ILE 35 HA ILE 35 -2.432 2.444 8.963 286 HB ILE 35 HB ILE 35 -4.846 4.154 8.303 287 HG12 ILE 35 HG12 ILE 35 -4.088 1.413 7.244 288 HG13 ILE 35 HG11 ILE 35 -5.307 1.682 8.490 289 HG21 ILE 35 HG21 ILE 35 -2.479 3.198 6.661 290 HG22 ILE 35 HG22 ILE 35 -2.812 4.862 7.143 291 HG23 ILE 35 HG23 ILE 35 -3.881 4.043 6.004 292 HD11 ILE 35 HD11 ILE 35 -6.453 3.262 6.851 293 HD12 ILE 35 HD12 ILE 35 -6.493 1.553 6.415 294 HD13 ILE 35 HD13 ILE 35 -5.353 2.640 5.621 295 H GLU 36 HN GLU 36 -4.281 4.985 10.619 296 HA GLU 36 HA GLU 36 -2.601 7.184 10.111 297 HB2 GLU 36 HB2 GLU 36 -4.802 7.244 11.321 298 HB3 GLU 36 HB1 GLU 36 -3.999 6.574 12.738 299 HG2 GLU 36 HG2 GLU 36 -2.998 8.571 13.281 300 HG3 GLU 36 HG1 GLU 36 -2.645 8.969 11.603 301 H GLN 37 HN GLN 37 -2.302 4.635 12.559 302 HA GLN 37 HA GLN 37 0.389 5.703 13.322 303 HB2 GLN 37 HB2 GLN 37 0.212 4.183 15.255 304 HB3 GLN 37 HB1 GLN 37 -1.164 5.282 15.185 305 HG2 GLN 37 HG2 GLN 37 -2.488 3.500 14.053 306 HG3 GLN 37 HG1 GLN 37 -1.124 2.400 14.238 307 HE21 GLN 37 HE21 GLN 37 -2.776 1.128 15.586 308 HE22 GLN 37 HE22 GLN 37 -2.948 1.545 17.223 309 H SER 38 HN SER 38 0.033 4.411 10.783 310 HA SER 38 HA SER 38 0.698 1.634 10.831 311 HB2 SER 38 HB2 SER 38 1.542 2.085 8.485 312 HB3 SER 38 HB1 SER 38 -0.113 2.603 8.787 313 HG SER 38 HG SER 38 1.264 4.642 9.478 314 H GLU 39 HN GLU 39 2.779 0.673 10.291 315 HA GLU 39 HA GLU 39 5.074 2.166 11.476 316 HB2 GLU 39 HB2 GLU 39 4.657 0.236 12.778 317 HB3 GLU 39 HB1 GLU 39 4.343 -0.764 11.364 318 HG2 GLU 39 HG2 GLU 39 7.072 0.436 11.431 319 HG3 GLU 39 HG1 GLU 39 6.747 -0.701 12.734 320 H THR 40 HN THR 40 6.614 2.765 10.112 321 HA THR 40 HA THR 40 7.839 3.045 8.150 322 HB THR 40 HB THR 40 8.707 0.872 7.248 323 HG1 THR 40 HG1 THR 40 8.101 -0.968 8.536 324 HG21 THR 40 HG21 THR 40 8.785 1.513 10.189 325 HG22 THR 40 HG22 THR 40 10.008 1.843 8.961 326 HG23 THR 40 HG23 THR 40 9.736 0.191 9.514 327 H ALA 41 HN ALA 41 7.938 2.259 5.731 328 HA ALA 41 HA ALA 41 5.150 2.371 4.709 329 HB1 ALA 41 HB1 ALA 41 6.038 3.304 2.716 330 HB2 ALA 41 HB2 ALA 41 7.669 2.745 3.092 331 HB3 ALA 41 HB3 ALA 41 6.954 4.059 4.024 332 HA PRO 42 HA PRO 42 5.359 -2.033 3.640 333 HB2 PRO 42 HB2 PRO 42 3.801 -1.141 1.241 334 HB3 PRO 42 HB1 PRO 42 3.463 -2.468 2.371 335 HG2 PRO 42 HG2 PRO 42 2.139 -0.128 2.421 336 HG3 PRO 42 HG1 PRO 42 2.456 -1.077 3.887 337 HD2 PRO 42 HD2 PRO 42 3.670 1.491 3.025 338 HD3 PRO 42 HD1 PRO 42 3.552 0.781 4.651 339 H VAL 43 HN VAL 43 6.627 -3.302 2.304 340 HA VAL 43 HA VAL 43 8.599 -2.050 0.620 341 HB VAL 43 HB VAL 43 9.110 -4.460 -0.043 342 HG11 VAL 43 HG11 VAL 43 10.180 -3.260 1.863 343 HG12 VAL 43 HG12 VAL 43 10.030 -4.993 2.149 344 HG13 VAL 43 HG13 VAL 43 8.911 -3.871 2.923 345 HG21 VAL 43 HG21 VAL 43 7.975 -6.228 1.168 346 HG22 VAL 43 HG22 VAL 43 6.747 -5.259 0.352 347 HG23 VAL 43 HG23 VAL 43 7.026 -5.055 2.082 348 H VAL 44 HN VAL 44 5.469 -3.531 0.009 349 HA VAL 44 HA VAL 44 5.741 -3.872 -2.820 350 HB VAL 44 HB VAL 44 3.896 -4.891 -1.549 351 HG11 VAL 44 HG11 VAL 44 2.905 -2.039 -1.238 352 HG12 VAL 44 HG12 VAL 44 3.543 -3.061 0.050 353 HG13 VAL 44 HG13 VAL 44 2.034 -3.491 -0.745 354 HG21 VAL 44 HG21 VAL 44 3.671 -4.299 -4.012 355 HG22 VAL 44 HG22 VAL 44 2.763 -2.875 -3.505 356 HG23 VAL 44 HG23 VAL 44 2.147 -4.488 -3.144 357 H VAL 45 HN VAL 45 4.931 -1.086 -0.825 358 HA VAL 45 HA VAL 45 3.975 0.633 -2.890 359 HB VAL 45 HB VAL 45 5.389 1.193 -0.270 360 HG11 VAL 45 HG11 VAL 45 4.429 3.561 -0.675 361 HG12 VAL 45 HG12 VAL 45 4.323 3.083 -2.370 362 HG13 VAL 45 HG13 VAL 45 5.890 3.120 -1.562 363 HG21 VAL 45 HG21 VAL 45 2.975 0.206 -0.487 364 HG22 VAL 45 HG22 VAL 45 2.531 1.825 -1.025 365 HG23 VAL 45 HG23 VAL 45 3.222 1.586 0.580 366 H LYS 46 HN LYS 46 7.260 0.134 -1.600 367 HA LYS 46 HA LYS 46 8.582 1.988 -3.325 368 HB2 LYS 46 HB2 LYS 46 9.579 -0.553 -2.002 369 HB3 LYS 46 HB1 LYS 46 10.625 0.600 -2.833 370 HG2 LYS 46 HG2 LYS 46 9.902 2.383 -1.302 371 HG3 LYS 46 HG1 LYS 46 8.828 1.251 -0.480 372 HD2 LYS 46 HD2 LYS 46 10.760 -0.141 0.150 373 HD3 LYS 46 HD1 LYS 46 11.841 0.979 -0.679 374 HE2 LYS 46 HE2 LYS 46 11.144 2.791 0.838 375 HE3 LYS 46 HE1 LYS 46 10.046 1.684 1.662 376 HZ1 LYS 46 HZ1 LYS 46 12.848 2.014 2.000 377 HZ2 LYS 46 HZ2 LYS 46 12.476 0.403 1.611 378 HZ3 LYS 46 HZ3 LYS 46 11.748 1.145 2.954 379 H TYR 47 HN TYR 47 7.674 -1.403 -3.711 380 HA TYR 47 HA TYR 47 9.084 -1.972 -6.106 381 HB2 TYR 47 HB2 TYR 47 7.790 -3.645 -4.736 382 HB3 TYR 47 HB1 TYR 47 6.303 -2.956 -5.387 383 HD1 TYR 47 HD2 TYR 47 9.355 -4.854 -6.171 384 HD2 TYR 47 HD1 TYR 47 5.658 -3.301 -7.731 385 HE1 TYR 47 HE2 TYR 47 9.615 -6.258 -8.197 386 HE2 TYR 47 HE1 TYR 47 5.940 -4.703 -9.756 387 HH TYR 47 HH TYR 47 8.352 -5.823 -10.911 388 H ILE 48 HN ILE 48 5.947 -0.402 -5.573 389 HA ILE 48 HA ILE 48 5.186 -0.189 -8.317 390 HB ILE 48 HB ILE 48 4.572 1.601 -5.945 391 HG12 ILE 48 HG12 ILE 48 2.847 -0.457 -7.352 392 HG13 ILE 48 HG11 ILE 48 3.811 -0.822 -5.920 393 HG21 ILE 48 HG21 ILE 48 2.607 2.291 -7.434 394 HG22 ILE 48 HG22 ILE 48 3.495 1.562 -8.772 395 HG23 ILE 48 HG23 ILE 48 4.185 2.929 -7.898 396 HD11 ILE 48 HD11 ILE 48 1.544 1.172 -6.148 397 HD12 ILE 48 HD12 ILE 48 2.624 1.091 -4.755 398 HD13 ILE 48 HD13 ILE 48 1.595 -0.284 -5.155 399 H ALA 49 HN ALA 49 7.075 1.962 -6.201 400 HA ALA 49 HA ALA 49 7.451 4.087 -8.044 401 HB1 ALA 49 HB1 ALA 49 9.499 3.067 -6.052 402 HB2 ALA 49 HB2 ALA 49 8.144 4.113 -5.623 403 HB3 ALA 49 HB3 ALA 49 9.397 4.696 -6.720 404 H PHE 50 HN PHE 50 9.197 1.011 -7.693 405 HA PHE 50 HA PHE 50 11.301 1.589 -9.535 406 HB2 PHE 50 HB2 PHE 50 11.018 -0.439 -7.936 407 HB3 PHE 50 HB1 PHE 50 10.065 -1.156 -9.235 408 HD1 PHE 50 HD2 PHE 50 13.397 0.246 -8.373 409 HD2 PHE 50 HD1 PHE 50 11.112 -2.050 -11.192 410 HE1 PHE 50 HE2 PHE 50 15.490 -0.431 -9.517 411 HE2 PHE 50 HE1 PHE 50 13.205 -2.727 -12.337 412 HZ PHE 50 HZ PHE 50 15.394 -1.919 -11.498 413 H LEU 51 HN LEU 51 8.130 0.032 -10.043 414 HA LEU 51 HA LEU 51 8.414 -0.298 -12.879 415 HB2 LEU 51 HB2 LEU 51 6.063 -0.193 -10.990 416 HB3 LEU 51 HB1 LEU 51 5.787 -0.261 -12.722 417 HG LEU 51 HG LEU 51 5.821 -2.501 -11.450 418 HD11 LEU 51 HD11 LEU 51 7.817 -2.306 -13.708 419 HD12 LEU 51 HD12 LEU 51 6.078 -2.202 -13.958 420 HD13 LEU 51 HD13 LEU 51 6.786 -3.670 -13.295 421 HD21 LEU 51 HD21 LEU 51 8.820 -2.168 -11.646 422 HD22 LEU 51 HD22 LEU 51 7.921 -3.457 -10.863 423 HD23 LEU 51 HD23 LEU 51 7.932 -1.845 -10.161 424 H ARG 52 HN ARG 52 7.076 2.322 -10.903 425 HA ARG 52 HA ARG 52 6.101 3.937 -13.051 426 HB2 ARG 52 HB2 ARG 52 5.625 4.332 -10.611 427 HB3 ARG 52 HB1 ARG 52 7.281 4.901 -10.424 428 HG2 ARG 52 HG2 ARG 52 6.775 6.598 -12.268 429 HG3 ARG 52 HG1 ARG 52 5.083 6.130 -12.105 430 HD2 ARG 52 HD2 ARG 52 6.768 7.079 -9.778 431 HD3 ARG 52 HD1 ARG 52 5.769 8.156 -10.749 432 HE ARG 52 HE ARG 52 4.115 6.033 -9.870 433 HH11 ARG 52 HH21 ARG 52 6.034 8.610 -8.656 434 HH12 ARG 52 HH22 ARG 52 5.015 8.912 -7.289 435 HH21 ARG 52 HH11 ARG 52 2.758 6.405 -8.086 436 HH22 ARG 52 HH12 ARG 52 3.161 7.662 -6.964 437 H SER 53 HN SER 53 9.265 3.744 -11.468 438 HA SER 53 HA SER 53 10.542 5.923 -12.729 439 HB2 SER 53 HB2 SER 53 11.542 4.595 -10.886 440 HB3 SER 53 HB1 SER 53 11.760 3.243 -11.994 441 HG SER 53 HG SER 53 13.129 5.647 -11.788 442 H LYS 54 HN LYS 54 9.505 2.918 -14.072 443 HA LYS 54 HA LYS 54 11.264 3.214 -16.453 444 HB2 LYS 54 HB2 LYS 54 9.297 1.076 -15.602 445 HB3 LYS 54 HB1 LYS 54 10.158 1.051 -17.142 446 HG2 LYS 54 HG2 LYS 54 12.304 1.049 -15.968 447 HG3 LYS 54 HG1 LYS 54 11.476 1.160 -14.414 448 HD2 LYS 54 HD2 LYS 54 10.382 -1.008 -14.833 449 HD3 LYS 54 HD1 LYS 54 11.201 -1.123 -16.392 450 HE2 LYS 54 HE2 LYS 54 13.382 -1.117 -15.279 451 HE3 LYS 54 HE1 LYS 54 12.600 -0.922 -13.711 452 HZ1 LYS 54 HZ1 LYS 54 13.259 -3.280 -14.727 453 HZ2 LYS 54 HZ2 LYS 54 11.678 -3.147 -15.335 454 HZ3 LYS 54 HZ3 LYS 54 11.958 -3.062 -13.661 455 H GLY 55 HN GLY 55 8.508 4.624 -15.467 456 HA2 GLY 55 HA2 GLY 55 7.024 5.959 -16.748 457 HA3 GLY 55 HA1 GLY 55 7.688 5.237 -18.214 458 H VAL 56 HN VAL 56 6.646 3.120 -15.671 459 HA VAL 56 HA VAL 56 4.759 1.785 -17.390 460 HB VAL 56 HB VAL 56 5.178 1.627 -14.388 461 HG11 VAL 56 HG11 VAL 56 3.024 0.697 -14.756 462 HG12 VAL 56 HG12 VAL 56 4.102 -0.700 -14.800 463 HG13 VAL 56 HG13 VAL 56 3.498 -0.003 -16.303 464 HG21 VAL 56 HG21 VAL 56 7.055 1.034 -16.094 465 HG22 VAL 56 HG22 VAL 56 6.055 -0.358 -16.487 466 HG23 VAL 56 HG23 VAL 56 6.669 -0.148 -14.851 467 H ASP 57 HN ASP 57 2.621 2.141 -17.669 468 HA ASP 57 HA ASP 57 1.445 4.556 -16.544 469 HB2 ASP 57 HB2 ASP 57 0.137 2.383 -18.203 470 HB3 ASP 57 HB1 ASP 57 -0.470 4.021 -17.950 471 H LEU 58 HN LEU 58 1.628 3.777 -14.262 472 HA LEU 58 HA LEU 58 -0.340 1.708 -13.465 473 HB2 LEU 58 HB2 LEU 58 0.616 1.884 -11.276 474 HB3 LEU 58 HB1 LEU 58 1.956 1.905 -12.418 475 HG LEU 58 HG LEU 58 1.382 4.608 -12.230 476 HD11 LEU 58 HD11 LEU 58 1.205 3.639 -9.376 477 HD12 LEU 58 HD12 LEU 58 -0.253 3.885 -10.334 478 HD13 LEU 58 HD13 LEU 58 0.838 5.236 -10.027 479 HD21 LEU 58 HD21 LEU 58 3.315 4.602 -10.514 480 HD22 LEU 58 HD22 LEU 58 3.628 3.883 -12.092 481 HD23 LEU 58 HD23 LEU 58 3.303 2.851 -10.702 482 H ASN 59 HN ASN 59 -0.073 5.112 -13.813 483 HA ASN 59 HA ASN 59 -1.928 6.013 -11.840 484 HB2 ASN 59 HB2 ASN 59 -2.269 7.941 -13.469 485 HB3 ASN 59 HB1 ASN 59 -0.588 7.635 -13.027 486 HD21 ASN 59 HD21 ASN 59 -1.404 8.919 -15.521 487 HD22 ASN 59 HD22 ASN 59 -0.920 7.904 -16.792 488 H ALA 60 HN ALA 60 -2.357 4.882 -15.176 489 HA ALA 60 HA ALA 60 -5.210 5.267 -15.226 490 HB1 ALA 60 HB1 ALA 60 -3.723 4.966 -17.255 491 HB2 ALA 60 HB2 ALA 60 -5.177 3.967 -17.258 492 HB3 ALA 60 HB3 ALA 60 -3.618 3.257 -16.840 493 H LEU 61 HN LEU 61 -3.101 2.617 -14.250 494 HA LEU 61 HA LEU 61 -5.042 0.548 -14.023 495 HB2 LEU 61 HB2 LEU 61 -2.425 0.537 -13.752 496 HB3 LEU 61 HB1 LEU 61 -2.769 0.856 -12.056 497 HG LEU 61 HG LEU 61 -3.849 -1.485 -13.654 498 HD11 LEU 61 HD11 LEU 61 -1.436 -1.668 -13.232 499 HD12 LEU 61 HD12 LEU 61 -2.314 -2.814 -12.218 500 HD13 LEU 61 HD13 LEU 61 -1.693 -1.318 -11.523 501 HD21 LEU 61 HD21 LEU 61 -4.339 -2.237 -11.180 502 HD22 LEU 61 HD22 LEU 61 -5.447 -1.124 -11.975 503 HD23 LEU 61 HD23 LEU 61 -4.257 -0.509 -10.829 504 H PHE 62 HN PHE 62 -3.876 2.857 -11.555 505 HA PHE 62 HA PHE 62 -5.797 2.010 -9.560 506 HB2 PHE 62 HB2 PHE 62 -3.911 4.340 -9.855 507 HB3 PHE 62 HB1 PHE 62 -5.127 4.365 -8.579 508 HD1 PHE 62 HD2 PHE 62 -2.508 2.104 -10.051 509 HD2 PHE 62 HD1 PHE 62 -4.653 3.333 -6.537 510 HE1 PHE 62 HE2 PHE 62 -1.102 0.602 -8.663 511 HE2 PHE 62 HE1 PHE 62 -3.252 1.839 -5.156 512 HZ PHE 62 HZ PHE 62 -1.474 0.470 -6.214 513 H ASP 63 HN ASP 63 -5.756 4.485 -12.060 514 HA ASP 63 HA ASP 63 -7.990 5.998 -11.207 515 HB2 ASP 63 HB2 ASP 63 -6.437 6.615 -13.080 516 HB3 ASP 63 HB1 ASP 63 -7.228 5.390 -14.074 517 H ARG 64 HN ARG 64 -7.824 2.963 -13.007 518 HA ARG 64 HA ARG 64 -10.628 2.903 -13.702 519 HB2 ARG 64 HB2 ARG 64 -8.530 0.727 -13.510 520 HB3 ARG 64 HB1 ARG 64 -10.180 0.432 -14.061 521 HG2 ARG 64 HG2 ARG 64 -9.898 2.084 -15.854 522 HG3 ARG 64 HG1 ARG 64 -8.262 2.429 -15.293 523 HD2 ARG 64 HD2 ARG 64 -7.618 0.086 -15.732 524 HD3 ARG 64 HD1 ARG 64 -9.252 -0.252 -16.304 525 HE ARG 64 HE ARG 64 -8.457 1.863 -17.884 526 HH11 ARG 64 HH21 ARG 64 -7.146 -1.198 -16.999 527 HH12 ARG 64 HH22 ARG 64 -6.292 -1.414 -18.490 528 HH21 ARG 64 HH11 ARG 64 -7.348 1.603 -19.834 529 HH22 ARG 64 HH12 ARG 64 -6.406 0.174 -20.097 530 H ILE 65 HN ILE 65 -8.743 1.663 -10.974 531 HA ILE 65 HA ILE 65 -11.025 0.297 -9.773 532 HB ILE 65 HB ILE 65 -8.340 1.060 -8.592 533 HG12 ILE 65 HG12 ILE 65 -9.268 -1.616 -9.673 534 HG13 ILE 65 HG11 ILE 65 -8.333 -0.463 -10.626 535 HG21 ILE 65 HG21 ILE 65 -10.541 -0.805 -7.661 536 HG22 ILE 65 HG22 ILE 65 -9.910 0.609 -6.817 537 HG23 ILE 65 HG23 ILE 65 -8.904 -0.827 -7.004 538 HD11 ILE 65 HD11 ILE 65 -7.494 -1.822 -8.053 539 HD12 ILE 65 HD12 ILE 65 -6.601 -0.485 -8.778 540 HD13 ILE 65 HD13 ILE 65 -6.765 -2.010 -9.647 541 H ILE 66 HN ILE 66 -9.005 2.798 -8.240 542 HA ILE 66 HA ILE 66 -9.604 4.444 -6.685 543 HB ILE 66 HB ILE 66 -11.995 4.851 -8.501 544 HG12 ILE 66 HG12 ILE 66 -9.194 5.975 -8.831 545 HG13 ILE 66 HG11 ILE 66 -9.845 4.646 -9.787 546 HG21 ILE 66 HG21 ILE 66 -10.341 6.974 -7.132 547 HG22 ILE 66 HG22 ILE 66 -11.589 6.125 -6.227 548 HG23 ILE 66 HG23 ILE 66 -12.018 7.052 -7.662 549 HD11 ILE 66 HD11 ILE 66 -11.603 6.056 -10.676 550 HD12 ILE 66 HD12 ILE 66 -10.073 6.895 -10.907 551 HD13 ILE 66 HD13 ILE 66 -11.149 7.375 -9.602 552 H VAL 67 HN VAL 67 -12.874 4.763 -6.970 553 HA VAL 67 HA VAL 67 -13.416 2.855 -4.719 554 HB VAL 67 HB VAL 67 -14.466 5.640 -5.275 555 HG11 VAL 67 HG11 VAL 67 -16.397 4.460 -4.551 556 HG12 VAL 67 HG12 VAL 67 -15.758 5.210 -3.089 557 HG13 VAL 67 HG13 VAL 67 -15.475 3.496 -3.398 558 HG21 VAL 67 HG21 VAL 67 -13.499 6.136 -3.094 559 HG22 VAL 67 HG22 VAL 67 -12.267 5.381 -4.105 560 HG23 VAL 67 HG23 VAL 67 -13.083 4.438 -2.857 561 H ASN 68 HN ASN 68 -15.081 1.455 -5.000 562 HA ASN 68 HA ASN 68 -16.807 0.287 -6.051 563 HB2 ASN 68 HB2 ASN 68 -17.610 3.111 -6.822 564 HB3 ASN 68 HB1 ASN 68 -18.638 1.691 -6.998 565 HD21 ASN 68 HD21 ASN 68 -17.035 0.818 -4.347 566 HD22 ASN 68 HD22 ASN 68 -17.973 1.543 -3.133 567 H LYS 69 HN LYS 69 -17.841 -0.137 -8.234 568 HA LYS 69 HA LYS 69 -15.726 -0.215 -10.249 569 HB2 LYS 69 HB2 LYS 69 -17.223 -2.155 -9.811 570 HB3 LYS 69 HB1 LYS 69 -18.587 -1.206 -10.402 571 HG2 LYS 69 HG2 LYS 69 -17.551 -1.004 -12.597 572 HG3 LYS 69 HG1 LYS 69 -16.101 -1.828 -12.022 573 HD2 LYS 69 HD2 LYS 69 -17.441 -3.850 -11.563 574 HD3 LYS 69 HD1 LYS 69 -18.884 -3.023 -12.155 575 HE2 LYS 69 HE2 LYS 69 -17.936 -4.422 -13.932 576 HE3 LYS 69 HE1 LYS 69 -17.781 -2.718 -14.359 577 HZ1 LYS 69 HZ1 LYS 69 -15.754 -4.624 -14.098 578 HZ2 LYS 69 HZ2 LYS 69 -15.533 -3.471 -12.869 579 HZ3 LYS 69 HZ3 LYS 69 -15.603 -2.982 -14.495 580 H LEU 70 HN LEU 70 -16.026 0.520 -12.443 581 HA LEU 70 HA LEU 70 -16.738 3.202 -12.744 582 HB2 LEU 70 HB2 LEU 70 -16.863 1.076 -14.903 583 HB3 LEU 70 HB1 LEU 70 -16.641 2.809 -15.149 584 HG LEU 70 HG LEU 70 -14.740 0.992 -13.636 585 HD11 LEU 70 HD11 LEU 70 -14.708 0.590 -16.059 586 HD12 LEU 70 HD12 LEU 70 -13.231 1.412 -15.557 587 HD13 LEU 70 HD13 LEU 70 -14.516 2.318 -16.355 588 HD21 LEU 70 HD21 LEU 70 -14.433 3.105 -12.658 589 HD22 LEU 70 HD22 LEU 70 -14.828 3.965 -14.146 590 HD23 LEU 70 HD23 LEU 70 -13.271 3.154 -13.982 591 H GLU 71 HN GLU 71 -18.491 4.192 -13.905 592 HA GLU 71 HA GLU 71 -21.053 3.630 -12.914 593 HB2 GLU 71 HB2 GLU 71 -21.512 4.913 -15.407 594 HB3 GLU 71 HB1 GLU 71 -21.318 5.697 -13.844 595 HG2 GLU 71 HG2 GLU 71 -19.762 6.607 -15.540 596 HG3 GLU 71 HG1 GLU 71 -18.899 5.870 -14.194 597 H HIS 72 HN HIS 72 -22.922 3.446 -14.833 598 HA HIS 72 HA HIS 72 -23.262 0.735 -15.378 599 HB2 HIS 72 HB2 HIS 72 -24.201 2.924 -17.250 600 HB3 HIS 72 HB1 HIS 72 -24.994 1.385 -16.904 601 HD2 HIS 72 HD2 HIS 72 -24.615 4.941 -15.302 602 HE1 HIS 72 HE1 HIS 72 -27.141 2.670 -12.794 603 HE2 HIS 72 HE2 HIS 72 -26.193 4.983 -13.226 604 H HIS 73 HN HIS 73 -21.356 -0.239 -16.142 605 HA HIS 73 HA HIS 73 -19.845 0.748 -18.379 606 HB2 HIS 73 HB2 HIS 73 -19.002 -0.832 -16.610 607 HB3 HIS 73 HB1 HIS 73 -19.976 -2.099 -17.353 608 HD2 HIS 73 HD2 HIS 73 -18.075 -3.582 -18.712 609 HE1 HIS 73 HE1 HIS 73 -16.102 -0.380 -20.631 610 HE2 HIS 73 HE2 HIS 73 -16.231 -2.905 -20.427 611 H HIS 74 HN HIS 74 -20.096 0.391 -20.539 612 HA HIS 74 HA HIS 74 -22.606 -0.765 -21.478 613 HB2 HIS 74 HB2 HIS 74 -20.331 -0.030 -23.316 614 HB3 HIS 74 HB1 HIS 74 -22.067 0.178 -23.553 615 HD2 HIS 74 HD2 HIS 74 -23.022 2.687 -22.775 616 HE1 HIS 74 HE1 HIS 74 -19.564 3.979 -20.722 617 HE2 HIS 74 HE2 HIS 74 -21.862 4.672 -21.541 618 H HIS 75 HN HIS 75 -22.785 -2.609 -22.877 619 HA HIS 75 HA HIS 75 -20.849 -4.731 -22.274 620 HB2 HIS 75 HB2 HIS 75 -23.356 -5.081 -22.363 621 HB3 HIS 75 HB1 HIS 75 -23.259 -4.852 -24.108 622 HD2 HIS 75 HD2 HIS 75 -24.109 -7.766 -23.879 623 HE1 HIS 75 HE1 HIS 75 -20.091 -8.974 -23.403 624 HE2 HIS 75 HE2 HIS 75 -22.443 -9.772 -23.917 625 H HIS 76 HN HIS 76 -19.192 -5.313 -23.603 626 HA HIS 76 HA HIS 76 -19.027 -4.030 -26.294 627 HB2 HIS 76 HB2 HIS 76 -17.159 -3.944 -24.453 628 HB3 HIS 76 HB1 HIS 76 -16.787 -5.579 -24.990 629 HD2 HIS 76 HD2 HIS 76 -17.143 -5.106 -28.256 630 HE1 HIS 76 HE1 HIS 76 -14.274 -2.051 -27.734 631 HE2 HIS 76 HE2 HIS 76 -15.419 -3.544 -29.435 632 H HIS 77 HN HIS 77 -19.497 -5.255 -28.044 633 HA HIS 77 HA HIS 77 -18.535 -7.944 -28.384 634 HB2 HIS 77 HB2 HIS 77 -20.495 -8.262 -26.766 635 HB3 HIS 77 HB1 HIS 77 -21.542 -7.759 -28.093 636 HD2 HIS 77 HD2 HIS 77 -21.958 -9.719 -30.067 637 HE1 HIS 77 HE1 HIS 77 -19.350 -12.627 -28.461 638 HE2 HIS 77 HE2 HIS 77 -21.102 -12.177 -30.239 639 H1 MET 1 HT1 MET 1 -10.226 -8.602 -12.062 640 H2 MET 1 HT2 MET 1 -10.168 -8.512 -13.759 641 H3 MET 1 HT3 MET 1 -9.776 -7.153 -12.816 642 HA MET 1 HA MET 1 -8.243 -9.683 -13.011 643 HB2 MET 1 HB2 MET 1 -7.668 -6.817 -13.829 644 HB3 MET 1 HB1 MET 1 -6.477 -8.116 -13.865 645 HG2 MET 1 HG2 MET 1 -9.106 -8.150 -15.378 646 HG3 MET 1 HG1 MET 1 -7.548 -7.738 -16.089 647 HE1 MET 1 HE1 MET 1 -5.515 -9.122 -15.845 648 HE2 MET 1 HE2 MET 1 -6.210 -9.586 -17.396 649 HE3 MET 1 HE3 MET 1 -5.546 -10.822 -16.332 650 H GLU 2 HN GLU 2 -6.918 -10.104 -11.320 651 HA GLU 2 HA GLU 2 -7.159 -8.568 -8.879 652 HB2 GLU 2 HB2 GLU 2 -5.189 -10.764 -9.584 653 HB3 GLU 2 HB1 GLU 2 -5.593 -10.210 -7.959 654 HG2 GLU 2 HG2 GLU 2 -7.614 -11.364 -9.897 655 HG3 GLU 2 HG1 GLU 2 -6.801 -12.307 -8.650 656 H LEU 3 HN LEU 3 -5.522 -7.374 -7.808 657 HA LEU 3 HA LEU 3 -3.879 -5.722 -9.473 658 HB2 LEU 3 HB2 LEU 3 -4.008 -6.241 -6.496 659 HB3 LEU 3 HB1 LEU 3 -2.760 -5.193 -7.168 660 HG LEU 3 HG LEU 3 -4.538 -3.839 -8.261 661 HD11 LEU 3 HD11 LEU 3 -6.346 -5.367 -8.492 662 HD12 LEU 3 HD12 LEU 3 -6.883 -4.210 -7.274 663 HD13 LEU 3 HD13 LEU 3 -6.299 -5.800 -6.783 664 HD21 LEU 3 HD21 LEU 3 -3.587 -3.344 -5.960 665 HD22 LEU 3 HD22 LEU 3 -5.013 -4.131 -5.284 666 HD23 LEU 3 HD23 LEU 3 -5.190 -2.672 -6.260 667 H SER 4 HN SER 4 -3.126 -8.504 -7.415 668 HA SER 4 HA SER 4 -0.307 -8.532 -7.786 669 HB2 SER 4 HB2 SER 4 -1.163 -9.968 -6.098 670 HB3 SER 4 HB1 SER 4 -2.317 -10.711 -7.202 671 HG SER 4 HG SER 4 0.450 -11.095 -6.946 672 H ASN 5 HN ASN 5 -2.929 -9.764 -9.775 673 HA ASN 5 HA ASN 5 -1.405 -11.371 -11.549 674 HB2 ASN 5 HB2 ASN 5 -3.900 -11.313 -11.468 675 HB3 ASN 5 HB1 ASN 5 -3.858 -9.715 -12.211 676 HD21 ASN 5 HD21 ASN 5 -3.909 -9.691 -14.466 677 HD22 ASN 5 HD22 ASN 5 -3.543 -11.020 -15.457 678 H GLU 6 HN GLU 6 -2.016 -7.876 -11.516 679 HA GLU 6 HA GLU 6 -0.700 -7.462 -14.081 680 HB2 GLU 6 HB2 GLU 6 -2.459 -5.924 -13.062 681 HB3 GLU 6 HB1 GLU 6 -1.187 -5.348 -11.983 682 HG2 GLU 6 HG2 GLU 6 -0.923 -3.832 -13.731 683 HG3 GLU 6 HG1 GLU 6 0.171 -5.091 -14.271 684 H LEU 7 HN LEU 7 0.290 -7.414 -10.700 685 HA LEU 7 HA LEU 7 2.766 -6.029 -11.000 686 HB2 LEU 7 HB2 LEU 7 1.614 -7.962 -9.034 687 HB3 LEU 7 HB1 LEU 7 3.360 -7.785 -8.999 688 HG LEU 7 HG LEU 7 2.012 -6.250 -7.449 689 HD11 LEU 7 HD11 LEU 7 4.434 -5.893 -8.397 690 HD12 LEU 7 HD12 LEU 7 3.618 -4.557 -7.595 691 HD13 LEU 7 HD13 LEU 7 3.678 -4.621 -9.354 692 HD21 LEU 7 HD21 LEU 7 1.594 -4.433 -9.799 693 HD22 LEU 7 HD22 LEU 7 0.715 -4.529 -8.278 694 HD23 LEU 7 HD23 LEU 7 0.420 -5.721 -9.535 695 H LYS 8 HN LYS 8 2.038 -9.520 -11.278 696 HA LYS 8 HA LYS 8 4.787 -10.197 -11.909 697 HB2 LYS 8 HB2 LYS 8 3.965 -12.426 -12.311 698 HB3 LYS 8 HB1 LYS 8 3.054 -11.787 -10.943 699 HG2 LYS 8 HG2 LYS 8 1.248 -11.121 -12.530 700 HG3 LYS 8 HG1 LYS 8 2.123 -11.928 -13.826 701 HD2 LYS 8 HD2 LYS 8 2.059 -14.031 -12.433 702 HD3 LYS 8 HD1 LYS 8 0.970 -13.185 -11.332 703 HE2 LYS 8 HE2 LYS 8 -0.568 -12.741 -13.228 704 HE3 LYS 8 HE1 LYS 8 0.498 -13.659 -14.286 705 HZ1 LYS 8 HZ1 LYS 8 -1.116 -15.172 -13.611 706 HZ2 LYS 8 HZ2 LYS 8 -1.099 -14.631 -12.000 707 HZ3 LYS 8 HZ3 LYS 8 0.211 -15.522 -12.615 708 H VAL 9 HN VAL 9 1.875 -9.524 -13.815 709 HA VAL 9 HA VAL 9 2.898 -10.260 -16.365 710 HB VAL 9 HB VAL 9 0.892 -8.140 -15.574 711 HG11 VAL 9 HG11 VAL 9 1.613 -7.498 -17.741 712 HG12 VAL 9 HG12 VAL 9 0.156 -8.453 -18.020 713 HG13 VAL 9 HG13 VAL 9 1.746 -9.173 -18.277 714 HG21 VAL 9 HG21 VAL 9 0.593 -10.763 -15.200 715 HG22 VAL 9 HG22 VAL 9 0.237 -10.747 -16.928 716 HG23 VAL 9 HG23 VAL 9 -0.742 -9.791 -15.815 717 H GLU 10 HN GLU 10 2.879 -6.986 -14.796 718 HA GLU 10 HA GLU 10 4.373 -5.750 -16.888 719 HB2 GLU 10 HB2 GLU 10 4.137 -5.133 -13.934 720 HB3 GLU 10 HB1 GLU 10 5.025 -4.103 -15.061 721 HG2 GLU 10 HG2 GLU 10 3.045 -3.734 -16.391 722 HG3 GLU 10 HG1 GLU 10 2.139 -4.920 -15.453 723 H ARG 11 HN ARG 11 5.361 -7.693 -14.124 724 HA ARG 11 HA ARG 11 8.161 -7.120 -14.229 725 HB2 ARG 11 HB2 ARG 11 6.491 -8.686 -12.658 726 HB3 ARG 11 HB1 ARG 11 7.407 -9.915 -13.519 727 HG2 ARG 11 HG2 ARG 11 8.731 -7.599 -12.072 728 HG3 ARG 11 HG1 ARG 11 8.386 -9.140 -11.298 729 HD2 ARG 11 HD2 ARG 11 9.895 -9.074 -13.899 730 HD3 ARG 11 HD1 ARG 11 10.732 -8.781 -12.374 731 HE ARG 11 HE ARG 11 9.169 -11.160 -12.131 732 HH11 ARG 11 HH21 ARG 11 11.907 -9.833 -13.743 733 HH12 ARG 11 HH22 ARG 11 12.772 -11.332 -13.802 734 HH21 ARG 11 HH11 ARG 11 10.283 -13.130 -12.187 735 HH22 ARG 11 HH12 ARG 11 11.852 -13.201 -12.918 736 H ILE 12 HN ILE 12 6.259 -9.739 -15.725 737 HA ILE 12 HA ILE 12 8.446 -10.867 -17.225 738 HB ILE 12 HB ILE 12 5.442 -11.060 -17.610 739 HG12 ILE 12 HG12 ILE 12 7.372 -13.109 -16.494 740 HG13 ILE 12 HG11 ILE 12 6.549 -11.936 -15.467 741 HG21 ILE 12 HG21 ILE 12 6.443 -11.644 -19.712 742 HG22 ILE 12 HG22 ILE 12 6.112 -13.169 -18.891 743 HG23 ILE 12 HG23 ILE 12 7.752 -12.522 -18.920 744 HD11 ILE 12 HD11 ILE 12 5.054 -13.736 -17.383 745 HD12 ILE 12 HD12 ILE 12 4.396 -12.783 -16.051 746 HD13 ILE 12 HD13 ILE 12 5.393 -14.199 -15.715 747 H ARG 13 HN ARG 13 5.840 -8.581 -18.115 748 HA ARG 13 HA ARG 13 6.506 -8.404 -20.884 749 HB2 ARG 13 HB2 ARG 13 5.207 -6.393 -19.028 750 HB3 ARG 13 HB1 ARG 13 5.363 -6.144 -20.767 751 HG2 ARG 13 HG2 ARG 13 4.145 -8.280 -21.151 752 HG3 ARG 13 HG1 ARG 13 3.921 -8.437 -19.409 753 HD2 ARG 13 HD2 ARG 13 2.752 -6.223 -19.409 754 HD3 ARG 13 HD1 ARG 13 2.885 -6.202 -21.167 755 HE ARG 13 HE ARG 13 1.554 -8.554 -19.963 756 HH11 ARG 13 HH21 ARG 13 1.346 -5.533 -21.652 757 HH12 ARG 13 HH22 ARG 13 -0.289 -5.792 -22.152 758 HH21 ARG 13 HH11 ARG 13 -0.571 -8.873 -20.599 759 HH22 ARG 13 HH12 ARG 13 -1.373 -7.672 -21.556 760 H LEU 14 HN LEU 14 7.676 -6.579 -18.082 761 HA LEU 14 HA LEU 14 9.475 -4.977 -19.787 762 HB2 LEU 14 HB2 LEU 14 9.267 -5.164 -16.769 763 HB3 LEU 14 HB1 LEU 14 10.175 -3.950 -17.666 764 HG LEU 14 HG LEU 14 7.178 -4.370 -17.903 765 HD11 LEU 14 HD11 LEU 14 8.547 -2.031 -16.572 766 HD12 LEU 14 HD12 LEU 14 8.117 -3.479 -15.663 767 HD13 LEU 14 HD13 LEU 14 6.862 -2.534 -16.454 768 HD21 LEU 14 HD21 LEU 14 7.843 -3.341 -19.908 769 HD22 LEU 14 HD22 LEU 14 9.159 -2.457 -19.138 770 HD23 LEU 14 HD23 LEU 14 7.491 -1.946 -18.891 771 H SER 15 HN SER 15 9.450 -8.055 -18.530 772 HA SER 15 HA SER 15 11.136 -9.602 -17.913 773 HB2 SER 15 HB2 SER 15 12.516 -8.220 -20.227 774 HB3 SER 15 HB1 SER 15 12.771 -9.875 -19.684 775 HG SER 15 HG SER 15 10.383 -8.758 -20.749 776 H LEU 16 HN LEU 16 11.342 -7.461 -16.185 777 HA LEU 16 HA LEU 16 14.119 -6.459 -16.232 778 HB2 LEU 16 HB2 LEU 16 13.502 -5.194 -14.263 779 HB3 LEU 16 HB1 LEU 16 12.206 -5.061 -15.447 780 HG LEU 16 HG LEU 16 11.412 -7.309 -14.042 781 HD11 LEU 16 HD11 LEU 16 13.178 -7.051 -12.364 782 HD12 LEU 16 HD12 LEU 16 11.611 -6.706 -11.634 783 HD13 LEU 16 HD13 LEU 16 12.687 -5.383 -12.077 784 HD21 LEU 16 HD21 LEU 16 9.863 -5.572 -14.570 785 HD22 LEU 16 HD22 LEU 16 10.752 -4.386 -13.622 786 HD23 LEU 16 HD23 LEU 16 9.871 -5.679 -12.811 787 H THR 17 HN THR 17 15.537 -6.783 -14.291 788 HA THR 17 HA THR 17 15.494 -9.638 -13.517 789 HB THR 17 HB THR 17 17.755 -9.070 -12.541 790 HG1 THR 17 HG1 THR 17 18.496 -6.968 -13.491 791 HG21 THR 17 HG21 THR 17 18.820 -8.782 -14.768 792 HG22 THR 17 HG22 THR 17 17.240 -8.398 -15.450 793 HG23 THR 17 HG23 THR 17 17.549 -10.003 -14.788 794 H ALA 18 HN ALA 18 14.694 -10.293 -11.623 795 HA ALA 18 HA ALA 18 13.657 -8.491 -9.645 796 HB1 ALA 18 HB1 ALA 18 13.551 -10.639 -8.230 797 HB2 ALA 18 HB2 ALA 18 14.202 -11.464 -9.645 798 HB3 ALA 18 HB3 ALA 18 12.645 -10.642 -9.746 799 H LYS 19 HN LYS 19 16.714 -10.230 -9.954 800 HA LYS 19 HA LYS 19 17.700 -9.861 -7.321 801 HB2 LYS 19 HB2 LYS 19 19.145 -9.960 -9.988 802 HB3 LYS 19 HB1 LYS 19 19.942 -10.060 -8.423 803 HG2 LYS 19 HG2 LYS 19 18.716 -12.084 -7.864 804 HG3 LYS 19 HG1 LYS 19 17.768 -11.956 -9.341 805 HD2 LYS 19 HD2 LYS 19 19.391 -13.508 -9.985 806 HD3 LYS 19 HD1 LYS 19 20.136 -12.005 -10.524 807 HE2 LYS 19 HE2 LYS 19 21.894 -13.010 -9.354 808 HE3 LYS 19 HE1 LYS 19 21.188 -11.991 -8.102 809 HZ1 LYS 19 HZ1 LYS 19 19.743 -14.065 -7.647 810 HZ2 LYS 19 HZ2 LYS 19 21.337 -14.015 -7.061 811 HZ3 LYS 19 HZ3 LYS 19 20.973 -14.902 -8.463 812 H SER 20 HN SER 20 17.963 -7.798 -10.213 813 HA SER 20 HA SER 20 19.540 -5.744 -9.008 814 HB2 SER 20 HB2 SER 20 17.491 -5.492 -11.229 815 HB3 SER 20 HB1 SER 20 18.754 -4.323 -10.857 816 HG SER 20 HG SER 20 20.081 -5.517 -11.947 817 H VAL 21 HN VAL 21 16.026 -6.204 -9.228 818 HA VAL 21 HA VAL 21 15.252 -3.711 -8.088 819 HB VAL 21 HB VAL 21 13.924 -6.438 -8.008 820 HG11 VAL 21 HG11 VAL 21 12.952 -3.713 -7.131 821 HG12 VAL 21 HG12 VAL 21 12.947 -5.220 -6.213 822 HG13 VAL 21 HG13 VAL 21 11.840 -5.011 -7.570 823 HG21 VAL 21 HG21 VAL 21 12.473 -5.319 -9.756 824 HG22 VAL 21 HG22 VAL 21 14.142 -5.593 -10.255 825 HG23 VAL 21 HG23 VAL 21 13.625 -3.984 -9.755 826 H ALA 22 HN ALA 22 15.797 -6.869 -6.520 827 HA ALA 22 HA ALA 22 15.290 -5.918 -3.863 828 HB1 ALA 22 HB1 ALA 22 16.849 -8.294 -4.907 829 HB2 ALA 22 HB2 ALA 22 15.215 -8.285 -4.243 830 HB3 ALA 22 HB3 ALA 22 16.598 -7.995 -3.188 831 H GLU 23 HN GLU 23 18.155 -5.921 -5.893 832 HA GLU 23 HA GLU 23 20.045 -5.352 -3.794 833 HB2 GLU 23 HB2 GLU 23 20.576 -6.198 -6.129 834 HB3 GLU 23 HB1 GLU 23 20.285 -4.557 -6.705 835 HG2 GLU 23 HG2 GLU 23 22.014 -3.730 -5.113 836 HG3 GLU 23 HG1 GLU 23 22.346 -5.399 -4.650 837 H GLU 24 HN GLU 24 18.598 -3.196 -6.260 838 HA GLU 24 HA GLU 24 19.662 -0.804 -5.062 839 HB2 GLU 24 HB2 GLU 24 17.247 -1.011 -6.882 840 HB3 GLU 24 HB1 GLU 24 18.289 0.393 -6.644 841 HG2 GLU 24 HG2 GLU 24 19.227 -2.266 -7.763 842 HG3 GLU 24 HG1 GLU 24 18.833 -0.852 -8.737 843 H MET 25 HN MET 25 16.542 -2.473 -4.754 844 HA MET 25 HA MET 25 15.239 -0.423 -3.238 845 HB2 MET 25 HB2 MET 25 14.838 -3.411 -3.407 846 HB3 MET 25 HB1 MET 25 13.851 -2.404 -2.348 847 HG2 MET 25 HG2 MET 25 13.165 -1.036 -4.281 848 HG3 MET 25 HG1 MET 25 14.161 -2.034 -5.341 849 HE1 MET 25 HE1 MET 25 10.196 -3.061 -3.312 850 HE2 MET 25 HE2 MET 25 10.709 -1.482 -3.899 851 HE3 MET 25 HE3 MET 25 11.535 -2.214 -2.527 852 H GLY 26 HN GLY 26 17.315 -3.138 -2.274 853 HA2 GLY 26 HA2 GLY 26 18.744 -3.067 -0.329 854 HA3 GLY 26 HA1 GLY 26 17.734 -1.788 0.344 855 H ILE 27 HN ILE 27 16.267 -4.635 -1.044 856 HA ILE 27 HA ILE 27 15.633 -5.651 1.710 857 HB ILE 27 HB ILE 27 13.416 -6.324 0.844 858 HG12 ILE 27 HG12 ILE 27 14.164 -4.723 -1.618 859 HG13 ILE 27 HG11 ILE 27 14.122 -6.483 -1.568 860 HG21 ILE 27 HG21 ILE 27 13.845 -3.392 0.261 861 HG22 ILE 27 HG22 ILE 27 13.915 -4.039 1.900 862 HG23 ILE 27 HG23 ILE 27 12.425 -4.169 0.963 863 HD11 ILE 27 HD11 ILE 27 12.005 -5.693 -2.454 864 HD12 ILE 27 HD12 ILE 27 11.797 -4.605 -1.081 865 HD13 ILE 27 HD13 ILE 27 11.728 -6.352 -0.840 866 H SER 28 HN SER 28 15.135 -7.974 1.762 867 HA SER 28 HA SER 28 17.072 -9.477 0.210 868 HB2 SER 28 HB2 SER 28 16.538 -11.284 1.613 869 HB3 SER 28 HB1 SER 28 16.231 -9.886 2.640 870 HG SER 28 HG SER 28 14.185 -10.901 1.004 871 H ARG 29 HN ARG 29 16.528 -11.367 -1.073 872 HA ARG 29 HA ARG 29 14.574 -10.817 -3.094 873 HB2 ARG 29 HB2 ARG 29 16.455 -13.051 -2.451 874 HB3 ARG 29 HB1 ARG 29 15.102 -13.453 -3.505 875 HG2 ARG 29 HG2 ARG 29 15.745 -11.848 -5.132 876 HG3 ARG 29 HG1 ARG 29 16.846 -11.040 -4.017 877 HD2 ARG 29 HD2 ARG 29 17.344 -13.933 -4.657 878 HD3 ARG 29 HD1 ARG 29 17.770 -12.712 -5.854 879 HE ARG 29 HE ARG 29 18.764 -12.366 -3.070 880 HH11 ARG 29 HH21 ARG 29 19.357 -13.064 -6.419 881 HH12 ARG 29 HH22 ARG 29 21.059 -12.787 -6.294 882 HH21 ARG 29 HH11 ARG 29 20.976 -12.010 -2.928 883 HH22 ARG 29 HH12 ARG 29 21.972 -12.196 -4.333 884 H GLN 30 HN GLN 30 14.518 -12.794 -0.178 885 HA GLN 30 HA GLN 30 12.215 -14.340 -0.643 886 HB2 GLN 30 HB2 GLN 30 13.009 -12.963 1.948 887 HB3 GLN 30 HB1 GLN 30 11.908 -14.334 1.809 888 HG2 GLN 30 HG2 GLN 30 14.806 -14.349 0.920 889 HG3 GLN 30 HG1 GLN 30 14.218 -15.034 2.436 890 HE21 GLN 30 HE21 GLN 30 15.194 -16.062 -0.494 891 HE22 GLN 30 HE22 GLN 30 14.157 -17.385 -0.728 892 H GLN 31 HN GLN 31 12.430 -11.008 0.622 893 HA GLN 31 HA GLN 31 9.569 -10.674 0.808 894 HB2 GLN 31 HB2 GLN 31 11.832 -8.664 0.665 895 HB3 GLN 31 HB1 GLN 31 10.146 -8.216 0.924 896 HG2 GLN 31 HG2 GLN 31 10.087 -9.680 2.927 897 HG3 GLN 31 HG1 GLN 31 11.794 -10.052 2.683 898 HE21 GLN 31 HE21 GLN 31 12.885 -8.897 4.301 899 HE22 GLN 31 HE22 GLN 31 12.653 -7.247 4.624 900 H LEU 32 HN LEU 32 11.965 -9.856 -1.692 901 HA LEU 32 HA LEU 32 10.178 -8.447 -3.415 902 HB2 LEU 32 HB2 LEU 32 12.636 -8.417 -3.699 903 HB3 LEU 32 HB1 LEU 32 12.606 -10.126 -4.126 904 HG LEU 32 HG LEU 32 11.235 -9.631 -6.102 905 HD11 LEU 32 HD11 LEU 32 9.913 -7.765 -5.626 906 HD12 LEU 32 HD12 LEU 32 11.151 -7.045 -6.650 907 HD13 LEU 32 HD13 LEU 32 11.248 -6.872 -4.899 908 HD21 LEU 32 HD21 LEU 32 12.958 -8.512 -7.394 909 HD22 LEU 32 HD22 LEU 32 13.744 -9.511 -6.172 910 HD23 LEU 32 HD23 LEU 32 13.619 -7.767 -5.939 911 H CYS 33 HN CYS 33 11.101 -11.883 -3.293 912 HA CYS 33 HA CYS 33 9.430 -12.677 -5.496 913 HB2 CYS 33 HB2 CYS 33 10.530 -14.268 -3.160 914 HB3 CYS 33 HB1 CYS 33 9.715 -14.982 -4.552 915 HG CYS 33 HG CYS 33 11.656 -13.840 -6.044 916 H ASN 34 HN ASN 34 8.897 -12.341 -2.032 917 HA ASN 34 HA ASN 34 6.396 -13.692 -1.862 918 HB2 ASN 34 HB2 ASN 34 7.883 -12.749 0.031 919 HB3 ASN 34 HB1 ASN 34 7.077 -11.211 -0.274 920 HD21 ASN 34 HD21 ASN 34 6.661 -14.442 1.036 921 HD22 ASN 34 HD22 ASN 34 5.094 -14.204 1.643 922 H ILE 35 HN ILE 35 7.225 -10.358 -2.717 923 HA ILE 35 HA ILE 35 4.555 -9.350 -2.906 924 HB ILE 35 HB ILE 35 7.101 -8.547 -4.347 925 HG12 ILE 35 HG12 ILE 35 5.644 -7.199 -2.057 926 HG13 ILE 35 HG11 ILE 35 6.956 -8.352 -1.814 927 HG21 ILE 35 HG21 ILE 35 4.353 -7.279 -4.265 928 HG22 ILE 35 HG22 ILE 35 5.307 -7.708 -5.685 929 HG23 ILE 35 HG23 ILE 35 5.805 -6.360 -4.663 930 HD11 ILE 35 HD11 ILE 35 7.110 -5.727 -3.320 931 HD12 ILE 35 HD12 ILE 35 8.410 -6.917 -3.268 932 HD13 ILE 35 HD13 ILE 35 7.892 -6.112 -1.786 933 H GLU 36 HN GLU 36 6.691 -10.888 -5.312 934 HA GLU 36 HA GLU 36 5.004 -10.583 -7.570 935 HB2 GLU 36 HB2 GLU 36 6.896 -12.853 -6.892 936 HB3 GLU 36 HB1 GLU 36 6.174 -12.592 -8.479 937 HG2 GLU 36 HG2 GLU 36 7.197 -10.293 -8.485 938 HG3 GLU 36 HG1 GLU 36 8.047 -10.729 -7.001 939 H GLN 37 HN GLN 37 5.082 -13.178 -5.127 940 HA GLN 37 HA GLN 37 2.639 -14.377 -6.338 941 HB2 GLN 37 HB2 GLN 37 3.037 -16.229 -4.776 942 HB3 GLN 37 HB1 GLN 37 4.505 -15.880 -5.689 943 HG2 GLN 37 HG2 GLN 37 5.269 -14.444 -3.767 944 HG3 GLN 37 HG1 GLN 37 3.881 -15.019 -2.850 945 HE21 GLN 37 HE21 GLN 37 5.699 -15.914 -1.395 946 HE22 GLN 37 HE22 GLN 37 6.331 -17.440 -1.786 947 H SER 38 HN SER 38 2.498 -11.777 -5.032 948 HA SER 38 HA SER 38 1.463 -12.077 -2.355 949 HB2 SER 38 HB2 SER 38 0.515 -9.747 -2.829 950 HB3 SER 38 HB1 SER 38 2.263 -9.916 -2.955 951 HG SER 38 HG SER 38 0.577 -10.291 -5.189 952 H GLU 39 HN GLU 39 -0.572 -12.557 -1.688 953 HA GLU 39 HA GLU 39 -2.578 -13.282 -3.751 954 HB2 GLU 39 HB2 GLU 39 -2.252 -13.826 -0.800 955 HB3 GLU 39 HB1 GLU 39 -3.830 -14.034 -1.559 956 HG2 GLU 39 HG2 GLU 39 -2.450 -16.135 -1.508 957 HG3 GLU 39 HG1 GLU 39 -2.938 -15.642 -3.129 958 H THR 40 HN THR 40 -2.923 -11.722 -0.558 959 HA THR 40 HA THR 40 -4.940 -9.862 -1.755 960 HB THR 40 HB THR 40 -5.772 -11.210 0.119 961 HG1 THR 40 HG1 THR 40 -5.289 -8.677 1.223 962 HG21 THR 40 HG21 THR 40 -4.754 -11.185 2.290 963 HG22 THR 40 HG22 THR 40 -3.635 -9.907 1.818 964 HG23 THR 40 HG23 THR 40 -3.465 -11.524 1.136 965 H ALA 41 HN ALA 41 -4.471 -7.724 -1.870 966 HA ALA 41 HA ALA 41 -1.830 -6.821 -0.941 967 HB1 ALA 41 HB1 ALA 41 -4.011 -5.590 -2.634 968 HB2 ALA 41 HB2 ALA 41 -2.387 -6.068 -3.127 969 HB3 ALA 41 HB3 ALA 41 -2.616 -4.652 -2.101 970 HA PRO 42 HA PRO 42 -3.353 -4.882 2.763 971 HB2 PRO 42 HB2 PRO 42 -1.596 -2.767 3.005 972 HB3 PRO 42 HB1 PRO 42 -1.172 -4.448 3.376 973 HG2 PRO 42 HG2 PRO 42 -0.593 -2.859 0.914 974 HG3 PRO 42 HG1 PRO 42 0.435 -4.011 1.779 975 HD2 PRO 42 HD2 PRO 42 -0.901 -4.664 -0.511 976 HD3 PRO 42 HD1 PRO 42 -0.547 -5.852 0.762 977 H VAL 43 HN VAL 43 -4.507 -3.037 3.558 978 HA VAL 43 HA VAL 43 -6.118 -1.658 1.633 979 HB VAL 43 HB VAL 43 -6.876 -0.308 3.616 980 HG11 VAL 43 HG11 VAL 43 -7.793 -2.269 4.856 981 HG12 VAL 43 HG12 VAL 43 -6.694 -3.315 3.957 982 HG13 VAL 43 HG13 VAL 43 -7.962 -2.430 3.108 983 HG21 VAL 43 HG21 VAL 43 -4.744 -0.229 4.826 984 HG22 VAL 43 HG22 VAL 43 -4.764 -1.982 5.015 985 HG23 VAL 43 HG23 VAL 43 -5.971 -0.993 5.838 986 H VAL 44 HN VAL 44 -3.127 -0.789 3.259 987 HA VAL 44 HA VAL 44 -3.050 1.983 3.007 988 HB VAL 44 HB VAL 44 -1.224 0.589 3.955 989 HG11 VAL 44 HG11 VAL 44 0.017 0.102 1.287 990 HG12 VAL 44 HG12 VAL 44 -1.405 -0.872 1.643 991 HG13 VAL 44 HG13 VAL 44 -0.016 -0.927 2.718 992 HG21 VAL 44 HG21 VAL 44 0.609 1.988 3.209 993 HG22 VAL 44 HG22 VAL 44 -0.854 2.974 3.203 994 HG23 VAL 44 HG23 VAL 44 -0.213 2.338 1.688 995 H VAL 45 HN VAL 45 -2.691 -0.443 0.457 996 HA VAL 45 HA VAL 45 -1.890 1.367 -1.630 997 HB VAL 45 HB VAL 45 -3.393 -1.270 -1.775 998 HG11 VAL 45 HG11 VAL 45 -1.973 0.366 -3.896 999 HG12 VAL 45 HG12 VAL 45 -3.688 -0.043 -3.850 1000 HG13 VAL 45 HG13 VAL 45 -2.488 -1.306 -4.121 1001 HG21 VAL 45 HG21 VAL 45 -0.462 -0.724 -2.288 1002 HG22 VAL 45 HG22 VAL 45 -1.250 -2.285 -2.062 1003 HG23 VAL 45 HG23 VAL 45 -1.067 -1.184 -0.697 1004 H LYS 46 HN LYS 46 -5.051 0.082 -0.627 1005 HA LYS 46 HA LYS 46 -6.613 1.536 -2.542 1006 HB2 LYS 46 HB2 LYS 46 -7.317 0.444 0.199 1007 HB3 LYS 46 HB1 LYS 46 -8.499 1.111 -0.927 1008 HG2 LYS 46 HG2 LYS 46 -7.860 -0.569 -2.609 1009 HG3 LYS 46 HG1 LYS 46 -6.665 -1.235 -1.494 1010 HD2 LYS 46 HD2 LYS 46 -8.428 -1.809 0.103 1011 HD3 LYS 46 HD1 LYS 46 -9.642 -1.072 -0.943 1012 HE2 LYS 46 HE2 LYS 46 -9.778 -3.381 -1.433 1013 HE3 LYS 46 HE1 LYS 46 -8.815 -2.717 -2.752 1014 HZ1 LYS 46 HZ1 LYS 46 -6.822 -3.428 -1.675 1015 HZ2 LYS 46 HZ2 LYS 46 -7.876 -4.758 -1.759 1016 HZ3 LYS 46 HZ3 LYS 46 -7.672 -3.924 -0.294 1017 H TYR 47 HN TYR 47 -5.434 2.284 0.691 1018 HA TYR 47 HA TYR 47 -6.929 4.639 1.165 1019 HB2 TYR 47 HB2 TYR 47 -5.197 3.309 2.671 1020 HB3 TYR 47 HB1 TYR 47 -4.037 4.462 2.015 1021 HD1 TYR 47 HD2 TYR 47 -7.497 4.400 3.435 1022 HD2 TYR 47 HD1 TYR 47 -3.751 6.483 3.185 1023 HE1 TYR 47 HE2 TYR 47 -8.338 6.095 5.022 1024 HE2 TYR 47 HE1 TYR 47 -4.594 8.186 4.781 1025 HH TYR 47 HH TYR 47 -7.605 8.760 5.424 1026 H ILE 48 HN ILE 48 -3.869 4.158 -0.574 1027 HA ILE 48 HA ILE 48 -3.353 6.918 -1.119 1028 HB ILE 48 HB ILE 48 -2.637 4.415 -2.680 1029 HG12 ILE 48 HG12 ILE 48 -0.931 6.166 -0.889 1030 HG13 ILE 48 HG11 ILE 48 -1.760 4.718 -0.317 1031 HG21 ILE 48 HG21 ILE 48 -2.464 6.214 -4.238 1032 HG22 ILE 48 HG22 ILE 48 -0.829 5.981 -3.621 1033 HG23 ILE 48 HG23 ILE 48 -1.819 7.309 -3.016 1034 HD11 ILE 48 HD11 ILE 48 0.327 4.853 -2.509 1035 HD12 ILE 48 HD12 ILE 48 -0.580 3.401 -2.085 1036 HD13 ILE 48 HD13 ILE 48 0.521 4.127 -0.914 1037 H ALA 49 HN ALA 49 -5.182 4.429 -2.892 1038 HA ALA 49 HA ALA 49 -5.849 6.011 -5.163 1039 HB1 ALA 49 HB1 ALA 49 -6.269 3.497 -4.786 1040 HB2 ALA 49 HB2 ALA 49 -7.531 4.398 -5.628 1041 HB3 ALA 49 HB3 ALA 49 -7.724 3.989 -3.923 1042 H PHE 50 HN PHE 50 -7.356 5.772 -1.959 1043 HA PHE 50 HA PHE 50 -9.700 7.295 -2.527 1044 HB2 PHE 50 HB2 PHE 50 -8.992 5.989 -0.363 1045 HB3 PHE 50 HB1 PHE 50 -8.227 7.504 0.108 1046 HD1 PHE 50 HD2 PHE 50 -11.454 5.961 -0.911 1047 HD2 PHE 50 HD1 PHE 50 -9.526 9.334 0.919 1048 HE1 PHE 50 HE2 PHE 50 -13.658 6.818 -0.169 1049 HE2 PHE 50 HE1 PHE 50 -11.731 10.189 1.663 1050 HZ PHE 50 HZ PHE 50 -13.792 8.932 1.115 1051 H LEU 51 HN LEU 51 -6.494 8.296 -1.344 1052 HA LEU 51 HA LEU 51 -7.046 11.126 -1.383 1053 HB2 LEU 51 HB2 LEU 51 -4.415 9.625 -1.596 1054 HB3 LEU 51 HB1 LEU 51 -4.566 11.355 -1.299 1055 HG LEU 51 HG LEU 51 -5.702 9.177 0.479 1056 HD11 LEU 51 HD11 LEU 51 -3.917 9.977 2.061 1057 HD12 LEU 51 HD12 LEU 51 -3.253 10.944 0.744 1058 HD13 LEU 51 HD13 LEU 51 -3.285 9.185 0.617 1059 HD21 LEU 51 HD21 LEU 51 -5.826 12.185 0.506 1060 HD22 LEU 51 HD22 LEU 51 -5.755 11.331 2.047 1061 HD23 LEU 51 HD23 LEU 51 -7.073 11.013 0.925 1062 H ARG 52 HN ARG 52 -5.738 8.842 -3.734 1063 HA ARG 52 HA ARG 52 -4.850 10.637 -5.719 1064 HB2 ARG 52 HB2 ARG 52 -4.700 8.053 -5.679 1065 HB3 ARG 52 HB1 ARG 52 -6.326 8.069 -6.358 1066 HG2 ARG 52 HG2 ARG 52 -5.025 8.015 -8.301 1067 HG3 ARG 52 HG1 ARG 52 -5.282 9.748 -8.109 1068 HD2 ARG 52 HD2 ARG 52 -3.044 9.508 -6.622 1069 HD3 ARG 52 HD1 ARG 52 -2.789 8.146 -7.709 1070 HE ARG 52 HE ARG 52 -3.350 10.036 -9.520 1071 HH11 ARG 52 HH21 ARG 52 -1.460 10.232 -6.619 1072 HH12 ARG 52 HH22 ARG 52 -0.435 11.485 -7.228 1073 HH21 ARG 52 HH11 ARG 52 -2.004 11.663 -10.307 1074 HH22 ARG 52 HH12 ARG 52 -0.738 12.290 -9.306 1075 H SER 53 HN SER 53 -8.103 9.362 -5.109 1076 HA SER 53 HA SER 53 -9.414 10.517 -7.342 1077 HB2 SER 53 HB2 SER 53 -11.469 10.265 -6.065 1078 HB3 SER 53 HB1 SER 53 -10.440 8.868 -5.763 1079 HG SER 53 HG SER 53 -11.416 10.640 -4.023 1080 H LYS 54 HN LYS 54 -8.370 11.929 -4.300 1081 HA LYS 54 HA LYS 54 -9.834 14.436 -4.791 1082 HB2 LYS 54 HB2 LYS 54 -7.791 13.639 -2.702 1083 HB3 LYS 54 HB1 LYS 54 -8.586 15.211 -2.751 1084 HG2 LYS 54 HG2 LYS 54 -10.775 14.126 -2.527 1085 HG3 LYS 54 HG1 LYS 54 -10.003 12.539 -2.526 1086 HD2 LYS 54 HD2 LYS 54 -8.777 13.112 -0.477 1087 HD3 LYS 54 HD1 LYS 54 -9.491 14.725 -0.486 1088 HE2 LYS 54 HE2 LYS 54 -10.837 13.502 1.029 1089 HE3 LYS 54 HE1 LYS 54 -11.772 13.513 -0.466 1090 HZ1 LYS 54 HZ1 LYS 54 -11.823 11.310 -0.101 1091 HZ2 LYS 54 HZ2 LYS 54 -10.428 11.314 0.869 1092 HZ3 LYS 54 HZ3 LYS 54 -10.290 11.338 -0.825 1093 H GLY 55 HN GLY 55 -7.064 13.056 -6.022 1094 HA2 GLY 55 HA2 GLY 55 -5.466 14.002 -7.476 1095 HA3 GLY 55 HA1 GLY 55 -6.231 15.569 -7.219 1096 H VAL 56 HN VAL 56 -5.061 13.611 -4.523 1097 HA VAL 56 HA VAL 56 -3.498 15.785 -3.495 1098 HB VAL 56 HB VAL 56 -3.350 12.830 -2.821 1099 HG11 VAL 56 HG11 VAL 56 -2.523 15.193 -1.110 1100 HG12 VAL 56 HG12 VAL 56 -1.369 14.290 -2.084 1101 HG13 VAL 56 HG13 VAL 56 -2.242 13.488 -0.783 1102 HG21 VAL 56 HG21 VAL 56 -4.719 13.775 -0.800 1103 HG22 VAL 56 HG22 VAL 56 -5.538 13.472 -2.325 1104 HG23 VAL 56 HG23 VAL 56 -5.075 15.112 -1.891 1105 H ASP 57 HN ASP 57 -1.330 16.237 -3.650 1106 HA ASP 57 HA ASP 57 0.043 15.449 -6.037 1107 HB2 ASP 57 HB2 ASP 57 1.386 16.700 -3.645 1108 HB3 ASP 57 HB1 ASP 57 1.726 16.954 -5.360 1109 H LEU 58 HN LEU 58 -0.372 12.988 -4.994 1110 HA LEU 58 HA LEU 58 1.726 12.024 -3.267 1111 HB2 LEU 58 HB2 LEU 58 -0.280 10.745 -5.095 1112 HB3 LEU 58 HB1 LEU 58 1.084 9.765 -4.571 1113 HG LEU 58 HG LEU 58 -0.965 9.611 -3.090 1114 HD11 LEU 58 HD11 LEU 58 1.682 9.529 -2.381 1115 HD12 LEU 58 HD12 LEU 58 0.363 9.184 -1.276 1116 HD13 LEU 58 HD13 LEU 58 1.099 10.782 -1.293 1117 HD21 LEU 58 HD21 LEU 58 -0.207 12.292 -1.964 1118 HD22 LEU 58 HD22 LEU 58 -1.745 11.434 -1.871 1119 HD23 LEU 58 HD23 LEU 58 -1.266 12.227 -3.370 1120 H ASN 59 HN ASN 59 1.417 12.298 -6.782 1121 HA ASN 59 HA ASN 59 3.684 10.852 -7.587 1122 HB2 ASN 59 HB2 ASN 59 3.739 12.388 -9.550 1123 HB3 ASN 59 HB1 ASN 59 2.101 11.839 -9.185 1124 HD21 ASN 59 HD21 ASN 59 0.758 13.386 -7.806 1125 HD22 ASN 59 HD22 ASN 59 1.017 15.053 -7.993 1126 H ALA 60 HN ALA 60 3.486 14.246 -6.511 1127 HA ALA 60 HA ALA 60 6.311 14.749 -6.803 1128 HB1 ALA 60 HB1 ALA 60 4.740 16.612 -6.688 1129 HB2 ALA 60 HB2 ALA 60 5.864 16.720 -5.332 1130 HB3 ALA 60 HB3 ALA 60 4.227 16.117 -5.076 1131 H LEU 61 HN LEU 61 4.301 13.554 -4.147 1132 HA LEU 61 HA LEU 61 6.240 13.707 -2.068 1133 HB2 LEU 61 HB2 LEU 61 3.862 13.212 -1.660 1134 HB3 LEU 61 HB1 LEU 61 4.025 11.675 -2.504 1135 HG LEU 61 HG LEU 61 5.613 10.880 -0.813 1136 HD11 LEU 61 HD11 LEU 61 5.367 13.718 0.158 1137 HD12 LEU 61 HD12 LEU 61 6.808 12.719 -0.014 1138 HD13 LEU 61 HD13 LEU 61 5.698 12.439 1.328 1139 HD21 LEU 61 HD21 LEU 61 4.001 11.052 1.205 1140 HD22 LEU 61 HD22 LEU 61 3.369 10.343 -0.279 1141 HD23 LEU 61 HD23 LEU 61 2.974 12.010 0.140 1142 H PHE 62 HN PHE 62 5.488 11.044 -4.322 1143 HA PHE 62 HA PHE 62 7.585 9.321 -3.335 1144 HB2 PHE 62 HB2 PHE 62 5.837 9.394 -5.779 1145 HB3 PHE 62 HB1 PHE 62 7.224 8.307 -5.766 1146 HD1 PHE 62 HD2 PHE 62 4.221 9.278 -3.735 1147 HD2 PHE 62 HD1 PHE 62 7.075 6.219 -4.709 1148 HE1 PHE 62 HE2 PHE 62 2.944 7.637 -2.377 1149 HE2 PHE 62 HE1 PHE 62 5.795 4.594 -3.357 1150 HZ PHE 62 HZ PHE 62 3.723 5.307 -2.189 1151 H ASP 63 HN ASP 63 7.385 11.559 -6.104 1152 HA ASP 63 HA ASP 63 9.910 11.042 -7.229 1153 HB2 ASP 63 HB2 ASP 63 8.370 13.644 -7.026 1154 HB3 ASP 63 HB1 ASP 63 9.802 13.427 -8.035 1155 H ARG 64 HN ARG 64 9.085 12.856 -4.340 1156 HA ARG 64 HA ARG 64 11.761 13.970 -4.027 1157 HB2 ARG 64 HB2 ARG 64 10.080 15.258 -2.974 1158 HB3 ARG 64 HB1 ARG 64 9.267 13.840 -2.330 1159 HG2 ARG 64 HG2 ARG 64 10.370 15.054 -0.526 1160 HG3 ARG 64 HG1 ARG 64 11.170 13.508 -0.738 1161 HD2 ARG 64 HD2 ARG 64 12.881 15.187 -0.499 1162 HD3 ARG 64 HD1 ARG 64 12.874 14.701 -2.189 1163 HE ARG 64 HE ARG 64 11.121 16.915 -1.921 1164 HH11 ARG 64 HH21 ARG 64 14.449 16.063 -1.619 1165 HH12 ARG 64 HH22 ARG 64 15.027 17.639 -2.047 1166 HH21 ARG 64 HH11 ARG 64 11.852 18.971 -2.472 1167 HH22 ARG 64 HH12 ARG 64 13.553 19.289 -2.531 1168 H ILE 65 HN ILE 65 10.164 11.001 -3.351 1169 HA ILE 65 HA ILE 65 12.239 10.119 -1.413 1170 HB ILE 65 HB ILE 65 9.706 8.794 -2.425 1171 HG12 ILE 65 HG12 ILE 65 10.383 9.894 0.317 1172 HG13 ILE 65 HG11 ILE 65 9.507 10.814 -0.905 1173 HG21 ILE 65 HG21 ILE 65 10.201 7.253 -0.428 1174 HG22 ILE 65 HG22 ILE 65 11.837 7.909 -0.469 1175 HG23 ILE 65 HG23 ILE 65 11.205 7.030 -1.860 1176 HD11 ILE 65 HD11 ILE 65 8.652 8.196 0.358 1177 HD12 ILE 65 HD12 ILE 65 7.825 8.947 -1.007 1178 HD13 ILE 65 HD13 ILE 65 7.881 9.771 0.552 1179 H ILE 66 HN ILE 66 11.246 9.701 -4.750 1180 HA ILE 66 HA ILE 66 12.645 7.262 -5.301 1181 HB ILE 66 HB ILE 66 11.925 9.604 -7.087 1182 HG12 ILE 66 HG12 ILE 66 10.744 6.815 -6.950 1183 HG13 ILE 66 HG11 ILE 66 10.092 8.174 -6.045 1184 HG21 ILE 66 HG21 ILE 66 13.744 8.551 -8.199 1185 HG22 ILE 66 HG22 ILE 66 12.300 7.853 -8.931 1186 HG23 ILE 66 HG23 ILE 66 13.206 6.941 -7.723 1187 HD11 ILE 66 HD11 ILE 66 10.480 8.875 -8.861 1188 HD12 ILE 66 HD12 ILE 66 9.026 8.975 -7.870 1189 HD13 ILE 66 HD13 ILE 66 9.437 7.464 -8.672 1190 H VAL 67 HN VAL 67 13.668 10.669 -5.514 1191 HA VAL 67 HA VAL 67 16.336 9.993 -6.445 1192 HB VAL 67 HB VAL 67 15.520 12.581 -5.099 1193 HG11 VAL 67 HG11 VAL 67 17.313 13.536 -6.298 1194 HG12 VAL 67 HG12 VAL 67 17.368 12.214 -7.462 1195 HG13 VAL 67 HG13 VAL 67 17.963 11.969 -5.823 1196 HG21 VAL 67 HG21 VAL 67 15.110 11.751 -7.993 1197 HG22 VAL 67 HG22 VAL 67 14.803 13.358 -7.336 1198 HG23 VAL 67 HG23 VAL 67 13.824 11.990 -6.810 1199 H ASN 68 HN ASN 68 16.994 12.188 -4.128 1200 HA ASN 68 HA ASN 68 17.125 10.580 -1.743 1201 HB2 ASN 68 HB2 ASN 68 19.613 10.292 -1.715 1202 HB3 ASN 68 HB1 ASN 68 18.818 9.325 -2.955 1203 HD21 ASN 68 HD21 ASN 68 18.941 12.731 -3.643 1204 HD22 ASN 68 HD22 ASN 68 20.219 12.670 -4.752 1205 H LYS 69 HN LYS 69 19.309 11.669 -0.500 1206 HA LYS 69 HA LYS 69 18.469 14.485 -0.241 1207 HB2 LYS 69 HB2 LYS 69 20.569 12.930 1.297 1208 HB3 LYS 69 HB1 LYS 69 19.870 14.482 1.755 1209 HG2 LYS 69 HG2 LYS 69 18.287 11.913 1.442 1210 HG3 LYS 69 HG1 LYS 69 18.848 12.557 2.983 1211 HD2 LYS 69 HD2 LYS 69 17.591 14.712 2.354 1212 HD3 LYS 69 HD1 LYS 69 16.816 13.756 1.092 1213 HE2 LYS 69 HE2 LYS 69 15.955 12.187 2.733 1214 HE3 LYS 69 HE1 LYS 69 16.803 13.033 4.028 1215 HZ1 LYS 69 HZ1 LYS 69 14.890 14.151 4.220 1216 HZ2 LYS 69 HZ2 LYS 69 14.353 13.726 2.665 1217 HZ3 LYS 69 HZ3 LYS 69 15.430 15.024 2.870 1218 H LEU 70 HN LEU 70 19.859 13.715 -2.686 1219 HA LEU 70 HA LEU 70 22.369 15.328 -2.380 1220 HB2 LEU 70 HB2 LEU 70 22.474 12.816 -3.108 1221 HB3 LEU 70 HB1 LEU 70 21.863 13.405 -4.651 1222 HG LEU 70 HG LEU 70 24.340 14.454 -3.262 1223 HD11 LEU 70 HD11 LEU 70 23.981 12.498 -5.546 1224 HD12 LEU 70 HD12 LEU 70 24.765 12.197 -3.994 1225 HD13 LEU 70 HD13 LEU 70 25.515 13.279 -5.167 1226 HD21 LEU 70 HD21 LEU 70 23.611 16.207 -4.641 1227 HD22 LEU 70 HD22 LEU 70 22.937 15.112 -5.849 1228 HD23 LEU 70 HD23 LEU 70 24.684 15.320 -5.723 1229 H GLU 71 HN GLU 71 21.975 17.323 -3.141 1230 HA GLU 71 HA GLU 71 21.125 17.764 -5.857 1231 HB2 GLU 71 HB2 GLU 71 19.205 19.370 -4.923 1232 HB3 GLU 71 HB1 GLU 71 18.879 17.682 -5.284 1233 HG2 GLU 71 HG2 GLU 71 19.874 18.312 -2.527 1234 HG3 GLU 71 HG1 GLU 71 18.224 18.790 -2.912 1235 H HIS 72 HN HIS 72 23.313 18.298 -4.023 1236 HA HIS 72 HA HIS 72 24.764 20.028 -3.430 1237 HB2 HIS 72 HB2 HIS 72 23.224 21.178 -5.757 1238 HB3 HIS 72 HB1 HIS 72 24.381 22.185 -4.890 1239 HD2 HIS 72 HD2 HIS 72 24.718 18.425 -6.203 1240 HE1 HIS 72 HE1 HIS 72 28.159 20.618 -7.289 1241 HE2 HIS 72 HE2 HIS 72 27.052 18.336 -7.363 1242 H HIS 73 HN HIS 73 22.952 19.768 -1.541 1243 HA HIS 73 HA HIS 73 21.245 22.032 -1.058 1244 HB2 HIS 73 HB2 HIS 73 21.229 19.737 0.138 1245 HB3 HIS 73 HB1 HIS 73 22.567 20.361 1.100 1246 HD2 HIS 73 HD2 HIS 73 18.825 21.523 0.339 1247 HE1 HIS 73 HE1 HIS 73 19.928 22.817 4.203 1248 HE2 HIS 73 HE2 HIS 73 18.034 22.712 2.520 1249 H HIS 74 HN HIS 74 24.581 21.237 -0.232 1250 HA HIS 74 HA HIS 74 26.337 22.544 0.590 1251 HB2 HIS 74 HB2 HIS 74 24.738 24.700 -0.825 1252 HB3 HIS 74 HB1 HIS 74 26.407 24.870 -0.281 1253 HD2 HIS 74 HD2 HIS 74 24.988 24.333 -3.567 1254 HE1 HIS 74 HE1 HIS 74 28.082 21.460 -3.493 1255 HE2 HIS 74 HE2 HIS 74 26.473 22.727 -4.988 1256 H HIS 75 HN HIS 75 23.323 22.718 1.840 1257 HA HIS 75 HA HIS 75 22.313 23.898 3.630 1258 HB2 HIS 75 HB2 HIS 75 23.964 22.182 4.580 1259 HB3 HIS 75 HB1 HIS 75 25.060 23.540 4.844 1260 HD2 HIS 75 HD2 HIS 75 22.932 21.754 7.130 1261 HE1 HIS 75 HE1 HIS 75 21.877 25.752 7.990 1262 HE2 HIS 75 HE2 HIS 75 21.750 23.356 8.815 1263 H HIS 76 HN HIS 76 22.276 26.017 2.468 1264 HA HIS 76 HA HIS 76 24.445 27.907 3.140 1265 HB2 HIS 76 HB2 HIS 76 23.692 29.130 1.345 1266 HB3 HIS 76 HB1 HIS 76 22.809 27.663 0.939 1267 HD2 HIS 76 HD2 HIS 76 22.009 30.941 3.076 1268 HE1 HIS 76 HE1 HIS 76 18.448 29.534 1.300 1269 HE2 HIS 76 HE2 HIS 76 19.456 31.354 2.750 1270 H HIS 77 HN HIS 77 24.179 29.699 4.507 1271 HA HIS 77 HA HIS 77 21.634 30.382 5.703 1272 HB2 HIS 77 HB2 HIS 77 22.057 29.691 7.985 1273 HB3 HIS 77 HB1 HIS 77 22.200 28.270 6.950 1274 HD2 HIS 77 HD2 HIS 77 23.959 28.511 9.821 1275 HE1 HIS 77 HE1 HIS 77 27.255 28.911 7.211 1276 HE2 HIS 77 HE2 HIS 77 26.555 28.397 9.595 Start of MODEL 4 1 H1 MET 1 HT1 MET 1 9.995 14.946 11.676 2 H2 MET 1 HT2 MET 1 11.143 14.217 10.657 3 H3 MET 1 HT3 MET 1 10.014 13.260 11.491 4 HA MET 1 HA MET 1 8.214 14.410 10.230 5 HB2 MET 1 HB2 MET 1 10.643 15.386 8.692 6 HB3 MET 1 HB1 MET 1 8.978 15.534 8.133 7 HG2 MET 1 HG2 MET 1 10.037 16.697 10.729 8 HG3 MET 1 HG1 MET 1 9.806 17.615 9.244 9 HE1 MET 1 HE1 MET 1 6.180 17.466 8.462 10 HE2 MET 1 HE2 MET 1 7.853 17.553 7.917 11 HE3 MET 1 HE3 MET 1 7.165 18.886 8.838 12 H GLU 2 HN GLU 2 8.710 11.901 10.562 13 HA GLU 2 HA GLU 2 10.022 10.458 8.469 14 HB2 GLU 2 HB2 GLU 2 8.987 8.506 9.408 15 HB3 GLU 2 HB1 GLU 2 9.353 9.583 10.756 16 HG2 GLU 2 HG2 GLU 2 6.816 10.430 10.077 17 HG3 GLU 2 HG1 GLU 2 6.711 8.716 9.695 18 H LEU 3 HN LEU 3 8.418 8.710 7.279 19 HA LEU 3 HA LEU 3 7.091 10.189 5.227 20 HB2 LEU 3 HB2 LEU 3 7.989 7.944 4.838 21 HB3 LEU 3 HB1 LEU 3 6.868 7.265 6.014 22 HG LEU 3 HG LEU 3 4.961 7.914 4.607 23 HD11 LEU 3 HD11 LEU 3 5.639 8.677 2.191 24 HD12 LEU 3 HD12 LEU 3 7.128 9.221 2.968 25 HD13 LEU 3 HD13 LEU 3 5.575 9.879 3.481 26 HD21 LEU 3 HD21 LEU 3 5.355 6.354 2.775 27 HD22 LEU 3 HD22 LEU 3 6.118 5.735 4.239 28 HD23 LEU 3 HD23 LEU 3 7.100 6.498 2.988 29 H SER 4 HN SER 4 5.817 8.377 8.023 30 HA SER 4 HA SER 4 3.054 8.810 7.401 31 HB2 SER 4 HB2 SER 4 4.142 7.148 9.070 32 HB3 SER 4 HB1 SER 4 4.105 8.488 10.211 33 HG SER 4 HG SER 4 1.824 7.769 8.714 34 H ASN 5 HN ASN 5 5.442 10.795 9.018 35 HA ASN 5 HA ASN 5 3.681 12.554 10.405 36 HB2 ASN 5 HB2 ASN 5 6.096 12.518 10.815 37 HB3 ASN 5 HB1 ASN 5 6.398 13.098 9.177 38 HD21 ASN 5 HD21 ASN 5 5.046 15.253 8.693 39 HD22 ASN 5 HD22 ASN 5 5.089 16.413 9.932 40 H GLU 6 HN GLU 6 5.120 12.836 7.136 41 HA GLU 6 HA GLU 6 3.744 15.290 6.536 42 HB2 GLU 6 HB2 GLU 6 5.741 14.617 5.288 43 HB3 GLU 6 HB1 GLU 6 4.923 13.170 4.707 44 HG2 GLU 6 HG2 GLU 6 4.889 14.865 2.961 45 HG3 GLU 6 HG1 GLU 6 3.248 14.632 3.550 46 H LEU 7 HN LEU 7 2.950 11.896 6.301 47 HA LEU 7 HA LEU 7 0.654 12.105 4.616 48 HB2 LEU 7 HB2 LEU 7 1.904 9.991 5.513 49 HB3 LEU 7 HB1 LEU 7 0.847 10.155 6.914 50 HG LEU 7 HG LEU 7 -1.056 10.335 5.055 51 HD11 LEU 7 HD11 LEU 7 0.560 10.301 3.156 52 HD12 LEU 7 HD12 LEU 7 -0.572 8.951 3.093 53 HD13 LEU 7 HD13 LEU 7 1.078 8.691 3.655 54 HD21 LEU 7 HD21 LEU 7 -1.353 7.881 5.201 55 HD22 LEU 7 HD22 LEU 7 -0.924 8.575 6.765 56 HD23 LEU 7 HD23 LEU 7 0.294 7.726 5.815 57 H LYS 8 HN LYS 8 1.119 12.537 8.095 58 HA LYS 8 HA LYS 8 -1.689 12.841 8.686 59 HB2 LYS 8 HB2 LYS 8 0.256 12.284 10.299 60 HB3 LYS 8 HB1 LYS 8 0.550 14.022 10.324 61 HG2 LYS 8 HG2 LYS 8 -1.702 14.442 11.142 62 HG3 LYS 8 HG1 LYS 8 -2.122 12.740 10.964 63 HD2 LYS 8 HD2 LYS 8 -1.626 13.098 13.290 64 HD3 LYS 8 HD1 LYS 8 -0.280 12.195 12.600 65 HE2 LYS 8 HE2 LYS 8 1.125 14.109 12.551 66 HE3 LYS 8 HE1 LYS 8 -0.233 15.212 12.778 67 HZ1 LYS 8 HZ1 LYS 8 -0.241 14.879 14.979 68 HZ2 LYS 8 HZ2 LYS 8 1.360 14.361 14.744 69 HZ3 LYS 8 HZ3 LYS 8 0.103 13.223 14.850 70 H VAL 9 HN VAL 9 0.899 15.071 7.776 71 HA VAL 9 HA VAL 9 -0.386 17.520 8.431 72 HB VAL 9 HB VAL 9 1.574 16.825 6.227 73 HG11 VAL 9 HG11 VAL 9 0.557 18.860 5.512 74 HG12 VAL 9 HG12 VAL 9 2.044 19.345 6.328 75 HG13 VAL 9 HG13 VAL 9 0.495 19.492 7.158 76 HG21 VAL 9 HG21 VAL 9 1.949 18.172 8.920 77 HG22 VAL 9 HG22 VAL 9 3.223 17.780 7.766 78 HG23 VAL 9 HG23 VAL 9 2.335 16.488 8.572 79 H GLU 10 HN GLU 10 -0.389 15.727 5.333 80 HA GLU 10 HA GLU 10 -2.172 17.570 4.037 81 HB2 GLU 10 HB2 GLU 10 -2.477 15.708 2.375 82 HB3 GLU 10 HB1 GLU 10 -0.793 16.124 2.692 83 HG2 GLU 10 HG2 GLU 10 -0.949 14.243 4.516 84 HG3 GLU 10 HG1 GLU 10 -2.343 13.703 3.592 85 H ARG 11 HN ARG 11 -2.700 14.573 5.861 86 HA ARG 11 HA ARG 11 -5.487 14.301 5.347 87 HB2 ARG 11 HB2 ARG 11 -4.396 12.488 6.411 88 HB3 ARG 11 HB1 ARG 11 -3.661 13.527 7.626 89 HG2 ARG 11 HG2 ARG 11 -5.537 12.134 8.513 90 HG3 ARG 11 HG1 ARG 11 -5.807 13.863 8.709 91 HD2 ARG 11 HD2 ARG 11 -7.288 13.902 6.786 92 HD3 ARG 11 HD1 ARG 11 -6.887 12.237 6.390 93 HE ARG 11 HE ARG 11 -8.531 11.588 7.928 94 HH11 ARG 11 HH21 ARG 11 -7.323 14.742 8.692 95 HH12 ARG 11 HH22 ARG 11 -8.381 14.953 10.045 96 HH21 ARG 11 HH11 ARG 11 -9.938 11.883 9.656 97 HH22 ARG 11 HH12 ARG 11 -9.868 13.345 10.582 98 H ILE 12 HN ILE 12 -3.727 16.027 7.906 99 HA ILE 12 HA ILE 12 -6.052 17.211 9.119 100 HB ILE 12 HB ILE 12 -3.123 17.989 9.152 101 HG12 ILE 12 HG12 ILE 12 -4.858 16.735 11.298 102 HG13 ILE 12 HG11 ILE 12 -3.873 15.791 10.181 103 HG21 ILE 12 HG21 ILE 12 -4.322 19.992 9.660 104 HG22 ILE 12 HG22 ILE 12 -3.862 19.307 11.218 105 HG23 ILE 12 HG23 ILE 12 -5.512 19.118 10.625 106 HD11 ILE 12 HD11 ILE 12 -2.753 16.287 12.393 107 HD12 ILE 12 HD12 ILE 12 -2.756 17.991 11.936 108 HD13 ILE 12 HD13 ILE 12 -1.846 16.822 10.978 109 H ARG 13 HN ARG 13 -3.754 18.312 6.646 110 HA ARG 13 HA ARG 13 -4.567 20.972 6.338 111 HB2 ARG 13 HB2 ARG 13 -2.696 19.767 5.121 112 HB3 ARG 13 HB1 ARG 13 -3.924 19.080 4.066 113 HG2 ARG 13 HG2 ARG 13 -3.803 20.943 2.763 114 HG3 ARG 13 HG1 ARG 13 -4.471 21.869 4.100 115 HD2 ARG 13 HD2 ARG 13 -2.307 22.509 4.874 116 HD3 ARG 13 HD1 ARG 13 -1.507 21.274 3.903 117 HE ARG 13 HE ARG 13 -1.485 22.805 2.145 118 HH11 ARG 13 HH21 ARG 13 -4.025 23.539 4.373 119 HH12 ARG 13 HH22 ARG 13 -4.556 24.940 3.508 120 HH21 ARG 13 HH11 ARG 13 -2.159 24.661 1.023 121 HH22 ARG 13 HH12 ARG 13 -3.497 25.582 1.627 122 H LEU 14 HN LEU 14 -5.976 18.059 4.829 123 HA LEU 14 HA LEU 14 -8.130 19.691 3.642 124 HB2 LEU 14 HB2 LEU 14 -7.581 16.708 3.628 125 HB3 LEU 14 HB1 LEU 14 -8.926 17.473 2.781 126 HG LEU 14 HG LEU 14 -6.002 18.148 2.327 127 HD11 LEU 14 HD11 LEU 14 -6.511 16.973 0.087 128 HD12 LEU 14 HD12 LEU 14 -7.903 16.274 0.913 129 HD13 LEU 14 HD13 LEU 14 -6.272 15.946 1.500 130 HD21 LEU 14 HD21 LEU 14 -8.608 19.137 1.181 131 HD22 LEU 14 HD22 LEU 14 -7.199 19.054 0.123 132 HD23 LEU 14 HD23 LEU 14 -7.145 20.039 1.580 133 H SER 15 HN SER 15 -7.478 18.472 6.642 134 HA SER 15 HA SER 15 -8.803 17.800 8.475 135 HB2 SER 15 HB2 SER 15 -10.606 19.356 8.923 136 HB3 SER 15 HB1 SER 15 -9.298 20.250 8.155 137 HG SER 15 HG SER 15 -10.550 20.614 6.506 138 H LEU 16 HN LEU 16 -9.018 15.861 6.609 139 HA LEU 16 HA LEU 16 -11.807 15.422 5.825 140 HB2 LEU 16 HB2 LEU 16 -9.328 13.698 5.700 141 HB3 LEU 16 HB1 LEU 16 -10.897 13.164 5.111 142 HG LEU 16 HG LEU 16 -9.609 15.740 4.190 143 HD11 LEU 16 HD11 LEU 16 -8.848 14.484 2.199 144 HD12 LEU 16 HD12 LEU 16 -9.435 12.990 2.927 145 HD13 LEU 16 HD13 LEU 16 -8.099 13.868 3.672 146 HD21 LEU 16 HD21 LEU 16 -11.951 14.054 3.296 147 HD22 LEU 16 HD22 LEU 16 -11.120 15.091 2.139 148 HD23 LEU 16 HD23 LEU 16 -11.877 15.795 3.563 149 H THR 17 HN THR 17 -12.734 13.147 6.389 150 HA THR 17 HA THR 17 -12.540 12.803 9.364 151 HB THR 17 HB THR 17 -14.833 11.664 8.969 152 HG1 THR 17 HG1 THR 17 -15.134 13.262 6.753 153 HG21 THR 17 HG21 THR 17 -14.422 14.625 8.483 154 HG22 THR 17 HG22 THR 17 -14.651 13.832 10.042 155 HG23 THR 17 HG23 THR 17 -15.975 13.888 8.878 156 H ALA 18 HN ALA 18 -11.586 10.986 10.034 157 HA ALA 18 HA ALA 18 -10.702 8.905 8.269 158 HB1 ALA 18 HB1 ALA 18 -9.446 9.195 10.254 159 HB2 ALA 18 HB2 ALA 18 -10.329 7.696 10.537 160 HB3 ALA 18 HB3 ALA 18 -10.887 9.201 11.268 161 H LYS 19 HN LYS 19 -13.487 9.255 10.420 162 HA LYS 19 HA LYS 19 -14.450 6.576 10.260 163 HB2 LYS 19 HB2 LYS 19 -15.259 8.312 11.874 164 HB3 LYS 19 HB1 LYS 19 -16.077 9.123 10.537 165 HG2 LYS 19 HG2 LYS 19 -17.429 7.122 10.120 166 HG3 LYS 19 HG1 LYS 19 -16.581 6.262 11.405 167 HD2 LYS 19 HD2 LYS 19 -17.388 7.924 13.047 168 HD3 LYS 19 HD1 LYS 19 -18.254 8.765 11.762 169 HE2 LYS 19 HE2 LYS 19 -19.602 6.753 11.333 170 HE3 LYS 19 HE1 LYS 19 -18.725 5.888 12.593 171 HZ1 LYS 19 HZ1 LYS 19 -19.479 7.688 14.141 172 HZ2 LYS 19 HZ2 LYS 19 -20.710 6.673 13.559 173 HZ3 LYS 19 HZ3 LYS 19 -20.511 8.230 12.910 174 H SER 20 HN SER 20 -15.084 9.439 8.245 175 HA SER 20 HA SER 20 -17.046 8.263 6.551 176 HB2 SER 20 HB2 SER 20 -16.528 10.690 6.611 177 HB3 SER 20 HB1 SER 20 -14.966 10.362 5.867 178 HG SER 20 HG SER 20 -16.696 9.147 4.366 179 H VAL 21 HN VAL 21 -13.494 8.399 6.271 180 HA VAL 21 HA VAL 21 -13.282 7.125 3.738 181 HB VAL 21 HB VAL 21 -11.390 7.067 6.108 182 HG11 VAL 21 HG11 VAL 21 -11.082 6.210 3.228 183 HG12 VAL 21 HG12 VAL 21 -10.710 5.291 4.687 184 HG13 VAL 21 HG13 VAL 21 -9.690 6.653 4.218 185 HG21 VAL 21 HG21 VAL 21 -11.204 8.753 3.606 186 HG22 VAL 21 HG22 VAL 21 -10.342 8.966 5.129 187 HG23 VAL 21 HG23 VAL 21 -12.069 9.310 5.037 188 H ALA 22 HN ALA 22 -13.362 5.761 7.026 189 HA ALA 22 HA ALA 22 -12.936 3.049 6.322 190 HB1 ALA 22 HB1 ALA 22 -14.472 4.361 8.569 191 HB2 ALA 22 HB2 ALA 22 -12.882 3.605 8.633 192 HB3 ALA 22 HB3 ALA 22 -14.324 2.608 8.442 193 H GLU 23 HN GLU 23 -15.895 5.011 6.285 194 HA GLU 23 HA GLU 23 -17.679 2.823 5.825 195 HB2 GLU 23 HB2 GLU 23 -17.906 5.764 5.132 196 HB3 GLU 23 HB1 GLU 23 -19.229 4.610 4.942 197 HG2 GLU 23 HG2 GLU 23 -18.895 4.019 7.409 198 HG3 GLU 23 HG1 GLU 23 -17.838 5.427 7.505 199 H GLU 24 HN GLU 24 -15.926 4.961 3.542 200 HA GLU 24 HA GLU 24 -17.095 3.677 1.207 201 HB2 GLU 24 HB2 GLU 24 -14.435 5.102 1.188 202 HB3 GLU 24 HB1 GLU 24 -15.662 5.034 -0.077 203 HG2 GLU 24 HG2 GLU 24 -15.889 6.488 2.566 204 HG3 GLU 24 HG1 GLU 24 -15.720 7.230 0.980 205 H MET 25 HN MET 25 -14.005 3.379 2.929 206 HA MET 25 HA MET 25 -12.849 1.402 1.216 207 HB2 MET 25 HB2 MET 25 -12.399 2.203 4.091 208 HB3 MET 25 HB1 MET 25 -11.473 0.903 3.342 209 HG2 MET 25 HG2 MET 25 -11.692 3.669 2.134 210 HG3 MET 25 HG1 MET 25 -10.399 3.213 3.241 211 HE1 MET 25 HE1 MET 25 -9.175 1.223 3.132 212 HE2 MET 25 HE2 MET 25 -7.987 1.969 2.068 213 HE3 MET 25 HE3 MET 25 -8.616 0.367 1.690 214 H GLY 26 HN GLY 26 -14.898 1.163 4.113 215 HA2 GLY 26 HA2 GLY 26 -16.391 -0.647 4.580 216 HA3 GLY 26 HA1 GLY 26 -15.589 -1.607 3.336 217 H ILE 27 HN ILE 27 -13.762 0.116 5.795 218 HA ILE 27 HA ILE 27 -13.120 -2.507 7.118 219 HB ILE 27 HB ILE 27 -10.831 -1.657 7.455 220 HG12 ILE 27 HG12 ILE 27 -11.690 0.624 5.649 221 HG13 ILE 27 HG11 ILE 27 -11.409 0.776 7.381 222 HG21 ILE 27 HG21 ILE 27 -11.638 -1.506 4.542 223 HG22 ILE 27 HG22 ILE 27 -11.485 -3.015 5.442 224 HG23 ILE 27 HG23 ILE 27 -10.072 -1.991 5.191 225 HD11 ILE 27 HD11 ILE 27 -9.394 1.465 6.221 226 HD12 ILE 27 HD12 ILE 27 -9.376 -0.029 5.286 227 HD13 ILE 27 HD13 ILE 27 -9.080 -0.073 7.024 228 H SER 28 HN SER 28 -12.245 -2.207 9.341 229 HA SER 28 HA SER 28 -14.053 -0.640 10.915 230 HB2 SER 28 HB2 SER 28 -11.446 -1.984 11.669 231 HB3 SER 28 HB1 SER 28 -12.634 -1.370 12.815 232 HG SER 28 HG SER 28 -12.581 -3.731 11.702 233 H ARG 29 HN ARG 29 -13.609 1.190 12.215 234 HA ARG 29 HA ARG 29 -11.997 3.236 11.053 235 HB2 ARG 29 HB2 ARG 29 -13.948 3.680 12.519 236 HB3 ARG 29 HB1 ARG 29 -13.051 3.035 13.893 237 HG2 ARG 29 HG2 ARG 29 -11.378 4.781 13.689 238 HG3 ARG 29 HG1 ARG 29 -12.124 5.373 12.206 239 HD2 ARG 29 HD2 ARG 29 -14.136 6.015 13.414 240 HD3 ARG 29 HD1 ARG 29 -13.508 5.303 14.902 241 HE ARG 29 HE ARG 29 -11.670 7.271 13.883 242 HH11 ARG 29 HH21 ARG 29 -14.717 6.841 15.444 243 HH12 ARG 29 HH22 ARG 29 -14.631 8.338 16.311 244 HH21 ARG 29 HH11 ARG 29 -11.537 9.220 15.015 245 HH22 ARG 29 HH12 ARG 29 -12.830 9.684 16.069 246 H GLN 30 HN GLN 30 -11.420 1.031 13.784 247 HA GLN 30 HA GLN 30 -8.958 2.134 14.665 248 HB2 GLN 30 HB2 GLN 30 -9.947 -0.731 14.647 249 HB3 GLN 30 HB1 GLN 30 -8.493 -0.201 15.493 250 HG2 GLN 30 HG2 GLN 30 -9.819 1.364 16.839 251 HG3 GLN 30 HG1 GLN 30 -11.280 0.896 15.968 252 HE21 GLN 30 HE21 GLN 30 -9.497 0.234 18.753 253 HE22 GLN 30 HE22 GLN 30 -10.123 -1.306 19.098 254 H GLN 31 HN GLN 31 -9.674 -0.206 12.090 255 HA GLN 31 HA GLN 31 -7.002 -0.907 11.436 256 HB2 GLN 31 HB2 GLN 31 -9.047 -2.014 10.518 257 HB3 GLN 31 HB1 GLN 31 -9.352 -0.577 9.543 258 HG2 GLN 31 HG2 GLN 31 -7.281 -0.882 8.330 259 HG3 GLN 31 HG1 GLN 31 -6.796 -2.197 9.402 260 HE21 GLN 31 HE21 GLN 31 -7.095 -2.551 6.543 261 HE22 GLN 31 HE22 GLN 31 -8.387 -3.622 6.287 262 H LEU 32 HN LEU 32 -9.060 1.745 10.221 263 HA LEU 32 HA LEU 32 -7.089 2.835 8.450 264 HB2 LEU 32 HB2 LEU 32 -9.642 3.358 8.642 265 HB3 LEU 32 HB1 LEU 32 -9.151 4.520 9.872 266 HG LEU 32 HG LEU 32 -7.414 5.304 8.031 267 HD11 LEU 32 HD11 LEU 32 -7.847 3.555 6.393 268 HD12 LEU 32 HD12 LEU 32 -8.418 5.089 5.740 269 HD13 LEU 32 HD13 LEU 32 -9.570 3.929 6.395 270 HD21 LEU 32 HD21 LEU 32 -9.059 6.833 8.792 271 HD22 LEU 32 HD22 LEU 32 -10.377 5.892 8.095 272 HD23 LEU 32 HD23 LEU 32 -9.275 6.782 7.043 273 H CYS 33 HN CYS 33 -7.867 3.473 11.842 274 HA CYS 33 HA CYS 33 -6.054 5.639 12.232 275 HB2 CYS 33 HB2 CYS 33 -7.066 3.541 14.179 276 HB3 CYS 33 HB1 CYS 33 -6.199 5.004 14.650 277 HG CYS 33 HG CYS 33 -8.312 6.265 14.422 278 H ASN 34 HN ASN 34 -5.609 2.150 12.250 279 HA ASN 34 HA ASN 34 -3.011 2.076 13.429 280 HB2 ASN 34 HB2 ASN 34 -4.407 0.063 13.059 281 HB3 ASN 34 HB1 ASN 34 -4.213 0.254 11.316 282 HD21 ASN 34 HD21 ASN 34 -3.062 -1.599 13.750 283 HD22 ASN 34 HD22 ASN 34 -1.471 -1.855 13.217 284 H ILE 35 HN ILE 35 -4.109 2.591 10.098 285 HA ILE 35 HA ILE 35 -1.550 2.505 8.838 286 HB ILE 35 HB ILE 35 -4.065 4.049 8.146 287 HG12 ILE 35 HG12 ILE 35 -2.910 1.526 6.922 288 HG13 ILE 35 HG11 ILE 35 -4.129 1.512 8.198 289 HG21 ILE 35 HG21 ILE 35 -1.480 3.644 6.630 290 HG22 ILE 35 HG22 ILE 35 -2.292 5.164 7.004 291 HG23 ILE 35 HG23 ILE 35 -2.991 4.059 5.821 292 HD11 ILE 35 HD11 ILE 35 -4.391 2.662 5.411 293 HD12 ILE 35 HD12 ILE 35 -5.552 2.993 6.696 294 HD13 ILE 35 HD13 ILE 35 -5.319 1.342 6.121 295 H GLU 36 HN GLU 36 -3.381 5.193 10.284 296 HA GLU 36 HA GLU 36 -1.456 7.229 9.671 297 HB2 GLU 36 HB2 GLU 36 -3.575 7.011 11.825 298 HB3 GLU 36 HB1 GLU 36 -2.614 8.467 11.558 299 HG2 GLU 36 HG2 GLU 36 -3.450 8.694 9.306 300 HG3 GLU 36 HG1 GLU 36 -4.252 7.125 9.390 301 H GLN 37 HN GLN 37 -1.735 4.891 12.283 302 HA GLN 37 HA GLN 37 0.624 6.086 13.669 303 HB2 GLN 37 HB2 GLN 37 -1.313 3.889 14.478 304 HB3 GLN 37 HB1 GLN 37 0.033 4.456 15.469 305 HG2 GLN 37 HG2 GLN 37 -0.920 6.727 15.486 306 HG3 GLN 37 HG1 GLN 37 -2.256 6.180 14.473 307 HE21 GLN 37 HE21 GLN 37 -3.337 7.131 16.640 308 HE22 GLN 37 HE22 GLN 37 -3.679 5.965 17.825 309 H SER 38 HN SER 38 0.062 3.970 11.214 310 HA SER 38 HA SER 38 1.657 1.693 11.931 311 HB2 SER 38 HB2 SER 38 0.154 1.500 10.072 312 HB3 SER 38 HB1 SER 38 0.893 2.875 9.252 313 HG SER 38 HG SER 38 1.997 0.319 9.779 314 H GLU 39 HN GLU 39 3.818 1.203 11.341 315 HA GLU 39 HA GLU 39 5.717 3.285 11.700 316 HB2 GLU 39 HB2 GLU 39 6.008 0.742 12.014 317 HB3 GLU 39 HB1 GLU 39 6.332 0.691 10.281 318 HG2 GLU 39 HG2 GLU 39 8.099 2.506 10.708 319 HG3 GLU 39 HG1 GLU 39 7.883 2.164 12.421 320 H THR 40 HN THR 40 7.218 1.876 9.235 321 HA THR 40 HA THR 40 6.857 4.180 7.466 322 HB THR 40 HB THR 40 8.626 2.928 6.102 323 HG1 THR 40 HG1 THR 40 8.935 0.952 6.688 324 HG21 THR 40 HG21 THR 40 9.390 4.679 7.496 325 HG22 THR 40 HG22 THR 40 10.377 3.293 7.957 326 HG23 THR 40 HG23 THR 40 9.019 3.784 8.969 327 H ALA 41 HN ALA 41 6.684 3.724 5.047 328 HA ALA 41 HA ALA 41 4.215 2.338 4.568 329 HB1 ALA 41 HB1 ALA 41 6.270 3.705 2.846 330 HB2 ALA 41 HB2 ALA 41 4.593 4.162 3.139 331 HB3 ALA 41 HB3 ALA 41 4.963 2.793 2.090 332 HA PRO 42 HA PRO 42 5.720 -1.757 3.711 333 HB2 PRO 42 HB2 PRO 42 3.917 -2.586 1.790 334 HB3 PRO 42 HB1 PRO 42 3.534 -2.470 3.519 335 HG2 PRO 42 HG2 PRO 42 2.908 -0.553 1.316 336 HG3 PRO 42 HG1 PRO 42 1.905 -1.061 2.685 337 HD2 PRO 42 HD2 PRO 42 3.231 1.321 2.649 338 HD3 PRO 42 HD1 PRO 42 2.927 0.423 4.152 339 H VAL 43 HN VAL 43 6.818 -3.056 2.103 340 HA VAL 43 HA VAL 43 8.385 -1.570 0.223 341 HB VAL 43 HB VAL 43 8.959 -3.963 -0.614 342 HG11 VAL 43 HG11 VAL 43 10.355 -2.711 0.992 343 HG12 VAL 43 HG12 VAL 43 10.287 -4.420 1.423 344 HG13 VAL 43 HG13 VAL 43 9.318 -3.246 2.315 345 HG21 VAL 43 HG21 VAL 43 7.543 -4.771 1.931 346 HG22 VAL 43 HG22 VAL 43 8.138 -5.799 0.627 347 HG23 VAL 43 HG23 VAL 43 6.705 -4.801 0.380 348 H VAL 44 HN VAL 44 5.408 -3.454 -0.124 349 HA VAL 44 HA VAL 44 5.297 -3.829 -2.887 350 HB VAL 44 HB VAL 44 3.566 -4.480 -1.130 351 HG11 VAL 44 HG11 VAL 44 3.429 -1.963 -0.408 352 HG12 VAL 44 HG12 VAL 44 1.967 -2.944 -0.388 353 HG13 VAL 44 HG13 VAL 44 2.263 -1.830 -1.722 354 HG21 VAL 44 HG21 VAL 44 1.721 -4.437 -2.730 355 HG22 VAL 44 HG22 VAL 44 3.230 -4.752 -3.587 356 HG23 VAL 44 HG23 VAL 44 2.505 -3.145 -3.642 357 H VAL 45 HN VAL 45 4.735 -0.844 -1.053 358 HA VAL 45 HA VAL 45 3.790 0.737 -3.252 359 HB VAL 45 HB VAL 45 5.198 1.463 -0.665 360 HG11 VAL 45 HG11 VAL 45 4.119 3.228 -2.868 361 HG12 VAL 45 HG12 VAL 45 5.710 3.284 -2.109 362 HG13 VAL 45 HG13 VAL 45 4.284 3.802 -1.208 363 HG21 VAL 45 HG21 VAL 45 2.342 2.038 -1.470 364 HG22 VAL 45 HG22 VAL 45 3.036 1.966 0.150 365 HG23 VAL 45 HG23 VAL 45 2.792 0.482 -0.771 366 H LYS 46 HN LYS 46 7.048 0.179 -1.914 367 HA LYS 46 HA LYS 46 8.422 1.925 -3.711 368 HB2 LYS 46 HB2 LYS 46 9.381 -0.593 -2.314 369 HB3 LYS 46 HB1 LYS 46 10.428 0.584 -3.110 370 HG2 LYS 46 HG2 LYS 46 9.601 2.348 -1.590 371 HG3 LYS 46 HG1 LYS 46 8.574 1.163 -0.780 372 HD2 LYS 46 HD2 LYS 46 10.601 -0.160 -0.204 373 HD3 LYS 46 HD1 LYS 46 11.598 1.092 -0.944 374 HE2 LYS 46 HE2 LYS 46 10.728 2.749 0.640 375 HE3 LYS 46 HE1 LYS 46 9.702 1.517 1.375 376 HZ1 LYS 46 HZ1 LYS 46 11.467 1.318 2.740 377 HZ2 LYS 46 HZ2 LYS 46 12.574 1.919 1.600 378 HZ3 LYS 46 HZ3 LYS 46 12.048 0.306 1.509 379 H TYR 47 HN TYR 47 7.421 -1.462 -3.943 380 HA TYR 47 HA TYR 47 8.854 -2.179 -6.282 381 HB2 TYR 47 HB2 TYR 47 7.367 -3.633 -4.721 382 HB3 TYR 47 HB1 TYR 47 6.023 -3.095 -5.725 383 HD1 TYR 47 HD1 TYR 47 6.308 -3.373 -8.314 384 HD2 TYR 47 HD2 TYR 47 8.659 -5.468 -5.392 385 HE1 TYR 47 HE1 TYR 47 6.899 -5.086 -10.010 386 HE2 TYR 47 HE2 TYR 47 9.251 -7.173 -7.089 387 HH TYR 47 HH TYR 47 9.401 -7.318 -9.567 388 H ILE 48 HN ILE 48 5.704 -0.597 -5.864 389 HA ILE 48 HA ILE 48 5.013 -0.433 -8.631 390 HB ILE 48 HB ILE 48 4.290 1.336 -6.270 391 HG12 ILE 48 HG12 ILE 48 2.652 -0.763 -7.722 392 HG13 ILE 48 HG11 ILE 48 3.591 -1.110 -6.270 393 HG21 ILE 48 HG21 ILE 48 2.346 1.977 -7.800 394 HG22 ILE 48 HG22 ILE 48 3.284 1.274 -9.115 395 HG23 ILE 48 HG23 ILE 48 3.918 2.657 -8.226 396 HD11 ILE 48 HD11 ILE 48 1.306 0.862 -6.535 397 HD12 ILE 48 HD12 ILE 48 2.338 0.746 -5.111 398 HD13 ILE 48 HD13 ILE 48 1.324 -0.621 -5.578 399 H ALA 49 HN ALA 49 6.799 1.777 -6.483 400 HA ALA 49 HA ALA 49 7.175 3.885 -8.351 401 HB1 ALA 49 HB1 ALA 49 8.863 2.916 -6.032 402 HB2 ALA 49 HB2 ALA 49 7.737 4.273 -6.053 403 HB3 ALA 49 HB3 ALA 49 9.249 4.369 -6.954 404 H PHE 50 HN PHE 50 8.928 0.850 -7.860 405 HA PHE 50 HA PHE 50 11.173 1.429 -9.512 406 HB2 PHE 50 HB2 PHE 50 10.685 -0.602 -7.946 407 HB3 PHE 50 HB1 PHE 50 9.899 -1.310 -9.355 408 HD1 PHE 50 HD1 PHE 50 13.083 0.385 -8.345 409 HD2 PHE 50 HD2 PHE 50 11.211 -2.521 -10.895 410 HE1 PHE 50 HE1 PHE 50 15.305 -0.295 -9.205 411 HE2 PHE 50 HE2 PHE 50 13.432 -3.196 -11.757 412 HZ PHE 50 HZ PHE 50 15.481 -2.085 -10.912 413 H LEU 51 HN LEU 51 8.079 -0.180 -10.316 414 HA LEU 51 HA LEU 51 8.643 -0.377 -13.133 415 HB2 LEU 51 HB2 LEU 51 6.145 -0.546 -11.450 416 HB3 LEU 51 HB1 LEU 51 6.033 -0.589 -13.204 417 HG LEU 51 HG LEU 51 6.155 -2.853 -12.026 418 HD11 LEU 51 HD11 LEU 51 7.363 -3.866 -13.764 419 HD12 LEU 51 HD12 LEU 51 8.473 -2.511 -13.927 420 HD13 LEU 51 HD13 LEU 51 6.806 -2.359 -14.482 421 HD21 LEU 51 HD21 LEU 51 8.267 -3.621 -11.193 422 HD22 LEU 51 HD22 LEU 51 7.934 -2.078 -10.403 423 HD23 LEU 51 HD23 LEU 51 9.083 -2.160 -11.739 424 H ARG 52 HN ARG 52 6.906 2.028 -11.175 425 HA ARG 52 HA ARG 52 5.993 3.618 -13.369 426 HB2 ARG 52 HB2 ARG 52 5.291 3.727 -10.890 427 HB3 ARG 52 HB1 ARG 52 6.729 4.721 -10.650 428 HG2 ARG 52 HG2 ARG 52 5.842 6.143 -12.620 429 HG3 ARG 52 HG1 ARG 52 4.314 5.298 -12.369 430 HD2 ARG 52 HD2 ARG 52 5.769 7.151 -10.497 431 HD3 ARG 52 HD1 ARG 52 4.089 7.214 -11.034 432 HE ARG 52 HE ARG 52 4.831 4.847 -9.438 433 HH11 ARG 52 HH21 ARG 52 3.478 8.023 -9.602 434 HH12 ARG 52 HH22 ARG 52 2.623 7.874 -8.105 435 HH21 ARG 52 HH11 ARG 52 3.737 4.652 -7.474 436 HH22 ARG 52 HH12 ARG 52 2.771 5.971 -6.901 437 H SER 53 HN SER 53 8.949 3.755 -11.401 438 HA SER 53 HA SER 53 10.033 6.132 -12.494 439 HB2 SER 53 HB2 SER 53 11.345 3.656 -11.356 440 HB3 SER 53 HB1 SER 53 12.265 5.076 -11.849 441 HG SER 53 HG SER 53 10.518 4.707 -9.716 442 H LYS 54 HN LYS 54 9.643 2.999 -13.887 443 HA LYS 54 HA LYS 54 11.663 3.490 -15.990 444 HB2 LYS 54 HB2 LYS 54 9.730 1.213 -15.471 445 HB3 LYS 54 HB1 LYS 54 10.844 1.263 -16.839 446 HG2 LYS 54 HG2 LYS 54 12.755 1.426 -15.299 447 HG3 LYS 54 HG1 LYS 54 11.657 1.415 -13.920 448 HD2 LYS 54 HD2 LYS 54 10.862 -0.827 -14.558 449 HD3 LYS 54 HD1 LYS 54 11.946 -0.820 -15.951 450 HE2 LYS 54 HE2 LYS 54 13.890 -0.635 -14.453 451 HE3 LYS 54 HE1 LYS 54 12.818 -0.612 -13.052 452 HZ1 LYS 54 HZ1 LYS 54 13.904 -2.829 -14.018 453 HZ2 LYS 54 HZ2 LYS 54 12.459 -2.814 -14.910 454 HZ3 LYS 54 HZ3 LYS 54 12.411 -2.805 -13.213 455 H GLY 55 HN GLY 55 8.834 4.857 -15.445 456 HA2 GLY 55 HA2 GLY 55 7.475 6.101 -16.922 457 HA3 GLY 55 HA1 GLY 55 8.329 5.362 -18.275 458 H VAL 56 HN VAL 56 7.061 3.195 -15.894 459 HA VAL 56 HA VAL 56 5.352 1.921 -17.844 460 HB VAL 56 HB VAL 56 5.541 1.608 -14.837 461 HG11 VAL 56 HG11 VAL 56 3.397 0.774 -15.438 462 HG12 VAL 56 HG12 VAL 56 4.441 -0.647 -15.398 463 HG13 VAL 56 HG13 VAL 56 4.001 0.081 -16.943 464 HG21 VAL 56 HG21 VAL 56 7.537 1.056 -16.414 465 HG22 VAL 56 HG22 VAL 56 6.540 -0.293 -16.963 466 HG23 VAL 56 HG23 VAL 56 7.022 -0.181 -15.272 467 H ASP 57 HN ASP 57 4.735 4.017 -15.035 468 HA ASP 57 HA ASP 57 2.868 5.282 -14.437 469 HB2 ASP 57 HB2 ASP 57 1.974 4.942 -17.308 470 HB3 ASP 57 HB1 ASP 57 1.548 6.233 -16.189 471 H LEU 58 HN LEU 58 1.823 3.894 -13.051 472 HA LEU 58 HA LEU 58 0.045 1.788 -14.131 473 HB2 LEU 58 HB2 LEU 58 0.399 2.522 -11.215 474 HB3 LEU 58 HB1 LEU 58 -0.164 1.001 -11.896 475 HG LEU 58 HG LEU 58 2.244 1.017 -13.071 476 HD11 LEU 58 HD11 LEU 58 3.159 3.069 -12.315 477 HD12 LEU 58 HD12 LEU 58 3.895 1.871 -11.267 478 HD13 LEU 58 HD13 LEU 58 2.551 2.847 -10.677 479 HD21 LEU 58 HD21 LEU 58 1.636 -0.808 -11.683 480 HD22 LEU 58 HD22 LEU 58 1.543 0.206 -10.245 481 HD23 LEU 58 HD23 LEU 58 3.113 -0.178 -10.952 482 H ASN 59 HN ASN 59 -0.132 5.044 -13.571 483 HA ASN 59 HA ASN 59 -2.554 5.439 -12.172 484 HB2 ASN 59 HB2 ASN 59 -1.642 6.968 -14.635 485 HB3 ASN 59 HB1 ASN 59 -2.718 7.554 -13.366 486 HD21 ASN 59 HD21 ASN 59 -1.212 6.512 -11.093 487 HD22 ASN 59 HD22 ASN 59 0.238 7.389 -11.006 488 H ALA 60 HN ALA 60 -1.914 4.610 -15.549 489 HA ALA 60 HA ALA 60 -4.607 4.727 -16.479 490 HB1 ALA 60 HB1 ALA 60 -3.795 3.234 -18.290 491 HB2 ALA 60 HB2 ALA 60 -2.305 2.970 -17.383 492 HB3 ALA 60 HB3 ALA 60 -2.687 4.576 -18.004 493 H LEU 61 HN LEU 61 -2.677 1.938 -15.310 494 HA LEU 61 HA LEU 61 -4.783 0.020 -15.476 495 HB2 LEU 61 HB2 LEU 61 -2.340 0.158 -13.686 496 HB3 LEU 61 HB1 LEU 61 -3.391 -1.251 -13.785 497 HG LEU 61 HG LEU 61 -1.992 -0.013 -16.176 498 HD11 LEU 61 HD11 LEU 61 -0.479 -2.015 -15.986 499 HD12 LEU 61 HD12 LEU 61 -1.208 -2.354 -14.416 500 HD13 LEU 61 HD13 LEU 61 -0.303 -0.861 -14.664 501 HD21 LEU 61 HD21 LEU 61 -2.481 -2.503 -16.971 502 HD22 LEU 61 HD22 LEU 61 -3.737 -1.276 -17.081 503 HD23 LEU 61 HD23 LEU 61 -3.747 -2.427 -15.746 504 H PHE 62 HN PHE 62 -3.740 2.105 -12.798 505 HA PHE 62 HA PHE 62 -5.595 1.081 -10.865 506 HB2 PHE 62 HB2 PHE 62 -3.976 3.607 -11.172 507 HB3 PHE 62 HB1 PHE 62 -5.192 3.513 -9.895 508 HD1 PHE 62 HD2 PHE 62 -2.665 1.133 -11.365 509 HD2 PHE 62 HD1 PHE 62 -4.263 2.969 -7.824 510 HE1 PHE 62 HE2 PHE 62 -1.067 -0.150 -9.980 511 HE2 PHE 62 HE1 PHE 62 -2.663 1.684 -6.444 512 HZ PHE 62 HZ PHE 62 -1.062 0.127 -7.518 513 H ASP 63 HN ASP 63 -5.818 3.605 -13.324 514 HA ASP 63 HA ASP 63 -8.289 4.735 -12.475 515 HB2 ASP 63 HB2 ASP 63 -6.828 4.564 -15.105 516 HB3 ASP 63 HB1 ASP 63 -8.465 5.219 -15.064 517 H ARG 64 HN ARG 64 -7.510 1.822 -14.312 518 HA ARG 64 HA ARG 64 -10.077 1.286 -15.405 519 HB2 ARG 64 HB2 ARG 64 -8.082 -0.732 -14.319 520 HB3 ARG 64 HB1 ARG 64 -9.363 -1.056 -15.489 521 HG2 ARG 64 HG2 ARG 64 -8.314 0.608 -17.033 522 HG3 ARG 64 HG1 ARG 64 -7.000 0.783 -15.878 523 HD2 ARG 64 HD2 ARG 64 -6.311 -0.803 -17.576 524 HD3 ARG 64 HD1 ARG 64 -6.569 -1.675 -16.062 525 HE ARG 64 HE ARG 64 -9.019 -1.710 -17.471 526 HH11 ARG 64 HH21 ARG 64 -5.762 -2.810 -17.793 527 HH12 ARG 64 HH22 ARG 64 -6.195 -4.223 -18.696 528 HH21 ARG 64 HH11 ARG 64 -9.598 -3.538 -18.635 529 HH22 ARG 64 HH12 ARG 64 -8.371 -4.636 -19.173 530 H ILE 65 HN ILE 65 -8.683 0.247 -12.280 531 HA ILE 65 HA ILE 65 -11.089 -1.027 -11.353 532 HB ILE 65 HB ILE 65 -8.686 0.083 -9.878 533 HG12 ILE 65 HG12 ILE 65 -9.483 -2.787 -10.437 534 HG13 ILE 65 HG11 ILE 65 -8.424 -1.864 -11.504 535 HG21 ILE 65 HG21 ILE 65 -9.540 -1.478 -8.038 536 HG22 ILE 65 HG22 ILE 65 -11.075 -1.497 -8.906 537 HG23 ILE 65 HG23 ILE 65 -10.442 0.019 -8.265 538 HD11 ILE 65 HD11 ILE 65 -7.935 -2.583 -8.603 539 HD12 ILE 65 HD12 ILE 65 -6.951 -1.418 -9.488 540 HD13 ILE 65 HD13 ILE 65 -7.005 -3.101 -10.009 541 H ILE 66 HN ILE 66 -9.710 2.213 -10.842 542 HA ILE 66 HA ILE 66 -11.825 3.103 -9.087 543 HB ILE 66 HB ILE 66 -9.845 4.665 -10.763 544 HG12 ILE 66 HG12 ILE 66 -9.810 4.040 -7.800 545 HG13 ILE 66 HG11 ILE 66 -8.947 3.079 -9.001 546 HG21 ILE 66 HG21 ILE 66 -11.855 5.488 -8.673 547 HG22 ILE 66 HG22 ILE 66 -11.534 6.218 -10.246 548 HG23 ILE 66 HG23 ILE 66 -10.385 6.427 -8.927 549 HD11 ILE 66 HD11 ILE 66 -7.560 4.917 -9.623 550 HD12 ILE 66 HD12 ILE 66 -7.587 4.920 -7.860 551 HD13 ILE 66 HD13 ILE 66 -8.576 6.070 -8.759 552 H VAL 67 HN VAL 67 -13.265 4.999 -9.717 553 HA VAL 67 HA VAL 67 -14.885 4.277 -11.980 554 HB VAL 67 HB VAL 67 -15.730 5.395 -9.923 555 HG11 VAL 67 HG11 VAL 67 -13.709 6.970 -9.836 556 HG12 VAL 67 HG12 VAL 67 -15.276 7.671 -9.441 557 HG13 VAL 67 HG13 VAL 67 -14.563 7.947 -11.030 558 HG21 VAL 67 HG21 VAL 67 -17.470 6.442 -11.043 559 HG22 VAL 67 HG22 VAL 67 -16.730 5.633 -12.421 560 HG23 VAL 67 HG23 VAL 67 -16.393 7.336 -12.114 561 H ASN 68 HN ASN 68 -12.136 4.836 -12.713 562 HA ASN 68 HA ASN 68 -10.990 5.818 -14.487 563 HB2 ASN 68 HB2 ASN 68 -13.608 7.130 -15.263 564 HB3 ASN 68 HB1 ASN 68 -12.221 6.810 -16.289 565 HD21 ASN 68 HD21 ASN 68 -13.401 4.373 -13.956 566 HD22 ASN 68 HD22 ASN 68 -13.964 3.296 -15.132 567 H LYS 69 HN LYS 69 -13.352 8.124 -13.104 568 HA LYS 69 HA LYS 69 -13.039 10.281 -12.273 569 HB2 LYS 69 HB2 LYS 69 -11.135 9.083 -11.029 570 HB3 LYS 69 HB1 LYS 69 -10.064 9.723 -12.273 571 HG2 LYS 69 HG2 LYS 69 -10.716 12.001 -11.740 572 HG3 LYS 69 HG1 LYS 69 -11.902 11.420 -10.569 573 HD2 LYS 69 HD2 LYS 69 -10.077 10.369 -9.263 574 HD3 LYS 69 HD1 LYS 69 -8.902 11.011 -10.412 575 HE2 LYS 69 HE2 LYS 69 -10.793 12.653 -8.703 576 HE3 LYS 69 HE1 LYS 69 -9.056 12.481 -8.455 577 HZ1 LYS 69 HZ1 LYS 69 -10.488 14.099 -10.362 578 HZ2 LYS 69 HZ2 LYS 69 -9.190 13.230 -11.030 579 HZ3 LYS 69 HZ3 LYS 69 -8.926 14.293 -9.730 580 H LEU 70 HN LEU 70 -11.574 9.152 -15.142 581 HA LEU 70 HA LEU 70 -10.844 11.899 -16.021 582 HB2 LEU 70 HB2 LEU 70 -9.165 10.142 -16.418 583 HB3 LEU 70 HB1 LEU 70 -10.349 9.199 -17.318 584 HG LEU 70 HG LEU 70 -10.521 10.969 -19.008 585 HD11 LEU 70 HD11 LEU 70 -8.765 12.451 -17.061 586 HD12 LEU 70 HD12 LEU 70 -10.180 13.022 -17.947 587 HD13 LEU 70 HD13 LEU 70 -8.644 12.814 -18.783 588 HD21 LEU 70 HD21 LEU 70 -8.829 9.322 -19.437 589 HD22 LEU 70 HD22 LEU 70 -7.713 10.083 -18.302 590 HD23 LEU 70 HD23 LEU 70 -8.115 10.889 -19.818 591 H GLU 71 HN GLU 71 -12.196 12.986 -17.314 592 HA GLU 71 HA GLU 71 -14.727 11.829 -18.137 593 HB2 GLU 71 HB2 GLU 71 -15.031 14.079 -19.253 594 HB3 GLU 71 HB1 GLU 71 -14.666 14.170 -17.529 595 HG2 GLU 71 HG2 GLU 71 -12.297 14.594 -18.034 596 HG3 GLU 71 HG1 GLU 71 -12.631 14.466 -19.759 597 H HIS 72 HN HIS 72 -12.943 10.182 -19.292 598 HA HIS 72 HA HIS 72 -12.201 9.284 -21.335 599 HB2 HIS 72 HB2 HIS 72 -14.543 10.979 -22.220 600 HB3 HIS 72 HB1 HIS 72 -13.661 9.927 -23.320 601 HD2 HIS 72 HD2 HIS 72 -16.523 8.800 -23.112 602 HE1 HIS 72 HE1 HIS 72 -15.310 6.378 -19.874 603 HE2 HIS 72 HE2 HIS 72 -17.105 6.737 -21.630 604 H HIS 73 HN HIS 73 -13.223 11.845 -23.318 605 HA HIS 73 HA HIS 73 -12.074 13.389 -24.622 606 HB2 HIS 73 HB2 HIS 73 -11.605 14.262 -22.207 607 HB3 HIS 73 HB1 HIS 73 -9.990 13.594 -22.442 608 HD2 HIS 73 HD2 HIS 73 -10.858 16.975 -22.548 609 HE1 HIS 73 HE1 HIS 73 -9.393 16.566 -26.488 610 HE2 HIS 73 HE2 HIS 73 -10.003 18.228 -24.671 611 H HIS 74 HN HIS 74 -11.551 10.749 -25.231 612 HA HIS 74 HA HIS 74 -8.663 10.854 -26.035 613 HB2 HIS 74 HB2 HIS 74 -10.206 8.507 -24.899 614 HB3 HIS 74 HB1 HIS 74 -8.700 8.313 -25.798 615 HD2 HIS 74 HD2 HIS 74 -8.111 7.460 -22.844 616 HE1 HIS 74 HE1 HIS 74 -7.023 11.449 -21.979 617 HE2 HIS 74 HE2 HIS 74 -6.889 9.048 -21.172 618 H HIS 75 HN HIS 75 -9.274 11.571 -28.118 619 HA HIS 75 HA HIS 75 -11.323 10.305 -29.700 620 HB2 HIS 75 HB2 HIS 75 -10.504 12.586 -30.156 621 HB3 HIS 75 HB1 HIS 75 -8.917 11.941 -30.564 622 HD2 HIS 75 HD2 HIS 75 -12.498 12.196 -32.141 623 HE1 HIS 75 HE1 HIS 75 -9.937 10.436 -35.001 624 HE2 HIS 75 HE2 HIS 75 -12.253 11.394 -34.610 625 H HIS 76 HN HIS 76 -8.047 10.440 -30.946 626 HA HIS 76 HA HIS 76 -7.490 7.621 -30.715 627 HB2 HIS 76 HB2 HIS 76 -9.322 7.563 -32.420 628 HB3 HIS 76 HB1 HIS 76 -8.352 8.613 -33.453 629 HD2 HIS 76 HD2 HIS 76 -6.675 5.600 -31.524 630 HE1 HIS 76 HE1 HIS 76 -6.603 4.742 -35.657 631 HE2 HIS 76 HE2 HIS 76 -5.810 3.978 -33.372 632 H HIS 77 HN HIS 77 -5.662 9.061 -29.943 633 HA HIS 77 HA HIS 77 -4.118 10.487 -31.955 634 HB2 HIS 77 HB2 HIS 77 -4.246 10.912 -29.386 635 HB3 HIS 77 HB1 HIS 77 -3.057 9.617 -29.263 636 HD2 HIS 77 HD2 HIS 77 -3.179 13.374 -30.100 637 HE1 HIS 77 HE1 HIS 77 0.659 12.025 -31.234 638 HE2 HIS 77 HE2 HIS 77 -0.790 14.076 -30.875 639 H1 MET 1 HT1 MET 1 -5.634 -14.814 -10.764 640 H2 MET 1 HT2 MET 1 -6.448 -14.029 -9.496 641 H3 MET 1 HT3 MET 1 -5.404 -15.327 -9.163 642 HA MET 1 HA MET 1 -3.846 -13.802 -8.760 643 HB2 MET 1 HB2 MET 1 -4.165 -13.533 -11.755 644 HB3 MET 1 HB1 MET 1 -2.828 -12.812 -10.858 645 HG2 MET 1 HG2 MET 1 -2.282 -15.103 -9.980 646 HG3 MET 1 HG1 MET 1 -3.511 -15.757 -11.061 647 HE1 MET 1 HE1 MET 1 -3.755 -15.229 -13.319 648 HE2 MET 1 HE2 MET 1 -2.438 -15.579 -14.436 649 HE3 MET 1 HE3 MET 1 -2.838 -13.906 -14.057 650 H GLU 2 HN GLU 2 -5.497 -12.074 -11.400 651 HA GLU 2 HA GLU 2 -6.615 -10.023 -11.417 652 HB2 GLU 2 HB2 GLU 2 -6.508 -9.857 -8.418 653 HB3 GLU 2 HB1 GLU 2 -7.769 -9.334 -9.523 654 HG2 GLU 2 HG2 GLU 2 -7.696 -12.103 -9.951 655 HG3 GLU 2 HG1 GLU 2 -7.387 -11.965 -8.223 656 H LEU 3 HN LEU 3 -5.906 -8.239 -8.866 657 HA LEU 3 HA LEU 3 -4.196 -6.387 -9.958 658 HB2 LEU 3 HB2 LEU 3 -4.464 -7.413 -7.132 659 HB3 LEU 3 HB1 LEU 3 -3.379 -6.076 -7.501 660 HG LEU 3 HG LEU 3 -6.261 -6.014 -8.425 661 HD11 LEU 3 HD11 LEU 3 -6.519 -6.392 -6.082 662 HD12 LEU 3 HD12 LEU 3 -6.674 -4.648 -6.302 663 HD13 LEU 3 HD13 LEU 3 -5.166 -5.330 -5.690 664 HD21 LEU 3 HD21 LEU 3 -5.813 -3.514 -8.042 665 HD22 LEU 3 HD22 LEU 3 -4.927 -4.259 -9.371 666 HD23 LEU 3 HD23 LEU 3 -4.118 -3.944 -7.835 667 H SER 4 HN SER 4 -3.232 -9.402 -8.351 668 HA SER 4 HA SER 4 -0.409 -8.991 -8.472 669 HB2 SER 4 HB2 SER 4 -1.949 -11.601 -8.617 670 HB3 SER 4 HB1 SER 4 -0.246 -11.426 -8.198 671 HG SER 4 HG SER 4 -0.785 -10.576 -6.301 672 H ASN 5 HN ASN 5 -2.724 -10.336 -10.818 673 HA ASN 5 HA ASN 5 -0.847 -11.298 -12.724 674 HB2 ASN 5 HB2 ASN 5 -3.177 -11.862 -12.964 675 HB3 ASN 5 HB1 ASN 5 -3.649 -10.173 -13.057 676 HD21 ASN 5 HD21 ASN 5 -3.692 -9.230 -15.109 677 HD22 ASN 5 HD22 ASN 5 -3.088 -9.960 -16.517 678 H GLU 6 HN GLU 6 -2.391 -8.085 -12.460 679 HA GLU 6 HA GLU 6 -1.280 -6.920 -14.760 680 HB2 GLU 6 HB2 GLU 6 -1.852 -5.715 -12.040 681 HB3 GLU 6 HB1 GLU 6 -1.458 -4.757 -13.470 682 HG2 GLU 6 HG2 GLU 6 -3.402 -5.675 -14.651 683 HG3 GLU 6 HG1 GLU 6 -3.781 -6.700 -13.266 684 H LEU 7 HN LEU 7 0.082 -6.850 -11.448 685 HA LEU 7 HA LEU 7 2.547 -5.617 -12.210 686 HB2 LEU 7 HB2 LEU 7 1.654 -7.285 -9.862 687 HB3 LEU 7 HB1 LEU 7 3.349 -6.822 -10.017 688 HG LEU 7 HG LEU 7 2.733 -4.458 -10.095 689 HD11 LEU 7 HD11 LEU 7 0.624 -4.510 -11.235 690 HD12 LEU 7 HD12 LEU 7 0.292 -3.887 -9.621 691 HD13 LEU 7 HD13 LEU 7 -0.084 -5.565 -10.012 692 HD21 LEU 7 HD21 LEU 7 3.061 -5.405 -7.878 693 HD22 LEU 7 HD22 LEU 7 1.401 -6.000 -7.851 694 HD23 LEU 7 HD23 LEU 7 1.716 -4.266 -7.810 695 H LYS 8 HN LYS 8 1.585 -9.028 -12.023 696 HA LYS 8 HA LYS 8 4.184 -10.121 -12.469 697 HB2 LYS 8 HB2 LYS 8 1.833 -11.206 -11.816 698 HB3 LYS 8 HB1 LYS 8 1.736 -11.493 -13.549 699 HG2 LYS 8 HG2 LYS 8 3.906 -12.445 -11.657 700 HG3 LYS 8 HG1 LYS 8 2.729 -13.440 -12.511 701 HD2 LYS 8 HD2 LYS 8 3.745 -12.469 -14.674 702 HD3 LYS 8 HD1 LYS 8 5.072 -11.918 -13.651 703 HE2 LYS 8 HE2 LYS 8 5.444 -14.227 -12.871 704 HE3 LYS 8 HE1 LYS 8 4.124 -14.784 -13.898 705 HZ1 LYS 8 HZ1 LYS 8 5.843 -15.117 -15.308 706 HZ2 LYS 8 HZ2 LYS 8 6.801 -13.886 -14.633 707 HZ3 LYS 8 HZ3 LYS 8 5.532 -13.495 -15.694 708 H VAL 9 HN VAL 9 1.615 -9.088 -14.705 709 HA VAL 9 HA VAL 9 2.725 -10.028 -17.132 710 HB VAL 9 HB VAL 9 1.071 -7.576 -16.481 711 HG11 VAL 9 HG11 VAL 9 2.149 -6.947 -18.500 712 HG12 VAL 9 HG12 VAL 9 0.602 -7.618 -19.014 713 HG13 VAL 9 HG13 VAL 9 2.071 -8.585 -19.149 714 HG21 VAL 9 HG21 VAL 9 0.176 -9.984 -16.253 715 HG22 VAL 9 HG22 VAL 9 0.281 -10.061 -18.010 716 HG23 VAL 9 HG23 VAL 9 -0.770 -8.872 -17.242 717 H GLU 10 HN GLU 10 2.921 -6.632 -16.002 718 HA GLU 10 HA GLU 10 4.842 -5.650 -17.704 719 HB2 GLU 10 HB2 GLU 10 5.661 -4.661 -15.143 720 HB3 GLU 10 HB1 GLU 10 4.619 -3.864 -16.312 721 HG2 GLU 10 HG2 GLU 10 3.479 -5.933 -14.430 722 HG3 GLU 10 HG1 GLU 10 3.722 -4.277 -13.898 723 H ARG 11 HN ARG 11 5.547 -7.584 -14.781 724 HA ARG 11 HA ARG 11 8.363 -7.462 -14.893 725 HB2 ARG 11 HB2 ARG 11 6.984 -8.561 -13.091 726 HB3 ARG 11 HB1 ARG 11 6.687 -9.896 -14.199 727 HG2 ARG 11 HG2 ARG 11 8.528 -10.720 -13.035 728 HG3 ARG 11 HG1 ARG 11 9.340 -9.933 -14.385 729 HD2 ARG 11 HD2 ARG 11 10.536 -9.059 -12.592 730 HD3 ARG 11 HD1 ARG 11 9.288 -7.827 -12.761 731 HE ARG 11 HE ARG 11 8.217 -8.681 -10.783 732 HH11 ARG 11 HH21 ARG 11 11.000 -10.504 -11.759 733 HH12 ARG 11 HH22 ARG 11 11.143 -11.327 -10.244 734 HH21 ARG 11 HH11 ARG 11 8.398 -9.774 -8.816 735 HH22 ARG 11 HH12 ARG 11 9.675 -10.920 -8.588 736 H ILE 12 HN ILE 12 6.119 -9.672 -16.560 737 HA ILE 12 HA ILE 12 8.145 -11.167 -17.928 738 HB ILE 12 HB ILE 12 5.229 -10.666 -18.602 739 HG12 ILE 12 HG12 ILE 12 6.575 -13.127 -17.450 740 HG13 ILE 12 HG11 ILE 12 5.838 -11.877 -16.447 741 HG21 ILE 12 HG21 ILE 12 5.583 -12.815 -19.972 742 HG22 ILE 12 HG22 ILE 12 7.310 -12.483 -19.833 743 HG23 ILE 12 HG23 ILE 12 6.255 -11.330 -20.649 744 HD11 ILE 12 HD11 ILE 12 3.672 -12.289 -17.334 745 HD12 ILE 12 HD12 ILE 12 4.355 -13.888 -17.040 746 HD13 ILE 12 HD13 ILE 12 4.316 -13.234 -18.677 747 H ARG 13 HN ARG 13 6.222 -8.309 -18.866 748 HA ARG 13 HA ARG 13 7.146 -8.083 -21.535 749 HB2 ARG 13 HB2 ARG 13 6.272 -5.982 -19.541 750 HB3 ARG 13 HB1 ARG 13 6.637 -5.608 -21.224 751 HG2 ARG 13 HG2 ARG 13 4.908 -7.185 -21.970 752 HG3 ARG 13 HG1 ARG 13 4.562 -7.615 -20.294 753 HD2 ARG 13 HD2 ARG 13 2.953 -5.929 -21.183 754 HD3 ARG 13 HD1 ARG 13 3.877 -5.313 -19.812 755 HE ARG 13 HE ARG 13 5.322 -4.599 -22.118 756 HH11 ARG 13 HH21 ARG 13 2.201 -4.083 -20.736 757 HH12 ARG 13 HH22 ARG 13 2.030 -2.491 -21.395 758 HH21 ARG 13 HH11 ARG 13 5.119 -2.521 -22.973 759 HH22 ARG 13 HH12 ARG 13 3.680 -1.606 -22.661 760 H LEU 14 HN LEU 14 8.492 -6.644 -18.554 761 HA LEU 14 HA LEU 14 10.856 -5.722 -20.102 762 HB2 LEU 14 HB2 LEU 14 9.936 -5.244 -17.256 763 HB3 LEU 14 HB1 LEU 14 11.451 -4.620 -17.907 764 HG LEU 14 HG LEU 14 8.718 -4.067 -19.108 765 HD11 LEU 14 HD11 LEU 14 8.961 -3.121 -16.821 766 HD12 LEU 14 HD12 LEU 14 8.867 -1.865 -18.056 767 HD13 LEU 14 HD13 LEU 14 10.424 -2.286 -17.344 768 HD21 LEU 14 HD21 LEU 14 11.535 -3.196 -19.738 769 HD22 LEU 14 HD22 LEU 14 10.213 -2.068 -20.035 770 HD23 LEU 14 HD23 LEU 14 10.227 -3.633 -20.837 771 H SER 15 HN SER 15 9.882 -8.498 -18.612 772 HA SER 15 HA SER 15 10.999 -10.259 -17.482 773 HB2 SER 15 HB2 SER 15 11.664 -10.491 -19.863 774 HB3 SER 15 HB1 SER 15 13.063 -9.464 -19.564 775 HG SER 15 HG SER 15 12.756 -11.559 -17.801 776 H LEU 16 HN LEU 16 11.236 -8.377 -15.712 777 HA LEU 16 HA LEU 16 14.036 -7.565 -15.263 778 HB2 LEU 16 HB2 LEU 16 11.619 -7.234 -13.470 779 HB3 LEU 16 HB1 LEU 16 13.156 -6.389 -13.321 780 HG LEU 16 HG LEU 16 11.337 -6.229 -15.732 781 HD11 LEU 16 HD11 LEU 16 10.181 -5.150 -13.954 782 HD12 LEU 16 HD12 LEU 16 10.989 -3.852 -14.833 783 HD13 LEU 16 HD13 LEU 16 11.666 -4.445 -13.316 784 HD21 LEU 16 HD21 LEU 16 12.838 -4.117 -16.069 785 HD22 LEU 16 HD22 LEU 16 13.512 -5.690 -16.478 786 HD23 LEU 16 HD23 LEU 16 13.944 -4.915 -14.952 787 H THR 17 HN THR 17 15.208 -8.133 -13.308 788 HA THR 17 HA THR 17 14.611 -10.925 -12.431 789 HB THR 17 HB THR 17 16.986 -10.866 -11.631 790 HG1 THR 17 HG1 THR 17 16.613 -8.247 -12.335 791 HG21 THR 17 HG21 THR 17 16.592 -11.818 -13.788 792 HG22 THR 17 HG22 THR 17 17.957 -10.719 -13.985 793 HG23 THR 17 HG23 THR 17 16.348 -10.230 -14.517 794 H ALA 18 HN ALA 18 14.117 -11.372 -10.346 795 HA ALA 18 HA ALA 18 13.300 -9.316 -8.539 796 HB1 ALA 18 HB1 ALA 18 13.844 -12.272 -8.231 797 HB2 ALA 18 HB2 ALA 18 12.288 -11.445 -8.273 798 HB3 ALA 18 HB3 ALA 18 13.333 -11.282 -6.863 799 H LYS 19 HN LYS 19 16.312 -11.136 -8.880 800 HA LYS 19 HA LYS 19 17.523 -10.378 -6.422 801 HB2 LYS 19 HB2 LYS 19 18.698 -11.043 -9.134 802 HB3 LYS 19 HB1 LYS 19 19.661 -10.840 -7.675 803 HG2 LYS 19 HG2 LYS 19 18.400 -12.648 -6.574 804 HG3 LYS 19 HG1 LYS 19 17.421 -12.849 -8.029 805 HD2 LYS 19 HD2 LYS 19 19.397 -13.460 -9.322 806 HD3 LYS 19 HD1 LYS 19 20.434 -13.167 -7.926 807 HE2 LYS 19 HE2 LYS 19 20.008 -15.563 -8.126 808 HE3 LYS 19 HE1 LYS 19 19.205 -14.944 -6.683 809 HZ1 LYS 19 HZ1 LYS 19 17.521 -16.128 -7.633 810 HZ2 LYS 19 HZ2 LYS 19 18.045 -15.839 -9.223 811 HZ3 LYS 19 HZ3 LYS 19 17.243 -14.618 -8.355 812 H SER 20 HN SER 20 17.544 -8.811 -9.631 813 HA SER 20 HA SER 20 19.342 -6.708 -8.958 814 HB2 SER 20 HB2 SER 20 18.836 -7.019 -11.262 815 HB3 SER 20 HB1 SER 20 17.100 -6.930 -10.972 816 HG SER 20 HG SER 20 17.616 -4.719 -10.181 817 H VAL 21 HN VAL 21 15.768 -6.840 -8.796 818 HA VAL 21 HA VAL 21 15.400 -4.173 -7.854 819 HB VAL 21 HB VAL 21 13.739 -6.656 -7.339 820 HG11 VAL 21 HG11 VAL 21 13.010 -5.060 -5.756 821 HG12 VAL 21 HG12 VAL 21 11.912 -4.835 -7.117 822 HG13 VAL 21 HG13 VAL 21 13.249 -3.714 -6.870 823 HG21 VAL 21 HG21 VAL 21 13.742 -4.543 -9.507 824 HG22 VAL 21 HG22 VAL 21 12.348 -5.581 -9.203 825 HG23 VAL 21 HG23 VAL 21 13.885 -6.290 -9.697 826 H ALA 22 HN ALA 22 15.781 -7.236 -6.064 827 HA ALA 22 HA ALA 22 15.550 -6.105 -3.454 828 HB1 ALA 22 HB1 ALA 22 16.878 -8.177 -2.772 829 HB2 ALA 22 HB2 ALA 22 16.958 -8.580 -4.488 830 HB3 ALA 22 HB3 ALA 22 15.396 -8.489 -3.675 831 H GLU 23 HN GLU 23 18.203 -6.256 -5.741 832 HA GLU 23 HA GLU 23 20.295 -5.622 -3.863 833 HB2 GLU 23 HB2 GLU 23 20.625 -6.602 -6.162 834 HB3 GLU 23 HB1 GLU 23 20.229 -5.021 -6.831 835 HG2 GLU 23 HG2 GLU 23 22.147 -4.004 -5.885 836 HG3 GLU 23 HG1 GLU 23 22.419 -5.345 -4.773 837 H GLU 24 HN GLU 24 18.071 -3.679 -5.806 838 HA GLU 24 HA GLU 24 19.366 -1.155 -5.308 839 HB2 GLU 24 HB2 GLU 24 16.654 -2.023 -6.277 840 HB3 GLU 24 HB1 GLU 24 16.854 -0.349 -5.776 841 HG2 GLU 24 HG2 GLU 24 17.350 -0.213 -8.051 842 HG3 GLU 24 HG1 GLU 24 18.960 -0.409 -7.375 843 H MET 25 HN MET 25 16.214 -2.264 -3.983 844 HA MET 25 HA MET 25 16.314 -0.355 -1.843 845 HB2 MET 25 HB2 MET 25 14.685 -2.864 -2.262 846 HB3 MET 25 HB1 MET 25 14.515 -1.877 -0.812 847 HG2 MET 25 HG2 MET 25 14.131 0.115 -2.374 848 HG3 MET 25 HG1 MET 25 13.990 -1.063 -3.681 849 HE1 MET 25 HE1 MET 25 12.175 -2.472 -4.182 850 HE2 MET 25 HE2 MET 25 10.833 -2.942 -3.140 851 HE3 MET 25 HE3 MET 25 12.463 -3.505 -2.774 852 H GLY 26 HN GLY 26 17.260 -3.770 -2.038 853 HA2 GLY 26 HA2 GLY 26 19.010 -4.745 -0.713 854 HA3 GLY 26 HA1 GLY 26 18.910 -3.374 0.396 855 H ILE 27 HN ILE 27 16.414 -5.638 -0.823 856 HA ILE 27 HA ILE 27 15.773 -6.320 2.036 857 HB ILE 27 HB ILE 27 13.427 -6.618 1.290 858 HG12 ILE 27 HG12 ILE 27 14.363 -5.332 -1.295 859 HG13 ILE 27 HG11 ILE 27 13.977 -7.046 -1.125 860 HG21 ILE 27 HG21 ILE 27 12.884 -4.256 1.146 861 HG22 ILE 27 HG22 ILE 27 14.524 -3.875 0.619 862 HG23 ILE 27 HG23 ILE 27 14.240 -4.465 2.257 863 HD11 ILE 27 HD11 ILE 27 12.106 -4.695 -0.771 864 HD12 ILE 27 HD12 ILE 27 11.697 -6.334 -0.263 865 HD13 ILE 27 HD13 ILE 27 11.997 -5.987 -1.966 866 H SER 28 HN SER 28 14.808 -8.469 2.304 867 HA SER 28 HA SER 28 16.347 -10.485 0.980 868 HB2 SER 28 HB2 SER 28 13.871 -10.681 2.707 869 HB3 SER 28 HB1 SER 28 14.847 -12.060 2.212 870 HG SER 28 HG SER 28 15.523 -9.883 3.880 871 H ARG 29 HN ARG 29 15.659 -12.100 -0.483 872 HA ARG 29 HA ARG 29 13.897 -11.261 -2.569 873 HB2 ARG 29 HB2 ARG 29 15.040 -13.974 -1.858 874 HB3 ARG 29 HB1 ARG 29 14.075 -13.685 -3.306 875 HG2 ARG 29 HG2 ARG 29 15.690 -11.975 -4.050 876 HG3 ARG 29 HG1 ARG 29 16.656 -12.258 -2.598 877 HD2 ARG 29 HD2 ARG 29 17.542 -13.513 -4.554 878 HD3 ARG 29 HD1 ARG 29 17.012 -14.595 -3.261 879 HE ARG 29 HE ARG 29 14.816 -14.180 -5.021 880 HH11 ARG 29 HH21 ARG 29 17.969 -15.584 -4.946 881 HH12 ARG 29 HH22 ARG 29 17.579 -16.832 -6.084 882 HH21 ARG 29 HH11 ARG 29 14.293 -15.803 -6.493 883 HH22 ARG 29 HH12 ARG 29 15.499 -16.957 -6.958 884 H GLN 30 HN GLN 30 13.420 -13.275 0.295 885 HA GLN 30 HA GLN 30 10.909 -14.409 -0.330 886 HB2 GLN 30 HB2 GLN 30 11.926 -13.387 2.343 887 HB3 GLN 30 HB1 GLN 30 10.555 -14.478 2.130 888 HG2 GLN 30 HG2 GLN 30 13.378 -15.070 1.193 889 HG3 GLN 30 HG1 GLN 30 12.676 -15.680 2.692 890 HE21 GLN 30 HE21 GLN 30 13.331 -16.711 -0.349 891 HE22 GLN 30 HE22 GLN 30 12.042 -17.789 -0.589 892 H GLN 31 HN GLN 31 11.683 -11.226 1.082 893 HA GLN 31 HA GLN 31 8.967 -10.399 1.463 894 HB2 GLN 31 HB2 GLN 31 11.512 -8.816 1.012 895 HB3 GLN 31 HB1 GLN 31 9.969 -8.081 1.448 896 HG2 GLN 31 HG2 GLN 31 9.893 -9.397 3.511 897 HG3 GLN 31 HG1 GLN 31 11.395 -10.210 3.068 898 HE21 GLN 31 HE21 GLN 31 10.197 -7.641 4.886 899 HE22 GLN 31 HE22 GLN 31 11.614 -6.712 4.987 900 H LEU 32 HN LEU 32 11.267 -9.780 -1.209 901 HA LEU 32 HA LEU 32 9.418 -8.310 -2.816 902 HB2 LEU 32 HB2 LEU 32 11.981 -8.540 -3.078 903 HB3 LEU 32 HB1 LEU 32 11.627 -10.040 -3.935 904 HG LEU 32 HG LEU 32 9.936 -8.511 -5.296 905 HD11 LEU 32 HD11 LEU 32 10.237 -6.485 -3.958 906 HD12 LEU 32 HD12 LEU 32 10.862 -6.216 -5.581 907 HD13 LEU 32 HD13 LEU 32 11.974 -6.522 -4.251 908 HD21 LEU 32 HD21 LEU 32 11.768 -9.623 -6.380 909 HD22 LEU 32 HD22 LEU 32 12.945 -8.541 -5.634 910 HD23 LEU 32 HD23 LEU 32 11.838 -7.929 -6.864 911 H CYS 33 HN CYS 33 10.243 -11.761 -2.743 912 HA CYS 33 HA CYS 33 8.603 -12.544 -4.937 913 HB2 CYS 33 HB2 CYS 33 10.401 -13.888 -3.619 914 HB3 CYS 33 HB1 CYS 33 9.075 -14.311 -2.536 915 HG CYS 33 HG CYS 33 8.066 -14.891 -5.241 916 H ASN 34 HN ASN 34 7.884 -11.984 -1.536 917 HA ASN 34 HA ASN 34 5.313 -13.200 -1.457 918 HB2 ASN 34 HB2 ASN 34 6.713 -12.248 0.481 919 HB3 ASN 34 HB1 ASN 34 6.054 -10.676 0.031 920 HD21 ASN 34 HD21 ASN 34 5.506 -12.126 2.543 921 HD22 ASN 34 HD22 ASN 34 3.835 -12.421 2.577 922 H ILE 35 HN ILE 35 6.365 -9.949 -2.432 923 HA ILE 35 HA ILE 35 3.768 -8.843 -2.870 924 HB ILE 35 HB ILE 35 6.436 -8.239 -4.175 925 HG12 ILE 35 HG12 ILE 35 4.885 -6.684 -2.084 926 HG13 ILE 35 HG11 ILE 35 6.132 -7.862 -1.676 927 HG21 ILE 35 HG21 ILE 35 4.800 -7.417 -5.696 928 HG22 ILE 35 HG22 ILE 35 5.241 -6.024 -4.707 929 HG23 ILE 35 HG23 ILE 35 3.739 -6.891 -4.390 930 HD11 ILE 35 HD11 ILE 35 6.872 -5.400 -1.859 931 HD12 ILE 35 HD12 ILE 35 6.672 -5.594 -3.598 932 HD13 ILE 35 HD13 ILE 35 7.835 -6.591 -2.728 933 H GLU 36 HN GLU 36 5.985 -10.622 -5.010 934 HA GLU 36 HA GLU 36 4.452 -10.413 -7.389 935 HB2 GLU 36 HB2 GLU 36 6.767 -11.229 -7.349 936 HB3 GLU 36 HB1 GLU 36 6.263 -12.664 -6.459 937 HG2 GLU 36 HG2 GLU 36 4.894 -12.053 -9.070 938 HG3 GLU 36 HG1 GLU 36 6.524 -12.718 -9.117 939 H GLN 37 HN GLN 37 4.189 -12.638 -4.648 940 HA GLN 37 HA GLN 37 1.780 -13.883 -5.947 941 HB2 GLN 37 HB2 GLN 37 2.192 -15.846 -4.592 942 HB3 GLN 37 HB1 GLN 37 3.697 -15.423 -5.406 943 HG2 GLN 37 HG2 GLN 37 4.389 -14.189 -3.335 944 HG3 GLN 37 HG1 GLN 37 2.958 -14.823 -2.528 945 HE21 GLN 37 HE21 GLN 37 3.856 -16.365 -1.106 946 HE22 GLN 37 HE22 GLN 37 4.840 -17.653 -1.607 947 H SER 38 HN SER 38 2.235 -11.371 -4.139 948 HA SER 38 HA SER 38 0.910 -11.929 -1.649 949 HB2 SER 38 HB2 SER 38 1.526 -9.435 -3.200 950 HB3 SER 38 HB1 SER 38 0.423 -9.340 -1.831 951 HG SER 38 HG SER 38 2.248 -9.196 -0.775 952 H GLU 39 HN GLU 39 -1.264 -11.588 -1.072 953 HA GLU 39 HA GLU 39 -3.173 -11.942 -3.292 954 HB2 GLU 39 HB2 GLU 39 -3.760 -11.890 -0.316 955 HB3 GLU 39 HB1 GLU 39 -4.761 -12.561 -1.601 956 HG2 GLU 39 HG2 GLU 39 -3.753 -14.517 -0.851 957 HG3 GLU 39 HG1 GLU 39 -2.585 -14.038 -2.078 958 H THR 40 HN THR 40 -3.761 -10.068 -4.222 959 HA THR 40 HA THR 40 -4.573 -7.894 -4.508 960 HB THR 40 HB THR 40 -5.756 -8.506 -1.786 961 HG1 THR 40 HG1 THR 40 -7.612 -8.630 -3.449 962 HG21 THR 40 HG21 THR 40 -7.447 -6.746 -2.614 963 HG22 THR 40 HG22 THR 40 -6.192 -6.261 -3.754 964 HG23 THR 40 HG23 THR 40 -5.896 -6.157 -2.018 965 H ALA 41 HN ALA 41 -4.430 -5.643 -3.672 966 HA ALA 41 HA ALA 41 -1.857 -5.252 -2.318 967 HB1 ALA 41 HB1 ALA 41 -3.796 -3.526 -3.828 968 HB2 ALA 41 HB2 ALA 41 -2.073 -3.765 -4.106 969 HB3 ALA 41 HB3 ALA 41 -2.615 -2.743 -2.775 970 HA PRO 42 HA PRO 42 -3.550 -4.377 1.699 971 HB2 PRO 42 HB2 PRO 42 -1.752 -2.527 2.653 972 HB3 PRO 42 HB1 PRO 42 -1.384 -4.256 2.493 973 HG2 PRO 42 HG2 PRO 42 -0.667 -1.995 0.675 974 HG3 PRO 42 HG1 PRO 42 0.310 -3.382 1.189 975 HD2 PRO 42 HD2 PRO 42 -0.916 -3.287 -1.250 976 HD3 PRO 42 HD1 PRO 42 -0.646 -4.811 -0.374 977 H VAL 43 HN VAL 43 -4.543 -2.692 3.033 978 HA VAL 43 HA VAL 43 -6.172 -0.865 1.607 979 HB VAL 43 HB VAL 43 -6.552 0.166 3.907 980 HG11 VAL 43 HG11 VAL 43 -7.855 -1.775 3.001 981 HG12 VAL 43 HG12 VAL 43 -7.703 -1.811 4.758 982 HG13 VAL 43 HG13 VAL 43 -6.695 -2.862 3.763 983 HG21 VAL 43 HG21 VAL 43 -4.273 -0.305 4.772 984 HG22 VAL 43 HG22 VAL 43 -4.614 -2.032 4.698 985 HG23 VAL 43 HG23 VAL 43 -5.516 -1.005 5.808 986 H VAL 44 HN VAL 44 -2.882 -0.596 2.602 987 HA VAL 44 HA VAL 44 -2.651 2.228 2.903 988 HB VAL 44 HB VAL 44 -0.659 0.210 1.822 989 HG11 VAL 44 HG11 VAL 44 0.992 1.996 2.615 990 HG12 VAL 44 HG12 VAL 44 -0.381 3.100 2.660 991 HG13 VAL 44 HG13 VAL 44 0.105 2.359 1.135 992 HG21 VAL 44 HG21 VAL 44 0.255 0.356 4.141 993 HG22 VAL 44 HG22 VAL 44 -1.389 -0.282 4.106 994 HG23 VAL 44 HG23 VAL 44 -1.103 1.392 4.583 995 H VAL 45 HN VAL 45 -2.382 0.157 0.003 996 HA VAL 45 HA VAL 45 -1.762 2.241 -1.839 997 HB VAL 45 HB VAL 45 -3.260 -0.363 -2.247 998 HG11 VAL 45 HG11 VAL 45 -3.781 1.008 -4.121 999 HG12 VAL 45 HG12 VAL 45 -2.435 -0.004 -4.648 1000 HG13 VAL 45 HG13 VAL 45 -2.148 1.673 -4.181 1001 HG21 VAL 45 HG21 VAL 45 -1.005 -1.053 -3.177 1002 HG22 VAL 45 HG22 VAL 45 -1.020 -0.757 -1.439 1003 HG23 VAL 45 HG23 VAL 45 -0.354 0.455 -2.533 1004 H LYS 46 HN LYS 46 -4.893 0.837 -0.876 1005 HA LYS 46 HA LYS 46 -6.506 2.513 -2.540 1006 HB2 LYS 46 HB2 LYS 46 -7.106 1.088 0.065 1007 HB3 LYS 46 HB1 LYS 46 -8.334 1.887 -0.919 1008 HG2 LYS 46 HG2 LYS 46 -7.751 0.443 -2.830 1009 HG3 LYS 46 HG1 LYS 46 -6.515 -0.355 -1.856 1010 HD2 LYS 46 HD2 LYS 46 -8.244 -1.110 -0.271 1011 HD3 LYS 46 HD1 LYS 46 -9.484 -0.310 -1.238 1012 HE2 LYS 46 HE2 LYS 46 -8.917 -1.740 -3.163 1013 HE3 LYS 46 HE1 LYS 46 -7.669 -2.537 -2.207 1014 HZ1 LYS 46 HZ1 LYS 46 -10.249 -2.476 -0.934 1015 HZ2 LYS 46 HZ2 LYS 46 -9.170 -3.771 -1.143 1016 HZ3 LYS 46 HZ3 LYS 46 -10.238 -3.343 -2.392 1017 H TYR 47 HN TYR 47 -5.246 2.901 0.751 1018 HA TYR 47 HA TYR 47 -6.704 5.213 1.499 1019 HB2 TYR 47 HB2 TYR 47 -5.168 3.846 2.975 1020 HB3 TYR 47 HB1 TYR 47 -3.805 4.628 2.175 1021 HD1 TYR 47 HD1 TYR 47 -3.674 7.185 2.222 1022 HD2 TYR 47 HD2 TYR 47 -6.311 4.921 4.744 1023 HE1 TYR 47 HE1 TYR 47 -3.898 9.129 3.738 1024 HE2 TYR 47 HE2 TYR 47 -6.534 6.873 6.262 1025 HH TYR 47 HH TYR 47 -5.667 8.906 6.785 1026 H ILE 48 HN ILE 48 -3.697 4.855 -0.369 1027 HA ILE 48 HA ILE 48 -3.108 7.632 -0.632 1028 HB ILE 48 HB ILE 48 -2.496 5.263 -2.421 1029 HG12 ILE 48 HG12 ILE 48 -0.700 6.855 -0.566 1030 HG13 ILE 48 HG11 ILE 48 -1.523 5.371 -0.087 1031 HG21 ILE 48 HG21 ILE 48 -0.654 6.961 -3.242 1032 HG22 ILE 48 HG22 ILE 48 -1.801 8.179 -2.683 1033 HG23 ILE 48 HG23 ILE 48 -2.274 7.032 -3.933 1034 HD11 ILE 48 HD11 ILE 48 -0.361 4.097 -1.772 1035 HD12 ILE 48 HD12 ILE 48 0.847 5.027 -0.890 1036 HD13 ILE 48 HD13 ILE 48 0.316 5.560 -2.485 1037 H ALA 49 HN ALA 49 -5.044 5.438 -2.675 1038 HA ALA 49 HA ALA 49 -5.633 7.293 -4.733 1039 HB1 ALA 49 HB1 ALA 49 -7.417 5.112 -3.608 1040 HB2 ALA 49 HB2 ALA 49 -6.197 4.890 -4.860 1041 HB3 ALA 49 HB3 ALA 49 -7.612 5.892 -5.177 1042 H PHE 50 HN PHE 50 -7.045 6.859 -1.530 1043 HA PHE 50 HA PHE 50 -9.342 8.501 -1.896 1044 HB2 PHE 50 HB2 PHE 50 -8.489 6.956 0.120 1045 HB3 PHE 50 HB1 PHE 50 -7.882 8.488 0.740 1046 HD1 PHE 50 HD1 PHE 50 -9.563 10.476 0.880 1047 HD2 PHE 50 HD2 PHE 50 -10.748 6.381 0.341 1048 HE1 PHE 50 HE1 PHE 50 -11.861 11.034 1.641 1049 HE2 PHE 50 HE2 PHE 50 -13.033 6.942 1.099 1050 HZ PHE 50 HZ PHE 50 -13.595 9.263 1.749 1051 H LEU 51 HN LEU 51 -6.065 9.289 -0.703 1052 HA LEU 51 HA LEU 51 -6.530 12.097 -0.365 1053 HB2 LEU 51 HB2 LEU 51 -3.997 10.526 -0.921 1054 HB3 LEU 51 HB1 LEU 51 -4.008 12.241 -0.521 1055 HG LEU 51 HG LEU 51 -5.208 10.072 1.229 1056 HD11 LEU 51 HD11 LEU 51 -3.007 9.577 1.581 1057 HD12 LEU 51 HD12 LEU 51 -3.066 10.982 2.641 1058 HD13 LEU 51 HD13 LEU 51 -2.435 11.142 1.004 1059 HD21 LEU 51 HD21 LEU 51 -4.957 13.064 1.440 1060 HD22 LEU 51 HD22 LEU 51 -4.833 12.111 2.916 1061 HD23 LEU 51 HD23 LEU 51 -6.285 12.012 1.927 1062 H ARG 52 HN ARG 52 -5.302 10.202 -3.109 1063 HA ARG 52 HA ARG 52 -4.748 12.433 -4.816 1064 HB2 ARG 52 HB2 ARG 52 -4.013 10.005 -5.122 1065 HB3 ARG 52 HB1 ARG 52 -5.637 9.687 -5.730 1066 HG2 ARG 52 HG2 ARG 52 -5.325 11.387 -7.482 1067 HG3 ARG 52 HG1 ARG 52 -3.708 11.733 -6.866 1068 HD2 ARG 52 HD2 ARG 52 -3.113 9.326 -7.256 1069 HD3 ARG 52 HD1 ARG 52 -4.681 9.109 -8.032 1070 HE ARG 52 HE ARG 52 -2.383 10.585 -9.144 1071 HH11 ARG 52 HH21 ARG 52 -5.760 9.862 -9.220 1072 HH12 ARG 52 HH22 ARG 52 -5.948 10.306 -10.882 1073 HH21 ARG 52 HH11 ARG 52 -2.618 11.172 -11.310 1074 HH22 ARG 52 HH12 ARG 52 -4.173 11.047 -12.064 1075 H SER 53 HN SER 53 -7.652 10.496 -4.249 1076 HA SER 53 HA SER 53 -9.254 11.510 -6.353 1077 HB2 SER 53 HB2 SER 53 -9.895 9.590 -4.929 1078 HB3 SER 53 HB1 SER 53 -10.118 10.685 -3.567 1079 HG SER 53 HG SER 53 -12.088 10.315 -4.610 1080 H LYS 54 HN LYS 54 -8.073 13.039 -3.515 1081 HA LYS 54 HA LYS 54 -10.113 15.200 -3.645 1082 HB2 LYS 54 HB2 LYS 54 -7.810 14.791 -1.712 1083 HB3 LYS 54 HB1 LYS 54 -9.107 15.973 -1.548 1084 HG2 LYS 54 HG2 LYS 54 -9.627 12.991 -1.707 1085 HG3 LYS 54 HG1 LYS 54 -9.371 13.827 -0.177 1086 HD2 LYS 54 HD2 LYS 54 -11.278 15.359 -0.765 1087 HD3 LYS 54 HD1 LYS 54 -11.584 14.360 -2.184 1088 HE2 LYS 54 HE2 LYS 54 -11.521 13.260 0.630 1089 HE3 LYS 54 HE1 LYS 54 -12.999 13.769 -0.185 1090 HZ1 LYS 54 HZ1 LYS 54 -13.016 11.944 -1.439 1091 HZ2 LYS 54 HZ2 LYS 54 -11.893 11.304 -0.335 1092 HZ3 LYS 54 HZ3 LYS 54 -11.356 12.031 -1.774 1093 H GLY 55 HN GLY 55 -7.373 14.448 -5.245 1094 HA2 GLY 55 HA2 GLY 55 -6.126 15.805 -6.715 1095 HA3 GLY 55 HA1 GLY 55 -6.970 17.212 -6.072 1096 H VAL 56 HN VAL 56 -5.391 15.034 -3.838 1097 HA VAL 56 HA VAL 56 -3.791 17.140 -2.735 1098 HB VAL 56 HB VAL 56 -3.640 14.124 -2.501 1099 HG11 VAL 56 HG11 VAL 56 -2.165 14.688 -0.471 1100 HG12 VAL 56 HG12 VAL 56 -1.946 16.273 -1.212 1101 HG13 VAL 56 HG13 VAL 56 -1.408 14.822 -2.059 1102 HG21 VAL 56 HG21 VAL 56 -5.572 15.533 -1.532 1103 HG22 VAL 56 HG22 VAL 56 -4.374 16.176 -0.408 1104 HG23 VAL 56 HG23 VAL 56 -4.736 14.452 -0.422 1105 H ASP 57 HN ASP 57 -3.369 15.105 -5.457 1106 HA ASP 57 HA ASP 57 -1.644 14.878 -7.015 1107 HB2 ASP 57 HB2 ASP 57 -0.699 17.466 -5.729 1108 HB3 ASP 57 HB1 ASP 57 -0.083 16.788 -7.230 1109 H LEU 58 HN LEU 58 -1.355 13.236 -4.919 1110 HA LEU 58 HA LEU 58 1.004 13.492 -3.359 1111 HB2 LEU 58 HB2 LEU 58 -0.973 11.779 -3.203 1112 HB3 LEU 58 HB1 LEU 58 -0.019 10.825 -4.333 1113 HG LEU 58 HG LEU 58 1.923 11.004 -2.735 1114 HD11 LEU 58 HD11 LEU 58 1.630 12.754 -1.267 1115 HD12 LEU 58 HD12 LEU 58 0.911 11.491 -0.276 1116 HD13 LEU 58 HD13 LEU 58 -0.123 12.572 -1.208 1117 HD21 LEU 58 HD21 LEU 58 0.317 9.062 -2.861 1118 HD22 LEU 58 HD22 LEU 58 -0.558 9.775 -1.508 1119 HD23 LEU 58 HD23 LEU 58 1.110 9.245 -1.298 1120 H ASN 59 HN ASN 59 0.785 13.375 -6.644 1121 HA ASN 59 HA ASN 59 2.820 11.532 -7.424 1122 HB2 ASN 59 HB2 ASN 59 1.749 14.088 -8.629 1123 HB3 ASN 59 HB1 ASN 59 3.049 13.186 -9.408 1124 HD21 ASN 59 HD21 ASN 59 1.204 10.896 -7.807 1125 HD22 ASN 59 HD22 ASN 59 0.160 10.462 -9.071 1126 H ALA 60 HN ALA 60 2.976 14.944 -6.432 1127 HA ALA 60 HA ALA 60 5.778 15.268 -6.949 1128 HB1 ALA 60 HB1 ALA 60 5.619 17.273 -5.614 1129 HB2 ALA 60 HB2 ALA 60 4.145 16.696 -4.836 1130 HB3 ALA 60 HB3 ALA 60 4.130 17.129 -6.545 1131 H LEU 61 HN LEU 61 3.994 14.149 -4.090 1132 HA LEU 61 HA LEU 61 6.188 14.139 -2.279 1133 HB2 LEU 61 HB2 LEU 61 3.716 13.785 -1.746 1134 HB3 LEU 61 HB1 LEU 61 3.925 12.134 -2.325 1135 HG LEU 61 HG LEU 61 5.972 12.125 -0.623 1136 HD11 LEU 61 HD11 LEU 61 5.472 14.627 -0.135 1137 HD12 LEU 61 HD12 LEU 61 5.766 13.565 1.238 1138 HD13 LEU 61 HD13 LEU 61 4.116 14.028 0.819 1139 HD21 LEU 61 HD21 LEU 61 3.103 11.977 0.356 1140 HD22 LEU 61 HD22 LEU 61 4.497 11.190 1.088 1141 HD23 LEU 61 HD23 LEU 61 3.936 10.682 -0.504 1142 H PHE 62 HN PHE 62 4.955 11.561 -4.426 1143 HA PHE 62 HA PHE 62 6.917 9.610 -3.676 1144 HB2 PHE 62 HB2 PHE 62 4.959 9.986 -5.899 1145 HB3 PHE 62 HB1 PHE 62 6.287 8.873 -6.226 1146 HD1 PHE 62 HD2 PHE 62 3.367 9.546 -4.047 1147 HD2 PHE 62 HD1 PHE 62 6.491 6.778 -5.057 1148 HE1 PHE 62 HE2 PHE 62 2.233 7.774 -2.732 1149 HE2 PHE 62 HE1 PHE 62 5.354 5.012 -3.743 1150 HZ PHE 62 HZ PHE 62 3.221 5.511 -2.582 1151 H ASP 63 HN ASP 63 6.820 11.969 -6.344 1152 HA ASP 63 HA ASP 63 9.325 11.230 -7.485 1153 HB2 ASP 63 HB2 ASP 63 7.635 12.716 -8.577 1154 HB3 ASP 63 HB1 ASP 63 8.065 13.988 -7.434 1155 H ARG 64 HN ARG 64 8.464 13.313 -4.766 1156 HA ARG 64 HA ARG 64 11.002 14.571 -4.453 1157 HB2 ARG 64 HB2 ARG 64 8.661 14.935 -3.248 1158 HB3 ARG 64 HB1 ARG 64 9.314 13.804 -2.070 1159 HG2 ARG 64 HG2 ARG 64 10.932 16.213 -2.924 1160 HG3 ARG 64 HG1 ARG 64 9.677 16.365 -1.702 1161 HD2 ARG 64 HD2 ARG 64 10.762 14.729 -0.284 1162 HD3 ARG 64 HD1 ARG 64 11.945 14.362 -1.535 1163 HE ARG 64 HE ARG 64 13.076 16.392 -1.030 1164 HH11 ARG 64 HH21 ARG 64 10.027 16.109 0.567 1165 HH12 ARG 64 HH22 ARG 64 10.316 17.443 1.632 1166 HH21 ARG 64 HH11 ARG 64 13.464 18.135 0.344 1167 HH22 ARG 64 HH12 ARG 64 12.262 18.593 1.505 1168 H ILE 65 HN ILE 65 9.672 11.611 -2.935 1169 HA ILE 65 HA ILE 65 12.138 10.919 -1.612 1170 HB ILE 65 HB ILE 65 9.724 9.253 -2.387 1171 HG12 ILE 65 HG12 ILE 65 10.605 10.295 0.321 1172 HG13 ILE 65 HG11 ILE 65 9.461 11.147 -0.717 1173 HG21 ILE 65 HG21 ILE 65 11.515 7.699 -2.140 1174 HG22 ILE 65 HG22 ILE 65 10.689 7.702 -0.582 1175 HG23 ILE 65 HG23 ILE 65 12.199 8.590 -0.781 1176 HD11 ILE 65 HD11 ILE 65 7.910 9.306 -0.650 1177 HD12 ILE 65 HD12 ILE 65 8.382 9.651 1.014 1178 HD13 ILE 65 HD13 ILE 65 9.087 8.275 0.163 1179 H ILE 66 HN ILE 66 10.636 9.887 -4.662 1180 HA ILE 66 HA ILE 66 12.810 8.101 -5.355 1181 HB ILE 66 HB ILE 66 10.596 9.315 -7.036 1182 HG12 ILE 66 HG12 ILE 66 10.863 6.514 -5.909 1183 HG13 ILE 66 HG11 ILE 66 9.977 7.800 -5.086 1184 HG21 ILE 66 HG21 ILE 66 11.150 7.329 -8.534 1185 HG22 ILE 66 HG22 ILE 66 12.639 7.153 -7.605 1186 HG23 ILE 66 HG23 ILE 66 12.345 8.625 -8.528 1187 HD11 ILE 66 HD11 ILE 66 8.584 8.087 -7.147 1188 HD12 ILE 66 HD12 ILE 66 8.405 6.497 -6.405 1189 HD13 ILE 66 HD13 ILE 66 9.402 6.690 -7.848 1190 H VAL 67 HN VAL 67 12.336 11.495 -5.543 1191 HA VAL 67 HA VAL 67 13.671 13.206 -6.413 1192 HB VAL 67 HB VAL 67 15.760 11.126 -7.068 1193 HG11 VAL 67 HG11 VAL 67 17.287 12.970 -6.536 1194 HG12 VAL 67 HG12 VAL 67 15.921 13.994 -6.096 1195 HG13 VAL 67 HG13 VAL 67 16.133 13.476 -7.768 1196 HG21 VAL 67 HG21 VAL 67 16.569 11.634 -4.671 1197 HG22 VAL 67 HG22 VAL 67 15.193 10.544 -4.831 1198 HG23 VAL 67 HG23 VAL 67 14.935 12.228 -4.374 1199 H ASN 68 HN ASN 68 14.594 10.430 -8.438 1200 HA ASN 68 HA ASN 68 14.357 10.065 -10.735 1201 HB2 ASN 68 HB2 ASN 68 11.913 10.644 -10.050 1202 HB3 ASN 68 HB1 ASN 68 12.231 12.210 -10.797 1203 HD21 ASN 68 HD21 ASN 68 13.253 8.888 -11.751 1204 HD22 ASN 68 HD22 ASN 68 12.602 8.979 -13.315 1205 H LYS 69 HN LYS 69 15.472 10.845 -12.485 1206 HA LYS 69 HA LYS 69 17.005 13.243 -12.239 1207 HB2 LYS 69 HB2 LYS 69 17.630 11.286 -13.669 1208 HB3 LYS 69 HB1 LYS 69 16.329 11.722 -14.778 1209 HG2 LYS 69 HG2 LYS 69 17.370 13.895 -15.195 1210 HG3 LYS 69 HG1 LYS 69 18.641 13.534 -14.027 1211 HD2 LYS 69 HD2 LYS 69 19.351 11.604 -15.399 1212 HD3 LYS 69 HD1 LYS 69 18.093 11.984 -16.576 1213 HE2 LYS 69 HE2 LYS 69 19.116 14.191 -16.969 1214 HE3 LYS 69 HE1 LYS 69 20.369 13.824 -15.785 1215 HZ1 LYS 69 HZ1 LYS 69 21.113 13.402 -18.051 1216 HZ2 LYS 69 HZ2 LYS 69 19.852 12.286 -18.273 1217 HZ3 LYS 69 HZ3 LYS 69 21.080 11.970 -17.142 1218 H LEU 70 HN LEU 70 15.225 14.737 -11.696 1219 HA LEU 70 HA LEU 70 13.352 15.477 -13.839 1220 HB2 LEU 70 HB2 LEU 70 12.947 15.468 -11.251 1221 HB3 LEU 70 HB1 LEU 70 13.802 17.008 -11.274 1222 HG LEU 70 HG LEU 70 12.098 17.562 -13.243 1223 HD11 LEU 70 HD11 LEU 70 11.189 15.143 -13.049 1224 HD12 LEU 70 HD12 LEU 70 10.009 16.449 -13.137 1225 HD13 LEU 70 HD13 LEU 70 10.385 15.704 -11.585 1226 HD21 LEU 70 HD21 LEU 70 12.193 18.832 -11.172 1227 HD22 LEU 70 HD22 LEU 70 11.390 17.532 -10.293 1228 HD23 LEU 70 HD23 LEU 70 10.505 18.450 -11.510 1229 H GLU 71 HN GLU 71 16.553 16.164 -13.094 1230 HA GLU 71 HA GLU 71 18.022 17.875 -13.730 1231 HB2 GLU 71 HB2 GLU 71 15.916 17.806 -15.874 1232 HB3 GLU 71 HB1 GLU 71 17.146 19.066 -15.934 1233 HG2 GLU 71 HG2 GLU 71 18.115 16.262 -15.482 1234 HG3 GLU 71 HG1 GLU 71 17.508 16.648 -17.091 1235 H HIS 72 HN HIS 72 15.825 20.015 -15.192 1236 HA HIS 72 HA HIS 72 14.811 21.364 -12.858 1237 HB2 HIS 72 HB2 HIS 72 17.335 21.815 -12.742 1238 HB3 HIS 72 HB1 HIS 72 17.124 22.776 -14.205 1239 HD2 HIS 72 HD2 HIS 72 15.773 25.242 -13.827 1240 HE1 HIS 72 HE1 HIS 72 15.373 24.908 -9.636 1241 HE2 HIS 72 HE2 HIS 72 15.102 26.463 -11.622 1242 H HIS 73 HN HIS 73 13.719 20.554 -15.301 1243 HA HIS 73 HA HIS 73 13.649 22.624 -17.286 1244 HB2 HIS 73 HB2 HIS 73 12.016 20.198 -16.625 1245 HB3 HIS 73 HB1 HIS 73 11.241 21.409 -17.643 1246 HD2 HIS 73 HD2 HIS 73 13.738 22.224 -19.603 1247 HE1 HIS 73 HE1 HIS 73 14.055 18.081 -20.365 1248 HE2 HIS 73 HE2 HIS 73 14.698 20.391 -21.194 1249 H HIS 74 HN HIS 74 11.819 22.063 -14.311 1250 HA HIS 74 HA HIS 74 9.970 24.257 -14.933 1251 HB2 HIS 74 HB2 HIS 74 9.617 22.043 -13.473 1252 HB3 HIS 74 HB1 HIS 74 10.184 23.086 -12.170 1253 HD2 HIS 74 HD2 HIS 74 7.278 23.184 -14.893 1254 HE1 HIS 74 HE1 HIS 74 6.150 25.567 -11.597 1255 HE2 HIS 74 HE2 HIS 74 5.401 24.655 -13.843 1256 H HIS 75 HN HIS 75 11.157 26.142 -15.040 1257 HA HIS 75 HA HIS 75 12.985 26.881 -12.839 1258 HB2 HIS 75 HB2 HIS 75 13.703 27.470 -15.069 1259 HB3 HIS 75 HB1 HIS 75 12.162 28.252 -15.414 1260 HD2 HIS 75 HD2 HIS 75 13.386 30.806 -15.708 1261 HE1 HIS 75 HE1 HIS 75 14.633 31.143 -11.688 1262 HE2 HIS 75 HE2 HIS 75 14.362 32.388 -13.882 1263 H HIS 76 HN HIS 76 9.974 28.105 -14.336 1264 HA HIS 76 HA HIS 76 8.926 28.877 -11.740 1265 HB2 HIS 76 HB2 HIS 76 10.478 30.757 -12.136 1266 HB3 HIS 76 HB1 HIS 76 9.702 31.069 -13.690 1267 HD2 HIS 76 HD2 HIS 76 7.311 30.217 -10.729 1268 HE1 HIS 76 HE1 HIS 76 7.056 34.378 -11.400 1269 HE2 HIS 76 HE2 HIS 76 6.047 32.420 -10.143 1270 H HIS 77 HN HIS 77 6.715 28.824 -11.882 1271 HA HIS 77 HA HIS 77 5.396 29.467 -14.451 1272 HB2 HIS 77 HB2 HIS 77 6.028 26.886 -14.155 1273 HB3 HIS 77 HB1 HIS 77 4.581 26.873 -13.152 1274 HD2 HIS 77 HD2 HIS 77 5.262 28.461 -16.761 1275 HE1 HIS 77 HE1 HIS 77 1.569 26.414 -16.810 1276 HE2 HIS 77 HE2 HIS 77 3.179 27.810 -18.187 Start of MODEL 5 1 H1 MET 1 HT1 MET 1 10.502 15.357 10.484 2 H2 MET 1 HT2 MET 1 11.432 14.432 9.405 3 H3 MET 1 HT3 MET 1 10.442 13.663 10.551 4 HA MET 1 HA MET 1 8.514 14.868 9.423 5 HB2 MET 1 HB2 MET 1 10.003 16.368 8.104 6 HB3 MET 1 HB1 MET 1 10.629 14.959 7.248 7 HG2 MET 1 HG2 MET 1 8.408 14.457 6.369 8 HG3 MET 1 HG1 MET 1 7.711 15.785 7.297 9 HE1 MET 1 HE1 MET 1 7.182 18.087 5.906 10 HE2 MET 1 HE2 MET 1 8.713 18.946 5.755 11 HE3 MET 1 HE3 MET 1 8.359 18.045 7.227 12 H GLU 2 HN GLU 2 8.164 12.596 10.128 13 HA GLU 2 HA GLU 2 9.099 10.426 8.425 14 HB2 GLU 2 HB2 GLU 2 7.032 10.544 10.634 15 HB3 GLU 2 HB1 GLU 2 7.496 9.055 9.806 16 HG2 GLU 2 HG2 GLU 2 9.836 9.385 10.500 17 HG3 GLU 2 HG1 GLU 2 9.388 10.890 11.306 18 H LEU 3 HN LEU 3 7.353 8.860 7.523 19 HA LEU 3 HA LEU 3 5.913 10.203 5.461 20 HB2 LEU 3 HB2 LEU 3 6.626 7.853 5.269 21 HB3 LEU 3 HB1 LEU 3 5.537 7.402 6.578 22 HG LEU 3 HG LEU 3 3.598 8.073 5.229 23 HD11 LEU 3 HD11 LEU 3 4.272 9.841 3.856 24 HD12 LEU 3 HD12 LEU 3 4.193 8.513 2.701 25 HD13 LEU 3 HD13 LEU 3 5.751 9.027 3.352 26 HD21 LEU 3 HD21 LEU 3 5.587 6.225 3.887 27 HD22 LEU 3 HD22 LEU 3 3.909 6.374 3.363 28 HD23 LEU 3 HD23 LEU 3 4.278 5.782 4.983 29 H SER 4 HN SER 4 4.799 8.757 8.520 30 HA SER 4 HA SER 4 2.029 9.370 8.132 31 HB2 SER 4 HB2 SER 4 2.495 7.765 9.804 32 HB3 SER 4 HB1 SER 4 3.703 8.791 10.572 33 HG SER 4 HG SER 4 0.913 9.319 10.410 34 H ASN 5 HN ASN 5 4.721 11.220 9.460 35 HA ASN 5 HA ASN 5 3.245 13.298 10.713 36 HB2 ASN 5 HB2 ASN 5 5.706 13.004 10.908 37 HB3 ASN 5 HB1 ASN 5 5.883 13.506 9.227 38 HD21 ASN 5 HD21 ASN 5 4.505 15.737 8.852 39 HD22 ASN 5 HD22 ASN 5 4.838 16.935 10.008 40 H GLU 6 HN GLU 6 4.431 13.051 7.344 41 HA GLU 6 HA GLU 6 3.211 15.552 6.548 42 HB2 GLU 6 HB2 GLU 6 4.135 13.185 4.893 43 HB3 GLU 6 HB1 GLU 6 3.631 14.739 4.226 44 HG2 GLU 6 HG2 GLU 6 5.402 15.836 5.642 45 HG3 GLU 6 HG1 GLU 6 5.970 14.223 6.081 46 H LEU 7 HN LEU 7 2.174 12.206 6.677 47 HA LEU 7 HA LEU 7 -0.147 12.405 5.032 48 HB2 LEU 7 HB2 LEU 7 0.987 10.323 6.142 49 HB3 LEU 7 HB1 LEU 7 -0.030 10.701 7.527 50 HG LEU 7 HG LEU 7 -2.020 10.681 5.970 51 HD11 LEU 7 HD11 LEU 7 -1.368 10.873 3.767 52 HD12 LEU 7 HD12 LEU 7 -1.334 9.118 3.856 53 HD13 LEU 7 HD13 LEU 7 0.159 10.033 4.022 54 HD21 LEU 7 HD21 LEU 7 -0.449 8.086 6.049 55 HD22 LEU 7 HD22 LEU 7 -2.203 8.262 6.002 56 HD23 LEU 7 HD23 LEU 7 -1.307 8.755 7.437 57 H LYS 8 HN LYS 8 0.341 12.971 8.512 58 HA LYS 8 HA LYS 8 -2.378 13.586 9.152 59 HB2 LYS 8 HB2 LYS 8 0.222 14.521 10.411 60 HB3 LYS 8 HB1 LYS 8 -1.369 14.798 11.119 61 HG2 LYS 8 HG2 LYS 8 -0.585 11.996 10.347 62 HG3 LYS 8 HG1 LYS 8 0.063 12.681 11.834 63 HD2 LYS 8 HD2 LYS 8 -2.895 12.922 11.327 64 HD3 LYS 8 HD1 LYS 8 -2.255 11.361 11.840 65 HE2 LYS 8 HE2 LYS 8 -1.782 13.980 13.296 66 HE3 LYS 8 HE1 LYS 8 -2.978 12.769 13.764 67 HZ1 LYS 8 HZ1 LYS 8 -1.415 11.461 14.637 68 HZ2 LYS 8 HZ2 LYS 8 -0.411 12.832 14.606 69 HZ3 LYS 8 HZ3 LYS 8 -0.343 11.696 13.344 70 H VAL 9 HN VAL 9 0.328 15.557 8.004 71 HA VAL 9 HA VAL 9 -0.943 18.097 8.216 72 HB VAL 9 HB VAL 9 1.120 17.104 6.225 73 HG11 VAL 9 HG11 VAL 9 1.610 19.607 6.055 74 HG12 VAL 9 HG12 VAL 9 0.054 19.869 6.843 75 HG13 VAL 9 HG13 VAL 9 0.123 19.064 5.276 76 HG21 VAL 9 HG21 VAL 9 1.623 17.105 8.747 77 HG22 VAL 9 HG22 VAL 9 1.504 18.861 8.660 78 HG23 VAL 9 HG23 VAL 9 2.738 18.014 7.728 79 H GLU 10 HN GLU 10 -0.937 15.700 5.563 80 HA GLU 10 HA GLU 10 -2.387 17.191 3.660 81 HB2 GLU 10 HB2 GLU 10 -1.504 15.127 2.924 82 HB3 GLU 10 HB1 GLU 10 -2.201 14.240 4.275 83 HG2 GLU 10 HG2 GLU 10 -4.008 15.619 2.295 84 HG3 GLU 10 HG1 GLU 10 -3.309 14.050 1.902 85 H ARG 11 HN ARG 11 -3.676 15.004 6.200 86 HA ARG 11 HA ARG 11 -6.422 15.554 5.632 87 HB2 ARG 11 HB2 ARG 11 -6.077 13.665 6.976 88 HB3 ARG 11 HB1 ARG 11 -4.952 14.502 8.042 89 HG2 ARG 11 HG2 ARG 11 -6.643 15.480 9.299 90 HG3 ARG 11 HG1 ARG 11 -7.772 15.528 7.946 91 HD2 ARG 11 HD2 ARG 11 -8.165 13.809 9.894 92 HD3 ARG 11 HD1 ARG 11 -8.416 13.303 8.224 93 HE ARG 11 HE ARG 11 -5.715 12.756 8.863 94 HH11 ARG 11 HH21 ARG 11 -8.909 11.902 9.803 95 HH12 ARG 11 HH22 ARG 11 -8.499 10.279 10.245 96 HH21 ARG 11 HH11 ARG 11 -5.147 10.630 9.429 97 HH22 ARG 11 HH12 ARG 11 -6.365 9.557 10.034 98 H ILE 12 HN ILE 12 -4.111 17.137 7.829 99 HA ILE 12 HA ILE 12 -5.985 18.976 8.969 100 HB ILE 12 HB ILE 12 -2.996 19.180 8.508 101 HG12 ILE 12 HG12 ILE 12 -4.515 18.694 11.081 102 HG13 ILE 12 HG11 ILE 12 -4.003 17.370 10.036 103 HG21 ILE 12 HG21 ILE 12 -4.931 20.974 9.988 104 HG22 ILE 12 HG22 ILE 12 -3.736 21.429 8.772 105 HG23 ILE 12 HG23 ILE 12 -3.212 20.930 10.380 106 HD11 ILE 12 HD11 ILE 12 -1.732 17.764 10.419 107 HD12 ILE 12 HD12 ILE 12 -2.434 18.139 11.992 108 HD13 ILE 12 HD13 ILE 12 -1.995 19.445 10.891 109 H ARG 13 HN ARG 13 -3.854 19.233 6.110 110 HA ARG 13 HA ARG 13 -4.538 21.915 5.414 111 HB2 ARG 13 HB2 ARG 13 -2.637 20.709 4.398 112 HB3 ARG 13 HB1 ARG 13 -3.756 19.608 3.598 113 HG2 ARG 13 HG2 ARG 13 -4.751 21.531 2.374 114 HG3 ARG 13 HG1 ARG 13 -3.588 22.606 3.150 115 HD2 ARG 13 HD2 ARG 13 -2.751 20.198 1.526 116 HD3 ARG 13 HD1 ARG 13 -2.971 21.796 0.811 117 HE ARG 13 HE ARG 13 -1.256 22.123 3.029 118 HH11 ARG 13 HH21 ARG 13 -1.398 20.432 0.033 119 HH12 ARG 13 HH22 ARG 13 0.305 20.533 -0.262 120 HH21 ARG 13 HH11 ARG 13 0.971 22.281 2.658 121 HH22 ARG 13 HH12 ARG 13 1.649 21.583 1.224 122 H LEU 14 HN LEU 14 -5.979 18.809 4.420 123 HA LEU 14 HA LEU 14 -8.136 20.256 2.989 124 HB2 LEU 14 HB2 LEU 14 -7.668 17.277 3.354 125 HB3 LEU 14 HB1 LEU 14 -8.834 18.021 2.258 126 HG LEU 14 HG LEU 14 -5.830 18.417 2.129 127 HD11 LEU 14 HD11 LEU 14 -6.063 17.088 0.004 128 HD12 LEU 14 HD12 LEU 14 -7.724 16.726 0.474 129 HD13 LEU 14 HD13 LEU 14 -6.381 16.158 1.466 130 HD21 LEU 14 HD21 LEU 14 -6.614 19.289 -0.237 131 HD22 LEU 14 HD22 LEU 14 -6.727 20.355 1.159 132 HD23 LEU 14 HD23 LEU 14 -8.165 19.521 0.571 133 H SER 15 HN SER 15 -7.509 19.424 6.121 134 HA SER 15 HA SER 15 -8.851 18.873 7.992 135 HB2 SER 15 HB2 SER 15 -11.012 20.306 7.954 136 HB3 SER 15 HB1 SER 15 -9.470 21.153 7.890 137 HG SER 15 HG SER 15 -11.288 21.588 6.259 138 H LEU 16 HN LEU 16 -9.019 16.827 6.154 139 HA LEU 16 HA LEU 16 -11.798 16.268 5.479 140 HB2 LEU 16 HB2 LEU 16 -9.695 15.487 4.214 141 HB3 LEU 16 HB1 LEU 16 -9.528 14.277 5.483 142 HG LEU 16 HG LEU 16 -11.873 13.524 4.994 143 HD11 LEU 16 HD11 LEU 16 -11.643 15.740 2.989 144 HD12 LEU 16 HD12 LEU 16 -13.054 15.164 3.871 145 HD13 LEU 16 HD13 LEU 16 -12.473 14.274 2.469 146 HD21 LEU 16 HD21 LEU 16 -9.822 12.438 4.055 147 HD22 LEU 16 HD22 LEU 16 -9.992 13.445 2.618 148 HD23 LEU 16 HD23 LEU 16 -11.236 12.264 3.018 149 H THR 17 HN THR 17 -13.004 14.419 6.331 150 HA THR 17 HA THR 17 -12.452 13.988 9.232 151 HB THR 17 HB THR 17 -14.846 13.176 9.228 152 HG1 THR 17 HG1 THR 17 -14.401 13.405 6.596 153 HG21 THR 17 HG21 THR 17 -15.780 15.428 9.095 154 HG22 THR 17 HG22 THR 17 -14.391 15.974 8.154 155 HG23 THR 17 HG23 THR 17 -14.182 15.498 9.840 156 H ALA 18 HN ALA 18 -12.073 11.978 10.040 157 HA ALA 18 HA ALA 18 -11.230 9.857 8.312 158 HB1 ALA 18 HB1 ALA 18 -11.885 9.983 11.261 159 HB2 ALA 18 HB2 ALA 18 -10.293 9.915 10.505 160 HB3 ALA 18 HB3 ALA 18 -11.341 8.496 10.489 161 H LYS 19 HN LYS 19 -14.256 10.479 10.036 162 HA LYS 19 HA LYS 19 -15.488 7.954 9.580 163 HB2 LYS 19 HB2 LYS 19 -16.350 9.716 11.132 164 HB3 LYS 19 HB1 LYS 19 -16.840 10.665 9.729 165 HG2 LYS 19 HG2 LYS 19 -18.319 8.851 8.991 166 HG3 LYS 19 HG1 LYS 19 -17.804 7.858 10.356 167 HD2 LYS 19 HD2 LYS 19 -18.684 9.557 11.921 168 HD3 LYS 19 HD1 LYS 19 -19.216 10.536 10.553 169 HE2 LYS 19 HE2 LYS 19 -20.693 8.715 9.808 170 HE3 LYS 19 HE1 LYS 19 -20.150 7.714 11.155 171 HZ1 LYS 19 HZ1 LYS 19 -22.274 9.374 11.218 172 HZ2 LYS 19 HZ2 LYS 19 -21.065 10.330 11.936 173 HZ3 LYS 19 HZ3 LYS 19 -21.447 8.806 12.585 174 H SER 20 HN SER 20 -15.496 10.933 7.631 175 HA SER 20 HA SER 20 -17.274 10.025 5.604 176 HB2 SER 20 HB2 SER 20 -16.210 11.768 4.196 177 HB3 SER 20 HB1 SER 20 -16.569 12.374 5.811 178 HG SER 20 HG SER 20 -14.345 12.667 4.782 179 H VAL 21 HN VAL 21 -13.720 9.816 5.823 180 HA VAL 21 HA VAL 21 -13.367 8.487 3.304 181 HB VAL 21 HB VAL 21 -11.650 8.537 5.799 182 HG11 VAL 21 HG11 VAL 21 -10.982 6.585 4.588 183 HG12 VAL 21 HG12 VAL 21 -9.838 7.845 4.129 184 HG13 VAL 21 HG13 VAL 21 -11.148 7.406 3.035 185 HG21 VAL 21 HG21 VAL 21 -12.125 10.681 4.505 186 HG22 VAL 21 HG22 VAL 21 -11.276 9.942 3.146 187 HG23 VAL 21 HG23 VAL 21 -10.422 10.249 4.659 188 H ALA 22 HN ALA 22 -13.696 7.245 6.620 189 HA ALA 22 HA ALA 22 -13.249 4.518 6.090 190 HB1 ALA 22 HB1 ALA 22 -14.804 4.139 8.075 191 HB2 ALA 22 HB2 ALA 22 -15.058 5.885 8.091 192 HB3 ALA 22 HB3 ALA 22 -13.445 5.225 8.365 193 H GLU 23 HN GLU 23 -16.376 6.263 6.028 194 HA GLU 23 HA GLU 23 -17.876 3.963 5.159 195 HB2 GLU 23 HB2 GLU 23 -18.805 6.057 6.254 196 HB3 GLU 23 HB1 GLU 23 -18.596 6.867 4.704 197 HG2 GLU 23 HG2 GLU 23 -20.820 6.134 4.576 198 HG3 GLU 23 HG1 GLU 23 -19.960 4.844 3.741 199 H GLU 24 HN GLU 24 -16.568 6.772 3.372 200 HA GLU 24 HA GLU 24 -17.562 6.031 0.813 201 HB2 GLU 24 HB2 GLU 24 -16.770 8.211 0.832 202 HB3 GLU 24 HB1 GLU 24 -15.404 7.811 1.861 203 HG2 GLU 24 HG2 GLU 24 -14.741 8.462 -0.458 204 HG3 GLU 24 HG1 GLU 24 -14.191 6.851 -0.014 205 H MET 25 HN MET 25 -14.397 5.336 2.305 206 HA MET 25 HA MET 25 -13.397 3.787 0.127 207 HB2 MET 25 HB2 MET 25 -12.791 3.872 3.075 208 HB3 MET 25 HB1 MET 25 -11.960 2.745 2.006 209 HG2 MET 25 HG2 MET 25 -11.211 4.625 0.602 210 HG3 MET 25 HG1 MET 25 -12.065 5.754 1.654 211 HE1 MET 25 HE1 MET 25 -8.172 3.497 2.371 212 HE2 MET 25 HE2 MET 25 -9.022 3.804 0.863 213 HE3 MET 25 HE3 MET 25 -9.660 2.623 2.002 214 H GLY 26 HN GLY 26 -15.339 2.887 2.968 215 HA2 GLY 26 HA2 GLY 26 -16.982 1.053 2.738 216 HA3 GLY 26 HA1 GLY 26 -15.852 0.232 1.662 217 H ILE 27 HN ILE 27 -14.498 1.809 4.402 218 HA ILE 27 HA ILE 27 -14.245 -0.808 5.846 219 HB ILE 27 HB ILE 27 -11.981 -0.107 6.526 220 HG12 ILE 27 HG12 ILE 27 -12.384 2.203 4.608 221 HG13 ILE 27 HG11 ILE 27 -12.387 2.360 6.361 222 HG21 ILE 27 HG21 ILE 27 -12.203 0.132 3.525 223 HG22 ILE 27 HG22 ILE 27 -12.475 -1.392 4.368 224 HG23 ILE 27 HG23 ILE 27 -10.902 -0.599 4.467 225 HD11 ILE 27 HD11 ILE 27 -10.170 2.910 5.537 226 HD12 ILE 27 HD12 ILE 27 -10.090 1.393 4.642 227 HD13 ILE 27 HD13 ILE 27 -10.089 1.378 6.405 228 H SER 28 HN SER 28 -13.819 -0.530 8.185 229 HA SER 28 HA SER 28 -15.641 1.448 9.312 230 HB2 SER 28 HB2 SER 28 -15.432 0.236 11.309 231 HB3 SER 28 HB1 SER 28 -15.172 -1.002 10.082 232 HG SER 28 HG SER 28 -12.871 -0.428 10.323 233 H ARG 29 HN ARG 29 -14.953 2.790 11.195 234 HA ARG 29 HA ARG 29 -12.778 4.523 10.524 235 HB2 ARG 29 HB2 ARG 29 -14.404 4.157 13.053 236 HB3 ARG 29 HB1 ARG 29 -13.156 5.396 12.897 237 HG2 ARG 29 HG2 ARG 29 -14.305 6.411 11.028 238 HG3 ARG 29 HG1 ARG 29 -15.472 5.090 10.967 239 HD2 ARG 29 HD2 ARG 29 -16.418 7.072 12.093 240 HD3 ARG 29 HD1 ARG 29 -16.302 5.704 13.199 241 HE ARG 29 HE ARG 29 -13.933 7.312 13.388 242 HH11 ARG 29 HH21 ARG 29 -17.299 7.230 14.112 243 HH12 ARG 29 HH22 ARG 29 -17.163 8.231 15.517 244 HH21 ARG 29 HH11 ARG 29 -13.729 8.618 15.228 245 HH22 ARG 29 HH12 ARG 29 -15.139 9.017 16.151 246 H GLN 30 HN GLN 30 -13.062 1.760 12.700 247 HA GLN 30 HA GLN 30 -10.588 2.058 14.078 248 HB2 GLN 30 HB2 GLN 30 -12.392 0.439 14.697 249 HB3 GLN 30 HB1 GLN 30 -11.976 -0.523 13.281 250 HG2 GLN 30 HG2 GLN 30 -10.868 -1.471 15.229 251 HG3 GLN 30 HG1 GLN 30 -9.648 -0.751 14.180 252 HE21 GLN 30 HE21 GLN 30 -8.112 -0.080 15.748 253 HE22 GLN 30 HE22 GLN 30 -8.463 1.013 16.998 254 H GLN 31 HN GLN 31 -11.373 0.428 11.007 255 HA GLN 31 HA GLN 31 -8.734 -0.596 10.529 256 HB2 GLN 31 HB2 GLN 31 -10.981 0.135 8.630 257 HB3 GLN 31 HB1 GLN 31 -9.503 -0.688 8.128 258 HG2 GLN 31 HG2 GLN 31 -9.977 -2.542 9.643 259 HG3 GLN 31 HG1 GLN 31 -11.407 -1.708 10.255 260 HE21 GLN 31 HE21 GLN 31 -10.384 -3.979 7.953 261 HE22 GLN 31 HE22 GLN 31 -11.738 -3.925 6.932 262 H LEU 32 HN LEU 32 -10.327 2.441 9.587 263 HA LEU 32 HA LEU 32 -8.151 3.451 8.033 264 HB2 LEU 32 HB2 LEU 32 -10.383 4.442 7.908 265 HB3 LEU 32 HB1 LEU 32 -10.294 4.917 9.601 266 HG LEU 32 HG LEU 32 -8.452 6.444 9.119 267 HD11 LEU 32 HD11 LEU 32 -7.187 5.466 7.394 268 HD12 LEU 32 HD12 LEU 32 -7.984 6.797 6.561 269 HD13 LEU 32 HD13 LEU 32 -8.607 5.156 6.395 270 HD21 LEU 32 HD21 LEU 32 -9.698 8.088 7.916 271 HD22 LEU 32 HD22 LEU 32 -10.905 7.071 8.702 272 HD23 LEU 32 HD23 LEU 32 -10.556 6.858 6.989 273 H CYS 33 HN CYS 33 -8.951 3.718 11.478 274 HA CYS 33 HA CYS 33 -6.873 5.519 12.212 275 HB2 CYS 33 HB2 CYS 33 -8.164 3.287 13.807 276 HB3 CYS 33 HB1 CYS 33 -7.141 4.547 14.497 277 HG CYS 33 HG CYS 33 -9.838 5.209 13.051 278 H ASN 34 HN ASN 34 -6.879 2.036 11.680 279 HA ASN 34 HA ASN 34 -4.353 1.441 12.856 280 HB2 ASN 34 HB2 ASN 34 -6.195 -0.135 11.857 281 HB3 ASN 34 HB1 ASN 34 -5.329 0.084 10.339 282 HD21 ASN 34 HD21 ASN 34 -5.443 -2.470 11.566 283 HD22 ASN 34 HD22 ASN 34 -3.896 -2.885 12.129 284 H ILE 35 HN ILE 35 -5.232 2.537 9.588 285 HA ILE 35 HA ILE 35 -2.572 2.454 8.514 286 HB ILE 35 HB ILE 35 -4.823 4.336 7.744 287 HG12 ILE 35 HG12 ILE 35 -4.159 1.596 6.624 288 HG13 ILE 35 HG11 ILE 35 -5.448 1.889 7.788 289 HG21 ILE 35 HG21 ILE 35 -2.701 4.979 6.756 290 HG22 ILE 35 HG22 ILE 35 -3.669 4.193 5.509 291 HG23 ILE 35 HG23 ILE 35 -2.361 3.311 6.297 292 HD11 ILE 35 HD11 ILE 35 -6.484 3.500 6.208 293 HD12 ILE 35 HD12 ILE 35 -6.368 1.879 5.522 294 HD13 ILE 35 HD13 ILE 35 -5.223 3.128 5.031 295 H GLU 36 HN GLU 36 -4.431 5.049 10.104 296 HA GLU 36 HA GLU 36 -2.469 7.097 9.878 297 HB2 GLU 36 HB2 GLU 36 -4.770 7.541 10.633 298 HB3 GLU 36 HB1 GLU 36 -4.480 6.606 12.100 299 HG2 GLU 36 HG2 GLU 36 -2.761 8.189 12.814 300 HG3 GLU 36 HG1 GLU 36 -2.933 9.092 11.308 301 H GLN 37 HN GLN 37 -2.613 4.253 11.831 302 HA GLN 37 HA GLN 37 -0.494 5.193 13.677 303 HB2 GLN 37 HB2 GLN 37 -2.036 2.593 13.445 304 HB3 GLN 37 HB1 GLN 37 -0.758 2.867 14.629 305 HG2 GLN 37 HG2 GLN 37 -1.992 4.748 15.580 306 HG3 GLN 37 HG1 GLN 37 -3.244 4.579 14.349 307 HE21 GLN 37 HE21 GLN 37 -4.414 4.359 16.685 308 HE22 GLN 37 HE22 GLN 37 -4.643 2.756 17.196 309 H SER 38 HN SER 38 -0.324 4.521 10.618 310 HA SER 38 HA SER 38 1.357 2.260 10.273 311 HB2 SER 38 HB2 SER 38 0.359 3.363 8.355 312 HB3 SER 38 HB1 SER 38 1.202 4.864 8.727 313 HG SER 38 HG SER 38 3.136 3.865 8.249 314 H GLU 39 HN GLU 39 3.581 1.996 10.415 315 HA GLU 39 HA GLU 39 5.185 4.313 11.463 316 HB2 GLU 39 HB2 GLU 39 4.622 2.587 13.215 317 HB3 GLU 39 HB1 GLU 39 5.502 1.399 12.252 318 HG2 GLU 39 HG2 GLU 39 7.041 2.225 13.900 319 HG3 GLU 39 HG1 GLU 39 7.508 2.956 12.366 320 H THR 40 HN THR 40 5.642 1.001 10.178 321 HA THR 40 HA THR 40 7.794 2.070 8.374 322 HB THR 40 HB THR 40 7.512 -0.705 9.582 323 HG1 THR 40 HG1 THR 40 8.293 0.566 11.150 324 HG21 THR 40 HG21 THR 40 8.570 -0.910 7.439 325 HG22 THR 40 HG22 THR 40 9.859 -0.948 8.642 326 HG23 THR 40 HG23 THR 40 9.556 0.524 7.720 327 H ALA 41 HN ALA 41 7.307 1.896 6.226 328 HA ALA 41 HA ALA 41 4.805 0.560 5.473 329 HB1 ALA 41 HB1 ALA 41 6.737 2.405 4.080 330 HB2 ALA 41 HB2 ALA 41 5.038 2.676 4.474 331 HB3 ALA 41 HB3 ALA 41 5.475 1.576 3.168 332 HA PRO 42 HA PRO 42 6.668 -3.104 3.719 333 HB2 PRO 42 HB2 PRO 42 4.830 -3.736 1.787 334 HB3 PRO 42 HB1 PRO 42 4.511 -3.940 3.522 335 HG2 PRO 42 HG2 PRO 42 3.684 -1.718 1.698 336 HG3 PRO 42 HG1 PRO 42 2.743 -2.562 2.942 337 HD2 PRO 42 HD2 PRO 42 3.866 -0.120 3.391 338 HD3 PRO 42 HD1 PRO 42 3.675 -1.330 4.682 339 H VAL 43 HN VAL 43 7.889 -3.829 1.907 340 HA VAL 43 HA VAL 43 9.022 -1.828 0.198 341 HB VAL 43 HB VAL 43 9.921 -3.899 -1.051 342 HG11 VAL 43 HG11 VAL 43 11.505 -4.378 0.718 343 HG12 VAL 43 HG12 VAL 43 10.379 -3.795 1.943 344 HG13 VAL 43 HG13 VAL 43 11.103 -2.663 0.800 345 HG21 VAL 43 HG21 VAL 43 8.785 -5.358 1.345 346 HG22 VAL 43 HG22 VAL 43 9.514 -6.048 -0.106 347 HG23 VAL 43 HG23 VAL 43 7.923 -5.294 -0.190 348 H VAL 44 HN VAL 44 6.061 -3.432 0.020 349 HA VAL 44 HA VAL 44 5.709 -3.841 -2.770 350 HB VAL 44 HB VAL 44 3.709 -3.025 -0.639 351 HG11 VAL 44 HG11 VAL 44 2.066 -4.067 -2.298 352 HG12 VAL 44 HG12 VAL 44 3.349 -3.948 -3.500 353 HG13 VAL 44 HG13 VAL 44 2.711 -2.487 -2.746 354 HG21 VAL 44 HG21 VAL 44 3.252 -5.358 -0.430 355 HG22 VAL 44 HG22 VAL 44 5.011 -5.230 -0.438 356 HG23 VAL 44 HG23 VAL 44 4.157 -5.743 -1.893 357 H VAL 45 HN VAL 45 5.159 -0.952 -0.763 358 HA VAL 45 HA VAL 45 4.108 0.722 -2.810 359 HB VAL 45 HB VAL 45 5.772 1.408 -0.369 360 HG11 VAL 45 HG11 VAL 45 4.254 3.140 -2.331 361 HG12 VAL 45 HG12 VAL 45 5.937 3.292 -1.825 362 HG13 VAL 45 HG13 VAL 45 4.638 3.683 -0.698 363 HG21 VAL 45 HG21 VAL 45 2.782 1.508 -0.888 364 HG22 VAL 45 HG22 VAL 45 3.585 1.952 0.618 365 HG23 VAL 45 HG23 VAL 45 3.607 0.277 0.068 366 H LYS 46 HN LYS 46 7.469 0.211 -1.740 367 HA LYS 46 HA LYS 46 8.669 2.061 -3.548 368 HB2 LYS 46 HB2 LYS 46 9.779 -0.497 -2.359 369 HB3 LYS 46 HB1 LYS 46 10.738 0.746 -3.168 370 HG2 LYS 46 HG2 LYS 46 10.056 2.406 -1.518 371 HG3 LYS 46 HG1 LYS 46 9.004 1.227 -0.733 372 HD2 LYS 46 HD2 LYS 46 11.015 -0.205 -0.307 373 HD3 LYS 46 HD1 LYS 46 12.022 1.091 -0.955 374 HE2 LYS 46 HE2 LYS 46 10.099 1.458 1.352 375 HE3 LYS 46 HE1 LYS 46 11.815 1.109 1.558 376 HZ1 LYS 46 HZ1 LYS 46 11.093 3.532 1.580 377 HZ2 LYS 46 HZ2 LYS 46 10.884 3.372 -0.098 378 HZ3 LYS 46 HZ3 LYS 46 12.415 3.127 0.597 379 H TYR 47 HN TYR 47 7.881 -1.388 -3.880 380 HA TYR 47 HA TYR 47 9.129 -1.830 -6.394 381 HB2 TYR 47 HB2 TYR 47 8.106 -3.593 -4.892 382 HB3 TYR 47 HB1 TYR 47 6.524 -3.077 -5.474 383 HD1 TYR 47 HD2 TYR 47 9.835 -4.378 -6.580 384 HD2 TYR 47 HD1 TYR 47 5.695 -3.822 -7.579 385 HE1 TYR 47 HE2 TYR 47 10.126 -5.801 -8.594 386 HE2 TYR 47 HE1 TYR 47 5.993 -5.245 -9.590 387 HH TYR 47 HH TYR 47 7.372 -6.692 -10.627 388 H ILE 48 HN ILE 48 5.928 -0.537 -5.573 389 HA ILE 48 HA ILE 48 4.916 -0.390 -8.243 390 HB ILE 48 HB ILE 48 4.355 1.318 -5.799 391 HG12 ILE 48 HG12 ILE 48 2.710 -0.875 -7.100 392 HG13 ILE 48 HG11 ILE 48 3.801 -1.153 -5.743 393 HG21 ILE 48 HG21 ILE 48 3.038 1.232 -8.526 394 HG22 ILE 48 HG22 ILE 48 3.700 2.636 -7.689 395 HG23 ILE 48 HG23 ILE 48 2.224 1.873 -7.098 396 HD11 ILE 48 HD11 ILE 48 1.654 -0.826 -4.768 397 HD12 ILE 48 HD12 ILE 48 1.310 0.558 -5.805 398 HD13 ILE 48 HD13 ILE 48 2.510 0.696 -4.521 399 H ALA 49 HN ALA 49 6.792 1.901 -6.269 400 HA ALA 49 HA ALA 49 6.844 4.030 -8.154 401 HB1 ALA 49 HB1 ALA 49 8.981 4.690 -6.984 402 HB2 ALA 49 HB2 ALA 49 8.858 3.197 -6.051 403 HB3 ALA 49 HB3 ALA 49 7.611 4.438 -5.901 404 H PHE 50 HN PHE 50 8.790 1.106 -7.842 405 HA PHE 50 HA PHE 50 10.842 1.763 -9.702 406 HB2 PHE 50 HB2 PHE 50 10.611 -0.284 -8.122 407 HB3 PHE 50 HB1 PHE 50 9.657 -1.007 -9.414 408 HD1 PHE 50 HD2 PHE 50 10.688 -1.340 -11.685 409 HD2 PHE 50 HD1 PHE 50 12.987 -0.118 -8.270 410 HE1 PHE 50 HE2 PHE 50 12.774 -2.003 -12.850 411 HE2 PHE 50 HE1 PHE 50 15.072 -0.781 -9.435 412 HZ PHE 50 HZ PHE 50 14.966 -1.723 -11.725 413 H LEU 51 HN LEU 51 7.737 0.077 -10.201 414 HA LEU 51 HA LEU 51 8.029 -0.041 -13.080 415 HB2 LEU 51 HB2 LEU 51 5.616 -0.348 -11.275 416 HB3 LEU 51 HB1 LEU 51 5.607 -0.679 -13.004 417 HG LEU 51 HG LEU 51 7.459 -2.026 -11.017 418 HD11 LEU 51 HD11 LEU 51 5.299 -2.821 -10.478 419 HD12 LEU 51 HD12 LEU 51 5.936 -4.033 -11.589 420 HD13 LEU 51 HD13 LEU 51 4.782 -2.830 -12.164 421 HD21 LEU 51 HD21 LEU 51 7.040 -2.230 -13.992 422 HD22 LEU 51 HD22 LEU 51 7.482 -3.685 -13.103 423 HD23 LEU 51 HD23 LEU 51 8.541 -2.282 -13.069 424 H ARG 52 HN ARG 52 6.359 2.131 -10.838 425 HA ARG 52 HA ARG 52 4.939 3.690 -12.741 426 HB2 ARG 52 HB2 ARG 52 4.777 3.764 -10.182 427 HB3 ARG 52 HB1 ARG 52 6.205 4.795 -10.229 428 HG2 ARG 52 HG2 ARG 52 5.013 6.376 -11.709 429 HG3 ARG 52 HG1 ARG 52 3.575 5.359 -11.621 430 HD2 ARG 52 HD2 ARG 52 3.624 5.631 -9.117 431 HD3 ARG 52 HD1 ARG 52 4.933 6.795 -9.329 432 HE ARG 52 HE ARG 52 2.417 7.311 -10.807 433 HH11 ARG 52 HH21 ARG 52 4.521 8.002 -8.143 434 HH12 ARG 52 HH22 ARG 52 3.800 9.540 -7.816 435 HH21 ARG 52 HH11 ARG 52 1.477 9.303 -10.372 436 HH22 ARG 52 HH12 ARG 52 2.080 10.274 -9.070 437 H SER 53 HN SER 53 8.246 4.005 -11.483 438 HA SER 53 HA SER 53 8.922 6.449 -12.754 439 HB2 SER 53 HB2 SER 53 10.598 4.052 -11.990 440 HB3 SER 53 HB1 SER 53 11.299 5.523 -12.657 441 HG SER 53 HG SER 53 10.720 6.614 -10.886 442 H LYS 54 HN LYS 54 8.462 3.270 -14.052 443 HA LYS 54 HA LYS 54 9.852 3.936 -16.583 444 HB2 LYS 54 HB2 LYS 54 8.404 1.460 -15.614 445 HB3 LYS 54 HB1 LYS 54 9.084 1.615 -17.235 446 HG2 LYS 54 HG2 LYS 54 11.310 2.013 -16.280 447 HG3 LYS 54 HG1 LYS 54 10.642 1.912 -14.651 448 HD2 LYS 54 HD2 LYS 54 9.919 -0.417 -15.110 449 HD3 LYS 54 HD1 LYS 54 10.653 -0.312 -16.711 450 HE2 LYS 54 HE2 LYS 54 12.165 0.114 -14.120 451 HE3 LYS 54 HE1 LYS 54 12.140 -1.404 -15.014 452 HZ1 LYS 54 HZ1 LYS 54 12.779 0.292 -16.952 453 HZ2 LYS 54 HZ2 LYS 54 13.935 -0.512 -15.999 454 HZ3 LYS 54 HZ3 LYS 54 13.492 1.087 -15.634 455 H GLY 55 HN GLY 55 6.981 4.758 -15.277 456 HA2 GLY 55 HA2 GLY 55 5.174 5.841 -16.368 457 HA3 GLY 55 HA1 GLY 55 5.803 5.276 -17.915 458 H VAL 56 HN VAL 56 5.413 2.910 -15.397 459 HA VAL 56 HA VAL 56 3.536 1.414 -17.010 460 HB VAL 56 HB VAL 56 4.489 1.068 -14.152 461 HG11 VAL 56 HG11 VAL 56 3.502 -1.264 -14.427 462 HG12 VAL 56 HG12 VAL 56 2.626 -0.641 -15.827 463 HG13 VAL 56 HG13 VAL 56 2.324 0.031 -14.223 464 HG21 VAL 56 HG21 VAL 56 5.154 -0.197 -16.821 465 HG22 VAL 56 HG22 VAL 56 5.585 -0.961 -15.297 466 HG23 VAL 56 HG23 VAL 56 6.243 0.621 -15.705 467 H ASP 57 HN ASP 57 1.354 1.434 -16.974 468 HA ASP 57 HA ASP 57 -0.006 3.588 -15.632 469 HB2 ASP 57 HB2 ASP 57 -1.157 1.159 -17.029 470 HB3 ASP 57 HB1 ASP 57 -2.034 2.637 -16.632 471 H LEU 58 HN LEU 58 -0.152 3.495 -13.441 472 HA LEU 58 HA LEU 58 -0.822 0.944 -12.092 473 HB2 LEU 58 HB2 LEU 58 -0.361 2.115 -10.044 474 HB3 LEU 58 HB1 LEU 58 0.899 2.567 -11.189 475 HG LEU 58 HG LEU 58 -1.015 4.509 -11.701 476 HD11 LEU 58 HD11 LEU 58 -0.961 4.293 -8.689 477 HD12 LEU 58 HD12 LEU 58 -2.240 3.533 -9.635 478 HD13 LEU 58 HD13 LEU 58 -2.012 5.280 -9.707 479 HD21 LEU 58 HD21 LEU 58 1.265 5.115 -11.463 480 HD22 LEU 58 HD22 LEU 58 1.351 4.485 -9.819 481 HD23 LEU 58 HD23 LEU 58 0.443 5.959 -10.153 482 H ASN 59 HN ASN 59 -2.327 3.742 -13.344 483 HA ASN 59 HA ASN 59 -4.590 3.983 -11.620 484 HB2 ASN 59 HB2 ASN 59 -5.662 4.953 -13.757 485 HB3 ASN 59 HB1 ASN 59 -4.205 5.753 -13.163 486 HD21 ASN 59 HD21 ASN 59 -2.160 5.318 -14.318 487 HD22 ASN 59 HD22 ASN 59 -2.176 4.711 -15.902 488 H ALA 60 HN ALA 60 -3.991 2.014 -14.512 489 HA ALA 60 HA ALA 60 -6.620 0.918 -14.729 490 HB1 ALA 60 HB1 ALA 60 -3.906 -0.123 -15.568 491 HB2 ALA 60 HB2 ALA 60 -5.129 0.642 -16.582 492 HB3 ALA 60 HB3 ALA 60 -5.406 -0.975 -15.933 493 H LEU 61 HN LEU 61 -3.696 -0.340 -13.100 494 HA LEU 61 HA LEU 61 -4.907 -2.717 -12.081 495 HB2 LEU 61 HB2 LEU 61 -2.512 -1.064 -11.288 496 HB3 LEU 61 HB1 LEU 61 -3.021 -2.409 -10.270 497 HG LEU 61 HG LEU 61 -2.857 -3.942 -12.196 498 HD11 LEU 61 HD11 LEU 61 -3.352 -2.470 -14.038 499 HD12 LEU 61 HD12 LEU 61 -1.706 -3.059 -14.269 500 HD13 LEU 61 HD13 LEU 61 -1.981 -1.430 -13.646 501 HD21 LEU 61 HD21 LEU 61 -0.460 -4.028 -12.298 502 HD22 LEU 61 HD22 LEU 61 -0.869 -3.393 -10.705 503 HD23 LEU 61 HD23 LEU 61 -0.321 -2.300 -11.975 504 H PHE 62 HN PHE 62 -4.636 0.550 -10.718 505 HA PHE 62 HA PHE 62 -5.868 -0.136 -8.195 506 HB2 PHE 62 HB2 PHE 62 -5.268 2.437 -9.644 507 HB3 PHE 62 HB1 PHE 62 -6.241 2.456 -8.175 508 HD1 PHE 62 HD2 PHE 62 -3.223 0.399 -9.164 509 HD2 PHE 62 HD1 PHE 62 -4.916 3.247 -6.422 510 HE1 PHE 62 HE2 PHE 62 -1.181 0.282 -7.784 511 HE2 PHE 62 HE1 PHE 62 -2.862 3.132 -5.049 512 HZ PHE 62 HZ PHE 62 -0.995 1.648 -5.726 513 H ASP 63 HN ASP 63 -7.089 1.225 -11.236 514 HA ASP 63 HA ASP 63 -9.707 1.858 -10.447 515 HB2 ASP 63 HB2 ASP 63 -8.491 0.888 -13.028 516 HB3 ASP 63 HB1 ASP 63 -10.242 1.063 -12.914 517 H ARG 64 HN ARG 64 -8.355 -1.298 -11.370 518 HA ARG 64 HA ARG 64 -10.874 -2.701 -11.165 519 HB2 ARG 64 HB2 ARG 64 -8.502 -4.366 -10.581 520 HB3 ARG 64 HB1 ARG 64 -9.657 -4.498 -11.906 521 HG2 ARG 64 HG2 ARG 64 -8.468 -2.470 -12.932 522 HG3 ARG 64 HG1 ARG 64 -7.212 -2.753 -11.733 523 HD2 ARG 64 HD2 ARG 64 -6.371 -4.001 -13.490 524 HD3 ARG 64 HD1 ARG 64 -7.346 -5.236 -12.692 525 HE ARG 64 HE ARG 64 -9.127 -4.102 -14.449 526 HH11 ARG 64 HH21 ARG 64 -5.915 -5.318 -14.666 527 HH12 ARG 64 HH22 ARG 64 -6.067 -5.809 -16.319 528 HH21 ARG 64 HH11 ARG 64 -9.347 -4.720 -16.610 529 HH22 ARG 64 HH12 ARG 64 -8.015 -5.471 -17.424 530 H ILE 65 HN ILE 65 -8.259 -1.981 -8.893 531 HA ILE 65 HA ILE 65 -9.359 -3.590 -6.740 532 HB ILE 65 HB ILE 65 -7.360 -1.312 -6.698 533 HG12 ILE 65 HG12 ILE 65 -6.903 -4.303 -6.498 534 HG13 ILE 65 HG11 ILE 65 -6.768 -3.403 -8.008 535 HG21 ILE 65 HG21 ILE 65 -8.244 -1.511 -4.493 536 HG22 ILE 65 HG22 ILE 65 -6.739 -2.430 -4.476 537 HG23 ILE 65 HG23 ILE 65 -8.285 -3.272 -4.587 538 HD11 ILE 65 HD11 ILE 65 -4.553 -3.549 -7.079 539 HD12 ILE 65 HD12 ILE 65 -5.123 -3.028 -5.494 540 HD13 ILE 65 HD13 ILE 65 -5.100 -1.890 -6.841 541 H ILE 66 HN ILE 66 -8.912 -0.039 -6.806 542 HA ILE 66 HA ILE 66 -11.019 0.323 -4.847 543 HB ILE 66 HB ILE 66 -10.639 2.793 -5.418 544 HG12 ILE 66 HG12 ILE 66 -8.208 1.755 -6.878 545 HG13 ILE 66 HG11 ILE 66 -9.702 2.092 -7.754 546 HG21 ILE 66 HG21 ILE 66 -8.387 0.973 -4.527 547 HG22 ILE 66 HG22 ILE 66 -9.545 1.823 -3.504 548 HG23 ILE 66 HG23 ILE 66 -8.318 2.730 -4.388 549 HD11 ILE 66 HD11 ILE 66 -8.450 4.130 -5.910 550 HD12 ILE 66 HD12 ILE 66 -9.633 4.394 -7.191 551 HD13 ILE 66 HD13 ILE 66 -7.966 3.992 -7.599 552 H VAL 67 HN VAL 67 -13.036 1.339 -5.147 553 HA VAL 67 HA VAL 67 -15.049 1.790 -6.234 554 HB VAL 67 HB VAL 67 -13.441 2.173 -8.767 555 HG11 VAL 67 HG11 VAL 67 -15.203 3.774 -9.285 556 HG12 VAL 67 HG12 VAL 67 -15.932 3.528 -7.700 557 HG13 VAL 67 HG13 VAL 67 -15.932 2.220 -8.882 558 HG21 VAL 67 HG21 VAL 67 -12.265 3.452 -7.106 559 HG22 VAL 67 HG22 VAL 67 -13.774 3.999 -6.374 560 HG23 VAL 67 HG23 VAL 67 -13.303 4.588 -7.969 561 H ASN 68 HN ASN 68 -16.300 0.022 -6.441 562 HA ASN 68 HA ASN 68 -15.445 -2.349 -7.857 563 HB2 ASN 68 HB2 ASN 68 -17.918 -3.004 -7.465 564 HB3 ASN 68 HB1 ASN 68 -16.906 -2.748 -6.045 565 HD21 ASN 68 HD21 ASN 68 -18.546 -0.381 -8.218 566 HD22 ASN 68 HD22 ASN 68 -19.399 0.391 -6.971 567 H LYS 69 HN LYS 69 -16.156 -3.132 -9.844 568 HA LYS 69 HA LYS 69 -17.341 -1.097 -11.678 569 HB2 LYS 69 HB2 LYS 69 -15.980 -3.730 -12.320 570 HB3 LYS 69 HB1 LYS 69 -16.442 -2.482 -13.475 571 HG2 LYS 69 HG2 LYS 69 -14.451 -2.099 -11.218 572 HG3 LYS 69 HG1 LYS 69 -14.017 -2.393 -12.901 573 HD2 LYS 69 HD2 LYS 69 -15.460 -0.319 -13.444 574 HD3 LYS 69 HD1 LYS 69 -15.387 0.027 -11.718 575 HE2 LYS 69 HE2 LYS 69 -12.957 0.072 -11.777 576 HE3 LYS 69 HE1 LYS 69 -12.962 -0.380 -13.481 577 HZ1 LYS 69 HZ1 LYS 69 -14.522 1.728 -13.604 578 HZ2 LYS 69 HZ2 LYS 69 -12.830 1.857 -13.696 579 HZ3 LYS 69 HZ3 LYS 69 -13.630 2.173 -12.231 580 H LEU 70 HN LEU 70 -18.657 -3.073 -9.669 581 HA LEU 70 HA LEU 70 -20.223 -4.883 -11.297 582 HB2 LEU 70 HB2 LEU 70 -20.824 -3.759 -8.543 583 HB3 LEU 70 HB1 LEU 70 -21.564 -5.187 -9.267 584 HG LEU 70 HG LEU 70 -18.602 -4.875 -8.687 585 HD11 LEU 70 HD11 LEU 70 -20.021 -5.030 -6.645 586 HD12 LEU 70 HD12 LEU 70 -18.994 -6.447 -6.855 587 HD13 LEU 70 HD13 LEU 70 -20.707 -6.533 -7.263 588 HD21 LEU 70 HD21 LEU 70 -18.720 -6.434 -10.437 589 HD22 LEU 70 HD22 LEU 70 -20.295 -7.043 -9.926 590 HD23 LEU 70 HD23 LEU 70 -18.845 -7.480 -9.026 591 H GLU 71 HN GLU 71 -20.106 -1.736 -11.592 592 HA GLU 71 HA GLU 71 -22.518 -0.473 -11.218 593 HB2 GLU 71 HB2 GLU 71 -20.727 -0.455 -13.657 594 HB3 GLU 71 HB1 GLU 71 -22.064 0.675 -13.432 595 HG2 GLU 71 HG2 GLU 71 -21.068 1.603 -11.464 596 HG3 GLU 71 HG1 GLU 71 -19.870 0.311 -11.381 597 H HIS 72 HN HIS 72 -24.547 -0.492 -12.161 598 HA HIS 72 HA HIS 72 -25.182 -2.868 -13.834 599 HB2 HIS 72 HB2 HIS 72 -27.478 -2.495 -13.191 600 HB3 HIS 72 HB1 HIS 72 -26.488 -2.381 -11.739 601 HD2 HIS 72 HD2 HIS 72 -25.891 0.467 -11.036 602 HE1 HIS 72 HE1 HIS 72 -29.413 1.840 -12.921 603 HE2 HIS 72 HE2 HIS 72 -27.553 2.459 -11.310 604 H HIS 73 HN HIS 73 -23.895 -1.438 -15.504 605 HA HIS 73 HA HIS 73 -25.383 0.753 -16.710 606 HB2 HIS 73 HB2 HIS 73 -22.827 -0.693 -17.233 607 HB3 HIS 73 HB1 HIS 73 -23.586 0.031 -18.647 608 HD2 HIS 73 HD2 HIS 73 -22.681 2.601 -18.967 609 HE1 HIS 73 HE1 HIS 73 -22.062 3.574 -14.905 610 HE2 HIS 73 HE2 HIS 73 -21.914 4.439 -17.285 611 H HIS 74 HN HIS 74 -25.911 -2.516 -16.663 612 HA HIS 74 HA HIS 74 -27.100 -4.000 -18.048 613 HB2 HIS 74 HB2 HIS 74 -28.447 -1.353 -18.074 614 HB3 HIS 74 HB1 HIS 74 -28.921 -2.404 -19.404 615 HD2 HIS 74 HD2 HIS 74 -31.301 -3.465 -18.494 616 HE1 HIS 74 HE1 HIS 74 -29.989 -4.657 -14.662 617 HE2 HIS 74 HE2 HIS 74 -31.930 -4.714 -16.295 618 H HIS 75 HN HIS 75 -27.541 -1.370 -20.331 619 HA HIS 75 HA HIS 75 -26.784 -2.879 -22.587 620 HB2 HIS 75 HB2 HIS 75 -26.169 -0.157 -23.198 621 HB3 HIS 75 HB1 HIS 75 -27.666 -1.013 -23.552 622 HD2 HIS 75 HD2 HIS 75 -29.623 -0.817 -21.318 623 HE1 HIS 75 HE1 HIS 75 -27.901 2.750 -19.851 624 HE2 HIS 75 HE2 HIS 75 -29.923 1.224 -19.721 625 H HIS 76 HN HIS 76 -24.813 -3.965 -22.313 626 HA HIS 76 HA HIS 76 -22.434 -2.402 -22.896 627 HB2 HIS 76 HB2 HIS 76 -22.587 -2.123 -20.425 628 HB3 HIS 76 HB1 HIS 76 -22.546 -3.878 -20.248 629 HD2 HIS 76 HD2 HIS 76 -20.141 -1.996 -22.766 630 HE1 HIS 76 HE1 HIS 76 -17.798 -3.729 -19.711 631 HE2 HIS 76 HE2 HIS 76 -17.725 -2.496 -21.926 632 H HIS 77 HN HIS 77 -20.566 -3.828 -23.319 633 HA HIS 77 HA HIS 77 -19.549 -5.844 -23.968 634 HB2 HIS 77 HB2 HIS 77 -21.219 -6.780 -22.066 635 HB3 HIS 77 HB1 HIS 77 -22.020 -7.484 -23.466 636 HD2 HIS 77 HD2 HIS 77 -19.481 -8.670 -21.085 637 HE1 HIS 77 HE1 HIS 77 -18.108 -10.215 -24.767 638 HE2 HIS 77 HE2 HIS 77 -17.856 -10.347 -22.246 639 H1 MET 1 HT1 MET 1 -8.227 -12.485 -14.119 640 H2 MET 1 HT2 MET 1 -9.115 -11.147 -13.563 641 H3 MET 1 HT3 MET 1 -8.270 -12.125 -12.462 642 HA MET 1 HA MET 1 -6.245 -11.428 -13.991 643 HB2 MET 1 HB2 MET 1 -8.243 -9.143 -14.100 644 HB3 MET 1 HB1 MET 1 -6.549 -9.018 -14.570 645 HG2 MET 1 HG2 MET 1 -8.548 -10.929 -15.814 646 HG3 MET 1 HG1 MET 1 -8.061 -9.394 -16.524 647 HE1 MET 1 HE1 MET 1 -4.615 -9.751 -17.774 648 HE2 MET 1 HE2 MET 1 -4.806 -9.216 -16.108 649 HE3 MET 1 HE3 MET 1 -5.991 -8.741 -17.320 650 H GLU 2 HN GLU 2 -5.571 -11.947 -11.819 651 HA GLU 2 HA GLU 2 -6.292 -10.232 -9.589 652 HB2 GLU 2 HB2 GLU 2 -4.173 -12.364 -9.928 653 HB3 GLU 2 HB1 GLU 2 -4.464 -11.514 -8.409 654 HG2 GLU 2 HG2 GLU 2 -6.815 -12.280 -8.435 655 HG3 GLU 2 HG1 GLU 2 -6.510 -13.143 -9.943 656 H LEU 3 HN LEU 3 -4.559 -9.122 -8.284 657 HA LEU 3 HA LEU 3 -3.270 -7.099 -9.830 658 HB2 LEU 3 HB2 LEU 3 -3.916 -6.812 -7.458 659 HB3 LEU 3 HB1 LEU 3 -2.708 -8.004 -6.986 660 HG LEU 3 HG LEU 3 -0.921 -6.554 -7.886 661 HD11 LEU 3 HD11 LEU 3 -3.291 -4.881 -8.703 662 HD12 LEU 3 HD12 LEU 3 -1.839 -5.279 -9.623 663 HD13 LEU 3 HD13 LEU 3 -1.760 -4.090 -8.327 664 HD21 LEU 3 HD21 LEU 3 -1.675 -6.364 -5.522 665 HD22 LEU 3 HD22 LEU 3 -2.801 -5.096 -6.004 666 HD23 LEU 3 HD23 LEU 3 -1.064 -4.832 -6.146 667 H SER 4 HN SER 4 -1.986 -10.018 -8.240 668 HA SER 4 HA SER 4 0.743 -9.553 -9.013 669 HB2 SER 4 HB2 SER 4 -0.183 -11.172 -7.215 670 HB3 SER 4 HB1 SER 4 -0.427 -12.296 -8.549 671 HG SER 4 HG SER 4 1.950 -11.207 -7.510 672 H ASN 5 HN ASN 5 -1.973 -11.152 -10.592 673 HA ASN 5 HA ASN 5 -0.539 -12.534 -12.621 674 HB2 ASN 5 HB2 ASN 5 -2.949 -12.851 -12.220 675 HB3 ASN 5 HB1 ASN 5 -3.261 -11.204 -12.766 676 HD21 ASN 5 HD21 ASN 5 -3.494 -10.872 -15.005 677 HD22 ASN 5 HD22 ASN 5 -3.219 -12.069 -16.177 678 H GLU 6 HN GLU 6 -1.887 -9.222 -12.619 679 HA GLU 6 HA GLU 6 -0.787 -8.605 -15.233 680 HB2 GLU 6 HB2 GLU 6 -1.936 -6.872 -13.038 681 HB3 GLU 6 HB1 GLU 6 -1.376 -6.231 -14.583 682 HG2 GLU 6 HG2 GLU 6 -2.938 -7.766 -15.760 683 HG3 GLU 6 HG1 GLU 6 -3.534 -8.325 -14.197 684 H LEU 7 HN LEU 7 0.283 -8.153 -11.901 685 HA LEU 7 HA LEU 7 2.439 -6.363 -12.420 686 HB2 LEU 7 HB2 LEU 7 1.438 -7.213 -10.160 687 HB3 LEU 7 HB1 LEU 7 2.574 -8.546 -10.335 688 HG LEU 7 HG LEU 7 4.344 -6.632 -10.742 689 HD11 LEU 7 HD11 LEU 7 2.845 -4.732 -10.834 690 HD12 LEU 7 HD12 LEU 7 3.768 -4.607 -9.342 691 HD13 LEU 7 HD13 LEU 7 2.104 -5.178 -9.298 692 HD21 LEU 7 HD21 LEU 7 3.127 -7.454 -8.100 693 HD22 LEU 7 HD22 LEU 7 4.547 -6.409 -8.167 694 HD23 LEU 7 HD23 LEU 7 4.615 -8.033 -8.849 695 H LYS 8 HN LYS 8 2.349 -9.927 -12.340 696 HA LYS 8 HA LYS 8 5.123 -10.298 -12.956 697 HB2 LYS 8 HB2 LYS 8 3.608 -12.066 -12.035 698 HB3 LYS 8 HB1 LYS 8 2.807 -12.140 -13.602 699 HG2 LYS 8 HG2 LYS 8 4.846 -12.857 -14.687 700 HG3 LYS 8 HG1 LYS 8 5.778 -12.586 -13.216 701 HD2 LYS 8 HD2 LYS 8 5.352 -14.952 -13.347 702 HD3 LYS 8 HD1 LYS 8 4.315 -14.306 -12.078 703 HE2 LYS 8 HE2 LYS 8 2.381 -14.407 -13.454 704 HE3 LYS 8 HE1 LYS 8 3.338 -14.618 -14.922 705 HZ1 LYS 8 HZ1 LYS 8 4.054 -16.766 -14.110 706 HZ2 LYS 8 HZ2 LYS 8 2.357 -16.698 -14.172 707 HZ3 LYS 8 HZ3 LYS 8 3.163 -16.558 -12.682 708 H VAL 9 HN VAL 9 2.225 -10.130 -15.022 709 HA VAL 9 HA VAL 9 3.546 -10.670 -17.489 710 HB VAL 9 HB VAL 9 1.054 -9.058 -16.883 711 HG11 VAL 9 HG11 VAL 9 0.585 -9.547 -19.356 712 HG12 VAL 9 HG12 VAL 9 2.299 -9.936 -19.499 713 HG13 VAL 9 HG13 VAL 9 1.800 -8.310 -19.030 714 HG21 VAL 9 HG21 VAL 9 1.187 -11.565 -16.349 715 HG22 VAL 9 HG22 VAL 9 1.327 -11.821 -18.088 716 HG23 VAL 9 HG23 VAL 9 -0.122 -11.069 -17.422 717 H GLU 10 HN GLU 10 2.867 -7.569 -15.841 718 HA GLU 10 HA GLU 10 3.919 -5.896 -17.869 719 HB2 GLU 10 HB2 GLU 10 2.786 -5.537 -15.363 720 HB3 GLU 10 HB1 GLU 10 4.440 -5.003 -15.085 721 HG2 GLU 10 HG2 GLU 10 3.158 -3.089 -15.785 722 HG3 GLU 10 HG1 GLU 10 4.216 -3.526 -17.123 723 H ARG 11 HN ARG 11 5.514 -7.760 -15.314 724 HA ARG 11 HA ARG 11 8.125 -6.613 -15.556 725 HB2 ARG 11 HB2 ARG 11 7.399 -8.292 -13.786 726 HB3 ARG 11 HB1 ARG 11 7.526 -9.544 -15.023 727 HG2 ARG 11 HG2 ARG 11 9.928 -8.666 -15.406 728 HG3 ARG 11 HG1 ARG 11 9.723 -7.822 -13.872 729 HD2 ARG 11 HD2 ARG 11 9.360 -10.806 -14.248 730 HD3 ARG 11 HD1 ARG 11 10.816 -10.045 -13.610 731 HE ARG 11 HE ARG 11 8.369 -10.502 -12.137 732 HH11 ARG 11 HH21 ARG 11 11.006 -8.345 -12.635 733 HH12 ARG 11 HH22 ARG 11 11.020 -7.769 -11.001 734 HH21 ARG 11 HH11 ARG 11 8.380 -9.780 -9.995 735 HH22 ARG 11 HH12 ARG 11 9.531 -8.584 -9.504 736 H ILE 12 HN ILE 12 6.564 -9.332 -17.239 737 HA ILE 12 HA ILE 12 8.787 -10.025 -18.893 738 HB ILE 12 HB ILE 12 5.804 -10.359 -19.329 739 HG12 ILE 12 HG12 ILE 12 7.901 -12.404 -18.555 740 HG13 ILE 12 HG11 ILE 12 6.966 -11.504 -17.361 741 HG21 ILE 12 HG21 ILE 12 6.633 -12.182 -20.939 742 HG22 ILE 12 HG22 ILE 12 8.198 -11.372 -20.878 743 HG23 ILE 12 HG23 ILE 12 6.786 -10.517 -21.498 744 HD11 ILE 12 HD11 ILE 12 6.061 -13.817 -18.078 745 HD12 ILE 12 HD12 ILE 12 5.609 -13.028 -19.589 746 HD13 ILE 12 HD13 ILE 12 4.922 -12.472 -18.062 747 H ARG 13 HN ARG 13 6.060 -7.791 -19.438 748 HA ARG 13 HA ARG 13 6.703 -7.092 -22.119 749 HB2 ARG 13 HB2 ARG 13 5.362 -5.545 -19.891 750 HB3 ARG 13 HB1 ARG 13 5.524 -4.906 -21.528 751 HG2 ARG 13 HG2 ARG 13 4.285 -6.789 -22.440 752 HG3 ARG 13 HG1 ARG 13 4.223 -7.558 -20.853 753 HD2 ARG 13 HD2 ARG 13 2.111 -6.354 -21.430 754 HD3 ARG 13 HD1 ARG 13 2.877 -5.730 -19.969 755 HE ARG 13 HE ARG 13 3.184 -3.693 -21.092 756 HH11 ARG 13 HH21 ARG 13 2.730 -6.295 -23.304 757 HH12 ARG 13 HH22 ARG 13 2.700 -5.276 -24.704 758 HH21 ARG 13 HH11 ARG 13 3.152 -2.348 -22.904 759 HH22 ARG 13 HH12 ARG 13 2.939 -3.039 -24.477 760 H LEU 14 HN LEU 14 7.838 -5.769 -19.030 761 HA LEU 14 HA LEU 14 9.649 -3.899 -20.443 762 HB2 LEU 14 HB2 LEU 14 9.215 -4.425 -17.486 763 HB3 LEU 14 HB1 LEU 14 10.213 -3.133 -18.157 764 HG LEU 14 HG LEU 14 7.246 -3.483 -18.686 765 HD11 LEU 14 HD11 LEU 14 8.557 -1.334 -17.013 766 HD12 LEU 14 HD12 LEU 14 7.970 -2.839 -16.306 767 HD13 LEU 14 HD13 LEU 14 6.848 -1.750 -17.115 768 HD21 LEU 14 HD21 LEU 14 9.341 -1.525 -19.613 769 HD22 LEU 14 HD22 LEU 14 7.687 -0.959 -19.385 770 HD23 LEU 14 HD23 LEU 14 8.020 -2.261 -20.520 771 H SER 15 HN SER 15 9.691 -7.106 -19.724 772 HA SER 15 HA SER 15 11.387 -8.689 -19.298 773 HB2 SER 15 HB2 SER 15 13.512 -8.094 -20.649 774 HB3 SER 15 HB1 SER 15 12.002 -8.259 -21.541 775 HG SER 15 HG SER 15 13.169 -5.848 -20.590 776 H LEU 16 HN LEU 16 11.260 -7.624 -16.989 777 HA LEU 16 HA LEU 16 13.935 -6.474 -16.263 778 HB2 LEU 16 HB2 LEU 16 11.323 -6.378 -14.731 779 HB3 LEU 16 HB1 LEU 16 12.822 -5.574 -14.280 780 HG LEU 16 HG LEU 16 11.348 -5.059 -16.875 781 HD11 LEU 16 HD11 LEU 16 9.976 -4.385 -14.941 782 HD12 LEU 16 HD12 LEU 16 10.584 -2.966 -15.794 783 HD13 LEU 16 HD13 LEU 16 11.338 -3.478 -14.284 784 HD21 LEU 16 HD21 LEU 16 13.602 -4.384 -17.156 785 HD22 LEU 16 HD22 LEU 16 13.733 -3.816 -15.492 786 HD23 LEU 16 HD23 LEU 16 12.786 -2.905 -16.667 787 H THR 17 HN THR 17 15.064 -7.423 -14.532 788 HA THR 17 HA THR 17 14.242 -10.219 -13.907 789 HB THR 17 HB THR 17 16.645 -10.331 -13.039 790 HG1 THR 17 HG1 THR 17 17.025 -8.037 -14.606 791 HG21 THR 17 HG21 THR 17 16.153 -9.640 -15.948 792 HG22 THR 17 HG22 THR 17 15.982 -11.238 -15.223 793 HG23 THR 17 HG23 THR 17 17.573 -10.483 -15.331 794 H ALA 18 HN ALA 18 13.867 -10.881 -11.820 795 HA ALA 18 HA ALA 18 13.079 -8.959 -9.864 796 HB1 ALA 18 HB1 ALA 18 13.146 -10.998 -8.306 797 HB2 ALA 18 HB2 ALA 18 13.690 -11.917 -9.708 798 HB3 ALA 18 HB3 ALA 18 12.109 -11.135 -9.725 799 H LYS 19 HN LYS 19 16.071 -10.805 -10.293 800 HA LYS 19 HA LYS 19 17.311 -10.058 -7.834 801 HB2 LYS 19 HB2 LYS 19 18.125 -11.864 -9.355 802 HB3 LYS 19 HB1 LYS 19 18.653 -10.625 -10.494 803 HG2 LYS 19 HG2 LYS 19 20.160 -9.682 -8.802 804 HG3 LYS 19 HG1 LYS 19 19.609 -10.879 -7.627 805 HD2 LYS 19 HD2 LYS 19 20.432 -12.693 -9.086 806 HD3 LYS 19 HD1 LYS 19 20.997 -11.497 -10.252 807 HE2 LYS 19 HE2 LYS 19 22.855 -12.226 -8.824 808 HE3 LYS 19 HE1 LYS 19 22.482 -10.529 -8.519 809 HZ1 LYS 19 HZ1 LYS 19 21.335 -12.740 -6.913 810 HZ2 LYS 19 HZ2 LYS 19 21.338 -11.079 -6.553 811 HZ3 LYS 19 HZ3 LYS 19 22.787 -11.965 -6.500 812 H SER 20 HN SER 20 17.327 -8.514 -11.042 813 HA SER 20 HA SER 20 19.186 -6.449 -10.442 814 HB2 SER 20 HB2 SER 20 16.829 -6.512 -12.338 815 HB3 SER 20 HB1 SER 20 17.989 -5.187 -12.280 816 HG SER 20 HG SER 20 18.661 -6.669 -13.818 817 H VAL 21 HN VAL 21 15.630 -6.496 -10.088 818 HA VAL 21 HA VAL 21 15.421 -3.810 -9.121 819 HB VAL 21 HB VAL 21 13.653 -6.230 -8.668 820 HG11 VAL 21 HG11 VAL 21 11.930 -4.380 -8.162 821 HG12 VAL 21 HG12 VAL 21 13.316 -3.317 -7.927 822 HG13 VAL 21 HG13 VAL 21 13.109 -4.735 -6.900 823 HG21 VAL 21 HG21 VAL 21 13.273 -3.826 -10.475 824 HG22 VAL 21 HG22 VAL 21 12.322 -5.311 -10.455 825 HG23 VAL 21 HG23 VAL 21 13.993 -5.341 -11.021 826 H ALA 22 HN ALA 22 15.681 -6.914 -7.387 827 HA ALA 22 HA ALA 22 15.615 -5.780 -4.762 828 HB1 ALA 22 HB1 ALA 22 16.443 -7.932 -4.002 829 HB2 ALA 22 HB2 ALA 22 16.998 -8.333 -5.627 830 HB3 ALA 22 HB3 ALA 22 15.272 -8.204 -5.292 831 H GLU 23 HN GLU 23 18.251 -6.386 -7.028 832 HA GLU 23 HA GLU 23 20.434 -5.908 -5.245 833 HB2 GLU 23 HB2 GLU 23 20.585 -6.909 -7.548 834 HB3 GLU 23 HB1 GLU 23 20.298 -5.303 -8.214 835 HG2 GLU 23 HG2 GLU 23 22.675 -5.622 -8.203 836 HG3 GLU 23 HG1 GLU 23 22.320 -4.515 -6.878 837 H GLU 24 HN GLU 24 18.899 -3.685 -7.601 838 HA GLU 24 HA GLU 24 20.371 -1.371 -6.751 839 HB2 GLU 24 HB2 GLU 24 17.607 -1.376 -8.001 840 HB3 GLU 24 HB1 GLU 24 18.812 -0.096 -8.084 841 HG2 GLU 24 HG2 GLU 24 19.435 -2.847 -9.165 842 HG3 GLU 24 HG1 GLU 24 18.537 -1.686 -10.136 843 H MET 25 HN MET 25 17.214 -2.689 -5.860 844 HA MET 25 HA MET 25 16.366 -0.559 -4.158 845 HB2 MET 25 HB2 MET 25 15.718 -3.501 -4.327 846 HB3 MET 25 HB1 MET 25 14.999 -2.488 -3.076 847 HG2 MET 25 HG2 MET 25 14.889 -1.729 -5.997 848 HG3 MET 25 HG1 MET 25 13.663 -2.756 -5.260 849 HE1 MET 25 HE1 MET 25 12.677 -2.386 -3.180 850 HE2 MET 25 HE2 MET 25 11.401 -1.383 -3.858 851 HE3 MET 25 HE3 MET 25 12.265 -0.845 -2.420 852 H GLY 26 HN GLY 26 18.315 -3.462 -3.539 853 HA2 GLY 26 HA2 GLY 26 20.014 -3.608 -1.848 854 HA3 GLY 26 HA1 GLY 26 19.313 -2.200 -1.047 855 H ILE 27 HN ILE 27 17.437 -4.976 -2.134 856 HA ILE 27 HA ILE 27 16.982 -5.753 0.729 857 HB ILE 27 HB ILE 27 14.651 -6.305 0.096 858 HG12 ILE 27 HG12 ILE 27 15.314 -4.902 -2.509 859 HG13 ILE 27 HG11 ILE 27 15.104 -6.645 -2.344 860 HG21 ILE 27 HG21 ILE 27 15.235 -3.446 -0.676 861 HG22 ILE 27 HG22 ILE 27 15.416 -4.021 0.981 862 HG23 ILE 27 HG23 ILE 27 13.839 -4.083 0.195 863 HD11 ILE 27 HD11 ILE 27 12.999 -5.728 -3.092 864 HD12 ILE 27 HD12 ILE 27 13.030 -4.501 -1.824 865 HD13 ILE 27 HD13 ILE 27 12.808 -6.199 -1.403 866 H SER 28 HN SER 28 16.252 -8.009 0.974 867 HA SER 28 HA SER 28 17.972 -9.822 -0.414 868 HB2 SER 28 HB2 SER 28 17.208 -10.297 1.848 869 HB3 SER 28 HB1 SER 28 15.531 -10.322 1.311 870 HG SER 28 HG SER 28 16.268 -12.052 -0.153 871 H ARG 29 HN ARG 29 17.484 -11.412 -1.950 872 HA ARG 29 HA ARG 29 15.606 -10.721 -3.984 873 HB2 ARG 29 HB2 ARG 29 17.587 -12.061 -4.480 874 HB3 ARG 29 HB1 ARG 29 17.013 -13.352 -3.427 875 HG2 ARG 29 HG2 ARG 29 15.271 -13.949 -4.892 876 HG3 ARG 29 HG1 ARG 29 15.321 -12.401 -5.737 877 HD2 ARG 29 HD2 ARG 29 16.326 -14.255 -7.075 878 HD3 ARG 29 HD1 ARG 29 17.475 -12.965 -6.731 879 HE ARG 29 HE ARG 29 18.680 -14.453 -5.323 880 HH11 ARG 29 HH21 ARG 29 15.626 -15.714 -6.297 881 HH12 ARG 29 HH22 ARG 29 15.979 -17.329 -5.783 882 HH21 ARG 29 HH11 ARG 29 19.164 -16.553 -4.655 883 HH22 ARG 29 HH12 ARG 29 17.984 -17.806 -4.851 884 H GLN 30 HN GLN 30 15.454 -13.046 -1.311 885 HA GLN 30 HA GLN 30 12.944 -14.215 -2.012 886 HB2 GLN 30 HB2 GLN 30 14.271 -13.807 0.682 887 HB3 GLN 30 HB1 GLN 30 12.811 -14.769 0.443 888 HG2 GLN 30 HG2 GLN 30 14.001 -16.225 -1.130 889 HG3 GLN 30 HG1 GLN 30 15.460 -15.249 -0.947 890 HE21 GLN 30 HE21 GLN 30 13.902 -18.003 0.232 891 HE22 GLN 30 HE22 GLN 30 14.738 -18.159 1.702 892 H GLN 31 HN GLN 31 13.757 -11.292 -0.165 893 HA GLN 31 HA GLN 31 11.123 -10.723 0.785 894 HB2 GLN 31 HB2 GLN 31 13.250 -9.567 1.516 895 HB3 GLN 31 HB1 GLN 31 13.233 -8.693 -0.015 896 HG2 GLN 31 HG2 GLN 31 11.098 -7.679 0.520 897 HG3 GLN 31 HG1 GLN 31 10.953 -8.660 1.980 898 HE21 GLN 31 HE21 GLN 31 10.911 -5.843 2.228 899 HE22 GLN 31 HE22 GLN 31 12.347 -5.326 2.968 900 H LEU 32 HN LEU 32 12.768 -9.865 -2.241 901 HA LEU 32 HA LEU 32 10.636 -8.266 -3.281 902 HB2 LEU 32 HB2 LEU 32 12.934 -8.267 -4.223 903 HB3 LEU 32 HB1 LEU 32 12.687 -9.916 -4.792 904 HG LEU 32 HG LEU 32 10.814 -9.152 -6.208 905 HD11 LEU 32 HD11 LEU 32 9.846 -7.276 -5.217 906 HD12 LEU 32 HD12 LEU 32 10.803 -6.511 -6.480 907 HD13 LEU 32 HD13 LEU 32 11.401 -6.545 -4.823 908 HD21 LEU 32 HD21 LEU 32 13.265 -9.117 -6.946 909 HD22 LEU 32 HD22 LEU 32 13.221 -7.377 -6.675 910 HD23 LEU 32 HD23 LEU 32 12.165 -8.108 -7.884 911 H CYS 33 HN CYS 33 11.354 -11.732 -3.462 912 HA CYS 33 HA CYS 33 9.329 -12.477 -5.305 913 HB2 CYS 33 HB2 CYS 33 10.461 -14.017 -2.949 914 HB3 CYS 33 HB1 CYS 33 9.473 -14.725 -4.229 915 HG CYS 33 HG CYS 33 11.815 -15.057 -5.153 916 H ASN 34 HN ASN 34 9.179 -11.793 -1.849 917 HA ASN 34 HA ASN 34 6.563 -12.844 -1.372 918 HB2 ASN 34 HB2 ASN 34 8.027 -10.523 -0.070 919 HB3 ASN 34 HB1 ASN 34 6.533 -11.228 0.548 920 HD21 ASN 34 HD21 ASN 34 6.639 -13.587 1.183 921 HD22 ASN 34 HD22 ASN 34 8.124 -14.232 1.693 922 H ILE 35 HN ILE 35 7.702 -9.685 -2.519 923 HA ILE 35 HA ILE 35 5.187 -8.338 -2.492 924 HB ILE 35 HB ILE 35 7.589 -7.989 -4.309 925 HG12 ILE 35 HG12 ILE 35 6.669 -6.335 -1.939 926 HG13 ILE 35 HG11 ILE 35 7.859 -7.628 -1.812 927 HG21 ILE 35 HG21 ILE 35 6.561 -5.647 -4.589 928 HG22 ILE 35 HG22 ILE 35 5.068 -6.351 -3.968 929 HG23 ILE 35 HG23 ILE 35 5.776 -6.961 -5.463 930 HD11 ILE 35 HD11 ILE 35 9.503 -6.309 -2.629 931 HD12 ILE 35 HD12 ILE 35 8.391 -4.958 -2.446 932 HD13 ILE 35 HD13 ILE 35 8.517 -5.784 -3.995 933 H GLU 36 HN GLU 36 6.743 -10.207 -5.129 934 HA GLU 36 HA GLU 36 4.419 -9.796 -6.864 935 HB2 GLU 36 HB2 GLU 36 5.641 -10.991 -8.522 936 HB3 GLU 36 HB1 GLU 36 6.834 -10.030 -7.649 937 HG2 GLU 36 HG2 GLU 36 7.201 -12.099 -6.184 938 HG3 GLU 36 HG1 GLU 36 6.285 -12.990 -7.398 939 H GLN 37 HN GLN 37 5.200 -11.933 -4.358 940 HA GLN 37 HA GLN 37 3.308 -14.032 -5.347 941 HB2 GLN 37 HB2 GLN 37 5.355 -14.030 -3.111 942 HB3 GLN 37 HB1 GLN 37 4.226 -15.352 -3.409 943 HG2 GLN 37 HG2 GLN 37 5.122 -15.660 -5.658 944 HG3 GLN 37 HG1 GLN 37 6.191 -14.276 -5.447 945 HE21 GLN 37 HE21 GLN 37 7.683 -16.350 -6.029 946 HE22 GLN 37 HE22 GLN 37 8.356 -17.117 -4.673 947 H SER 38 HN SER 38 2.815 -11.253 -4.065 948 HA SER 38 HA SER 38 1.681 -11.677 -1.472 949 HB2 SER 38 HB2 SER 38 0.870 -9.480 -1.651 950 HB3 SER 38 HB1 SER 38 2.272 -9.459 -2.719 951 HG SER 38 HG SER 38 -0.339 -9.087 -3.296 952 H GLU 39 HN GLU 39 -0.613 -11.683 -0.934 953 HA GLU 39 HA GLU 39 -2.311 -13.016 -3.022 954 HB2 GLU 39 HB2 GLU 39 -1.727 -14.506 -1.147 955 HB3 GLU 39 HB1 GLU 39 -2.386 -13.332 -0.007 956 HG2 GLU 39 HG2 GLU 39 -4.604 -13.584 -0.909 957 HG3 GLU 39 HG1 GLU 39 -4.007 -14.566 -2.249 958 H THR 40 HN THR 40 -2.491 -10.943 -0.108 959 HA THR 40 HA THR 40 -4.898 -9.609 -1.317 960 HB THR 40 HB THR 40 -4.252 -10.023 1.619 961 HG1 THR 40 HG1 THR 40 -6.427 -11.051 0.143 962 HG21 THR 40 HG21 THR 40 -6.590 -9.115 1.893 963 HG22 THR 40 HG22 THR 40 -6.554 -8.676 0.185 964 HG23 THR 40 HG23 THR 40 -5.417 -7.934 1.311 965 H ALA 41 HN ALA 41 -4.667 -7.442 -1.646 966 HA ALA 41 HA ALA 41 -2.126 -6.183 -0.959 967 HB1 ALA 41 HB1 ALA 41 -3.318 -4.145 -2.043 968 HB2 ALA 41 HB2 ALA 41 -4.603 -5.289 -2.434 969 HB3 ALA 41 HB3 ALA 41 -2.977 -5.537 -3.072 970 HA PRO 42 HA PRO 42 -3.568 -4.374 2.868 971 HB2 PRO 42 HB2 PRO 42 -1.871 -2.224 3.078 972 HB3 PRO 42 HB1 PRO 42 -1.359 -3.898 3.365 973 HG2 PRO 42 HG2 PRO 42 -1.002 -2.209 0.926 974 HG3 PRO 42 HG1 PRO 42 0.137 -3.321 1.701 975 HD2 PRO 42 HD2 PRO 42 -1.301 -3.995 -0.527 976 HD3 PRO 42 HD1 PRO 42 -0.798 -5.190 0.690 977 H VAL 43 HN VAL 43 -4.831 -2.617 3.676 978 HA VAL 43 HA VAL 43 -6.451 -1.231 1.753 979 HB VAL 43 HB VAL 43 -7.251 0.051 3.808 980 HG11 VAL 43 HG11 VAL 43 -7.196 -2.975 3.756 981 HG12 VAL 43 HG12 VAL 43 -8.457 -1.910 3.134 982 HG13 VAL 43 HG13 VAL 43 -8.200 -2.051 4.873 983 HG21 VAL 43 HG21 VAL 43 -6.445 -0.670 5.976 984 HG22 VAL 43 HG22 VAL 43 -5.044 -0.193 5.015 985 HG23 VAL 43 HG23 VAL 43 -5.422 -1.901 5.237 986 H VAL 44 HN VAL 44 -3.564 -0.331 3.534 987 HA VAL 44 HA VAL 44 -3.519 2.429 3.436 988 HB VAL 44 HB VAL 44 -1.121 2.307 3.365 989 HG11 VAL 44 HG11 VAL 44 -2.056 -0.347 4.490 990 HG12 VAL 44 HG12 VAL 44 -2.283 1.196 5.310 991 HG13 VAL 44 HG13 VAL 44 -0.657 0.593 5.003 992 HG21 VAL 44 HG21 VAL 44 -0.113 -0.029 2.680 993 HG22 VAL 44 HG22 VAL 44 -0.584 1.106 1.415 994 HG23 VAL 44 HG23 VAL 44 -1.647 -0.233 1.834 995 H VAL 45 HN VAL 45 -3.046 0.214 0.719 996 HA VAL 45 HA VAL 45 -2.234 2.151 -1.214 997 HB VAL 45 HB VAL 45 -3.775 -0.438 -1.564 998 HG11 VAL 45 HG11 VAL 45 -2.801 -0.264 -3.917 999 HG12 VAL 45 HG12 VAL 45 -2.429 1.418 -3.538 1000 HG13 VAL 45 HG13 VAL 45 -4.105 0.866 -3.548 1001 HG21 VAL 45 HG21 VAL 45 -0.846 0.086 -2.103 1002 HG22 VAL 45 HG22 VAL 45 -1.662 -1.465 -1.903 1003 HG23 VAL 45 HG23 VAL 45 -1.411 -0.415 -0.509 1004 H LYS 46 HN LYS 46 -5.459 0.921 -0.335 1005 HA LYS 46 HA LYS 46 -6.921 2.456 -2.244 1006 HB2 LYS 46 HB2 LYS 46 -7.730 1.445 0.499 1007 HB3 LYS 46 HB1 LYS 46 -8.850 2.088 -0.703 1008 HG2 LYS 46 HG2 LYS 46 -8.207 0.333 -2.285 1009 HG3 LYS 46 HG1 LYS 46 -7.026 -0.296 -1.135 1010 HD2 LYS 46 HD2 LYS 46 -8.864 -0.719 0.485 1011 HD3 LYS 46 HD1 LYS 46 -10.026 -0.160 -0.719 1012 HE2 LYS 46 HE2 LYS 46 -8.088 -2.423 -1.234 1013 HE3 LYS 46 HE1 LYS 46 -9.716 -2.680 -0.607 1014 HZ1 LYS 46 HZ1 LYS 46 -10.673 -2.008 -2.554 1015 HZ2 LYS 46 HZ2 LYS 46 -9.253 -2.722 -3.156 1016 HZ3 LYS 46 HZ3 LYS 46 -9.362 -1.033 -3.009 1017 H TYR 47 HN TYR 47 -5.928 3.153 1.097 1018 HA TYR 47 HA TYR 47 -7.245 5.672 1.351 1019 HB2 TYR 47 HB2 TYR 47 -6.233 4.418 3.253 1020 HB3 TYR 47 HB1 TYR 47 -4.632 4.776 2.613 1021 HD1 TYR 47 HD1 TYR 47 -7.774 6.379 3.835 1022 HD2 TYR 47 HD2 TYR 47 -3.565 6.833 3.110 1023 HE1 TYR 47 HE1 TYR 47 -7.806 8.562 5.012 1024 HE2 TYR 47 HE2 TYR 47 -3.605 9.016 4.285 1025 HH TYR 47 HH TYR 47 -4.979 10.660 5.058 1026 H ILE 48 HN ILE 48 -3.967 4.840 0.227 1027 HA ILE 48 HA ILE 48 -3.083 7.516 -0.243 1028 HB ILE 48 HB ILE 48 -2.315 4.901 -1.574 1029 HG12 ILE 48 HG12 ILE 48 -0.814 6.561 0.469 1030 HG13 ILE 48 HG11 ILE 48 -1.891 5.238 0.916 1031 HG21 ILE 48 HG21 ILE 48 -1.649 6.585 -3.113 1032 HG22 ILE 48 HG22 ILE 48 -0.206 6.263 -2.155 1033 HG23 ILE 48 HG23 ILE 48 -1.185 7.693 -1.822 1034 HD11 ILE 48 HD11 ILE 48 0.351 4.343 0.796 1035 HD12 ILE 48 HD12 ILE 48 0.603 5.062 -0.795 1036 HD13 ILE 48 HD13 ILE 48 -0.541 3.733 -0.599 1037 H ALA 49 HN ALA 49 -4.720 5.162 -2.355 1038 HA ALA 49 HA ALA 49 -4.691 6.685 -4.737 1039 HB1 ALA 49 HB1 ALA 49 -6.424 5.261 -5.512 1040 HB2 ALA 49 HB2 ALA 49 -7.062 5.014 -3.886 1041 HB3 ALA 49 HB3 ALA 49 -5.533 4.271 -4.357 1042 H PHE 50 HN PHE 50 -6.842 6.842 -1.928 1043 HA PHE 50 HA PHE 50 -8.768 8.625 -3.040 1044 HB2 PHE 50 HB2 PHE 50 -8.889 7.390 -0.798 1045 HB3 PHE 50 HB1 PHE 50 -7.846 8.658 -0.155 1046 HD1 PHE 50 HD1 PHE 50 -11.066 8.071 -1.930 1047 HD2 PHE 50 HD2 PHE 50 -8.755 10.759 0.494 1048 HE1 PHE 50 HE1 PHE 50 -13.047 9.533 -1.668 1049 HE2 PHE 50 HE2 PHE 50 -10.737 12.224 0.753 1050 HZ PHE 50 HZ PHE 50 -12.885 11.610 -0.324 1051 H LEU 51 HN LEU 51 -5.727 9.241 -1.275 1052 HA LEU 51 HA LEU 51 -5.892 12.102 -1.351 1053 HB2 LEU 51 HB2 LEU 51 -3.356 10.445 -1.438 1054 HB3 LEU 51 HB1 LEU 51 -3.534 12.088 -0.823 1055 HG LEU 51 HG LEU 51 -4.811 9.598 0.343 1056 HD11 LEU 51 HD11 LEU 51 -3.257 9.795 2.118 1057 HD12 LEU 51 HD12 LEU 51 -2.803 11.436 1.659 1058 HD13 LEU 51 HD13 LEU 51 -2.286 10.066 0.673 1059 HD21 LEU 51 HD21 LEU 51 -5.328 11.340 2.222 1060 HD22 LEU 51 HD22 LEU 51 -6.355 11.323 0.791 1061 HD23 LEU 51 HD23 LEU 51 -5.091 12.543 0.954 1062 H ARG 52 HN ARG 52 -4.496 9.733 -3.599 1063 HA ARG 52 HA ARG 52 -3.339 11.623 -5.404 1064 HB2 ARG 52 HB2 ARG 52 -4.372 8.803 -5.829 1065 HB3 ARG 52 HB1 ARG 52 -3.522 9.715 -7.074 1066 HG2 ARG 52 HG2 ARG 52 -2.290 9.389 -4.342 1067 HG3 ARG 52 HG1 ARG 52 -2.160 8.091 -5.526 1068 HD2 ARG 52 HD2 ARG 52 -1.237 10.957 -5.926 1069 HD3 ARG 52 HD1 ARG 52 -0.198 9.561 -5.668 1070 HE ARG 52 HE ARG 52 -1.714 10.169 -8.140 1071 HH11 ARG 52 HH21 ARG 52 0.329 8.037 -6.324 1072 HH12 ARG 52 HH22 ARG 52 0.801 7.117 -7.711 1073 HH21 ARG 52 HH11 ARG 52 -1.107 8.965 -9.931 1074 HH22 ARG 52 HH12 ARG 52 -0.009 7.639 -9.744 1075 H SER 53 HN SER 53 -6.579 10.243 -5.166 1076 HA SER 53 HA SER 53 -7.627 11.137 -7.637 1077 HB2 SER 53 HB2 SER 53 -9.010 10.926 -4.947 1078 HB3 SER 53 HB1 SER 53 -9.835 11.095 -6.494 1079 HG SER 53 HG SER 53 -8.975 8.885 -5.343 1080 H LYS 54 HN LYS 54 -7.090 12.864 -4.609 1081 HA LYS 54 HA LYS 54 -8.381 15.304 -5.657 1082 HB2 LYS 54 HB2 LYS 54 -6.939 14.702 -3.060 1083 HB3 LYS 54 HB1 LYS 54 -7.668 16.261 -3.446 1084 HG2 LYS 54 HG2 LYS 54 -9.862 15.187 -3.714 1085 HG3 LYS 54 HG1 LYS 54 -9.144 13.614 -3.371 1086 HD2 LYS 54 HD2 LYS 54 -8.490 14.389 -1.126 1087 HD3 LYS 54 HD1 LYS 54 -9.195 15.971 -1.463 1088 HE2 LYS 54 HE2 LYS 54 -11.406 14.934 -1.770 1089 HE3 LYS 54 HE1 LYS 54 -10.711 13.345 -1.458 1090 HZ1 LYS 54 HZ1 LYS 54 -11.582 14.009 0.579 1091 HZ2 LYS 54 HZ2 LYS 54 -11.038 15.610 0.410 1092 HZ3 LYS 54 HZ3 LYS 54 -9.930 14.362 0.724 1093 H GLY 55 HN GLY 55 -5.467 13.841 -6.166 1094 HA2 GLY 55 HA2 GLY 55 -3.541 14.671 -7.239 1095 HA3 GLY 55 HA1 GLY 55 -4.304 16.261 -7.262 1096 H VAL 56 HN VAL 56 -3.979 14.546 -4.243 1097 HA VAL 56 HA VAL 56 -2.704 16.668 -2.894 1098 HB VAL 56 HB VAL 56 -2.757 13.691 -2.345 1099 HG11 VAL 56 HG11 VAL 56 -2.016 14.427 0.001 1100 HG12 VAL 56 HG12 VAL 56 -1.492 15.932 -0.750 1101 HG13 VAL 56 HG13 VAL 56 -0.766 14.401 -1.240 1102 HG21 VAL 56 HG21 VAL 56 -4.838 15.193 -2.197 1103 HG22 VAL 56 HG22 VAL 56 -4.049 15.967 -0.825 1104 HG23 VAL 56 HG23 VAL 56 -4.447 14.251 -0.760 1105 H ASP 57 HN ASP 57 -0.532 17.143 -2.438 1106 HA ASP 57 HA ASP 57 1.405 16.434 -4.437 1107 HB2 ASP 57 HB2 ASP 57 1.337 18.074 -1.965 1108 HB3 ASP 57 HB1 ASP 57 2.920 17.389 -2.301 1109 H LEU 58 HN LEU 58 0.940 14.039 -4.158 1110 HA LEU 58 HA LEU 58 2.270 12.770 -1.844 1111 HB2 LEU 58 HB2 LEU 58 0.087 11.978 -3.033 1112 HB3 LEU 58 HB1 LEU 58 1.169 11.348 -4.272 1113 HG LEU 58 HG LEU 58 2.428 10.272 -2.193 1114 HD11 LEU 58 HD11 LEU 58 -0.391 10.266 -1.112 1115 HD12 LEU 58 HD12 LEU 58 0.748 11.525 -0.644 1116 HD13 LEU 58 HD13 LEU 58 1.107 9.837 -0.287 1117 HD21 LEU 58 HD21 LEU 58 -0.208 9.239 -3.290 1118 HD22 LEU 58 HD22 LEU 58 0.985 8.258 -2.443 1119 HD23 LEU 58 HD23 LEU 58 1.386 8.980 -3.998 1120 H ASN 59 HN ASN 59 3.081 13.919 -4.904 1121 HA ASN 59 HA ASN 59 4.969 11.987 -5.821 1122 HB2 ASN 59 HB2 ASN 59 5.249 14.990 -6.141 1123 HB3 ASN 59 HB1 ASN 59 5.804 13.728 -7.240 1124 HD21 ASN 59 HD21 ASN 59 3.684 16.047 -7.408 1125 HD22 ASN 59 HD22 ASN 59 2.336 15.276 -8.094 1126 H ALA 60 HN ALA 60 5.295 14.797 -3.684 1127 HA ALA 60 HA ALA 60 8.128 14.592 -3.302 1128 HB1 ALA 60 HB1 ALA 60 7.098 16.660 -2.736 1129 HB2 ALA 60 HB2 ALA 60 7.592 15.956 -1.195 1130 HB3 ALA 60 HB3 ALA 60 5.906 15.870 -1.705 1131 H LEU 61 HN LEU 61 5.372 13.280 -1.468 1132 HA LEU 61 HA LEU 61 6.885 12.208 0.696 1133 HB2 LEU 61 HB2 LEU 61 4.228 11.517 -0.552 1134 HB3 LEU 61 HB1 LEU 61 4.885 10.510 0.736 1135 HG LEU 61 HG LEU 61 5.081 12.531 2.179 1136 HD11 LEU 61 HD11 LEU 61 3.694 14.538 1.364 1137 HD12 LEU 61 HD12 LEU 61 3.828 13.831 -0.247 1138 HD13 LEU 61 HD13 LEU 61 5.280 14.323 0.624 1139 HD21 LEU 61 HD21 LEU 61 2.644 12.789 2.560 1140 HD22 LEU 61 HD22 LEU 61 3.081 11.102 2.303 1141 HD23 LEU 61 HD23 LEU 61 2.331 12.024 1.003 1142 H PHE 62 HN PHE 62 5.936 10.756 -2.429 1143 HA PHE 62 HA PHE 62 7.184 8.222 -1.892 1144 HB2 PHE 62 HB2 PHE 62 6.018 9.591 -4.266 1145 HB3 PHE 62 HB1 PHE 62 7.202 8.336 -4.625 1146 HD1 PHE 62 HD2 PHE 62 4.470 8.794 -2.084 1147 HD2 PHE 62 HD1 PHE 62 6.228 6.262 -5.078 1148 HE1 PHE 62 HE2 PHE 62 2.775 7.048 -1.607 1149 HE2 PHE 62 HE1 PHE 62 4.533 4.520 -4.600 1150 HZ PHE 62 HZ PHE 62 2.805 4.914 -2.866 1151 H ASP 63 HN ASP 63 8.333 11.143 -3.560 1152 HA ASP 63 HA ASP 63 10.769 10.269 -4.565 1153 HB2 ASP 63 HB2 ASP 63 10.131 12.550 -4.904 1154 HB3 ASP 63 HB1 ASP 63 10.038 12.857 -3.172 1155 H ARG 64 HN ARG 64 10.083 11.243 -1.203 1156 HA ARG 64 HA ARG 64 12.774 10.663 -0.316 1157 HB2 ARG 64 HB2 ARG 64 10.261 10.754 1.371 1158 HB3 ARG 64 HB1 ARG 64 11.917 11.003 1.916 1159 HG2 ARG 64 HG2 ARG 64 10.317 12.792 0.064 1160 HG3 ARG 64 HG1 ARG 64 10.878 13.177 1.689 1161 HD2 ARG 64 HD2 ARG 64 13.265 12.676 0.663 1162 HD3 ARG 64 HD1 ARG 64 12.447 13.012 -0.864 1163 HE ARG 64 HE ARG 64 13.082 14.955 1.225 1164 HH11 ARG 64 HH21 ARG 64 11.036 14.138 -1.441 1165 HH12 ARG 64 HH22 ARG 64 10.686 15.787 -1.836 1166 HH21 ARG 64 HH11 ARG 64 12.627 17.097 0.713 1167 HH22 ARG 64 HH12 ARG 64 11.586 17.458 -0.622 1168 H ILE 65 HN ILE 65 9.728 8.800 -0.247 1169 HA ILE 65 HA ILE 65 10.774 6.593 1.246 1170 HB ILE 65 HB ILE 65 8.541 6.706 -0.798 1171 HG12 ILE 65 HG12 ILE 65 8.423 6.532 2.225 1172 HG13 ILE 65 HG11 ILE 65 8.358 8.059 1.345 1173 HG21 ILE 65 HG21 ILE 65 9.184 4.414 -0.689 1174 HG22 ILE 65 HG22 ILE 65 7.822 4.562 0.421 1175 HG23 ILE 65 HG23 ILE 65 9.469 4.498 1.049 1176 HD11 ILE 65 HD11 ILE 65 6.084 7.348 1.773 1177 HD12 ILE 65 HD12 ILE 65 6.414 5.747 1.115 1178 HD13 ILE 65 HD13 ILE 65 6.400 7.154 0.052 1179 H ILE 66 HN ILE 66 10.594 7.182 -2.261 1180 HA ILE 66 HA ILE 66 11.627 4.667 -3.074 1181 HB ILE 66 HB ILE 66 11.906 7.377 -4.403 1182 HG12 ILE 66 HG12 ILE 66 9.924 5.136 -4.900 1183 HG13 ILE 66 HG11 ILE 66 9.575 6.526 -3.882 1184 HG21 ILE 66 HG21 ILE 66 12.348 4.546 -5.388 1185 HG22 ILE 66 HG22 ILE 66 13.497 5.884 -5.408 1186 HG23 ILE 66 HG23 ILE 66 12.096 5.910 -6.478 1187 HD11 ILE 66 HD11 ILE 66 10.349 6.643 -6.811 1188 HD12 ILE 66 HD12 ILE 66 10.009 8.038 -5.787 1189 HD13 ILE 66 HD13 ILE 66 8.726 6.888 -6.166 1190 H VAL 67 HN VAL 67 13.315 4.178 -1.571 1191 HA VAL 67 HA VAL 67 15.539 4.020 -0.886 1192 HB VAL 67 HB VAL 67 16.227 5.474 -3.443 1193 HG11 VAL 67 HG11 VAL 67 18.180 3.912 -3.346 1194 HG12 VAL 67 HG12 VAL 67 17.591 3.324 -1.791 1195 HG13 VAL 67 HG13 VAL 67 18.107 5.001 -1.961 1196 HG21 VAL 67 HG21 VAL 67 14.674 3.816 -4.161 1197 HG22 VAL 67 HG22 VAL 67 15.279 2.634 -2.999 1198 HG23 VAL 67 HG23 VAL 67 16.261 3.082 -4.395 1199 H ASN 68 HN ASN 68 16.912 5.202 0.404 1200 HA ASN 68 HA ASN 68 16.264 8.035 0.792 1201 HB2 ASN 68 HB2 ASN 68 18.136 7.746 2.593 1202 HB3 ASN 68 HB1 ASN 68 16.597 6.914 2.831 1203 HD21 ASN 68 HD21 ASN 68 19.664 6.238 1.029 1204 HD22 ASN 68 HD22 ASN 68 19.778 4.626 1.550 1205 H LYS 69 HN LYS 69 17.451 9.722 0.044 1206 HA LYS 69 HA LYS 69 19.630 9.246 -1.815 1207 HB2 LYS 69 HB2 LYS 69 18.637 11.843 -0.597 1208 HB3 LYS 69 HB1 LYS 69 19.675 11.703 -2.012 1209 HG2 LYS 69 HG2 LYS 69 16.934 10.427 -1.891 1210 HG3 LYS 69 HG1 LYS 69 17.174 12.076 -2.458 1211 HD2 LYS 69 HD2 LYS 69 18.737 11.238 -4.195 1212 HD3 LYS 69 HD1 LYS 69 18.446 9.589 -3.653 1213 HE2 LYS 69 HE2 LYS 69 16.060 9.811 -4.169 1214 HE3 LYS 69 HE1 LYS 69 16.324 11.472 -4.701 1215 HZ1 LYS 69 HZ1 LYS 69 16.436 9.322 -6.305 1216 HZ2 LYS 69 HZ2 LYS 69 18.078 9.530 -5.918 1217 HZ3 LYS 69 HZ3 LYS 69 17.202 10.800 -6.628 1218 H LEU 70 HN LEU 70 21.798 9.421 -1.461 1219 HA LEU 70 HA LEU 70 22.726 10.366 1.230 1220 HB2 LEU 70 HB2 LEU 70 23.669 7.917 -0.295 1221 HB3 LEU 70 HB1 LEU 70 24.414 8.538 1.177 1222 HG LEU 70 HG LEU 70 21.517 7.666 0.953 1223 HD11 LEU 70 HD11 LEU 70 22.189 5.648 2.122 1224 HD12 LEU 70 HD12 LEU 70 23.847 6.233 2.262 1225 HD13 LEU 70 HD13 LEU 70 23.190 5.813 0.680 1226 HD21 LEU 70 HD21 LEU 70 21.545 9.115 2.784 1227 HD22 LEU 70 HD22 LEU 70 23.232 8.777 3.167 1228 HD23 LEU 70 HD23 LEU 70 21.982 7.603 3.576 1229 H GLU 71 HN GLU 71 24.796 8.984 -1.223 1230 HA GLU 71 HA GLU 71 26.783 9.947 -2.063 1231 HB2 GLU 71 HB2 GLU 71 25.257 12.016 -3.519 1232 HB3 GLU 71 HB1 GLU 71 26.170 10.650 -4.143 1233 HG2 GLU 71 HG2 GLU 71 23.386 10.448 -2.961 1234 HG3 GLU 71 HG1 GLU 71 23.739 10.555 -4.679 1235 H HIS 72 HN HIS 72 26.902 12.769 -3.004 1236 HA HIS 72 HA HIS 72 27.509 14.033 -0.358 1237 HB2 HIS 72 HB2 HIS 72 28.644 14.316 -3.137 1238 HB3 HIS 72 HB1 HIS 72 28.807 15.649 -1.995 1239 HD2 HIS 72 HD2 HIS 72 29.397 11.739 -1.386 1240 HE1 HIS 72 HE1 HIS 72 32.753 13.906 -0.012 1241 HE2 HIS 72 HE2 HIS 72 31.730 11.594 -0.227 1242 H HIS 73 HN HIS 73 26.928 15.560 -3.510 1243 HA HIS 73 HA HIS 73 25.571 17.406 -4.032 1244 HB2 HIS 73 HB2 HIS 73 23.808 15.430 -2.608 1245 HB3 HIS 73 HB1 HIS 73 23.142 17.026 -2.948 1246 HD2 HIS 73 HD2 HIS 73 21.549 16.311 -5.157 1247 HE1 HIS 73 HE1 HIS 73 24.663 14.721 -7.527 1248 HE2 HIS 73 HE2 HIS 73 22.220 15.406 -7.511 1249 H HIS 74 HN HIS 74 27.177 18.494 -2.453 1250 HA HIS 74 HA HIS 74 26.027 19.271 0.137 1251 HB2 HIS 74 HB2 HIS 74 28.526 18.876 -0.353 1252 HB3 HIS 74 HB1 HIS 74 28.498 20.448 -1.151 1253 HD2 HIS 74 HD2 HIS 74 29.869 21.857 0.881 1254 HE1 HIS 74 HE1 HIS 74 27.112 21.033 3.971 1255 HE2 HIS 74 HE2 HIS 74 29.162 22.386 3.336 1256 H HIS 75 HN HIS 75 26.780 21.949 0.332 1257 HA HIS 75 HA HIS 75 25.834 24.066 -0.049 1258 HB2 HIS 75 HB2 HIS 75 26.233 23.027 -2.865 1259 HB3 HIS 75 HB1 HIS 75 25.654 24.657 -2.532 1260 HD2 HIS 75 HD2 HIS 75 27.616 25.911 -0.452 1261 HE1 HIS 75 HE1 HIS 75 30.842 24.109 -2.499 1262 HE2 HIS 75 HE2 HIS 75 30.200 25.892 -0.813 1263 H HIS 76 HN HIS 76 24.146 21.383 -0.209 1264 HA HIS 76 HA HIS 76 21.816 21.975 -1.751 1265 HB2 HIS 76 HB2 HIS 76 20.768 20.180 -0.530 1266 HB3 HIS 76 HB1 HIS 76 22.454 19.728 -0.770 1267 HD2 HIS 76 HD2 HIS 76 23.077 22.037 1.919 1268 HE1 HIS 76 HE1 HIS 76 21.501 18.736 4.029 1269 HE2 HIS 76 HE2 HIS 76 22.777 20.917 4.256 1270 H HIS 77 HN HIS 77 20.173 21.418 0.864 1271 HA HIS 77 HA HIS 77 18.828 23.792 1.171 1272 HB2 HIS 77 HB2 HIS 77 18.421 21.547 2.345 1273 HB3 HIS 77 HB1 HIS 77 19.558 22.104 3.571 1274 HD2 HIS 77 HD2 HIS 77 15.871 22.164 3.155 1275 HE1 HIS 77 HE1 HIS 77 16.708 25.788 5.154 1276 HE2 HIS 77 HE2 HIS 77 14.872 24.168 4.489 Start of MODEL 6 1 H1 MET 1 HT1 MET 1 9.220 11.882 6.356 2 H2 MET 1 HT2 MET 1 10.753 11.230 6.695 3 H3 MET 1 HT3 MET 1 10.599 12.865 6.256 4 HA MET 1 HA MET 1 10.806 12.025 8.777 5 HB2 MET 1 HB2 MET 1 10.941 14.354 7.907 6 HB3 MET 1 HB1 MET 1 9.181 14.398 7.811 7 HG2 MET 1 HG2 MET 1 9.005 14.056 10.223 8 HG3 MET 1 HG1 MET 1 10.755 13.889 10.351 9 HE1 MET 1 HE1 MET 1 8.220 17.565 9.531 10 HE2 MET 1 HE2 MET 1 7.824 15.861 9.326 11 HE3 MET 1 HE3 MET 1 8.736 16.703 8.077 12 H GLU 2 HN GLU 2 9.468 10.149 9.175 13 HA GLU 2 HA GLU 2 7.560 9.056 9.973 14 HB2 GLU 2 HB2 GLU 2 7.805 11.248 11.478 15 HB3 GLU 2 HB1 GLU 2 6.318 11.706 10.665 16 HG2 GLU 2 HG2 GLU 2 5.408 10.549 12.460 17 HG3 GLU 2 HG1 GLU 2 5.593 9.211 11.333 18 H LEU 3 HN LEU 3 6.524 8.240 8.185 19 HA LEU 3 HA LEU 3 5.248 9.785 6.151 20 HB2 LEU 3 HB2 LEU 3 4.853 6.922 7.055 21 HB3 LEU 3 HB1 LEU 3 4.088 7.594 5.619 22 HG LEU 3 HG LEU 3 7.083 7.693 6.064 23 HD11 LEU 3 HD11 LEU 3 7.147 5.730 4.473 24 HD12 LEU 3 HD12 LEU 3 5.409 5.558 4.716 25 HD13 LEU 3 HD13 LEU 3 6.513 5.354 6.076 26 HD21 LEU 3 HD21 LEU 3 6.908 7.737 3.450 27 HD22 LEU 3 HD22 LEU 3 6.530 9.207 4.337 28 HD23 LEU 3 HD23 LEU 3 5.228 8.188 3.726 29 H SER 4 HN SER 4 3.959 8.264 9.103 30 HA SER 4 HA SER 4 1.211 8.802 8.608 31 HB2 SER 4 HB2 SER 4 0.940 8.598 11.062 32 HB3 SER 4 HB1 SER 4 1.962 7.318 10.413 33 HG SER 4 HG SER 4 3.074 9.743 11.325 34 H ASN 5 HN ASN 5 3.702 10.818 10.194 35 HA ASN 5 HA ASN 5 1.890 12.928 10.924 36 HB2 ASN 5 HB2 ASN 5 4.338 12.481 11.709 37 HB3 ASN 5 HB1 ASN 5 4.798 13.404 10.279 38 HD21 ASN 5 HD21 ASN 5 5.497 15.337 11.317 39 HD22 ASN 5 HD22 ASN 5 4.471 16.314 12.252 40 H GLU 6 HN GLU 6 4.123 12.606 8.144 41 HA GLU 6 HA GLU 6 3.397 15.051 6.882 42 HB2 GLU 6 HB2 GLU 6 5.241 14.223 5.790 43 HB3 GLU 6 HB1 GLU 6 4.837 12.568 6.194 44 HG2 GLU 6 HG2 GLU 6 4.848 12.813 3.789 45 HG3 GLU 6 HG1 GLU 6 3.183 12.564 4.287 46 H LEU 7 HN LEU 7 2.099 11.773 6.571 47 HA LEU 7 HA LEU 7 0.086 12.396 4.640 48 HB2 LEU 7 HB2 LEU 7 0.835 10.084 5.316 49 HB3 LEU 7 HB1 LEU 7 -0.038 10.307 6.829 50 HG LEU 7 HG LEU 7 -2.127 10.712 5.521 51 HD11 LEU 7 HD11 LEU 7 -0.210 10.313 3.244 52 HD12 LEU 7 HD12 LEU 7 -1.590 11.399 3.374 53 HD13 LEU 7 HD13 LEU 7 -1.847 9.686 3.061 54 HD21 LEU 7 HD21 LEU 7 -0.654 8.097 5.076 55 HD22 LEU 7 HD22 LEU 7 -2.384 8.310 4.814 56 HD23 LEU 7 HD23 LEU 7 -1.708 8.503 6.431 57 H LYS 8 HN LYS 8 0.093 12.393 8.191 58 HA LYS 8 HA LYS 8 -2.666 13.057 8.549 59 HB2 LYS 8 HB2 LYS 8 -1.145 12.215 10.355 60 HB3 LYS 8 HB1 LYS 8 -0.335 13.781 10.349 61 HG2 LYS 8 HG2 LYS 8 -2.434 14.903 10.941 62 HG3 LYS 8 HG1 LYS 8 -3.291 13.362 10.885 63 HD2 LYS 8 HD2 LYS 8 -1.855 12.501 12.706 64 HD3 LYS 8 HD1 LYS 8 -1.019 14.053 12.772 65 HE2 LYS 8 HE2 LYS 8 -3.132 15.181 13.341 66 HE3 LYS 8 HE1 LYS 8 -3.984 13.640 13.258 67 HZ1 LYS 8 HZ1 LYS 8 -1.661 14.042 15.041 68 HZ2 LYS 8 HZ2 LYS 8 -2.850 12.830 15.111 69 HZ3 LYS 8 HZ3 LYS 8 -3.237 14.429 15.533 70 H VAL 9 HN VAL 9 0.222 15.056 8.038 71 HA VAL 9 HA VAL 9 -0.960 17.583 8.624 72 HB VAL 9 HB VAL 9 1.278 16.783 6.747 73 HG11 VAL 9 HG11 VAL 9 1.850 19.279 6.868 74 HG12 VAL 9 HG12 VAL 9 0.199 19.524 7.437 75 HG13 VAL 9 HG13 VAL 9 0.488 18.841 5.836 76 HG21 VAL 9 HG21 VAL 9 1.426 16.605 9.338 77 HG22 VAL 9 HG22 VAL 9 1.464 18.366 9.315 78 HG23 VAL 9 HG23 VAL 9 2.725 17.445 8.494 79 H GLU 10 HN GLU 10 -0.753 15.785 5.523 80 HA GLU 10 HA GLU 10 -2.166 17.786 4.012 81 HB2 GLU 10 HB2 GLU 10 -1.871 14.802 3.538 82 HB3 GLU 10 HB1 GLU 10 -2.422 15.969 2.339 83 HG2 GLU 10 HG2 GLU 10 0.228 16.354 3.742 84 HG3 GLU 10 HG1 GLU 10 0.105 15.282 2.351 85 H ARG 11 HN ARG 11 -3.176 14.940 5.873 86 HA ARG 11 HA ARG 11 -5.916 14.881 5.092 87 HB2 ARG 11 HB2 ARG 11 -4.899 13.086 6.400 88 HB3 ARG 11 HB1 ARG 11 -4.586 14.193 7.732 89 HG2 ARG 11 HG2 ARG 11 -6.828 14.276 8.378 90 HG3 ARG 11 HG1 ARG 11 -7.415 13.856 6.773 91 HD2 ARG 11 HD2 ARG 11 -7.107 11.576 7.106 92 HD3 ARG 11 HD1 ARG 11 -5.768 11.811 8.225 93 HE ARG 11 HE ARG 11 -7.327 12.065 10.007 94 HH11 ARG 11 HH21 ARG 11 -8.856 11.892 6.911 95 HH12 ARG 11 HH22 ARG 11 -10.432 11.625 7.572 96 HH21 ARG 11 HH11 ARG 11 -9.363 11.709 10.868 97 HH22 ARG 11 HH12 ARG 11 -10.722 11.522 9.810 98 H ILE 12 HN ILE 12 -4.239 16.659 7.667 99 HA ILE 12 HA ILE 12 -6.581 18.045 8.626 100 HB ILE 12 HB ILE 12 -3.622 18.672 8.847 101 HG12 ILE 12 HG12 ILE 12 -5.571 17.655 10.932 102 HG13 ILE 12 HG11 ILE 12 -4.582 16.582 9.942 103 HG21 ILE 12 HG21 ILE 12 -6.057 20.003 10.055 104 HG22 ILE 12 HG22 ILE 12 -4.753 20.759 9.140 105 HG23 ILE 12 HG23 ILE 12 -4.449 20.151 10.766 106 HD11 ILE 12 HD11 ILE 12 -3.637 17.234 12.243 107 HD12 ILE 12 HD12 ILE 12 -3.364 18.832 11.548 108 HD13 ILE 12 HD13 ILE 12 -2.560 17.422 10.860 109 H ARG 13 HN ARG 13 -4.023 18.818 6.288 110 HA ARG 13 HA ARG 13 -4.677 21.494 5.720 111 HB2 ARG 13 HB2 ARG 13 -2.740 20.084 4.806 112 HB3 ARG 13 HB1 ARG 13 -3.885 19.471 3.614 113 HG2 ARG 13 HG2 ARG 13 -4.317 21.756 2.824 114 HG3 ARG 13 HG1 ARG 13 -3.212 22.398 4.043 115 HD2 ARG 13 HD2 ARG 13 -2.492 20.539 1.757 116 HD3 ARG 13 HD1 ARG 13 -2.024 22.231 1.923 117 HE ARG 13 HE ARG 13 -1.118 20.825 4.229 118 HH11 ARG 13 HH21 ARG 13 -0.617 21.110 0.833 119 HH12 ARG 13 HH22 ARG 13 1.030 20.580 0.895 120 HH21 ARG 13 HH11 ARG 13 1.029 20.121 4.334 121 HH22 ARG 13 HH12 ARG 13 1.962 20.018 2.878 122 H LEU 14 HN LEU 14 -6.033 18.518 4.271 123 HA LEU 14 HA LEU 14 -8.105 20.159 2.895 124 HB2 LEU 14 HB2 LEU 14 -7.571 17.172 2.767 125 HB3 LEU 14 HB1 LEU 14 -8.693 18.072 1.747 126 HG LEU 14 HG LEU 14 -5.696 18.530 1.871 127 HD11 LEU 14 HD11 LEU 14 -7.479 17.037 -0.057 128 HD12 LEU 14 HD12 LEU 14 -6.012 16.471 0.743 129 HD13 LEU 14 HD13 LEU 14 -5.907 17.668 -0.549 130 HD21 LEU 14 HD21 LEU 14 -7.967 19.879 0.417 131 HD22 LEU 14 HD22 LEU 14 -6.375 19.811 -0.340 132 HD23 LEU 14 HD23 LEU 14 -6.574 20.602 1.220 133 H SER 15 HN SER 15 -7.634 18.767 5.855 134 HA SER 15 HA SER 15 -9.072 17.939 7.528 135 HB2 SER 15 HB2 SER 15 -11.297 19.280 7.526 136 HB3 SER 15 HB1 SER 15 -9.791 20.174 7.706 137 HG SER 15 HG SER 15 -11.593 20.088 5.603 138 H LEU 16 HN LEU 16 -9.208 15.798 6.458 139 HA LEU 16 HA LEU 16 -11.636 15.295 4.837 140 HB2 LEU 16 HB2 LEU 16 -9.470 13.409 5.801 141 HB3 LEU 16 HB1 LEU 16 -10.760 12.991 4.678 142 HG LEU 16 HG LEU 16 -8.712 15.176 4.204 143 HD11 LEU 16 HD11 LEU 16 -8.890 12.450 2.897 144 HD12 LEU 16 HD12 LEU 16 -7.799 12.822 4.233 145 HD13 LEU 16 HD13 LEU 16 -7.621 13.658 2.690 146 HD21 LEU 16 HD21 LEU 16 -11.079 14.120 2.666 147 HD22 LEU 16 HD22 LEU 16 -9.674 14.697 1.769 148 HD23 LEU 16 HD23 LEU 16 -10.522 15.781 2.867 149 H THR 17 HN THR 17 -13.188 13.650 5.477 150 HA THR 17 HA THR 17 -13.647 13.649 8.424 151 HB THR 17 HB THR 17 -15.925 12.737 7.677 152 HG1 THR 17 HG1 THR 17 -14.589 12.786 5.351 153 HG21 THR 17 HG21 THR 17 -15.680 15.054 8.332 154 HG22 THR 17 HG22 THR 17 -16.670 14.994 6.873 155 HG23 THR 17 HG23 THR 17 -14.973 15.464 6.769 156 H ALA 18 HN ALA 18 -13.303 11.807 9.572 157 HA ALA 18 HA ALA 18 -12.199 9.455 8.359 158 HB1 ALA 18 HB1 ALA 18 -12.464 8.440 10.598 159 HB2 ALA 18 HB2 ALA 18 -13.474 9.799 11.090 160 HB3 ALA 18 HB3 ALA 18 -11.771 10.058 10.712 161 H LYS 19 HN LYS 19 -15.486 10.318 9.381 162 HA LYS 19 HA LYS 19 -16.655 7.738 9.090 163 HB2 LYS 19 HB2 LYS 19 -17.813 10.513 8.734 164 HB3 LYS 19 HB1 LYS 19 -18.775 9.042 8.800 165 HG2 LYS 19 HG2 LYS 19 -17.904 8.551 11.048 166 HG3 LYS 19 HG1 LYS 19 -16.913 10.009 10.985 167 HD2 LYS 19 HD2 LYS 19 -18.945 11.389 10.765 168 HD3 LYS 19 HD1 LYS 19 -19.941 9.933 10.826 169 HE2 LYS 19 HE2 LYS 19 -19.072 9.428 13.079 170 HE3 LYS 19 HE1 LYS 19 -18.076 10.883 13.019 171 HZ1 LYS 19 HZ1 LYS 19 -21.005 10.650 13.189 172 HZ2 LYS 19 HZ2 LYS 19 -20.302 12.046 12.524 173 HZ3 LYS 19 HZ3 LYS 19 -19.952 11.595 14.125 174 H SER 20 HN SER 20 -16.364 10.442 6.757 175 HA SER 20 HA SER 20 -17.695 9.099 4.609 176 HB2 SER 20 HB2 SER 20 -17.075 11.590 4.802 177 HB3 SER 20 HB1 SER 20 -15.472 11.116 4.241 178 HG SER 20 HG SER 20 -17.108 9.918 2.637 179 H VAL 21 HN VAL 21 -14.242 9.347 5.449 180 HA VAL 21 HA VAL 21 -13.279 7.847 3.219 181 HB VAL 21 HB VAL 21 -12.148 8.309 5.987 182 HG11 VAL 21 HG11 VAL 21 -9.956 7.657 4.784 183 HG12 VAL 21 HG12 VAL 21 -10.997 6.890 3.582 184 HG13 VAL 21 HG13 VAL 21 -11.039 6.351 5.261 185 HG21 VAL 21 HG21 VAL 21 -12.494 10.243 4.360 186 HG22 VAL 21 HG22 VAL 21 -11.303 9.462 3.320 187 HG23 VAL 21 HG23 VAL 21 -10.841 10.014 4.930 188 H ALA 22 HN ALA 22 -14.129 6.817 6.535 189 HA ALA 22 HA ALA 22 -13.440 4.064 6.156 190 HB1 ALA 22 HB1 ALA 22 -15.346 5.443 8.054 191 HB2 ALA 22 HB2 ALA 22 -13.719 4.853 8.395 192 HB3 ALA 22 HB3 ALA 22 -15.032 3.709 8.113 193 H GLU 23 HN GLU 23 -16.481 5.835 5.611 194 HA GLU 23 HA GLU 23 -18.077 3.511 5.089 195 HB2 GLU 23 HB2 GLU 23 -18.625 6.159 5.372 196 HB3 GLU 23 HB1 GLU 23 -18.707 6.046 3.621 197 HG2 GLU 23 HG2 GLU 23 -20.913 5.562 4.252 198 HG3 GLU 23 HG1 GLU 23 -20.221 3.950 4.078 199 H GLU 24 HN GLU 24 -16.302 5.696 2.893 200 HA GLU 24 HA GLU 24 -16.995 4.243 0.495 201 HB2 GLU 24 HB2 GLU 24 -14.674 6.113 1.060 202 HB3 GLU 24 HB1 GLU 24 -15.210 5.608 -0.542 203 HG2 GLU 24 HG2 GLU 24 -17.138 6.917 1.384 204 HG3 GLU 24 HG1 GLU 24 -16.066 7.892 0.384 205 H MET 25 HN MET 25 -14.130 4.243 2.618 206 HA MET 25 HA MET 25 -12.633 2.326 1.092 207 HB2 MET 25 HB2 MET 25 -12.546 3.203 3.979 208 HB3 MET 25 HB1 MET 25 -11.449 1.971 3.351 209 HG2 MET 25 HG2 MET 25 -10.638 3.553 1.649 210 HG3 MET 25 HG1 MET 25 -11.754 4.779 2.246 211 HE1 MET 25 HE1 MET 25 -9.160 2.300 2.970 212 HE2 MET 25 HE2 MET 25 -8.185 2.884 4.316 213 HE3 MET 25 HE3 MET 25 -7.964 3.578 2.712 214 H GLY 26 HN GLY 26 -14.968 1.987 3.749 215 HA2 GLY 26 HA2 GLY 26 -16.370 0.077 4.089 216 HA3 GLY 26 HA1 GLY 26 -15.350 -0.849 2.987 217 H ILE 27 HN ILE 27 -14.038 1.080 5.613 218 HA ILE 27 HA ILE 27 -13.359 -1.435 7.106 219 HB ILE 27 HB ILE 27 -11.194 -0.394 7.691 220 HG12 ILE 27 HG12 ILE 27 -11.986 1.743 5.691 221 HG13 ILE 27 HG11 ILE 27 -11.952 1.980 7.435 222 HG21 ILE 27 HG21 ILE 27 -10.121 -0.803 5.598 223 HG22 ILE 27 HG22 ILE 27 -11.565 -0.353 4.690 224 HG23 ILE 27 HG23 ILE 27 -11.541 -1.849 5.625 225 HD11 ILE 27 HD11 ILE 27 -9.870 2.797 6.435 226 HD12 ILE 27 HD12 ILE 27 -9.584 1.219 5.703 227 HD13 ILE 27 HD13 ILE 27 -9.545 1.398 7.457 228 H SER 28 HN SER 28 -12.846 -0.989 9.429 229 HA SER 28 HA SER 28 -14.948 0.608 10.604 230 HB2 SER 28 HB2 SER 28 -12.619 -0.946 11.735 231 HB3 SER 28 HB1 SER 28 -13.691 -0.007 12.770 232 HG SER 28 HG SER 28 -14.778 -1.766 10.874 233 H ARG 29 HN ARG 29 -14.682 2.438 11.979 234 HA ARG 29 HA ARG 29 -12.864 4.436 11.032 235 HB2 ARG 29 HB2 ARG 29 -14.665 4.210 13.450 236 HB3 ARG 29 HB1 ARG 29 -13.634 5.621 13.206 237 HG2 ARG 29 HG2 ARG 29 -14.712 6.200 11.172 238 HG3 ARG 29 HG1 ARG 29 -15.476 4.619 11.030 239 HD2 ARG 29 HD2 ARG 29 -16.080 6.520 13.306 240 HD3 ARG 29 HD1 ARG 29 -16.994 6.522 11.798 241 HE ARG 29 HE ARG 29 -17.250 4.569 13.918 242 HH11 ARG 29 HH21 ARG 29 -17.256 5.056 10.502 243 HH12 ARG 29 HH22 ARG 29 -18.346 3.748 10.182 244 HH21 ARG 29 HH11 ARG 29 -18.681 2.858 13.515 245 HH22 ARG 29 HH12 ARG 29 -19.153 2.508 11.885 246 H GLN 30 HN GLN 30 -12.752 2.193 13.766 247 HA GLN 30 HA GLN 30 -10.470 3.324 15.062 248 HB2 GLN 30 HB2 GLN 30 -11.936 1.559 16.059 249 HB3 GLN 30 HB1 GLN 30 -11.279 0.402 14.905 250 HG2 GLN 30 HG2 GLN 30 -10.088 0.178 17.018 251 HG3 GLN 30 HG1 GLN 30 -8.991 0.857 15.815 252 HE21 GLN 30 HE21 GLN 30 -7.678 2.159 17.184 253 HE22 GLN 30 HE22 GLN 30 -8.288 3.431 18.128 254 H GLN 31 HN GLN 31 -10.797 0.974 12.409 255 HA GLN 31 HA GLN 31 -8.013 0.335 12.184 256 HB2 GLN 31 HB2 GLN 31 -10.265 0.318 10.159 257 HB3 GLN 31 HB1 GLN 31 -8.642 -0.268 9.796 258 HG2 GLN 31 HG2 GLN 31 -10.284 -1.283 12.130 259 HG3 GLN 31 HG1 GLN 31 -10.275 -2.057 10.545 260 HE21 GLN 31 HE21 GLN 31 -7.509 -1.707 9.883 261 HE22 GLN 31 HE22 GLN 31 -6.580 -2.635 10.959 262 H LEU 32 HN LEU 32 -10.005 2.826 10.576 263 HA LEU 32 HA LEU 32 -7.901 3.866 8.949 264 HB2 LEU 32 HB2 LEU 32 -10.317 4.386 8.615 265 HB3 LEU 32 HB1 LEU 32 -10.296 5.328 10.100 266 HG LEU 32 HG LEU 32 -8.501 6.777 9.078 267 HD11 LEU 32 HD11 LEU 32 -9.103 4.990 6.719 268 HD12 LEU 32 HD12 LEU 32 -7.535 5.464 7.365 269 HD13 LEU 32 HD13 LEU 32 -8.510 6.631 6.480 270 HD21 LEU 32 HD21 LEU 32 -10.092 7.936 7.515 271 HD22 LEU 32 HD22 LEU 32 -10.804 7.541 9.079 272 HD23 LEU 32 HD23 LEU 32 -11.175 6.553 7.666 273 H CYS 33 HN CYS 33 -9.025 4.720 12.212 274 HA CYS 33 HA CYS 33 -7.263 6.932 12.617 275 HB2 CYS 33 HB2 CYS 33 -8.468 4.988 14.607 276 HB3 CYS 33 HB1 CYS 33 -7.655 6.488 15.047 277 HG CYS 33 HG CYS 33 -10.426 6.289 13.664 278 H ASN 34 HN ASN 34 -6.825 3.444 13.037 279 HA ASN 34 HA ASN 34 -4.369 3.535 14.486 280 HB2 ASN 34 HB2 ASN 34 -5.255 1.473 12.447 281 HB3 ASN 34 HB1 ASN 34 -4.029 1.242 13.692 282 HD21 ASN 34 HD21 ASN 34 -5.583 2.781 15.734 283 HD22 ASN 34 HD22 ASN 34 -6.866 1.767 16.192 284 H ILE 35 HN ILE 35 -5.032 3.554 10.981 285 HA ILE 35 HA ILE 35 -2.293 3.415 10.155 286 HB ILE 35 HB ILE 35 -4.586 4.782 8.722 287 HG12 ILE 35 HG12 ILE 35 -3.663 1.904 8.458 288 HG13 ILE 35 HG11 ILE 35 -5.028 2.388 9.464 289 HG21 ILE 35 HG21 ILE 35 -2.612 5.335 7.562 290 HG22 ILE 35 HG22 ILE 35 -3.160 3.889 6.720 291 HG23 ILE 35 HG23 ILE 35 -1.858 3.778 7.900 292 HD11 ILE 35 HD11 ILE 35 -5.953 3.538 7.346 293 HD12 ILE 35 HD12 ILE 35 -6.010 1.781 7.395 294 HD13 ILE 35 HD13 ILE 35 -4.754 2.593 6.465 295 H GLU 36 HN GLU 36 -4.452 6.199 10.729 296 HA GLU 36 HA GLU 36 -2.550 8.197 9.989 297 HB2 GLU 36 HB2 GLU 36 -5.022 8.565 10.324 298 HB3 GLU 36 HB1 GLU 36 -4.744 8.456 12.062 299 HG2 GLU 36 HG2 GLU 36 -3.230 10.366 11.985 300 HG3 GLU 36 HG1 GLU 36 -3.372 10.441 10.228 301 H GLN 37 HN GLN 37 -2.877 6.209 12.809 302 HA GLN 37 HA GLN 37 -1.044 7.918 14.403 303 HB2 GLN 37 HB2 GLN 37 -2.512 5.337 15.011 304 HB3 GLN 37 HB1 GLN 37 -1.411 6.124 16.143 305 HG2 GLN 37 HG2 GLN 37 -2.788 8.158 16.095 306 HG3 GLN 37 HG1 GLN 37 -3.878 7.406 14.929 307 HE21 GLN 37 HE21 GLN 37 -5.769 6.949 16.083 308 HE22 GLN 37 HE22 GLN 37 -5.816 6.153 17.582 309 H SER 38 HN SER 38 -0.808 5.532 12.063 310 HA SER 38 HA SER 38 2.026 5.234 12.387 311 HB2 SER 38 HB2 SER 38 0.272 3.028 13.463 312 HB3 SER 38 HB1 SER 38 1.875 2.673 12.829 313 HG SER 38 HG SER 38 1.101 4.096 15.100 314 H GLU 39 HN GLU 39 2.630 5.041 10.294 315 HA GLU 39 HA GLU 39 0.901 3.487 8.409 316 HB2 GLU 39 HB2 GLU 39 1.347 6.055 8.077 317 HB3 GLU 39 HB1 GLU 39 2.936 5.536 7.521 318 HG2 GLU 39 HG2 GLU 39 0.257 4.661 6.392 319 HG3 GLU 39 HG1 GLU 39 1.433 5.712 5.603 320 H THR 40 HN THR 40 1.792 1.671 7.675 321 HA THR 40 HA THR 40 4.693 1.163 8.126 322 HB THR 40 HB THR 40 4.080 -1.200 7.605 323 HG1 THR 40 HG1 THR 40 1.834 -1.636 7.424 324 HG21 THR 40 HG21 THR 40 2.712 -1.573 9.630 325 HG22 THR 40 HG22 THR 40 2.340 0.150 9.689 326 HG23 THR 40 HG23 THR 40 3.997 -0.404 9.928 327 H ALA 41 HN ALA 41 6.105 1.001 6.421 328 HA ALA 41 HA ALA 41 4.988 1.263 3.649 329 HB1 ALA 41 HB1 ALA 41 7.752 1.997 4.618 330 HB2 ALA 41 HB2 ALA 41 6.412 3.138 4.497 331 HB3 ALA 41 HB3 ALA 41 7.041 2.356 3.045 332 HA PRO 42 HA PRO 42 7.046 -2.869 3.794 333 HB2 PRO 42 HB2 PRO 42 5.304 -4.221 2.216 334 HB3 PRO 42 HB1 PRO 42 4.964 -3.883 3.926 335 HG2 PRO 42 HG2 PRO 42 3.962 -2.480 1.489 336 HG3 PRO 42 HG1 PRO 42 3.094 -2.919 2.971 337 HD2 PRO 42 HD2 PRO 42 4.080 -0.394 2.458 338 HD3 PRO 42 HD1 PRO 42 3.807 -1.027 4.099 339 H VAL 43 HN VAL 43 8.036 -4.187 2.058 340 HA VAL 43 HA VAL 43 9.346 -2.630 0.083 341 HB VAL 43 HB VAL 43 9.991 -4.847 -0.903 342 HG11 VAL 43 HG11 VAL 43 11.357 -4.018 0.888 343 HG12 VAL 43 HG12 VAL 43 11.055 -5.721 1.237 344 HG13 VAL 43 HG13 VAL 43 10.155 -4.471 2.097 345 HG21 VAL 43 HG21 VAL 43 9.209 -6.886 0.288 346 HG22 VAL 43 HG22 VAL 43 7.878 -6.036 -0.496 347 HG23 VAL 43 HG23 VAL 43 8.114 -5.890 1.245 348 H VAL 44 HN VAL 44 6.217 -4.098 0.094 349 HA VAL 44 HA VAL 44 5.801 -4.451 -2.704 350 HB VAL 44 HB VAL 44 3.860 -3.702 -0.500 351 HG11 VAL 44 HG11 VAL 44 2.177 -4.711 -2.147 352 HG12 VAL 44 HG12 VAL 44 3.425 -4.514 -3.378 353 HG13 VAL 44 HG13 VAL 44 2.785 -3.102 -2.537 354 HG21 VAL 44 HG21 VAL 44 3.265 -6.159 -0.751 355 HG22 VAL 44 HG22 VAL 44 4.861 -5.843 -0.071 356 HG23 VAL 44 HG23 VAL 44 4.702 -6.322 -1.760 357 H VAL 45 HN VAL 45 5.240 -1.615 -0.601 358 HA VAL 45 HA VAL 45 4.178 0.078 -2.638 359 HB VAL 45 HB VAL 45 5.723 0.745 -0.116 360 HG11 VAL 45 HG11 VAL 45 4.232 2.487 -2.089 361 HG12 VAL 45 HG12 VAL 45 5.897 2.666 -1.531 362 HG13 VAL 45 HG13 VAL 45 4.556 2.997 -0.432 363 HG21 VAL 45 HG21 VAL 45 3.498 1.183 0.802 364 HG22 VAL 45 HG22 VAL 45 3.553 -0.458 0.157 365 HG23 VAL 45 HG23 VAL 45 2.759 0.824 -0.758 366 H LYS 46 HN LYS 46 7.540 -0.356 -1.490 367 HA LYS 46 HA LYS 46 8.692 1.568 -3.268 368 HB2 LYS 46 HB2 LYS 46 9.850 -0.901 -1.955 369 HB3 LYS 46 HB1 LYS 46 10.815 0.230 -2.904 370 HG2 LYS 46 HG2 LYS 46 10.106 2.072 -1.413 371 HG3 LYS 46 HG1 LYS 46 9.178 0.925 -0.448 372 HD2 LYS 46 HD2 LYS 46 11.202 -0.296 0.137 373 HD3 LYS 46 HD1 LYS 46 12.166 0.730 -0.925 374 HE2 LYS 46 HE2 LYS 46 12.516 1.681 1.203 375 HE3 LYS 46 HE1 LYS 46 11.256 2.701 0.515 376 HZ1 LYS 46 HZ1 LYS 46 10.105 2.208 2.335 377 HZ2 LYS 46 HZ2 LYS 46 11.147 0.939 2.770 378 HZ3 LYS 46 HZ3 LYS 46 9.880 0.663 1.673 379 H TYR 47 HN TYR 47 7.926 -1.866 -3.648 380 HA TYR 47 HA TYR 47 9.253 -2.382 -6.094 381 HB2 TYR 47 HB2 TYR 47 7.935 -4.020 -4.640 382 HB3 TYR 47 HB1 TYR 47 6.477 -3.363 -5.376 383 HD1 TYR 47 HD2 TYR 47 6.350 -3.383 -7.992 384 HD2 TYR 47 HD1 TYR 47 9.119 -5.748 -5.706 385 HE1 TYR 47 HE2 TYR 47 6.665 -4.897 -9.927 386 HE2 TYR 47 HE1 TYR 47 9.416 -7.260 -7.647 387 HH TYR 47 HH TYR 47 8.137 -6.495 -10.792 388 H ILE 48 HN ILE 48 6.053 -0.971 -5.463 389 HA ILE 48 HA ILE 48 5.247 -0.663 -8.180 390 HB ILE 48 HB ILE 48 4.554 0.937 -5.696 391 HG12 ILE 48 HG12 ILE 48 2.961 -1.181 -7.167 392 HG13 ILE 48 HG11 ILE 48 3.999 -1.540 -5.787 393 HG21 ILE 48 HG21 ILE 48 3.357 0.932 -8.475 394 HG22 ILE 48 HG22 ILE 48 4.012 2.313 -7.594 395 HG23 ILE 48 HG23 ILE 48 2.511 1.557 -7.060 396 HD11 ILE 48 HD11 ILE 48 2.700 0.196 -4.478 397 HD12 ILE 48 HD12 ILE 48 1.767 -1.229 -4.933 398 HD13 ILE 48 HD13 ILE 48 1.574 0.276 -5.834 399 H ALA 49 HN ALA 49 6.969 1.557 -5.972 400 HA ALA 49 HA ALA 49 7.150 3.737 -7.802 401 HB1 ALA 49 HB1 ALA 49 8.909 2.885 -5.492 402 HB2 ALA 49 HB2 ALA 49 7.689 4.159 -5.505 403 HB3 ALA 49 HB3 ALA 49 9.192 4.366 -6.407 404 H PHE 50 HN PHE 50 9.025 0.794 -7.435 405 HA PHE 50 HA PHE 50 11.280 1.540 -9.002 406 HB2 PHE 50 HB2 PHE 50 10.774 -0.645 -7.596 407 HB3 PHE 50 HB1 PHE 50 10.144 -1.256 -9.124 408 HD1 PHE 50 HD1 PHE 50 13.114 0.574 -7.761 409 HD2 PHE 50 HD2 PHE 50 11.655 -2.288 -10.612 410 HE1 PHE 50 HE1 PHE 50 15.433 0.141 -8.509 411 HE2 PHE 50 HE2 PHE 50 13.981 -2.725 -11.358 412 HZ PHE 50 HZ PHE 50 15.869 -1.514 -10.304 413 H LEU 51 HN LEU 51 8.168 0.070 -9.921 414 HA LEU 51 HA LEU 51 8.712 -0.135 -12.724 415 HB2 LEU 51 HB2 LEU 51 6.017 0.399 -11.446 416 HB3 LEU 51 HB1 LEU 51 6.324 -0.384 -12.996 417 HG LEU 51 HG LEU 51 7.190 -1.457 -10.294 418 HD11 LEU 51 HD11 LEU 51 4.683 -1.469 -10.891 419 HD12 LEU 51 HD12 LEU 51 5.409 -3.014 -10.456 420 HD13 LEU 51 HD13 LEU 51 5.113 -2.627 -12.150 421 HD21 LEU 51 HD21 LEU 51 8.748 -2.288 -11.863 422 HD22 LEU 51 HD22 LEU 51 7.539 -2.407 -13.141 423 HD23 LEU 51 HD23 LEU 51 7.527 -3.557 -11.806 424 H ARG 52 HN ARG 52 7.431 2.508 -10.738 425 HA ARG 52 HA ARG 52 6.635 4.248 -12.842 426 HB2 ARG 52 HB2 ARG 52 7.794 4.945 -10.129 427 HB3 ARG 52 HB1 ARG 52 6.931 6.065 -11.183 428 HG2 ARG 52 HG2 ARG 52 4.944 4.556 -11.100 429 HG3 ARG 52 HG1 ARG 52 5.807 3.535 -9.953 430 HD2 ARG 52 HD2 ARG 52 4.610 6.242 -9.543 431 HD3 ARG 52 HD1 ARG 52 4.686 4.875 -8.441 432 HE ARG 52 HE ARG 52 6.941 5.512 -7.829 433 HH11 ARG 52 HH21 ARG 52 5.434 7.626 -10.131 434 HH12 ARG 52 HH22 ARG 52 6.538 8.923 -9.836 435 HH21 ARG 52 HH11 ARG 52 8.378 7.198 -7.467 436 HH22 ARG 52 HH12 ARG 52 8.199 8.684 -8.340 437 H SER 53 HN SER 53 9.814 3.592 -11.441 438 HA SER 53 HA SER 53 11.254 5.793 -12.455 439 HB2 SER 53 HB2 SER 53 12.200 2.918 -12.300 440 HB3 SER 53 HB1 SER 53 13.232 4.341 -12.389 441 HG SER 53 HG SER 53 12.811 4.779 -10.351 442 H LYS 54 HN LYS 54 10.251 2.799 -14.098 443 HA LYS 54 HA LYS 54 11.597 3.576 -16.591 444 HB2 LYS 54 HB2 LYS 54 9.636 1.367 -15.948 445 HB3 LYS 54 HB1 LYS 54 10.552 1.503 -17.448 446 HG2 LYS 54 HG2 LYS 54 12.656 1.350 -16.211 447 HG3 LYS 54 HG1 LYS 54 11.779 1.289 -14.684 448 HD2 LYS 54 HD2 LYS 54 11.329 -0.730 -16.882 449 HD3 LYS 54 HD1 LYS 54 12.561 -0.952 -15.647 450 HE2 LYS 54 HE2 LYS 54 10.685 -0.597 -13.927 451 HE3 LYS 54 HE1 LYS 54 9.564 -0.793 -15.274 452 HZ1 LYS 54 HZ1 LYS 54 11.650 -2.787 -15.076 453 HZ2 LYS 54 HZ2 LYS 54 10.003 -2.960 -15.456 454 HZ3 LYS 54 HZ3 LYS 54 10.493 -2.813 -13.836 455 H GLY 55 HN GLY 55 8.844 4.626 -15.077 456 HA2 GLY 55 HA2 GLY 55 7.210 6.105 -15.944 457 HA3 GLY 55 HA1 GLY 55 7.784 5.746 -17.570 458 H VAL 56 HN VAL 56 6.926 3.133 -15.379 459 HA VAL 56 HA VAL 56 4.995 2.104 -17.277 460 HB VAL 56 HB VAL 56 5.537 1.335 -14.388 461 HG11 VAL 56 HG11 VAL 56 3.751 0.138 -16.515 462 HG12 VAL 56 HG12 VAL 56 3.357 0.511 -14.837 463 HG13 VAL 56 HG13 VAL 56 4.409 -0.856 -15.212 464 HG21 VAL 56 HG21 VAL 56 6.931 -0.376 -15.281 465 HG22 VAL 56 HG22 VAL 56 7.353 1.068 -16.198 466 HG23 VAL 56 HG23 VAL 56 6.298 -0.149 -16.913 467 H ASP 57 HN ASP 57 2.826 2.482 -17.374 468 HA ASP 57 HA ASP 57 1.709 4.617 -15.720 469 HB2 ASP 57 HB2 ASP 57 0.285 2.836 -17.718 470 HB3 ASP 57 HB1 ASP 57 -0.233 4.423 -17.148 471 H LEU 58 HN LEU 58 1.658 3.713 -13.610 472 HA LEU 58 HA LEU 58 0.068 1.270 -13.143 473 HB2 LEU 58 HB2 LEU 58 0.778 1.423 -10.865 474 HB3 LEU 58 HB1 LEU 58 2.179 1.851 -11.837 475 HG LEU 58 HG LEU 58 0.312 3.840 -10.482 476 HD11 LEU 58 HD11 LEU 58 1.621 2.745 -8.822 477 HD12 LEU 58 HD12 LEU 58 2.406 4.291 -9.134 478 HD13 LEU 58 HD13 LEU 58 3.072 2.810 -9.822 479 HD21 LEU 58 HD21 LEU 58 2.758 4.132 -12.235 480 HD22 LEU 58 HD22 LEU 58 2.297 5.390 -11.090 481 HD23 LEU 58 HD23 LEU 58 1.201 4.941 -12.389 482 H ASN 59 HN ASN 59 -0.340 4.702 -13.141 483 HA ASN 59 HA ASN 59 -2.572 4.889 -11.351 484 HB2 ASN 59 HB2 ASN 59 -2.430 6.749 -13.696 485 HB3 ASN 59 HB1 ASN 59 -2.636 7.116 -11.983 486 HD21 ASN 59 HD21 ASN 59 -0.657 7.172 -10.633 487 HD22 ASN 59 HD22 ASN 59 0.871 7.329 -11.354 488 H ALA 60 HN ALA 60 -2.313 4.329 -14.845 489 HA ALA 60 HA ALA 60 -5.105 4.420 -15.427 490 HB1 ALA 60 HB1 ALA 60 -4.541 3.395 -17.508 491 HB2 ALA 60 HB2 ALA 60 -3.093 2.655 -16.828 492 HB3 ALA 60 HB3 ALA 60 -3.156 4.400 -17.078 493 H LEU 61 HN LEU 61 -2.989 1.610 -14.726 494 HA LEU 61 HA LEU 61 -5.101 -0.321 -14.826 495 HB2 LEU 61 HB2 LEU 61 -2.473 -0.328 -13.316 496 HB3 LEU 61 HB1 LEU 61 -3.522 -1.734 -13.471 497 HG LEU 61 HG LEU 61 -2.383 -0.202 -15.827 498 HD11 LEU 61 HD11 LEU 61 -0.529 -1.187 -14.657 499 HD12 LEU 61 HD12 LEU 61 -0.878 -2.225 -16.039 500 HD13 LEU 61 HD13 LEU 61 -1.404 -2.701 -14.425 501 HD21 LEU 61 HD21 LEU 61 -2.952 -2.581 -16.867 502 HD22 LEU 61 HD22 LEU 61 -4.211 -1.366 -16.694 503 HD23 LEU 61 HD23 LEU 61 -4.082 -2.671 -15.517 504 H PHE 62 HN PHE 62 -3.684 1.503 -12.114 505 HA PHE 62 HA PHE 62 -5.341 0.311 -10.094 506 HB2 PHE 62 HB2 PHE 62 -3.633 2.777 -10.285 507 HB3 PHE 62 HB1 PHE 62 -4.736 2.628 -8.920 508 HD1 PHE 62 HD2 PHE 62 -2.541 0.234 -10.817 509 HD2 PHE 62 HD1 PHE 62 -3.645 1.866 -6.998 510 HE1 PHE 62 HE2 PHE 62 -0.968 -1.319 -9.695 511 HE2 PHE 62 HE1 PHE 62 -2.069 0.316 -5.880 512 HZ PHE 62 HZ PHE 62 -0.731 -1.279 -7.227 513 H ASP 63 HN ASP 63 -5.668 3.367 -11.917 514 HA ASP 63 HA ASP 63 -8.086 4.196 -10.642 515 HB2 ASP 63 HB2 ASP 63 -6.982 4.818 -13.395 516 HB3 ASP 63 HB1 ASP 63 -8.341 5.664 -12.654 517 H ARG 64 HN ARG 64 -7.468 2.049 -13.347 518 HA ARG 64 HA ARG 64 -10.160 1.871 -14.320 519 HB2 ARG 64 HB2 ARG 64 -8.477 1.079 -15.771 520 HB3 ARG 64 HB1 ARG 64 -7.684 0.160 -14.502 521 HG2 ARG 64 HG2 ARG 64 -8.795 -1.362 -16.042 522 HG3 ARG 64 HG1 ARG 64 -9.622 -1.435 -14.500 523 HD2 ARG 64 HD2 ARG 64 -11.214 -1.302 -16.398 524 HD3 ARG 64 HD1 ARG 64 -11.354 0.094 -15.330 525 HE ARG 64 HE ARG 64 -10.708 1.430 -17.147 526 HH11 ARG 64 HH21 ARG 64 -9.647 -1.831 -17.572 527 HH12 ARG 64 HH22 ARG 64 -8.940 -1.530 -19.125 528 HH21 ARG 64 HH11 ARG 64 -9.792 1.827 -19.162 529 HH22 ARG 64 HH12 ARG 64 -9.018 0.538 -20.020 530 H ILE 65 HN ILE 65 -8.310 -0.075 -11.974 531 HA ILE 65 HA ILE 65 -10.534 -1.849 -11.431 532 HB ILE 65 HB ILE 65 -7.973 -1.355 -9.889 533 HG12 ILE 65 HG12 ILE 65 -8.703 -3.620 -11.767 534 HG13 ILE 65 HG11 ILE 65 -7.818 -2.188 -12.291 535 HG21 ILE 65 HG21 ILE 65 -8.505 -3.687 -9.009 536 HG22 ILE 65 HG22 ILE 65 -10.126 -3.474 -9.672 537 HG23 ILE 65 HG23 ILE 65 -9.542 -2.397 -8.403 538 HD11 ILE 65 HD11 ILE 65 -5.970 -2.680 -10.881 539 HD12 ILE 65 HD12 ILE 65 -6.412 -4.228 -11.603 540 HD13 ILE 65 HD13 ILE 65 -6.895 -3.857 -9.948 541 H ILE 66 HN ILE 66 -8.871 0.235 -9.033 542 HA ILE 66 HA ILE 66 -9.759 1.122 -7.034 543 HB ILE 66 HB ILE 66 -11.857 2.081 -8.997 544 HG12 ILE 66 HG12 ILE 66 -9.605 2.532 -9.816 545 HG13 ILE 66 HG11 ILE 66 -10.351 4.027 -9.278 546 HG21 ILE 66 HG21 ILE 66 -11.773 4.088 -7.387 547 HG22 ILE 66 HG22 ILE 66 -10.938 3.005 -6.274 548 HG23 ILE 66 HG23 ILE 66 -12.579 2.636 -6.799 549 HD11 ILE 66 HD11 ILE 66 -8.123 2.460 -8.011 550 HD12 ILE 66 HD12 ILE 66 -9.139 3.469 -6.992 551 HD13 ILE 66 HD13 ILE 66 -8.229 4.189 -8.312 552 H VAL 67 HN VAL 67 -10.308 -1.274 -6.589 553 HA VAL 67 HA VAL 67 -13.274 -1.673 -6.383 554 HB VAL 67 HB VAL 67 -11.956 -3.438 -7.558 555 HG11 VAL 67 HG11 VAL 67 -9.925 -3.069 -6.015 556 HG12 VAL 67 HG12 VAL 67 -10.324 -4.736 -6.430 557 HG13 VAL 67 HG13 VAL 67 -10.776 -4.090 -4.854 558 HG21 VAL 67 HG21 VAL 67 -12.998 -5.292 -6.407 559 HG22 VAL 67 HG22 VAL 67 -14.074 -3.902 -6.266 560 HG23 VAL 67 HG23 VAL 67 -13.066 -4.380 -4.899 561 H ASN 68 HN ASN 68 -14.180 -1.504 -4.416 562 HA ASN 68 HA ASN 68 -12.516 -0.931 -2.087 563 HB2 ASN 68 HB2 ASN 68 -15.515 -1.265 -2.387 564 HB3 ASN 68 HB1 ASN 68 -14.705 -0.698 -0.926 565 HD21 ASN 68 HD21 ASN 68 -15.512 0.170 -4.266 566 HD22 ASN 68 HD22 ASN 68 -15.095 1.810 -4.126 567 H LYS 69 HN LYS 69 -12.763 -2.151 -0.032 568 HA LYS 69 HA LYS 69 -12.332 -4.959 -0.376 569 HB2 LYS 69 HB2 LYS 69 -13.126 -3.395 2.101 570 HB3 LYS 69 HB1 LYS 69 -12.557 -5.058 2.113 571 HG2 LYS 69 HG2 LYS 69 -10.944 -2.757 0.974 572 HG3 LYS 69 HG1 LYS 69 -10.792 -3.312 2.639 573 HD2 LYS 69 HD2 LYS 69 -10.384 -5.663 1.589 574 HD3 LYS 69 HD1 LYS 69 -10.082 -4.777 0.095 575 HE2 LYS 69 HE2 LYS 69 -8.651 -4.256 2.716 576 HE3 LYS 69 HE1 LYS 69 -7.994 -5.203 1.382 577 HZ1 LYS 69 HZ1 LYS 69 -8.954 -2.438 0.991 578 HZ2 LYS 69 HZ2 LYS 69 -7.913 -3.348 0.004 579 HZ3 LYS 69 HZ3 LYS 69 -7.370 -2.759 1.503 580 H LEU 70 HN LEU 70 -15.175 -3.118 0.722 581 HA LEU 70 HA LEU 70 -17.360 -3.854 1.210 582 HB2 LEU 70 HB2 LEU 70 -16.947 -3.787 -1.423 583 HB3 LEU 70 HB1 LEU 70 -17.203 -5.523 -1.291 584 HG LEU 70 HG LEU 70 -19.121 -3.415 -0.242 585 HD11 LEU 70 HD11 LEU 70 -20.493 -3.864 -2.146 586 HD12 LEU 70 HD12 LEU 70 -19.478 -5.219 -2.643 587 HD13 LEU 70 HD13 LEU 70 -18.871 -3.568 -2.771 588 HD21 LEU 70 HD21 LEU 70 -19.196 -6.436 -0.406 589 HD22 LEU 70 HD22 LEU 70 -20.655 -5.468 -0.203 590 HD23 LEU 70 HD23 LEU 70 -19.390 -5.423 1.024 591 H GLU 71 HN GLU 71 -16.311 -5.207 2.994 592 HA GLU 71 HA GLU 71 -15.940 -7.252 4.107 593 HB2 GLU 71 HB2 GLU 71 -18.412 -6.911 4.187 594 HB3 GLU 71 HB1 GLU 71 -18.563 -7.899 2.732 595 HG2 GLU 71 HG2 GLU 71 -17.646 -9.826 3.855 596 HG3 GLU 71 HG1 GLU 71 -17.218 -8.865 5.269 597 H HIS 72 HN HIS 72 -14.149 -8.192 3.118 598 HA HIS 72 HA HIS 72 -14.502 -9.799 0.665 599 HB2 HIS 72 HB2 HIS 72 -12.002 -10.293 1.159 600 HB3 HIS 72 HB1 HIS 72 -12.436 -8.643 0.710 601 HD2 HIS 72 HD2 HIS 72 -10.690 -10.448 3.600 602 HE1 HIS 72 HE1 HIS 72 -11.741 -6.632 5.075 603 HE2 HIS 72 HE2 HIS 72 -10.382 -8.724 5.533 604 H HIS 73 HN HIS 73 -13.606 -12.097 0.719 605 HA HIS 73 HA HIS 73 -13.937 -13.426 3.369 606 HB2 HIS 73 HB2 HIS 73 -16.081 -13.391 1.761 607 HB3 HIS 73 HB1 HIS 73 -15.232 -14.719 0.973 608 HD2 HIS 73 HD2 HIS 73 -16.578 -13.892 4.628 609 HE1 HIS 73 HE1 HIS 73 -16.249 -18.081 4.202 610 HE2 HIS 73 HE2 HIS 73 -16.999 -16.212 5.744 611 H HIS 74 HN HIS 74 -11.795 -14.096 3.472 612 HA HIS 74 HA HIS 74 -10.449 -15.233 1.132 613 HB2 HIS 74 HB2 HIS 74 -8.660 -15.783 2.858 614 HB3 HIS 74 HB1 HIS 74 -9.057 -14.069 2.719 615 HD2 HIS 74 HD2 HIS 74 -9.923 -12.920 5.102 616 HE1 HIS 74 HE1 HIS 74 -10.563 -16.494 7.259 617 HE2 HIS 74 HE2 HIS 74 -10.552 -13.962 7.409 618 H HIS 75 HN HIS 75 -12.328 -16.357 3.831 619 HA HIS 75 HA HIS 75 -12.794 -18.526 4.627 620 HB2 HIS 75 HB2 HIS 75 -13.967 -19.780 3.022 621 HB3 HIS 75 HB1 HIS 75 -14.048 -18.146 2.374 622 HD2 HIS 75 HD2 HIS 75 -12.503 -17.724 0.003 623 HE1 HIS 75 HE1 HIS 75 -11.355 -21.761 -0.472 624 HE2 HIS 75 HE2 HIS 75 -11.388 -19.478 -1.575 625 H HIS 76 HN HIS 76 -9.883 -17.949 4.101 626 HA HIS 76 HA HIS 76 -8.761 -20.364 2.981 627 HB2 HIS 76 HB2 HIS 76 -6.642 -19.465 3.526 628 HB3 HIS 76 HB1 HIS 76 -7.637 -18.056 3.189 629 HD2 HIS 76 HD2 HIS 76 -4.999 -18.323 5.470 630 HE1 HIS 76 HE1 HIS 76 -8.059 -17.113 8.116 631 HE2 HIS 76 HE2 HIS 76 -5.549 -17.329 7.816 632 H HIS 77 HN HIS 77 -10.457 -21.536 4.463 633 HA HIS 77 HA HIS 77 -9.429 -22.087 7.183 634 HB2 HIS 77 HB2 HIS 77 -11.928 -22.745 5.637 635 HB3 HIS 77 HB1 HIS 77 -11.502 -23.756 7.016 636 HD2 HIS 77 HD2 HIS 77 -13.062 -20.277 6.326 637 HE1 HIS 77 HE1 HIS 77 -12.378 -20.533 10.486 638 HE2 HIS 77 HE2 HIS 77 -13.506 -19.187 8.656 639 H1 MET 1 HT1 MET 1 -10.591 -7.667 -11.019 640 H2 MET 1 HT2 MET 1 -11.520 -8.742 -11.950 641 H3 MET 1 HT3 MET 1 -10.685 -7.468 -12.701 642 HA MET 1 HA MET 1 -9.784 -10.080 -12.129 643 HB2 MET 1 HB2 MET 1 -9.472 -8.745 -14.228 644 HB3 MET 1 HB1 MET 1 -8.355 -7.699 -13.351 645 HG2 MET 1 HG2 MET 1 -6.884 -9.593 -12.893 646 HG3 MET 1 HG1 MET 1 -8.025 -10.696 -13.664 647 HE1 MET 1 HE1 MET 1 -6.266 -11.639 -14.929 648 HE2 MET 1 HE2 MET 1 -5.820 -11.091 -16.543 649 HE3 MET 1 HE3 MET 1 -7.502 -11.474 -16.183 650 H GLU 2 HN GLU 2 -7.697 -10.644 -11.153 651 HA GLU 2 HA GLU 2 -7.284 -9.370 -8.604 652 HB2 GLU 2 HB2 GLU 2 -5.774 -11.467 -10.167 653 HB3 GLU 2 HB1 GLU 2 -5.141 -10.848 -8.642 654 HG2 GLU 2 HG2 GLU 2 -6.420 -12.827 -8.139 655 HG3 GLU 2 HG1 GLU 2 -7.361 -11.446 -7.580 656 H LEU 3 HN LEU 3 -6.074 -7.624 -8.123 657 HA LEU 3 HA LEU 3 -4.701 -6.095 -10.123 658 HB2 LEU 3 HB2 LEU 3 -5.664 -5.083 -8.107 659 HB3 LEU 3 HB1 LEU 3 -4.531 -5.972 -7.097 660 HG LEU 3 HG LEU 3 -3.248 -4.359 -9.258 661 HD11 LEU 3 HD11 LEU 3 -3.502 -2.225 -8.032 662 HD12 LEU 3 HD12 LEU 3 -4.637 -2.999 -6.926 663 HD13 LEU 3 HD13 LEU 3 -5.053 -2.814 -8.630 664 HD21 LEU 3 HD21 LEU 3 -2.781 -4.507 -6.258 665 HD22 LEU 3 HD22 LEU 3 -1.689 -3.806 -7.449 666 HD23 LEU 3 HD23 LEU 3 -1.991 -5.542 -7.446 667 H SER 4 HN SER 4 -3.544 -8.335 -7.609 668 HA SER 4 HA SER 4 -0.761 -7.903 -7.940 669 HB2 SER 4 HB2 SER 4 -1.735 -9.292 -6.127 670 HB3 SER 4 HB1 SER 4 -2.179 -10.513 -7.316 671 HG SER 4 HG SER 4 0.459 -9.560 -6.861 672 H ASN 5 HN ASN 5 -3.016 -9.961 -9.738 673 HA ASN 5 HA ASN 5 -1.101 -11.309 -11.367 674 HB2 ASN 5 HB2 ASN 5 -3.379 -12.095 -11.322 675 HB3 ASN 5 HB1 ASN 5 -3.987 -10.531 -11.860 676 HD21 ASN 5 HD21 ASN 5 -1.159 -12.312 -13.182 677 HD22 ASN 5 HD22 ASN 5 -1.810 -12.488 -14.740 678 H GLU 6 HN GLU 6 -2.746 -8.186 -11.753 679 HA GLU 6 HA GLU 6 -1.869 -7.576 -14.383 680 HB2 GLU 6 HB2 GLU 6 -2.245 -5.669 -12.048 681 HB3 GLU 6 HB1 GLU 6 -2.250 -5.229 -13.755 682 HG2 GLU 6 HG2 GLU 6 -4.179 -7.261 -12.618 683 HG3 GLU 6 HG1 GLU 6 -4.547 -5.538 -12.655 684 H LEU 7 HN LEU 7 -0.313 -6.997 -11.225 685 HA LEU 7 HA LEU 7 1.977 -5.625 -12.250 686 HB2 LEU 7 HB2 LEU 7 1.430 -7.181 -9.725 687 HB3 LEU 7 HB1 LEU 7 3.059 -6.599 -10.063 688 HG LEU 7 HG LEU 7 2.043 -4.283 -10.381 689 HD11 LEU 7 HD11 LEU 7 -0.283 -4.919 -10.732 690 HD12 LEU 7 HD12 LEU 7 -0.172 -3.958 -9.260 691 HD13 LEU 7 HD13 LEU 7 -0.337 -5.710 -9.157 692 HD21 LEU 7 HD21 LEU 7 1.802 -5.665 -7.692 693 HD22 LEU 7 HD22 LEU 7 1.804 -3.917 -7.917 694 HD23 LEU 7 HD23 LEU 7 3.233 -4.862 -8.335 695 H LYS 8 HN LYS 8 1.367 -9.102 -11.697 696 HA LYS 8 HA LYS 8 4.015 -9.955 -12.347 697 HB2 LYS 8 HB2 LYS 8 1.386 -11.416 -12.725 698 HB3 LYS 8 HB1 LYS 8 2.978 -12.163 -12.858 699 HG2 LYS 8 HG2 LYS 8 3.357 -11.172 -10.457 700 HG3 LYS 8 HG1 LYS 8 1.598 -11.071 -10.412 701 HD2 LYS 8 HD2 LYS 8 3.193 -13.591 -10.981 702 HD3 LYS 8 HD1 LYS 8 2.417 -13.202 -9.447 703 HE2 LYS 8 HE2 LYS 8 0.224 -13.082 -10.653 704 HE3 LYS 8 HE1 LYS 8 1.043 -13.648 -12.111 705 HZ1 LYS 8 HZ1 LYS 8 1.827 -15.568 -10.694 706 HZ2 LYS 8 HZ2 LYS 8 0.174 -15.553 -11.090 707 HZ3 LYS 8 HZ3 LYS 8 0.685 -15.074 -9.542 708 H VAL 9 HN VAL 9 1.197 -9.239 -14.370 709 HA VAL 9 HA VAL 9 2.215 -10.287 -16.811 710 HB VAL 9 HB VAL 9 0.399 -7.916 -16.298 711 HG11 VAL 9 HG11 VAL 9 1.267 -7.592 -18.500 712 HG12 VAL 9 HG12 VAL 9 -0.290 -8.388 -18.725 713 HG13 VAL 9 HG13 VAL 9 1.203 -9.318 -18.858 714 HG21 VAL 9 HG21 VAL 9 -0.295 -10.270 -15.577 715 HG22 VAL 9 HG22 VAL 9 -0.291 -10.693 -17.289 716 HG23 VAL 9 HG23 VAL 9 -1.393 -9.453 -16.689 717 H GLU 10 HN GLU 10 2.548 -6.988 -15.410 718 HA GLU 10 HA GLU 10 4.113 -5.939 -17.558 719 HB2 GLU 10 HB2 GLU 10 4.143 -5.204 -14.614 720 HB3 GLU 10 HB1 GLU 10 4.736 -4.195 -15.937 721 HG2 GLU 10 HG2 GLU 10 2.509 -4.053 -16.900 722 HG3 GLU 10 HG1 GLU 10 1.882 -5.196 -15.712 723 H ARG 11 HN ARG 11 4.987 -7.699 -14.605 724 HA ARG 11 HA ARG 11 7.820 -7.401 -14.751 725 HB2 ARG 11 HB2 ARG 11 6.798 -8.315 -12.765 726 HB3 ARG 11 HB1 ARG 11 6.045 -9.614 -13.681 727 HG2 ARG 11 HG2 ARG 11 8.076 -10.322 -12.376 728 HG3 ARG 11 HG1 ARG 11 8.192 -10.650 -14.103 729 HD2 ARG 11 HD2 ARG 11 9.737 -8.934 -14.459 730 HD3 ARG 11 HD1 ARG 11 9.253 -8.058 -13.010 731 HE ARG 11 HE ARG 11 11.025 -10.450 -13.084 732 HH11 ARG 11 HH21 ARG 11 9.397 -7.956 -11.303 733 HH12 ARG 11 HH22 ARG 11 10.371 -8.166 -9.890 734 HH21 ARG 11 HH11 ARG 11 12.280 -10.720 -11.232 735 HH22 ARG 11 HH12 ARG 11 11.990 -9.721 -9.847 736 H ILE 12 HN ILE 12 5.660 -9.878 -16.075 737 HA ILE 12 HA ILE 12 7.773 -11.300 -17.462 738 HB ILE 12 HB ILE 12 4.768 -11.396 -17.879 739 HG12 ILE 12 HG12 ILE 12 6.472 -13.287 -16.234 740 HG13 ILE 12 HG11 ILE 12 5.699 -11.878 -15.514 741 HG21 ILE 12 HG21 ILE 12 7.065 -13.188 -18.695 742 HG22 ILE 12 HG22 ILE 12 5.865 -12.429 -19.739 743 HG23 ILE 12 HG23 ILE 12 5.393 -13.748 -18.669 744 HD11 ILE 12 HD11 ILE 12 4.334 -14.203 -16.894 745 HD12 ILE 12 HD12 ILE 12 3.500 -12.720 -16.428 746 HD13 ILE 12 HD13 ILE 12 4.219 -13.752 -15.191 747 H ARG 13 HN ARG 13 5.451 -8.780 -18.291 748 HA ARG 13 HA ARG 13 5.707 -8.801 -21.113 749 HB2 ARG 13 HB2 ARG 13 4.121 -7.401 -19.648 750 HB3 ARG 13 HB1 ARG 13 5.467 -6.284 -19.447 751 HG2 ARG 13 HG2 ARG 13 5.611 -6.040 -21.905 752 HG3 ARG 13 HG1 ARG 13 4.239 -7.134 -22.083 753 HD2 ARG 13 HD2 ARG 13 2.951 -5.523 -20.556 754 HD3 ARG 13 HD1 ARG 13 4.274 -4.388 -20.825 755 HE ARG 13 HE ARG 13 3.148 -5.488 -23.286 756 HH11 ARG 13 HH21 ARG 13 3.035 -3.042 -20.855 757 HH12 ARG 13 HH22 ARG 13 2.176 -1.913 -21.848 758 HH21 ARG 13 HH11 ARG 13 2.025 -4.032 -24.589 759 HH22 ARG 13 HH12 ARG 13 1.603 -2.474 -23.962 760 H LEU 14 HN LEU 14 7.595 -7.031 -18.660 761 HA LEU 14 HA LEU 14 9.555 -6.225 -20.753 762 HB2 LEU 14 HB2 LEU 14 9.394 -5.456 -17.820 763 HB3 LEU 14 HB1 LEU 14 10.451 -4.732 -19.032 764 HG LEU 14 HG LEU 14 7.418 -4.705 -19.135 765 HD11 LEU 14 HD11 LEU 14 8.328 -3.299 -17.316 766 HD12 LEU 14 HD12 LEU 14 7.635 -2.311 -18.603 767 HD13 LEU 14 HD13 LEU 14 9.385 -2.490 -18.473 768 HD21 LEU 14 HD21 LEU 14 8.115 -4.527 -21.372 769 HD22 LEU 14 HD22 LEU 14 9.598 -3.672 -20.950 770 HD23 LEU 14 HD23 LEU 14 8.047 -2.836 -20.880 771 H SER 15 HN SER 15 9.038 -8.820 -18.783 772 HA SER 15 HA SER 15 10.438 -10.401 -17.722 773 HB2 SER 15 HB2 SER 15 12.458 -10.936 -19.251 774 HB3 SER 15 HB1 SER 15 10.845 -11.118 -19.934 775 HG SER 15 HG SER 15 11.129 -8.895 -20.686 776 H LEU 16 HN LEU 16 10.822 -8.584 -16.050 777 HA LEU 16 HA LEU 16 13.436 -7.277 -16.142 778 HB2 LEU 16 HB2 LEU 16 11.562 -7.586 -13.780 779 HB3 LEU 16 HB1 LEU 16 12.842 -6.391 -13.970 780 HG LEU 16 HG LEU 16 10.415 -6.613 -15.775 781 HD11 LEU 16 HD11 LEU 16 11.047 -4.553 -13.642 782 HD12 LEU 16 HD12 LEU 16 9.903 -5.874 -13.437 783 HD13 LEU 16 HD13 LEU 16 9.593 -4.626 -14.640 784 HD21 LEU 16 HD21 LEU 16 12.140 -5.601 -17.045 785 HD22 LEU 16 HD22 LEU 16 12.788 -4.743 -15.646 786 HD23 LEU 16 HD23 LEU 16 11.266 -4.229 -16.371 787 H THR 17 HN THR 17 15.163 -7.705 -14.606 788 HA THR 17 HA THR 17 15.390 -10.607 -13.971 789 HB THR 17 HB THR 17 17.815 -10.003 -13.584 790 HG1 THR 17 HG1 THR 17 17.279 -7.597 -14.900 791 HG21 THR 17 HG21 THR 17 17.258 -10.926 -15.707 792 HG22 THR 17 HG22 THR 17 18.228 -9.495 -16.053 793 HG23 THR 17 HG23 THR 17 16.474 -9.436 -16.230 794 H ALA 18 HN ALA 18 15.649 -11.350 -11.873 795 HA ALA 18 HA ALA 18 14.686 -9.743 -9.711 796 HB1 ALA 18 HB1 ALA 18 14.473 -12.123 -9.510 797 HB2 ALA 18 HB2 ALA 18 15.628 -11.624 -8.272 798 HB3 ALA 18 HB3 ALA 18 16.202 -12.361 -9.768 799 H LYS 19 HN LYS 19 17.943 -10.529 -10.833 800 HA LYS 19 HA LYS 19 19.381 -9.504 -8.602 801 HB2 LYS 19 HB2 LYS 19 20.372 -10.851 -10.461 802 HB3 LYS 19 HB1 LYS 19 20.208 -9.446 -11.514 803 HG2 LYS 19 HG2 LYS 19 21.687 -8.143 -10.072 804 HG3 LYS 19 HG1 LYS 19 21.795 -9.483 -8.930 805 HD2 LYS 19 HD2 LYS 19 22.803 -10.895 -10.695 806 HD3 LYS 19 HD1 LYS 19 22.728 -9.535 -11.815 807 HE2 LYS 19 HE2 LYS 19 24.262 -9.571 -9.199 808 HE3 LYS 19 HE1 LYS 19 24.973 -9.730 -10.805 809 HZ1 LYS 19 HZ1 LYS 19 25.192 -7.493 -10.394 810 HZ2 LYS 19 HZ2 LYS 19 23.718 -7.381 -9.556 811 HZ3 LYS 19 HZ3 LYS 19 23.727 -7.529 -11.249 812 H SER 20 HN SER 20 18.303 -7.881 -11.601 813 HA SER 20 HA SER 20 19.453 -5.341 -10.996 814 HB2 SER 20 HB2 SER 20 18.693 -5.673 -13.223 815 HB3 SER 20 HB1 SER 20 17.096 -6.184 -12.683 816 HG SER 20 HG SER 20 17.009 -3.966 -11.742 817 H VAL 21 HN VAL 21 16.095 -6.499 -10.461 818 HA VAL 21 HA VAL 21 15.277 -4.111 -9.087 819 HB VAL 21 HB VAL 21 14.163 -6.921 -8.898 820 HG11 VAL 21 HG11 VAL 21 12.040 -5.545 -8.339 821 HG12 VAL 21 HG12 VAL 21 13.155 -4.225 -7.991 822 HG13 VAL 21 HG13 VAL 21 13.257 -5.727 -7.074 823 HG21 VAL 21 HG21 VAL 21 13.003 -4.682 -10.552 824 HG22 VAL 21 HG22 VAL 21 12.784 -6.421 -10.730 825 HG23 VAL 21 HG23 VAL 21 14.309 -5.674 -11.204 826 H ALA 22 HN ALA 22 16.399 -7.282 -7.901 827 HA ALA 22 HA ALA 22 16.153 -6.661 -5.119 828 HB1 ALA 22 HB1 ALA 22 17.557 -8.609 -4.746 829 HB2 ALA 22 HB2 ALA 22 18.131 -8.556 -6.413 830 HB3 ALA 22 HB3 ALA 22 16.450 -8.965 -6.073 831 H GLU 23 HN GLU 23 18.779 -6.123 -7.449 832 HA GLU 23 HA GLU 23 20.806 -5.431 -5.577 833 HB2 GLU 23 HB2 GLU 23 21.403 -5.811 -7.881 834 HB3 GLU 23 HB1 GLU 23 20.331 -4.524 -8.428 835 HG2 GLU 23 HG2 GLU 23 22.777 -3.887 -8.362 836 HG3 GLU 23 HG1 GLU 23 21.733 -2.829 -7.415 837 H GLU 24 HN GLU 24 18.574 -3.234 -7.354 838 HA GLU 24 HA GLU 24 19.493 -0.907 -5.911 839 HB2 GLU 24 HB2 GLU 24 16.770 -1.209 -7.183 840 HB3 GLU 24 HB1 GLU 24 17.712 0.268 -6.977 841 HG2 GLU 24 HG2 GLU 24 18.476 -2.070 -8.753 842 HG3 GLU 24 HG1 GLU 24 17.811 -0.537 -9.311 843 H MET 25 HN MET 25 16.763 -3.128 -5.467 844 HA MET 25 HA MET 25 15.528 -1.701 -3.315 845 HB2 MET 25 HB2 MET 25 15.505 -4.607 -4.149 846 HB3 MET 25 HB1 MET 25 14.573 -4.016 -2.774 847 HG2 MET 25 HG2 MET 25 14.372 -2.850 -5.565 848 HG3 MET 25 HG1 MET 25 13.281 -4.087 -4.943 849 HE1 MET 25 HE1 MET 25 10.878 -3.182 -3.537 850 HE2 MET 25 HE2 MET 25 11.565 -2.644 -2.008 851 HE3 MET 25 HE3 MET 25 12.255 -4.037 -2.832 852 H GLY 26 HN GLY 26 18.057 -4.200 -3.377 853 HA2 GLY 26 HA2 GLY 26 19.762 -4.495 -1.743 854 HA3 GLY 26 HA1 GLY 26 18.936 -3.337 -0.702 855 H ILE 27 HN ILE 27 17.296 -6.070 -2.182 856 HA ILE 27 HA ILE 27 17.094 -7.382 0.514 857 HB ILE 27 HB ILE 27 14.806 -8.079 -0.127 858 HG12 ILE 27 HG12 ILE 27 15.222 -6.234 -2.501 859 HG13 ILE 27 HG11 ILE 27 15.154 -7.991 -2.596 860 HG21 ILE 27 HG21 ILE 27 13.754 -5.942 0.247 861 HG22 ILE 27 HG22 ILE 27 15.160 -5.082 -0.382 862 HG23 ILE 27 HG23 ILE 27 15.271 -5.957 1.147 863 HD11 ILE 27 HD11 ILE 27 12.870 -7.938 -1.623 864 HD12 ILE 27 HD12 ILE 27 12.962 -7.054 -3.145 865 HD13 ILE 27 HD13 ILE 27 12.931 -6.176 -1.616 866 H SER 28 HN SER 28 16.616 -9.733 0.357 867 HA SER 28 HA SER 28 18.428 -10.999 -1.510 868 HB2 SER 28 HB2 SER 28 17.782 -13.068 -0.413 869 HB3 SER 28 HB1 SER 28 17.976 -11.822 0.817 870 HG SER 28 HG SER 28 15.481 -11.736 -0.114 871 H ARG 29 HN ARG 29 17.733 -12.813 -2.937 872 HA ARG 29 HA ARG 29 15.701 -11.979 -4.778 873 HB2 ARG 29 HB2 ARG 29 16.902 -14.746 -4.438 874 HB3 ARG 29 HB1 ARG 29 16.092 -14.133 -5.877 875 HG2 ARG 29 HG2 ARG 29 18.536 -12.764 -4.753 876 HG3 ARG 29 HG1 ARG 29 18.673 -14.121 -5.865 877 HD2 ARG 29 HD2 ARG 29 17.427 -12.919 -7.566 878 HD3 ARG 29 HD1 ARG 29 17.134 -11.578 -6.463 879 HE ARG 29 HE ARG 29 19.583 -12.046 -7.935 880 HH11 ARG 29 HH21 ARG 29 18.194 -10.900 -4.998 881 HH12 ARG 29 HH22 ARG 29 19.442 -9.736 -4.702 882 HH21 ARG 29 HH11 ARG 29 21.226 -10.532 -7.567 883 HH22 ARG 29 HH12 ARG 29 21.159 -9.527 -6.158 884 H GLN 30 HN GLN 30 15.716 -14.296 -2.094 885 HA GLN 30 HA GLN 30 13.177 -15.489 -2.603 886 HB2 GLN 30 HB2 GLN 30 14.832 -16.300 -0.903 887 HB3 GLN 30 HB1 GLN 30 14.432 -14.907 0.100 888 HG2 GLN 30 HG2 GLN 30 13.141 -16.809 0.877 889 HG3 GLN 30 HG1 GLN 30 12.039 -15.671 0.103 890 HE21 GLN 30 HE21 GLN 30 13.457 -18.875 -0.137 891 HE22 GLN 30 HE22 GLN 30 12.580 -19.370 -1.503 892 H GLN 31 HN GLN 31 14.071 -12.555 -0.785 893 HA GLN 31 HA GLN 31 11.424 -11.923 0.113 894 HB2 GLN 31 HB2 GLN 31 13.948 -10.338 -0.335 895 HB3 GLN 31 HB1 GLN 31 12.455 -9.497 0.076 896 HG2 GLN 31 HG2 GLN 31 13.440 -11.839 1.713 897 HG3 GLN 31 HG1 GLN 31 14.007 -10.197 2.024 898 HE21 GLN 31 HE21 GLN 31 12.536 -11.403 4.051 899 HE22 GLN 31 HE22 GLN 31 10.990 -10.712 4.142 900 H LEU 32 HN LEU 32 13.250 -10.955 -2.789 901 HA LEU 32 HA LEU 32 11.213 -9.280 -3.877 902 HB2 LEU 32 HB2 LEU 32 13.563 -9.285 -4.674 903 HB3 LEU 32 HB1 LEU 32 13.324 -10.901 -5.331 904 HG LEU 32 HG LEU 32 11.552 -10.034 -6.824 905 HD11 LEU 32 HD11 LEU 32 10.577 -8.176 -5.811 906 HD12 LEU 32 HD12 LEU 32 11.622 -7.390 -6.985 907 HD13 LEU 32 HD13 LEU 32 12.124 -7.502 -5.301 908 HD21 LEU 32 HD21 LEU 32 13.986 -10.071 -7.491 909 HD22 LEU 32 HD22 LEU 32 14.076 -8.368 -7.036 910 HD23 LEU 32 HD23 LEU 32 13.016 -8.875 -8.351 911 H CYS 33 HN CYS 33 11.910 -12.744 -4.290 912 HA CYS 33 HA CYS 33 9.943 -13.281 -6.261 913 HB2 CYS 33 HB2 CYS 33 11.835 -14.774 -5.006 914 HB3 CYS 33 HB1 CYS 33 10.399 -15.381 -4.190 915 HG CYS 33 HG CYS 33 11.145 -16.429 -6.741 916 H ASN 34 HN ASN 34 9.672 -13.049 -2.729 917 HA ASN 34 HA ASN 34 7.005 -14.058 -2.523 918 HB2 ASN 34 HB2 ASN 34 8.723 -12.262 -0.828 919 HB3 ASN 34 HB1 ASN 34 7.014 -12.421 -0.431 920 HD21 ASN 34 HD21 ASN 34 10.045 -13.815 0.148 921 HD22 ASN 34 HD22 ASN 34 9.520 -15.338 0.684 922 H ILE 35 HN ILE 35 8.236 -10.768 -3.118 923 HA ILE 35 HA ILE 35 5.694 -9.466 -3.039 924 HB ILE 35 HB ILE 35 8.116 -8.733 -4.710 925 HG12 ILE 35 HG12 ILE 35 7.360 -7.831 -1.914 926 HG13 ILE 35 HG11 ILE 35 8.561 -9.076 -2.253 927 HG21 ILE 35 HG21 ILE 35 5.754 -7.132 -3.682 928 HG22 ILE 35 HG22 ILE 35 6.125 -7.492 -5.367 929 HG23 ILE 35 HG23 ILE 35 7.179 -6.424 -4.441 930 HD11 ILE 35 HD11 ILE 35 9.755 -7.376 -3.714 931 HD12 ILE 35 HD12 ILE 35 9.768 -7.019 -1.986 932 HD13 ILE 35 HD13 ILE 35 8.660 -6.160 -3.056 933 H GLU 36 HN GLU 36 7.541 -10.806 -5.791 934 HA GLU 36 HA GLU 36 5.480 -10.203 -7.711 935 HB2 GLU 36 HB2 GLU 36 8.103 -11.480 -7.700 936 HB3 GLU 36 HB1 GLU 36 6.989 -12.406 -8.699 937 HG2 GLU 36 HG2 GLU 36 7.457 -9.417 -8.957 938 HG3 GLU 36 HG1 GLU 36 8.192 -10.644 -9.990 939 H GLN 37 HN GLN 37 6.102 -12.945 -5.583 940 HA GLN 37 HA GLN 37 4.000 -14.563 -6.872 941 HB2 GLN 37 HB2 GLN 37 5.739 -15.001 -4.435 942 HB3 GLN 37 HB1 GLN 37 4.513 -16.151 -4.973 943 HG2 GLN 37 HG2 GLN 37 5.623 -16.319 -7.167 944 HG3 GLN 37 HG1 GLN 37 6.845 -15.161 -6.641 945 HE21 GLN 37 HE21 GLN 37 8.513 -15.909 -5.209 946 HE22 GLN 37 HE22 GLN 37 8.685 -17.542 -4.781 947 H SER 38 HN SER 38 3.986 -12.003 -4.731 948 HA SER 38 HA SER 38 1.206 -12.401 -4.078 949 HB2 SER 38 HB2 SER 38 1.456 -12.608 -1.623 950 HB3 SER 38 HB1 SER 38 2.119 -14.005 -2.465 951 HG SER 38 HG SER 38 3.759 -13.482 -1.192 952 H GLU 39 HN GLU 39 0.824 -10.288 -4.639 953 HA GLU 39 HA GLU 39 2.488 -8.123 -3.490 954 HB2 GLU 39 HB2 GLU 39 0.129 -8.064 -5.404 955 HB3 GLU 39 HB1 GLU 39 1.083 -6.658 -4.933 956 HG2 GLU 39 HG2 GLU 39 2.466 -9.083 -6.085 957 HG3 GLU 39 HG1 GLU 39 1.674 -7.934 -7.162 958 H THR 40 HN THR 40 1.927 -7.952 -1.333 959 HA THR 40 HA THR 40 -0.755 -8.260 -0.338 960 HB THR 40 HB THR 40 0.128 -7.507 1.768 961 HG1 THR 40 HG1 THR 40 2.451 -6.691 1.550 962 HG21 THR 40 HG21 THR 40 1.987 -8.981 2.048 963 HG22 THR 40 HG22 THR 40 2.461 -8.815 0.357 964 HG23 THR 40 HG23 THR 40 0.992 -9.693 0.778 965 H ALA 41 HN ALA 41 -2.355 -6.759 -0.061 966 HA ALA 41 HA ALA 41 -1.792 -3.924 -0.880 967 HB1 ALA 41 HB1 ALA 41 -4.384 -5.440 -1.195 968 HB2 ALA 41 HB2 ALA 41 -3.201 -5.229 -2.487 969 HB3 ALA 41 HB3 ALA 41 -4.017 -3.824 -1.797 970 HA PRO 42 HA PRO 42 -3.461 -3.977 3.439 971 HB2 PRO 42 HB2 PRO 42 -1.736 -2.163 4.515 972 HB3 PRO 42 HB1 PRO 42 -1.334 -3.883 4.335 973 HG2 PRO 42 HG2 PRO 42 -0.522 -1.569 2.643 974 HG3 PRO 42 HG1 PRO 42 0.422 -2.978 3.145 975 HD2 PRO 42 HD2 PRO 42 -0.745 -2.710 0.662 976 HD3 PRO 42 HD1 PRO 42 -0.365 -4.279 1.405 977 H VAL 43 HN VAL 43 -4.608 -2.306 4.615 978 HA VAL 43 HA VAL 43 -6.169 -0.572 3.079 979 HB VAL 43 HB VAL 43 -6.557 0.662 5.288 980 HG11 VAL 43 HG11 VAL 43 -6.793 -2.361 5.217 981 HG12 VAL 43 HG12 VAL 43 -7.965 -1.213 4.572 982 HG13 VAL 43 HG13 VAL 43 -7.683 -1.302 6.310 983 HG21 VAL 43 HG21 VAL 43 -5.625 -0.506 7.294 984 HG22 VAL 43 HG22 VAL 43 -4.376 0.272 6.322 985 HG23 VAL 43 HG23 VAL 43 -4.610 -1.473 6.229 986 H VAL 44 HN VAL 44 -2.875 -0.152 3.955 987 HA VAL 44 HA VAL 44 -2.713 2.696 4.089 988 HB VAL 44 HB VAL 44 -0.711 0.690 3.014 989 HG11 VAL 44 HG11 VAL 44 0.960 2.471 3.536 990 HG12 VAL 44 HG12 VAL 44 -0.373 3.581 3.851 991 HG13 VAL 44 HG13 VAL 44 -0.136 2.922 2.233 992 HG21 VAL 44 HG21 VAL 44 -1.528 0.448 5.412 993 HG22 VAL 44 HG22 VAL 44 -0.806 2.026 5.726 994 HG23 VAL 44 HG23 VAL 44 0.210 0.674 5.226 995 H VAL 45 HN VAL 45 -2.484 0.472 1.307 996 HA VAL 45 HA VAL 45 -2.061 2.485 -0.674 997 HB VAL 45 HB VAL 45 -3.413 -0.222 -0.887 998 HG11 VAL 45 HG11 VAL 45 -2.502 1.772 -2.969 999 HG12 VAL 45 HG12 VAL 45 -4.090 1.023 -2.804 1000 HG13 VAL 45 HG13 VAL 45 -2.712 0.059 -3.336 1001 HG21 VAL 45 HG21 VAL 45 -1.110 -0.406 -0.145 1002 HG22 VAL 45 HG22 VAL 45 -0.578 0.738 -1.378 1003 HG23 VAL 45 HG23 VAL 45 -1.175 -0.854 -1.850 1004 H LYS 46 HN LYS 46 -5.027 1.028 0.634 1005 HA LYS 46 HA LYS 46 -6.889 2.369 -1.052 1006 HB2 LYS 46 HB2 LYS 46 -7.208 1.552 1.853 1007 HB3 LYS 46 HB1 LYS 46 -8.526 1.917 0.744 1008 HG2 LYS 46 HG2 LYS 46 -6.511 -0.322 0.373 1009 HG3 LYS 46 HG1 LYS 46 -8.148 -0.529 0.996 1010 HD2 LYS 46 HD2 LYS 46 -8.910 0.616 -1.202 1011 HD3 LYS 46 HD1 LYS 46 -7.283 0.264 -1.784 1012 HE2 LYS 46 HE2 LYS 46 -7.605 -2.123 -1.289 1013 HE3 LYS 46 HE1 LYS 46 -9.236 -1.785 -0.707 1014 HZ1 LYS 46 HZ1 LYS 46 -8.898 -2.540 -3.132 1015 HZ2 LYS 46 HZ2 LYS 46 -8.422 -0.933 -3.405 1016 HZ3 LYS 46 HZ3 LYS 46 -9.977 -1.272 -2.810 1017 H TYR 47 HN TYR 47 -5.309 3.385 1.961 1018 HA TYR 47 HA TYR 47 -6.821 5.746 2.435 1019 HB2 TYR 47 HB2 TYR 47 -4.810 4.529 3.744 1020 HB3 TYR 47 HB1 TYR 47 -3.854 5.763 2.938 1021 HD1 TYR 47 HD1 TYR 47 -5.678 8.113 2.944 1022 HD2 TYR 47 HD2 TYR 47 -4.961 5.172 5.989 1023 HE1 TYR 47 HE1 TYR 47 -6.353 9.742 4.670 1024 HE2 TYR 47 HE2 TYR 47 -5.635 6.811 7.719 1025 HH TYR 47 HH TYR 47 -7.263 9.662 7.016 1026 H ILE 48 HN ILE 48 -3.810 5.295 0.552 1027 HA ILE 48 HA ILE 48 -3.587 8.008 -0.299 1028 HB ILE 48 HB ILE 48 -2.692 5.527 -1.794 1029 HG12 ILE 48 HG12 ILE 48 -1.151 7.196 0.217 1030 HG13 ILE 48 HG11 ILE 48 -1.950 5.678 0.625 1031 HG21 ILE 48 HG21 ILE 48 -1.860 8.440 -1.872 1032 HG22 ILE 48 HG22 ILE 48 -2.526 7.480 -3.193 1033 HG23 ILE 48 HG23 ILE 48 -0.905 7.144 -2.589 1034 HD11 ILE 48 HD11 ILE 48 0.115 5.949 -1.575 1035 HD12 ILE 48 HD12 ILE 48 -0.573 4.455 -0.940 1036 HD13 ILE 48 HD13 ILE 48 0.495 5.431 0.068 1037 H ALA 49 HN ALA 49 -5.221 5.214 -1.792 1038 HA ALA 49 HA ALA 49 -5.991 6.388 -4.211 1039 HB1 ALA 49 HB1 ALA 49 -6.452 4.004 -3.348 1040 HB2 ALA 49 HB2 ALA 49 -7.705 4.753 -4.340 1041 HB3 ALA 49 HB3 ALA 49 -7.887 4.692 -2.587 1042 H PHE 50 HN PHE 50 -7.622 6.620 -1.046 1043 HA PHE 50 HA PHE 50 -9.815 8.214 -1.917 1044 HB2 PHE 50 HB2 PHE 50 -9.509 7.098 0.364 1045 HB3 PHE 50 HB1 PHE 50 -8.470 8.461 0.781 1046 HD1 PHE 50 HD1 PHE 50 -11.901 7.430 -0.097 1047 HD2 PHE 50 HD2 PHE 50 -9.389 10.695 1.120 1048 HE1 PHE 50 HE1 PHE 50 -13.911 8.789 0.405 1049 HE2 PHE 50 HE2 PHE 50 -11.404 12.052 1.623 1050 HZ PHE 50 HZ PHE 50 -13.664 11.099 1.267 1051 H LEU 51 HN LEU 51 -6.595 9.137 -0.700 1052 HA LEU 51 HA LEU 51 -7.000 11.963 -0.812 1053 HB2 LEU 51 HB2 LEU 51 -4.446 10.360 -1.164 1054 HB3 LEU 51 HB1 LEU 51 -4.514 12.095 -0.883 1055 HG LEU 51 HG LEU 51 -5.567 9.963 1.001 1056 HD11 LEU 51 HD11 LEU 51 -3.058 11.645 0.962 1057 HD12 LEU 51 HD12 LEU 51 -3.207 9.897 1.151 1058 HD13 LEU 51 HD13 LEU 51 -3.694 10.971 2.464 1059 HD21 LEU 51 HD21 LEU 51 -5.697 12.971 1.000 1060 HD22 LEU 51 HD22 LEU 51 -5.549 12.127 2.542 1061 HD23 LEU 51 HD23 LEU 51 -6.920 11.797 1.488 1062 H ARG 52 HN ARG 52 -5.941 9.623 -3.266 1063 HA ARG 52 HA ARG 52 -5.186 11.507 -5.262 1064 HB2 ARG 52 HB2 ARG 52 -6.391 8.744 -5.546 1065 HB3 ARG 52 HB1 ARG 52 -5.738 9.677 -6.892 1066 HG2 ARG 52 HG2 ARG 52 -3.570 9.833 -5.594 1067 HG3 ARG 52 HG1 ARG 52 -4.245 8.661 -4.465 1068 HD2 ARG 52 HD2 ARG 52 -3.834 8.245 -7.439 1069 HD3 ARG 52 HD1 ARG 52 -2.909 7.488 -6.142 1070 HE ARG 52 HE ARG 52 -5.711 6.934 -5.817 1071 HH11 ARG 52 HH21 ARG 52 -2.918 6.202 -7.688 1072 HH12 ARG 52 HH22 ARG 52 -3.463 4.618 -8.128 1073 HH21 ARG 52 HH11 ARG 52 -6.447 4.875 -6.375 1074 HH22 ARG 52 HH12 ARG 52 -5.465 3.865 -7.383 1075 H SER 53 HN SER 53 -8.347 10.379 -4.192 1076 HA SER 53 HA SER 53 -9.922 11.124 -6.406 1077 HB2 SER 53 HB2 SER 53 -11.768 11.375 -4.857 1078 HB3 SER 53 HB1 SER 53 -10.767 10.042 -4.290 1079 HG SER 53 HG SER 53 -11.192 12.563 -3.216 1080 H LYS 54 HN LYS 54 -8.410 13.148 -3.926 1081 HA LYS 54 HA LYS 54 -9.632 15.587 -5.118 1082 HB2 LYS 54 HB2 LYS 54 -7.889 15.158 -2.675 1083 HB3 LYS 54 HB1 LYS 54 -8.443 16.740 -3.224 1084 HG2 LYS 54 HG2 LYS 54 -10.781 16.016 -3.009 1085 HG3 LYS 54 HG1 LYS 54 -10.248 14.416 -2.491 1086 HD2 LYS 54 HD2 LYS 54 -9.119 15.424 -0.542 1087 HD3 LYS 54 HD1 LYS 54 -9.670 17.021 -1.051 1088 HE2 LYS 54 HE2 LYS 54 -11.450 14.680 -0.308 1089 HE3 LYS 54 HE1 LYS 54 -11.175 16.124 0.666 1090 HZ1 LYS 54 HZ1 LYS 54 -13.229 16.267 -0.610 1091 HZ2 LYS 54 HZ2 LYS 54 -12.354 16.099 -2.057 1092 HZ3 LYS 54 HZ3 LYS 54 -12.127 17.469 -1.076 1093 H GLY 55 HN GLY 55 -6.981 13.653 -5.678 1094 HA2 GLY 55 HA2 GLY 55 -5.168 14.030 -7.139 1095 HA3 GLY 55 HA1 GLY 55 -5.722 15.692 -7.330 1096 H VAL 56 HN VAL 56 -4.844 14.015 -4.302 1097 HA VAL 56 HA VAL 56 -3.301 16.263 -3.384 1098 HB VAL 56 HB VAL 56 -3.375 13.376 -2.469 1099 HG11 VAL 56 HG11 VAL 56 -1.938 15.799 -1.367 1100 HG12 VAL 56 HG12 VAL 56 -1.285 14.191 -1.682 1101 HG13 VAL 56 HG13 VAL 56 -2.390 14.444 -0.331 1102 HG21 VAL 56 HG21 VAL 56 -5.479 14.585 -2.187 1103 HG22 VAL 56 HG22 VAL 56 -4.630 15.943 -1.454 1104 HG23 VAL 56 HG23 VAL 56 -4.712 14.399 -0.610 1105 H ASP 57 HN ASP 57 -1.167 16.744 -3.646 1106 HA ASP 57 HA ASP 57 0.368 15.717 -5.755 1107 HB2 ASP 57 HB2 ASP 57 2.299 16.820 -4.687 1108 HB3 ASP 57 HB1 ASP 57 0.867 17.847 -4.604 1109 H LEU 58 HN LEU 58 0.227 13.391 -5.633 1110 HA LEU 58 HA LEU 58 1.567 12.055 -3.354 1111 HB2 LEU 58 HB2 LEU 58 0.770 10.003 -4.312 1112 HB3 LEU 58 HB1 LEU 58 -0.547 11.167 -4.417 1113 HG LEU 58 HG LEU 58 0.713 11.621 -6.827 1114 HD11 LEU 58 HD11 LEU 58 1.541 9.660 -7.805 1115 HD12 LEU 58 HD12 LEU 58 0.768 8.614 -6.614 1116 HD13 LEU 58 HD13 LEU 58 2.188 9.555 -6.169 1117 HD21 LEU 58 HD21 LEU 58 -1.709 11.222 -6.452 1118 HD22 LEU 58 HD22 LEU 58 -1.386 9.493 -6.317 1119 HD23 LEU 58 HD23 LEU 58 -1.100 10.325 -7.844 1120 H ASN 59 HN ASN 59 2.170 12.947 -6.690 1121 HA ASN 59 HA ASN 59 4.357 11.185 -7.212 1122 HB2 ASN 59 HB2 ASN 59 3.739 13.960 -8.260 1123 HB3 ASN 59 HB1 ASN 59 4.992 12.910 -8.924 1124 HD21 ASN 59 HD21 ASN 59 1.766 13.777 -9.327 1125 HD22 ASN 59 HD22 ASN 59 1.223 12.396 -10.151 1126 H ALA 60 HN ALA 60 4.273 14.493 -5.874 1127 HA ALA 60 HA ALA 60 7.140 14.665 -5.551 1128 HB1 ALA 60 HB1 ALA 60 4.844 16.206 -4.326 1129 HB2 ALA 60 HB2 ALA 60 5.903 16.719 -5.640 1130 HB3 ALA 60 HB3 ALA 60 6.535 16.581 -3.998 1131 H LEU 61 HN LEU 61 4.469 13.680 -3.433 1132 HA LEU 61 HA LEU 61 5.984 13.461 -1.025 1133 HB2 LEU 61 HB2 LEU 61 3.557 13.419 -1.011 1134 HB3 LEU 61 HB1 LEU 61 3.533 11.958 -1.990 1135 HG LEU 61 HG LEU 61 5.122 11.714 0.523 1136 HD11 LEU 61 HD11 LEU 61 3.067 11.413 1.924 1137 HD12 LEU 61 HD12 LEU 61 2.114 12.101 0.609 1138 HD13 LEU 61 HD13 LEU 61 3.328 13.084 1.426 1139 HD21 LEU 61 HD21 LEU 61 4.121 9.531 0.580 1140 HD22 LEU 61 HD22 LEU 61 4.475 9.858 -1.116 1141 HD23 LEU 61 HD23 LEU 61 2.828 10.023 -0.511 1142 H PHE 62 HN PHE 62 5.304 11.070 -3.584 1143 HA PHE 62 HA PHE 62 6.802 8.957 -2.314 1144 HB2 PHE 62 HB2 PHE 62 5.487 9.414 -4.940 1145 HB3 PHE 62 HB1 PHE 62 6.834 8.281 -4.985 1146 HD1 PHE 62 HD1 PHE 62 3.560 8.997 -3.335 1147 HD2 PHE 62 HD2 PHE 62 6.648 6.104 -4.073 1148 HE1 PHE 62 HE1 PHE 62 2.122 7.214 -2.380 1149 HE2 PHE 62 HE2 PHE 62 5.215 4.327 -3.121 1150 HZ PHE 62 HZ PHE 62 2.950 4.878 -2.272 1151 H ASP 63 HN ASP 63 7.672 11.453 -4.704 1152 HA ASP 63 HA ASP 63 10.198 10.449 -5.449 1153 HB2 ASP 63 HB2 ASP 63 9.227 13.295 -5.129 1154 HB3 ASP 63 HB1 ASP 63 10.783 12.883 -5.849 1155 H ARG 64 HN ARG 64 9.443 12.630 -2.716 1156 HA ARG 64 HA ARG 64 12.148 12.800 -1.772 1157 HB2 ARG 64 HB2 ARG 64 9.471 13.221 -0.432 1158 HB3 ARG 64 HB1 ARG 64 11.003 13.520 0.390 1159 HG2 ARG 64 HG2 ARG 64 11.568 15.307 -1.001 1160 HG3 ARG 64 HG1 ARG 64 10.551 14.744 -2.321 1161 HD2 ARG 64 HD2 ARG 64 8.536 15.306 -0.930 1162 HD3 ARG 64 HD1 ARG 64 9.621 15.998 0.279 1163 HE ARG 64 HE ARG 64 9.834 17.886 -1.113 1164 HH11 ARG 64 HH21 ARG 64 8.842 15.097 -2.883 1165 HH12 ARG 64 HH22 ARG 64 8.560 15.965 -4.356 1166 HH21 ARG 64 HH11 ARG 64 9.467 19.035 -3.032 1167 HH22 ARG 64 HH12 ARG 64 8.912 18.189 -4.438 1168 H ILE 65 HN ILE 65 9.497 10.563 -1.003 1169 HA ILE 65 HA ILE 65 10.781 9.278 1.198 1170 HB ILE 65 HB ILE 65 8.694 8.278 -0.752 1171 HG12 ILE 65 HG12 ILE 65 8.454 9.151 2.139 1172 HG13 ILE 65 HG11 ILE 65 8.200 10.244 0.779 1173 HG21 ILE 65 HG21 ILE 65 8.254 6.605 1.149 1174 HG22 ILE 65 HG22 ILE 65 9.855 7.034 1.751 1175 HG23 ILE 65 HG23 ILE 65 9.681 6.302 0.156 1176 HD11 ILE 65 HD11 ILE 65 6.104 9.143 1.727 1177 HD12 ILE 65 HD12 ILE 65 6.708 7.629 1.056 1178 HD13 ILE 65 HD13 ILE 65 6.337 8.982 -0.013 1179 H ILE 66 HN ILE 66 10.836 8.473 -2.294 1180 HA ILE 66 HA ILE 66 12.091 6.029 -2.315 1181 HB ILE 66 HB ILE 66 12.732 8.439 -4.030 1182 HG12 ILE 66 HG12 ILE 66 11.143 5.931 -4.641 1183 HG13 ILE 66 HG11 ILE 66 10.407 7.411 -4.040 1184 HG21 ILE 66 HG21 ILE 66 14.641 7.040 -4.276 1185 HG22 ILE 66 HG22 ILE 66 13.596 6.616 -5.632 1186 HG23 ILE 66 HG23 ILE 66 13.669 5.571 -4.214 1187 HD11 ILE 66 HD11 ILE 66 10.203 7.501 -6.419 1188 HD12 ILE 66 HD12 ILE 66 11.879 7.005 -6.649 1189 HD13 ILE 66 HD13 ILE 66 11.515 8.605 -6.009 1190 H VAL 67 HN VAL 67 13.520 5.477 -0.735 1191 HA VAL 67 HA VAL 67 16.224 6.656 -0.880 1192 HB VAL 67 HB VAL 67 14.530 6.629 1.635 1193 HG11 VAL 67 HG11 VAL 67 17.530 6.780 1.285 1194 HG12 VAL 67 HG12 VAL 67 16.611 5.723 2.356 1195 HG13 VAL 67 HG13 VAL 67 16.724 7.447 2.706 1196 HG21 VAL 67 HG21 VAL 67 15.326 9.012 1.715 1197 HG22 VAL 67 HG22 VAL 67 14.337 8.655 0.299 1198 HG23 VAL 67 HG23 VAL 67 16.090 8.763 0.145 1199 H ASN 68 HN ASN 68 14.044 4.102 -0.311 1200 HA ASN 68 HA ASN 68 14.424 1.791 -0.251 1201 HB2 ASN 68 HB2 ASN 68 17.398 2.190 -0.001 1202 HB3 ASN 68 HB1 ASN 68 16.508 0.912 -0.820 1203 HD21 ASN 68 HD21 ASN 68 18.489 3.343 -1.601 1204 HD22 ASN 68 HD22 ASN 68 17.802 3.865 -3.062 1205 H LYS 69 HN LYS 69 14.502 0.308 1.429 1206 HA LYS 69 HA LYS 69 14.603 1.321 4.115 1207 HB2 LYS 69 HB2 LYS 69 14.632 -1.508 3.028 1208 HB3 LYS 69 HB1 LYS 69 14.502 -1.124 4.744 1209 HG2 LYS 69 HG2 LYS 69 12.456 0.177 4.303 1210 HG3 LYS 69 HG1 LYS 69 12.585 -0.198 2.586 1211 HD2 LYS 69 HD2 LYS 69 12.334 -2.582 3.044 1212 HD3 LYS 69 HD1 LYS 69 12.314 -2.272 4.781 1213 HE2 LYS 69 HE2 LYS 69 10.025 -2.477 4.185 1214 HE3 LYS 69 HE1 LYS 69 10.296 -0.739 4.306 1215 HZ1 LYS 69 HZ1 LYS 69 9.138 -1.125 2.299 1216 HZ2 LYS 69 HZ2 LYS 69 10.183 -2.387 1.844 1217 HZ3 LYS 69 HZ3 LYS 69 10.741 -0.781 1.863 1218 H LEU 70 HN LEU 70 16.900 -0.545 2.159 1219 HA LEU 70 HA LEU 70 19.176 -1.007 2.479 1220 HB2 LEU 70 HB2 LEU 70 19.115 1.379 4.346 1221 HB3 LEU 70 HB1 LEU 70 20.513 0.724 3.498 1222 HG LEU 70 HG LEU 70 18.076 1.950 2.194 1223 HD11 LEU 70 HD11 LEU 70 19.825 3.662 1.466 1224 HD12 LEU 70 HD12 LEU 70 20.884 2.950 2.682 1225 HD13 LEU 70 HD13 LEU 70 19.365 3.704 3.168 1226 HD21 LEU 70 HD21 LEU 70 20.544 0.591 1.116 1227 HD22 LEU 70 HD22 LEU 70 19.729 1.835 0.166 1228 HD23 LEU 70 HD23 LEU 70 18.862 0.374 0.634 1229 H GLU 71 HN GLU 71 20.765 -0.628 4.791 1230 HA GLU 71 HA GLU 71 19.695 -2.816 6.472 1231 HB2 GLU 71 HB2 GLU 71 22.352 -1.514 7.011 1232 HB3 GLU 71 HB1 GLU 71 21.899 -3.212 7.126 1233 HG2 GLU 71 HG2 GLU 71 22.229 -1.693 4.514 1234 HG3 GLU 71 HG1 GLU 71 23.447 -2.739 5.227 1235 H HIS 72 HN HIS 72 18.584 -2.359 8.261 1236 HA HIS 72 HA HIS 72 19.137 0.205 9.729 1237 HB2 HIS 72 HB2 HIS 72 16.620 -0.053 10.385 1238 HB3 HIS 72 HB1 HIS 72 17.013 0.581 8.788 1239 HD2 HIS 72 HD2 HIS 72 15.669 -0.781 6.805 1240 HE1 HIS 72 HE1 HIS 72 15.105 -4.438 8.841 1241 HE2 HIS 72 HE2 HIS 72 14.641 -3.175 6.690 1242 H HIS 73 HN HIS 73 17.749 -0.167 11.994 1243 HA HIS 73 HA HIS 73 18.408 -2.874 13.061 1244 HB2 HIS 73 HB2 HIS 73 19.761 -2.054 14.819 1245 HB3 HIS 73 HB1 HIS 73 20.308 -1.128 13.425 1246 HD2 HIS 73 HD2 HIS 73 19.387 -0.353 16.952 1247 HE1 HIS 73 HE1 HIS 73 18.124 3.065 14.816 1248 HE2 HIS 73 HE2 HIS 73 18.590 2.124 17.126 1249 H HIS 74 HN HIS 74 16.823 -3.567 14.483 1250 HA HIS 74 HA HIS 74 14.556 -1.740 14.958 1251 HB2 HIS 74 HB2 HIS 74 13.784 -3.935 16.284 1252 HB3 HIS 74 HB1 HIS 74 13.692 -3.853 14.529 1253 HD2 HIS 74 HD2 HIS 74 16.132 -5.034 13.250 1254 HE1 HIS 74 HE1 HIS 74 16.763 -7.629 16.521 1255 HE2 HIS 74 HE2 HIS 74 17.389 -7.151 14.110 1256 H HIS 75 HN HIS 75 14.111 -0.768 16.916 1257 HA HIS 75 HA HIS 75 16.269 -0.726 18.883 1258 HB2 HIS 75 HB2 HIS 75 13.563 0.505 19.376 1259 HB3 HIS 75 HB1 HIS 75 15.153 1.091 19.852 1260 HD2 HIS 75 HD2 HIS 75 15.948 0.568 16.329 1261 HE1 HIS 75 HE1 HIS 75 13.709 4.145 16.202 1262 HE2 HIS 75 HE2 HIS 75 15.267 2.631 14.894 1263 H HIS 76 HN HIS 76 13.832 -2.865 18.311 1264 HA HIS 76 HA HIS 76 12.528 -3.402 20.711 1265 HB2 HIS 76 HB2 HIS 76 13.739 -5.493 18.882 1266 HB3 HIS 76 HB1 HIS 76 12.365 -5.713 19.967 1267 HD2 HIS 76 HD2 HIS 76 11.731 -2.353 18.497 1268 HE1 HIS 76 HE1 HIS 76 10.064 -5.009 15.669 1269 HE2 HIS 76 HE2 HIS 76 10.182 -2.588 16.412 1270 H HIS 77 HN HIS 77 13.091 -5.471 22.102 1271 HA HIS 77 HA HIS 77 14.440 -6.387 23.769 1272 HB2 HIS 77 HB2 HIS 77 16.744 -5.734 21.907 1273 HB3 HIS 77 HB1 HIS 77 16.744 -6.905 23.220 1274 HD2 HIS 77 HD2 HIS 77 17.049 -7.731 19.904 1275 HE1 HIS 77 HE1 HIS 77 13.378 -9.679 20.654 1276 HE2 HIS 77 HE2 HIS 77 15.353 -9.527 19.070 Start of MODEL 7 1 H1 MET 1 HT1 MET 1 10.822 15.719 6.485 2 H2 MET 1 HT2 MET 1 9.902 17.144 6.386 3 H3 MET 1 HT3 MET 1 10.065 16.138 5.026 4 HA MET 1 HA MET 1 8.719 15.367 7.556 5 HB2 MET 1 HB2 MET 1 6.681 15.416 5.936 6 HB3 MET 1 HB1 MET 1 7.274 16.944 6.582 7 HG2 MET 1 HG2 MET 1 8.562 17.345 4.535 8 HG3 MET 1 HG1 MET 1 8.054 15.785 3.891 9 HE1 MET 1 HE1 MET 1 5.681 19.612 4.501 10 HE2 MET 1 HE2 MET 1 7.213 19.118 5.213 11 HE3 MET 1 HE3 MET 1 5.701 18.528 5.898 12 H GLU 2 HN GLU 2 8.141 13.224 7.634 13 HA GLU 2 HA GLU 2 9.363 11.444 5.653 14 HB2 GLU 2 HB2 GLU 2 9.152 11.160 8.268 15 HB3 GLU 2 HB1 GLU 2 7.558 10.514 7.888 16 HG2 GLU 2 HG2 GLU 2 8.579 8.842 6.393 17 HG3 GLU 2 HG1 GLU 2 10.176 9.503 6.730 18 H LEU 3 HN LEU 3 7.869 9.496 4.914 19 HA LEU 3 HA LEU 3 5.811 10.526 3.240 20 HB2 LEU 3 HB2 LEU 3 6.581 7.769 4.176 21 HB3 LEU 3 HB1 LEU 3 5.162 7.988 3.161 22 HG LEU 3 HG LEU 3 7.857 9.135 2.394 23 HD11 LEU 3 HD11 LEU 3 8.296 7.144 1.077 24 HD12 LEU 3 HD12 LEU 3 6.752 6.441 1.546 25 HD13 LEU 3 HD13 LEU 3 8.028 6.650 2.747 26 HD21 LEU 3 HD21 LEU 3 6.186 10.077 1.016 27 HD22 LEU 3 HD22 LEU 3 5.237 8.596 0.983 28 HD23 LEU 3 HD23 LEU 3 6.729 8.701 0.069 29 H SER 4 HN SER 4 5.608 8.764 6.335 30 HA SER 4 HA SER 4 2.711 8.927 6.423 31 HB2 SER 4 HB2 SER 4 4.007 7.147 7.578 32 HB3 SER 4 HB1 SER 4 4.690 8.366 8.647 33 HG SER 4 HG SER 4 2.003 7.516 8.395 34 H ASN 5 HN ASN 5 5.397 10.848 7.627 35 HA ASN 5 HA ASN 5 3.921 12.471 9.463 36 HB2 ASN 5 HB2 ASN 5 6.447 12.316 9.236 37 HB3 ASN 5 HB1 ASN 5 6.302 13.349 7.814 38 HD21 ASN 5 HD21 ASN 5 4.412 15.229 8.565 39 HD22 ASN 5 HD22 ASN 5 4.946 16.094 9.924 40 H GLU 6 HN GLU 6 4.738 12.954 6.016 41 HA GLU 6 HA GLU 6 3.305 15.458 5.830 42 HB2 GLU 6 HB2 GLU 6 5.156 14.761 4.287 43 HB3 GLU 6 HB1 GLU 6 4.057 13.569 3.588 44 HG2 GLU 6 HG2 GLU 6 2.548 15.273 2.831 45 HG3 GLU 6 HG1 GLU 6 3.402 16.519 3.739 46 H LEU 7 HN LEU 7 2.479 12.078 5.133 47 HA LEU 7 HA LEU 7 -0.036 12.582 3.879 48 HB2 LEU 7 HB2 LEU 7 1.174 10.394 3.909 49 HB3 LEU 7 HB1 LEU 7 0.769 10.228 5.613 50 HG LEU 7 HG LEU 7 -1.565 10.813 3.850 51 HD11 LEU 7 HD11 LEU 7 -1.667 8.340 3.192 52 HD12 LEU 7 HD12 LEU 7 0.054 8.279 3.570 53 HD13 LEU 7 HD13 LEU 7 -0.529 9.346 2.296 54 HD21 LEU 7 HD21 LEU 7 -1.789 10.256 6.258 55 HD22 LEU 7 HD22 LEU 7 -1.027 8.694 5.966 56 HD23 LEU 7 HD23 LEU 7 -2.597 9.056 5.249 57 H LYS 8 HN LYS 8 0.905 12.125 7.259 58 HA LYS 8 HA LYS 8 -1.713 12.184 8.387 59 HB2 LYS 8 HB2 LYS 8 0.374 11.466 9.565 60 HB3 LYS 8 HB1 LYS 8 0.872 13.157 9.621 61 HG2 LYS 8 HG2 LYS 8 -1.067 13.746 10.951 62 HG3 LYS 8 HG1 LYS 8 -1.728 12.122 10.779 63 HD2 LYS 8 HD2 LYS 8 -0.693 12.203 12.943 64 HD3 LYS 8 HD1 LYS 8 0.373 11.255 11.909 65 HE2 LYS 8 HE2 LYS 8 1.921 13.044 11.680 66 HE3 LYS 8 HE1 LYS 8 0.767 14.230 12.289 67 HZ1 LYS 8 HZ1 LYS 8 1.118 13.614 14.426 68 HZ2 LYS 8 HZ2 LYS 8 2.640 13.183 13.804 69 HZ3 LYS 8 HZ3 LYS 8 1.447 11.995 14.039 70 H VAL 9 HN VAL 9 0.573 14.767 7.542 71 HA VAL 9 HA VAL 9 -0.843 16.928 8.756 72 HB VAL 9 HB VAL 9 0.932 16.837 6.301 73 HG11 VAL 9 HG11 VAL 9 -0.374 18.806 6.024 74 HG12 VAL 9 HG12 VAL 9 1.116 19.356 6.788 75 HG13 VAL 9 HG13 VAL 9 -0.348 19.162 7.752 76 HG21 VAL 9 HG21 VAL 9 1.544 17.988 9.029 77 HG22 VAL 9 HG22 VAL 9 2.672 17.555 7.746 78 HG23 VAL 9 HG23 VAL 9 1.840 16.292 8.651 79 H GLU 10 HN GLU 10 -1.069 15.493 5.492 80 HA GLU 10 HA GLU 10 -2.965 17.253 4.374 81 HB2 GLU 10 HB2 GLU 10 -2.645 14.255 4.016 82 HB3 GLU 10 HB1 GLU 10 -3.578 15.303 2.946 83 HG2 GLU 10 HG2 GLU 10 -1.604 16.556 2.335 84 HG3 GLU 10 HG1 GLU 10 -0.640 15.716 3.551 85 H ARG 11 HN ARG 11 -3.415 14.403 6.456 86 HA ARG 11 HA ARG 11 -6.262 14.315 6.346 87 HB2 ARG 11 HB2 ARG 11 -4.575 12.655 7.395 88 HB3 ARG 11 HB1 ARG 11 -4.638 13.688 8.818 89 HG2 ARG 11 HG2 ARG 11 -7.059 12.410 7.499 90 HG3 ARG 11 HG1 ARG 11 -6.247 11.779 8.930 91 HD2 ARG 11 HD2 ARG 11 -6.650 14.222 9.863 92 HD3 ARG 11 HD1 ARG 11 -7.926 14.244 8.646 93 HE ARG 11 HE ARG 11 -8.503 11.921 9.868 94 HH11 ARG 11 HH21 ARG 11 -7.574 15.003 11.125 95 HH12 ARG 11 HH22 ARG 11 -8.419 14.793 12.620 96 HH21 ARG 11 HH11 ARG 11 -9.619 11.647 11.810 97 HH22 ARG 11 HH12 ARG 11 -9.578 12.897 13.007 98 H ILE 12 HN ILE 12 -4.082 15.957 8.667 99 HA ILE 12 HA ILE 12 -6.164 17.250 10.154 100 HB ILE 12 HB ILE 12 -3.244 17.953 9.746 101 HG12 ILE 12 HG12 ILE 12 -4.602 16.758 12.175 102 HG13 ILE 12 HG11 ILE 12 -3.937 15.754 10.885 103 HG21 ILE 12 HG21 ILE 12 -4.288 19.975 10.452 104 HG22 ILE 12 HG22 ILE 12 -3.642 19.252 11.925 105 HG23 ILE 12 HG23 ILE 12 -5.364 19.123 11.561 106 HD11 ILE 12 HD11 ILE 12 -1.725 16.512 11.274 107 HD12 ILE 12 HD12 ILE 12 -2.394 16.263 12.890 108 HD13 ILE 12 HD13 ILE 12 -2.279 17.893 12.227 109 H ARG 13 HN ARG 13 -4.163 18.322 7.415 110 HA ARG 13 HA ARG 13 -5.227 20.972 7.266 111 HB2 ARG 13 HB2 ARG 13 -3.125 20.242 6.153 112 HB3 ARG 13 HB1 ARG 13 -4.086 19.283 5.027 113 HG2 ARG 13 HG2 ARG 13 -5.181 21.257 4.169 114 HG3 ARG 13 HG1 ARG 13 -4.434 22.269 5.406 115 HD2 ARG 13 HD2 ARG 13 -3.186 22.538 3.339 116 HD3 ARG 13 HD1 ARG 13 -2.197 21.650 4.494 117 HE ARG 13 HE ARG 13 -3.802 20.122 2.498 118 HH11 ARG 13 HH21 ARG 13 -0.733 21.161 3.750 119 HH12 ARG 13 HH22 ARG 13 0.165 20.008 2.832 120 HH21 ARG 13 HH11 ARG 13 -2.612 18.641 1.291 121 HH22 ARG 13 HH12 ARG 13 -0.888 18.591 1.444 122 H LEU 14 HN LEU 14 -6.180 17.933 5.699 123 HA LEU 14 HA LEU 14 -8.379 19.236 4.250 124 HB2 LEU 14 HB2 LEU 14 -7.626 16.321 4.611 125 HB3 LEU 14 HB1 LEU 14 -8.862 16.908 3.504 126 HG LEU 14 HG LEU 14 -5.974 17.834 3.400 127 HD11 LEU 14 HD11 LEU 14 -7.232 15.784 1.569 128 HD12 LEU 14 HD12 LEU 14 -6.314 15.323 3.002 129 HD13 LEU 14 HD13 LEU 14 -5.530 16.220 1.708 130 HD21 LEU 14 HD21 LEU 14 -8.387 18.142 1.605 131 HD22 LEU 14 HD22 LEU 14 -6.757 18.304 0.963 132 HD23 LEU 14 HD23 LEU 14 -7.313 19.394 2.223 133 H SER 15 HN SER 15 -7.859 18.277 7.382 134 HA SER 15 HA SER 15 -9.249 17.648 9.164 135 HB2 SER 15 HB2 SER 15 -11.477 18.961 9.058 136 HB3 SER 15 HB1 SER 15 -9.980 19.884 9.074 137 HG SER 15 HG SER 15 -11.622 19.221 6.858 138 H LEU 16 HN LEU 16 -9.274 15.417 8.056 139 HA LEU 16 HA LEU 16 -12.000 14.702 7.062 140 HB2 LEU 16 HB2 LEU 16 -9.411 13.122 7.007 141 HB3 LEU 16 HB1 LEU 16 -10.942 12.616 6.291 142 HG LEU 16 HG LEU 16 -9.392 15.108 5.529 143 HD11 LEU 16 HD11 LEU 16 -9.603 12.351 4.312 144 HD12 LEU 16 HD12 LEU 16 -8.156 13.298 4.660 145 HD13 LEU 16 HD13 LEU 16 -9.206 13.757 3.321 146 HD21 LEU 16 HD21 LEU 16 -12.054 13.966 4.694 147 HD22 LEU 16 HD22 LEU 16 -11.096 14.866 3.519 148 HD23 LEU 16 HD23 LEU 16 -11.610 15.645 5.008 149 H THR 17 HN THR 17 -13.182 13.056 8.048 150 HA THR 17 HA THR 17 -12.432 12.541 10.878 151 HB THR 17 HB THR 17 -14.821 11.780 11.049 152 HG1 THR 17 HG1 THR 17 -15.597 11.282 9.155 153 HG21 THR 17 HG21 THR 17 -15.774 14.085 10.720 154 HG22 THR 17 HG22 THR 17 -14.261 14.542 9.938 155 HG23 THR 17 HG23 THR 17 -14.266 14.065 11.635 156 H ALA 18 HN ALA 18 -11.829 10.553 11.538 157 HA ALA 18 HA ALA 18 -11.220 8.456 9.697 158 HB1 ALA 18 HB1 ALA 18 -10.041 8.624 11.806 159 HB2 ALA 18 HB2 ALA 18 -10.918 7.094 11.796 160 HB3 ALA 18 HB3 ALA 18 -11.550 8.464 12.707 161 H LYS 19 HN LYS 19 -14.002 9.088 11.772 162 HA LYS 19 HA LYS 19 -15.293 6.562 11.503 163 HB2 LYS 19 HB2 LYS 19 -15.931 8.336 13.136 164 HB3 LYS 19 HB1 LYS 19 -16.570 9.293 11.799 165 HG2 LYS 19 HG2 LYS 19 -18.165 7.509 11.252 166 HG3 LYS 19 HG1 LYS 19 -17.513 6.509 12.551 167 HD2 LYS 19 HD2 LYS 19 -18.172 8.225 14.203 168 HD3 LYS 19 HD1 LYS 19 -18.833 9.218 12.902 169 HE2 LYS 19 HE2 LYS 19 -20.629 7.934 13.978 170 HE3 LYS 19 HE1 LYS 19 -20.398 7.386 12.318 171 HZ1 LYS 19 HZ1 LYS 19 -19.081 5.552 13.114 172 HZ2 LYS 19 HZ2 LYS 19 -20.590 5.542 13.893 173 HZ3 LYS 19 HZ3 LYS 19 -19.210 6.096 14.714 174 H SER 20 HN SER 20 -15.654 9.564 9.586 175 HA SER 20 HA SER 20 -17.647 8.597 7.814 176 HB2 SER 20 HB2 SER 20 -16.991 10.967 7.974 177 HB3 SER 20 HB1 SER 20 -15.419 10.582 7.276 178 HG SER 20 HG SER 20 -16.927 9.575 5.561 179 H VAL 21 HN VAL 21 -14.093 8.524 7.512 180 HA VAL 21 HA VAL 21 -14.078 7.229 4.948 181 HB VAL 21 HB VAL 21 -11.999 7.396 7.141 182 HG11 VAL 21 HG11 VAL 21 -10.436 6.781 5.195 183 HG12 VAL 21 HG12 VAL 21 -11.886 6.223 4.357 184 HG13 VAL 21 HG13 VAL 21 -11.400 5.469 5.878 185 HG21 VAL 21 HG21 VAL 21 -12.137 8.785 4.450 186 HG22 VAL 21 HG22 VAL 21 -11.033 9.132 5.780 187 HG23 VAL 21 HG23 VAL 21 -12.750 9.505 5.940 188 H ALA 22 HN ALA 22 -13.859 5.987 8.275 189 HA ALA 22 HA ALA 22 -13.367 3.269 7.667 190 HB1 ALA 22 HB1 ALA 22 -13.176 3.906 9.934 191 HB2 ALA 22 HB2 ALA 22 -14.614 2.886 9.898 192 HB3 ALA 22 HB3 ALA 22 -14.781 4.641 9.948 193 H GLU 23 HN GLU 23 -16.499 4.939 8.085 194 HA GLU 23 HA GLU 23 -18.153 2.658 7.675 195 HB2 GLU 23 HB2 GLU 23 -18.697 5.559 6.982 196 HB3 GLU 23 HB1 GLU 23 -19.919 4.301 7.154 197 HG2 GLU 23 HG2 GLU 23 -18.010 4.900 9.409 198 HG3 GLU 23 HG1 GLU 23 -19.465 5.865 9.183 199 H GLU 24 HN GLU 24 -16.936 5.086 5.348 200 HA GLU 24 HA GLU 24 -18.254 3.906 3.071 201 HB2 GLU 24 HB2 GLU 24 -17.395 6.276 3.229 202 HB3 GLU 24 HB1 GLU 24 -15.764 5.625 3.065 203 HG2 GLU 24 HG2 GLU 24 -16.497 6.277 0.866 204 HG3 GLU 24 HG1 GLU 24 -16.517 4.515 0.919 205 H MET 25 HN MET 25 -14.852 3.794 4.177 206 HA MET 25 HA MET 25 -13.980 1.995 2.131 207 HB2 MET 25 HB2 MET 25 -12.908 2.715 4.861 208 HB3 MET 25 HB1 MET 25 -12.098 1.530 3.833 209 HG2 MET 25 HG2 MET 25 -11.922 3.213 2.034 210 HG3 MET 25 HG1 MET 25 -12.748 4.389 3.051 211 HE1 MET 25 HE1 MET 25 -9.762 2.351 2.227 212 HE2 MET 25 HE2 MET 25 -9.772 1.704 3.865 213 HE3 MET 25 HE3 MET 25 -8.481 2.792 3.365 214 H GLY 26 HN GLY 26 -15.285 1.468 5.389 215 HA2 GLY 26 HA2 GLY 26 -16.550 -0.492 5.995 216 HA3 GLY 26 HA1 GLY 26 -15.821 -1.357 4.645 217 H ILE 27 HN ILE 27 -13.945 0.582 6.915 218 HA ILE 27 HA ILE 27 -12.800 -1.939 8.068 219 HB ILE 27 HB ILE 27 -10.613 -0.795 8.148 220 HG12 ILE 27 HG12 ILE 27 -11.932 1.342 6.456 221 HG13 ILE 27 HG11 ILE 27 -11.572 1.542 8.167 222 HG21 ILE 27 HG21 ILE 27 -10.077 -1.104 5.844 223 HG22 ILE 27 HG22 ILE 27 -11.718 -0.690 5.339 224 HG23 ILE 27 HG23 ILE 27 -11.412 -2.210 6.181 225 HD11 ILE 27 HD11 ILE 27 -9.791 2.487 6.710 226 HD12 ILE 27 HD12 ILE 27 -9.513 0.875 6.050 227 HD13 ILE 27 HD13 ILE 27 -9.197 1.196 7.755 228 H SER 28 HN SER 28 -11.808 -1.639 10.203 229 HA SER 28 HA SER 28 -13.540 -0.081 11.926 230 HB2 SER 28 HB2 SER 28 -12.294 -1.089 13.734 231 HB3 SER 28 HB1 SER 28 -12.550 -2.323 12.504 232 HG SER 28 HG SER 28 -10.251 -1.364 13.477 233 H ARG 29 HN ARG 29 -12.673 1.458 13.546 234 HA ARG 29 HA ARG 29 -11.179 3.578 12.347 235 HB2 ARG 29 HB2 ARG 29 -11.694 3.029 15.285 236 HB3 ARG 29 HB1 ARG 29 -11.175 4.570 14.604 237 HG2 ARG 29 HG2 ARG 29 -13.290 4.462 13.147 238 HG3 ARG 29 HG1 ARG 29 -13.818 3.153 14.204 239 HD2 ARG 29 HD2 ARG 29 -14.770 5.085 15.185 240 HD3 ARG 29 HD1 ARG 29 -13.326 4.792 16.154 241 HE ARG 29 HE ARG 29 -12.708 6.533 13.950 242 HH11 ARG 29 HH21 ARG 29 -14.303 6.389 17.010 243 HH12 ARG 29 HH22 ARG 29 -14.070 8.070 17.353 244 HH21 ARG 29 HH11 ARG 29 -12.413 8.723 14.382 245 HH22 ARG 29 HH12 ARG 29 -13.000 9.391 15.868 246 H GLN 30 HN GLN 30 -10.268 0.854 14.396 247 HA GLN 30 HA GLN 30 -7.609 1.722 15.028 248 HB2 GLN 30 HB2 GLN 30 -8.768 -0.134 16.200 249 HB3 GLN 30 HB1 GLN 30 -8.670 -1.101 14.728 250 HG2 GLN 30 HG2 GLN 30 -6.246 -1.065 14.790 251 HG3 GLN 30 HG1 GLN 30 -6.257 0.050 16.158 252 HE21 GLN 30 HE21 GLN 30 -4.957 -2.472 16.371 253 HE22 GLN 30 HE22 GLN 30 -5.824 -3.445 17.459 254 H GLN 31 HN GLN 31 -8.933 -0.182 12.325 255 HA GLN 31 HA GLN 31 -6.444 -0.862 11.111 256 HB2 GLN 31 HB2 GLN 31 -9.224 -0.444 10.002 257 HB3 GLN 31 HB1 GLN 31 -7.874 -0.933 8.977 258 HG2 GLN 31 HG2 GLN 31 -7.510 -2.920 10.361 259 HG3 GLN 31 HG1 GLN 31 -8.797 -2.417 11.456 260 HE21 GLN 31 HE21 GLN 31 -8.157 -4.307 8.707 261 HE22 GLN 31 HE22 GLN 31 -9.753 -4.492 8.157 262 H LEU 32 HN LEU 32 -8.550 1.967 10.771 263 HA LEU 32 HA LEU 32 -7.032 3.251 8.714 264 HB2 LEU 32 HB2 LEU 32 -9.382 3.846 9.501 265 HB3 LEU 32 HB1 LEU 32 -8.625 4.618 10.888 266 HG LEU 32 HG LEU 32 -7.205 5.927 9.167 267 HD11 LEU 32 HD11 LEU 32 -9.379 4.770 7.403 268 HD12 LEU 32 HD12 LEU 32 -7.642 4.767 7.125 269 HD13 LEU 32 HD13 LEU 32 -8.551 6.267 7.001 270 HD21 LEU 32 HD21 LEU 32 -8.964 6.974 10.510 271 HD22 LEU 32 HD22 LEU 32 -10.196 6.380 9.396 272 HD23 LEU 32 HD23 LEU 32 -9.034 7.593 8.860 273 H CYS 33 HN CYS 33 -6.907 3.405 12.247 274 HA CYS 33 HA CYS 33 -4.880 5.426 12.414 275 HB2 CYS 33 HB2 CYS 33 -5.712 3.242 14.336 276 HB3 CYS 33 HB1 CYS 33 -4.590 4.539 14.744 277 HG CYS 33 HG CYS 33 -6.677 6.191 14.028 278 H ASN 34 HN ASN 34 -4.763 1.917 12.067 279 HA ASN 34 HA ASN 34 -2.030 1.506 12.738 280 HB2 ASN 34 HB2 ASN 34 -3.977 0.079 10.930 281 HB3 ASN 34 HB1 ASN 34 -2.301 -0.459 11.041 282 HD21 ASN 34 HD21 ASN 34 -4.870 -1.760 12.045 283 HD22 ASN 34 HD22 ASN 34 -4.581 -2.056 13.692 284 H ILE 35 HN ILE 35 -3.535 2.318 9.602 285 HA ILE 35 HA ILE 35 -1.127 2.219 8.071 286 HB ILE 35 HB ILE 35 -3.544 3.991 7.628 287 HG12 ILE 35 HG12 ILE 35 -3.024 1.214 6.520 288 HG13 ILE 35 HG11 ILE 35 -4.015 1.506 7.948 289 HG21 ILE 35 HG21 ILE 35 -1.844 4.694 6.141 290 HG22 ILE 35 HG22 ILE 35 -2.800 3.561 5.187 291 HG23 ILE 35 HG23 ILE 35 -1.263 3.049 5.885 292 HD11 ILE 35 HD11 ILE 35 -5.376 3.123 6.507 293 HD12 ILE 35 HD12 ILE 35 -5.544 1.413 6.124 294 HD13 ILE 35 HD13 ILE 35 -4.524 2.444 5.120 295 H GLU 36 HN GLU 36 -2.742 4.936 9.726 296 HA GLU 36 HA GLU 36 -0.629 6.809 9.019 297 HB2 GLU 36 HB2 GLU 36 -2.876 7.007 11.044 298 HB3 GLU 36 HB1 GLU 36 -1.841 8.344 10.539 299 HG2 GLU 36 HG2 GLU 36 -2.655 8.249 8.287 300 HG3 GLU 36 HG1 GLU 36 -3.468 6.711 8.579 301 H GLN 37 HN GLN 37 -0.805 4.301 11.240 302 HA GLN 37 HA GLN 37 1.070 5.637 13.161 303 HB2 GLN 37 HB2 GLN 37 -1.006 4.558 14.096 304 HB3 GLN 37 HB1 GLN 37 -0.432 3.017 13.466 305 HG2 GLN 37 HG2 GLN 37 0.187 3.197 15.814 306 HG3 GLN 37 HG1 GLN 37 1.646 3.274 14.827 307 HE21 GLN 37 HE21 GLN 37 2.954 4.653 16.107 308 HE22 GLN 37 HE22 GLN 37 2.508 6.232 16.543 309 H SER 38 HN SER 38 0.743 3.140 10.758 310 HA SER 38 HA SER 38 3.196 1.745 11.543 311 HB2 SER 38 HB2 SER 38 1.657 1.516 8.948 312 HB3 SER 38 HB1 SER 38 2.789 0.350 9.623 313 HG SER 38 HG SER 38 0.219 0.429 9.993 314 H GLU 39 HN GLU 39 3.884 1.445 8.592 315 HA GLU 39 HA GLU 39 5.731 3.735 8.477 316 HB2 GLU 39 HB2 GLU 39 6.799 2.515 6.669 317 HB3 GLU 39 HB1 GLU 39 6.525 1.432 8.025 318 HG2 GLU 39 HG2 GLU 39 4.363 1.536 5.940 319 HG3 GLU 39 HG1 GLU 39 5.866 0.780 5.488 320 H THR 40 HN THR 40 2.733 2.768 7.143 321 HA THR 40 HA THR 40 1.324 3.757 5.580 322 HB THR 40 HB THR 40 3.132 6.171 5.643 323 HG1 THR 40 HG1 THR 40 1.223 5.325 7.554 324 HG21 THR 40 HG21 THR 40 0.150 5.740 5.326 325 HG22 THR 40 HG22 THR 40 1.275 6.338 4.105 326 HG23 THR 40 HG23 THR 40 0.898 7.323 5.519 327 H ALA 41 HN ALA 41 4.524 3.076 4.977 328 HA ALA 41 HA ALA 41 4.144 3.416 2.036 329 HB1 ALA 41 HB1 ALA 41 5.766 5.061 3.133 330 HB2 ALA 41 HB2 ALA 41 6.350 4.144 1.743 331 HB3 ALA 41 HB3 ALA 41 6.820 3.667 3.375 332 HA PRO 42 HA PRO 42 5.122 -0.986 3.132 333 HB2 PRO 42 HB2 PRO 42 3.428 -2.150 1.321 334 HB3 PRO 42 HB1 PRO 42 2.895 -1.586 2.917 335 HG2 PRO 42 HG2 PRO 42 2.624 -0.260 0.258 336 HG3 PRO 42 HG1 PRO 42 1.456 -0.368 1.585 337 HD2 PRO 42 HD2 PRO 42 2.971 1.849 1.103 338 HD3 PRO 42 HD1 PRO 42 2.394 1.417 2.728 339 H VAL 43 HN VAL 43 6.225 -2.657 1.876 340 HA VAL 43 HA VAL 43 8.103 -1.698 -0.008 341 HB VAL 43 HB VAL 43 8.441 -4.149 -0.558 342 HG11 VAL 43 HG11 VAL 43 8.305 -3.353 2.365 343 HG12 VAL 43 HG12 VAL 43 9.664 -3.077 1.276 344 HG13 VAL 43 HG13 VAL 43 9.217 -4.722 1.730 345 HG21 VAL 43 HG21 VAL 43 6.174 -4.962 -0.267 346 HG22 VAL 43 HG22 VAL 43 6.140 -4.404 1.405 347 HG23 VAL 43 HG23 VAL 43 7.192 -5.738 0.944 348 H VAL 44 HN VAL 44 4.799 -2.493 -0.407 349 HA VAL 44 HA VAL 44 4.748 -3.326 -3.136 350 HB VAL 44 HB VAL 44 2.729 -1.744 -1.525 351 HG11 VAL 44 HG11 VAL 44 1.136 -2.731 -3.275 352 HG12 VAL 44 HG12 VAL 44 2.577 -3.051 -4.242 353 HG13 VAL 44 HG13 VAL 44 2.158 -1.394 -3.803 354 HG21 VAL 44 HG21 VAL 44 3.111 -3.895 -0.526 355 HG22 VAL 44 HG22 VAL 44 3.099 -4.693 -2.100 356 HG23 VAL 44 HG23 VAL 44 1.609 -4.017 -1.443 357 H VAL 45 HN VAL 45 4.671 -0.102 -1.638 358 HA VAL 45 HA VAL 45 4.327 1.422 -4.019 359 HB VAL 45 HB VAL 45 5.777 2.084 -1.438 360 HG11 VAL 45 HG11 VAL 45 5.298 4.475 -2.219 361 HG12 VAL 45 HG12 VAL 45 5.013 3.787 -3.818 362 HG13 VAL 45 HG13 VAL 45 6.597 3.626 -3.057 363 HG21 VAL 45 HG21 VAL 45 3.003 2.796 -2.442 364 HG22 VAL 45 HG22 VAL 45 3.697 3.258 -0.887 365 HG23 VAL 45 HG23 VAL 45 3.358 1.561 -1.232 366 H LYS 46 HN LYS 46 7.288 0.292 -2.376 367 HA LYS 46 HA LYS 46 9.157 1.527 -4.135 368 HB2 LYS 46 HB2 LYS 46 9.322 -1.028 -2.519 369 HB3 LYS 46 HB1 LYS 46 10.698 -0.320 -3.367 370 HG2 LYS 46 HG2 LYS 46 10.420 1.762 -2.062 371 HG3 LYS 46 HG1 LYS 46 9.053 1.041 -1.211 372 HD2 LYS 46 HD2 LYS 46 10.520 -0.748 -0.354 373 HD3 LYS 46 HD1 LYS 46 11.891 -0.031 -1.201 374 HE2 LYS 46 HE2 LYS 46 11.635 2.035 0.115 375 HE3 LYS 46 HE1 LYS 46 10.255 1.333 0.957 376 HZ1 LYS 46 HZ1 LYS 46 13.092 0.776 1.257 377 HZ2 LYS 46 HZ2 LYS 46 12.056 -0.569 1.339 378 HZ3 LYS 46 HZ3 LYS 46 11.849 0.734 2.410 379 H TYR 47 HN TYR 47 7.464 -1.599 -4.302 380 HA TYR 47 HA TYR 47 8.813 -2.676 -6.551 381 HB2 TYR 47 HB2 TYR 47 6.792 -3.543 -4.988 382 HB3 TYR 47 HB1 TYR 47 5.825 -2.995 -6.348 383 HD1 TYR 47 HD1 TYR 47 7.507 -3.624 -8.681 384 HD2 TYR 47 HD2 TYR 47 6.855 -5.882 -5.087 385 HE1 TYR 47 HE1 TYR 47 8.055 -5.703 -9.893 386 HE2 TYR 47 HE2 TYR 47 7.395 -7.968 -6.314 387 HH TYR 47 HH TYR 47 8.505 -8.725 -8.236 388 H ILE 48 HN ILE 48 5.955 -0.566 -6.360 389 HA ILE 48 HA ILE 48 5.544 -0.265 -9.164 390 HB ILE 48 HB ILE 48 4.908 1.582 -6.845 391 HG12 ILE 48 HG12 ILE 48 3.051 -0.231 -8.410 392 HG13 ILE 48 HG11 ILE 48 3.893 -0.781 -6.962 393 HG21 ILE 48 HG21 ILE 48 4.117 1.633 -9.766 394 HG22 ILE 48 HG22 ILE 48 4.848 2.929 -8.817 395 HG23 ILE 48 HG23 ILE 48 3.176 2.454 -8.521 396 HD11 ILE 48 HD11 ILE 48 2.351 1.794 -6.850 397 HD12 ILE 48 HD12 ILE 48 2.705 0.649 -5.559 398 HD13 ILE 48 HD13 ILE 48 1.477 0.267 -6.765 399 H ALA 49 HN ALA 49 7.445 1.685 -6.847 400 HA ALA 49 HA ALA 49 8.239 3.706 -8.703 401 HB1 ALA 49 HB1 ALA 49 8.502 3.939 -6.264 402 HB2 ALA 49 HB2 ALA 49 10.048 4.170 -7.082 403 HB3 ALA 49 HB3 ALA 49 9.702 2.645 -6.269 404 H PHE 50 HN PHE 50 9.678 0.582 -7.847 405 HA PHE 50 HA PHE 50 12.093 0.874 -9.335 406 HB2 PHE 50 HB2 PHE 50 11.531 -0.922 -7.616 407 HB3 PHE 50 HB1 PHE 50 10.615 -1.727 -8.891 408 HD1 PHE 50 HD2 PHE 50 13.982 -0.452 -7.973 409 HD2 PHE 50 HD1 PHE 50 11.716 -2.981 -10.600 410 HE1 PHE 50 HE2 PHE 50 16.085 -1.413 -8.860 411 HE2 PHE 50 HE1 PHE 50 13.825 -3.943 -11.489 412 HZ PHE 50 HZ PHE 50 16.009 -3.157 -10.617 413 H LEU 51 HN LEU 51 8.909 -0.428 -10.252 414 HA LEU 51 HA LEU 51 9.617 -1.293 -12.877 415 HB2 LEU 51 HB2 LEU 51 6.987 -0.310 -11.737 416 HB3 LEU 51 HB1 LEU 51 7.143 -1.027 -13.335 417 HG LEU 51 HG LEU 51 7.950 -2.389 -10.748 418 HD11 LEU 51 HD11 LEU 51 5.934 -3.639 -10.868 419 HD12 LEU 51 HD12 LEU 51 5.576 -3.063 -12.498 420 HD13 LEU 51 HD13 LEU 51 5.454 -1.962 -11.123 421 HD21 LEU 51 HD21 LEU 51 9.219 -3.506 -12.340 422 HD22 LEU 51 HD22 LEU 51 8.096 -3.148 -13.652 423 HD23 LEU 51 HD23 LEU 51 7.719 -4.414 -12.486 424 H ARG 52 HN ARG 52 8.561 1.834 -11.620 425 HA ARG 52 HA ARG 52 8.235 3.177 -14.107 426 HB2 ARG 52 HB2 ARG 52 7.413 4.207 -12.108 427 HB3 ARG 52 HB1 ARG 52 9.002 4.157 -11.353 428 HG2 ARG 52 HG2 ARG 52 9.729 6.046 -12.433 429 HG3 ARG 52 HG1 ARG 52 8.934 5.617 -13.945 430 HD2 ARG 52 HD2 ARG 52 7.494 6.696 -11.502 431 HD3 ARG 52 HD1 ARG 52 7.981 7.671 -12.889 432 HE ARG 52 HE ARG 52 5.714 5.848 -12.789 433 HH11 ARG 52 HH21 ARG 52 8.140 7.301 -14.775 434 HH12 ARG 52 HH22 ARG 52 7.194 7.211 -16.224 435 HH21 ARG 52 HH11 ARG 52 4.466 5.741 -14.674 436 HH22 ARG 52 HH12 ARG 52 5.119 6.329 -16.166 437 H SER 53 HN SER 53 11.112 2.541 -12.142 438 HA SER 53 HA SER 53 12.940 4.272 -13.421 439 HB2 SER 53 HB2 SER 53 14.669 2.826 -12.589 440 HB3 SER 53 HB1 SER 53 13.367 2.791 -11.403 441 HG SER 53 HG SER 53 13.948 0.687 -11.825 442 H LYS 54 HN LYS 54 11.401 1.394 -14.629 443 HA LYS 54 HA LYS 54 13.321 1.186 -16.895 444 HB2 LYS 54 HB2 LYS 54 11.124 -0.541 -15.768 445 HB3 LYS 54 HB1 LYS 54 11.604 -0.760 -17.452 446 HG2 LYS 54 HG2 LYS 54 12.871 -2.274 -15.973 447 HG3 LYS 54 HG1 LYS 54 13.946 -1.107 -16.742 448 HD2 LYS 54 HD2 LYS 54 13.994 0.254 -14.737 449 HD3 LYS 54 HD1 LYS 54 12.774 -0.761 -13.966 450 HE2 LYS 54 HE2 LYS 54 15.490 -1.752 -14.875 451 HE3 LYS 54 HE1 LYS 54 15.120 -1.262 -13.222 452 HZ1 LYS 54 HZ1 LYS 54 13.545 -2.981 -13.011 453 HZ2 LYS 54 HZ2 LYS 54 14.916 -3.699 -13.713 454 HZ3 LYS 54 HZ3 LYS 54 13.564 -3.325 -14.671 455 H GLY 55 HN GLY 55 10.570 2.900 -16.105 456 HA2 GLY 55 HA2 GLY 55 9.435 4.424 -17.548 457 HA3 GLY 55 HA1 GLY 55 10.072 3.550 -18.940 458 H VAL 56 HN VAL 56 8.512 1.861 -16.282 459 HA VAL 56 HA VAL 56 6.634 0.620 -18.088 460 HB VAL 56 HB VAL 56 6.870 0.631 -15.070 461 HG11 VAL 56 HG11 VAL 56 4.557 0.202 -15.442 462 HG12 VAL 56 HG12 VAL 56 5.288 -1.397 -15.313 463 HG13 VAL 56 HG13 VAL 56 4.883 -0.738 -16.898 464 HG21 VAL 56 HG21 VAL 56 8.650 -0.524 -16.297 465 HG22 VAL 56 HG22 VAL 56 7.447 -1.411 -17.236 466 HG23 VAL 56 HG23 VAL 56 7.609 -1.708 -15.509 467 H ASP 57 HN ASP 57 4.539 1.168 -18.553 468 HA ASP 57 HA ASP 57 3.618 3.809 -17.795 469 HB2 ASP 57 HB2 ASP 57 1.582 3.185 -19.118 470 HB3 ASP 57 HB1 ASP 57 3.090 2.982 -20.007 471 H LEU 58 HN LEU 58 3.140 3.982 -15.655 472 HA LEU 58 HA LEU 58 1.458 1.955 -14.306 473 HB2 LEU 58 HB2 LEU 58 2.732 4.527 -13.328 474 HB3 LEU 58 HB1 LEU 58 1.882 3.372 -12.307 475 HG LEU 58 HG LEU 58 4.307 2.692 -13.996 476 HD11 LEU 58 HD11 LEU 58 4.033 3.539 -11.109 477 HD12 LEU 58 HD12 LEU 58 5.086 4.210 -12.352 478 HD13 LEU 58 HD13 LEU 58 5.422 2.613 -11.683 479 HD21 LEU 58 HD21 LEU 58 3.225 0.652 -13.580 480 HD22 LEU 58 HD22 LEU 58 2.604 1.178 -12.017 481 HD23 LEU 58 HD23 LEU 58 4.306 0.763 -12.195 482 H ASN 59 HN ASN 59 1.143 4.907 -16.007 483 HA ASN 59 HA ASN 59 -1.049 6.132 -14.679 484 HB2 ASN 59 HB2 ASN 59 -0.622 6.017 -17.675 485 HB3 ASN 59 HB1 ASN 59 -1.467 7.267 -16.770 486 HD21 ASN 59 HD21 ASN 59 1.231 6.336 -14.961 487 HD22 ASN 59 HD22 ASN 59 2.314 7.529 -15.493 488 H ALA 60 HN ALA 60 -1.037 3.798 -17.386 489 HA ALA 60 HA ALA 60 -3.871 3.555 -17.596 490 HB1 ALA 60 HB1 ALA 60 -1.662 1.603 -18.290 491 HB2 ALA 60 HB2 ALA 60 -2.394 2.788 -19.373 492 HB3 ALA 60 HB3 ALA 60 -3.344 1.422 -18.785 493 H LEU 61 HN LEU 61 -1.474 1.649 -15.771 494 HA LEU 61 HA LEU 61 -3.338 -0.273 -14.773 495 HB2 LEU 61 HB2 LEU 61 -0.859 -0.540 -14.697 496 HB3 LEU 61 HB1 LEU 61 -0.787 0.720 -13.468 497 HG LEU 61 HG LEU 61 -2.247 -0.652 -11.996 498 HD11 LEU 61 HD11 LEU 61 -2.203 -2.457 -14.400 499 HD12 LEU 61 HD12 LEU 61 -3.543 -2.059 -13.322 500 HD13 LEU 61 HD13 LEU 61 -2.297 -3.184 -12.797 501 HD21 LEU 61 HD21 LEU 61 0.242 -0.797 -11.875 502 HD22 LEU 61 HD22 LEU 61 0.194 -2.155 -12.998 503 HD23 LEU 61 HD23 LEU 61 -0.543 -2.304 -11.403 504 H PHE 62 HN PHE 62 -2.155 2.801 -13.419 505 HA PHE 62 HA PHE 62 -3.715 2.607 -10.998 506 HB2 PHE 62 HB2 PHE 62 -2.049 4.670 -12.362 507 HB3 PHE 62 HB1 PHE 62 -3.255 5.283 -11.235 508 HD1 PHE 62 HD2 PHE 62 -0.628 2.616 -11.489 509 HD2 PHE 62 HD1 PHE 62 -2.700 5.413 -8.973 510 HE1 PHE 62 HE2 PHE 62 0.844 2.003 -9.591 511 HE2 PHE 62 HE1 PHE 62 -1.231 4.799 -7.078 512 HZ PHE 62 HZ PHE 62 0.536 3.097 -7.386 513 H ASP 63 HN ASP 63 -4.220 4.264 -14.106 514 HA ASP 63 HA ASP 63 -6.695 5.471 -13.334 515 HB2 ASP 63 HB2 ASP 63 -5.757 4.644 -16.103 516 HB3 ASP 63 HB1 ASP 63 -7.048 5.792 -15.747 517 H ARG 64 HN ARG 64 -5.815 2.289 -14.551 518 HA ARG 64 HA ARG 64 -8.495 1.387 -15.103 519 HB2 ARG 64 HB2 ARG 64 -6.838 0.038 -16.073 520 HB3 ARG 64 HB1 ARG 64 -5.832 0.062 -14.626 521 HG2 ARG 64 HG2 ARG 64 -7.122 -1.545 -13.514 522 HG3 ARG 64 HG1 ARG 64 -8.545 -1.243 -14.505 523 HD2 ARG 64 HD2 ARG 64 -6.387 -2.199 -16.200 524 HD3 ARG 64 HD1 ARG 64 -6.633 -3.306 -14.861 525 HE ARG 64 HE ARG 64 -8.580 -2.700 -16.984 526 HH11 ARG 64 HH21 ARG 64 -7.929 -3.992 -13.844 527 HH12 ARG 64 HH22 ARG 64 -9.324 -5.017 -13.831 528 HH21 ARG 64 HH11 ARG 64 -10.408 -4.022 -16.971 529 HH22 ARG 64 HH12 ARG 64 -10.728 -5.035 -15.603 530 H ILE 65 HN ILE 65 -6.328 1.080 -12.297 531 HA ILE 65 HA ILE 65 -8.225 -0.307 -10.646 532 HB ILE 65 HB ILE 65 -5.812 1.385 -9.935 533 HG12 ILE 65 HG12 ILE 65 -6.158 -1.628 -9.896 534 HG13 ILE 65 HG11 ILE 65 -5.498 -0.756 -11.281 535 HG21 ILE 65 HG21 ILE 65 -7.172 1.345 -7.979 536 HG22 ILE 65 HG22 ILE 65 -5.998 0.050 -7.750 537 HG23 ILE 65 HG23 ILE 65 -7.646 -0.332 -8.250 538 HD11 ILE 65 HD11 ILE 65 -3.797 0.261 -9.679 539 HD12 ILE 65 HD12 ILE 65 -3.616 -1.464 -9.975 540 HD13 ILE 65 HD13 ILE 65 -4.360 -0.902 -8.480 541 H ILE 66 HN ILE 66 -7.350 3.126 -10.977 542 HA ILE 66 HA ILE 66 -9.565 3.866 -9.136 543 HB ILE 66 HB ILE 66 -7.429 5.598 -10.415 544 HG12 ILE 66 HG12 ILE 66 -7.575 4.639 -7.544 545 HG13 ILE 66 HG11 ILE 66 -6.677 3.750 -8.773 546 HG21 ILE 66 HG21 ILE 66 -8.140 7.126 -8.507 547 HG22 ILE 66 HG22 ILE 66 -9.510 6.045 -8.256 548 HG23 ILE 66 HG23 ILE 66 -9.343 6.916 -9.780 549 HD11 ILE 66 HD11 ILE 66 -5.407 5.852 -9.284 550 HD12 ILE 66 HD12 ILE 66 -5.137 5.236 -7.651 551 HD13 ILE 66 HD13 ILE 66 -6.209 6.612 -7.907 552 H VAL 67 HN VAL 67 -11.486 4.314 -10.034 553 HA VAL 67 HA VAL 67 -11.645 5.006 -12.913 554 HB VAL 67 HB VAL 67 -13.091 3.218 -12.106 555 HG11 VAL 67 HG11 VAL 67 -13.215 4.370 -9.724 556 HG12 VAL 67 HG12 VAL 67 -14.558 3.393 -10.299 557 HG13 VAL 67 HG13 VAL 67 -14.646 5.146 -10.395 558 HG21 VAL 67 HG21 VAL 67 -15.183 4.031 -12.995 559 HG22 VAL 67 HG22 VAL 67 -13.882 4.831 -13.876 560 HG23 VAL 67 HG23 VAL 67 -14.756 5.700 -12.613 561 H ASN 68 HN ASN 68 -11.447 7.180 -13.302 562 HA ASN 68 HA ASN 68 -13.234 9.007 -11.798 563 HB2 ASN 68 HB2 ASN 68 -10.784 8.963 -10.899 564 HB3 ASN 68 HB1 ASN 68 -10.381 9.811 -12.392 565 HD21 ASN 68 HD21 ASN 68 -9.923 11.811 -11.349 566 HD22 ASN 68 HD22 ASN 68 -11.126 12.765 -10.621 567 H LYS 69 HN LYS 69 -11.893 11.296 -13.148 568 HA LYS 69 HA LYS 69 -13.482 11.363 -15.514 569 HB2 LYS 69 HB2 LYS 69 -12.675 13.366 -14.250 570 HB3 LYS 69 HB1 LYS 69 -11.057 13.063 -14.884 571 HG2 LYS 69 HG2 LYS 69 -11.864 13.322 -17.176 572 HG3 LYS 69 HG1 LYS 69 -13.520 13.518 -16.597 573 HD2 LYS 69 HD2 LYS 69 -12.847 15.552 -15.365 574 HD3 LYS 69 HD1 LYS 69 -11.196 15.363 -15.957 575 HE2 LYS 69 HE2 LYS 69 -12.382 16.981 -17.355 576 HE3 LYS 69 HE1 LYS 69 -12.047 15.525 -18.293 577 HZ1 LYS 69 HZ1 LYS 69 -14.463 16.669 -18.071 578 HZ2 LYS 69 HZ2 LYS 69 -14.553 15.487 -16.855 579 HZ3 LYS 69 HZ3 LYS 69 -14.210 15.037 -18.458 580 H LEU 70 HN LEU 70 -13.077 10.679 -17.554 581 HA LEU 70 HA LEU 70 -10.499 9.343 -18.092 582 HB2 LEU 70 HB2 LEU 70 -12.508 8.127 -18.705 583 HB3 LEU 70 HB1 LEU 70 -13.086 9.485 -19.668 584 HG LEU 70 HG LEU 70 -11.217 9.233 -21.224 585 HD11 LEU 70 HD11 LEU 70 -9.795 7.056 -20.852 586 HD12 LEU 70 HD12 LEU 70 -10.281 7.239 -19.167 587 HD13 LEU 70 HD13 LEU 70 -9.372 8.520 -19.968 588 HD21 LEU 70 HD21 LEU 70 -12.491 6.542 -20.629 589 HD22 LEU 70 HD22 LEU 70 -11.802 7.053 -22.172 590 HD23 LEU 70 HD23 LEU 70 -13.253 7.840 -21.550 591 H GLU 71 HN GLU 71 -8.914 10.264 -19.282 592 HA GLU 71 HA GLU 71 -9.395 12.931 -20.455 593 HB2 GLU 71 HB2 GLU 71 -7.382 12.511 -19.067 594 HB3 GLU 71 HB1 GLU 71 -6.839 11.319 -20.249 595 HG2 GLU 71 HG2 GLU 71 -6.765 13.043 -21.995 596 HG3 GLU 71 HG1 GLU 71 -7.372 14.243 -20.853 597 H HIS 72 HN HIS 72 -9.850 13.177 -22.567 598 HA HIS 72 HA HIS 72 -9.572 10.877 -24.389 599 HB2 HIS 72 HB2 HIS 72 -11.599 12.519 -24.190 600 HB3 HIS 72 HB1 HIS 72 -10.614 13.600 -25.171 601 HD2 HIS 72 HD2 HIS 72 -11.050 9.672 -25.712 602 HE1 HIS 72 HE1 HIS 72 -12.209 11.691 -29.233 603 HE2 HIS 72 HE2 HIS 72 -11.838 9.413 -28.181 604 H HIS 73 HN HIS 73 -8.900 11.604 -26.732 605 HA HIS 73 HA HIS 73 -7.252 12.364 -28.186 606 HB2 HIS 73 HB2 HIS 73 -6.323 14.340 -26.102 607 HB3 HIS 73 HB1 HIS 73 -6.241 14.463 -27.856 608 HD2 HIS 73 HD2 HIS 73 -8.185 16.318 -25.474 609 HE1 HIS 73 HE1 HIS 73 -11.144 15.216 -28.279 610 HE2 HIS 73 HE2 HIS 73 -10.599 16.774 -26.353 611 H HIS 74 HN HIS 74 -6.160 10.389 -28.013 612 HA HIS 74 HA HIS 74 -4.044 10.111 -25.968 613 HB2 HIS 74 HB2 HIS 74 -3.790 7.843 -26.845 614 HB3 HIS 74 HB1 HIS 74 -5.491 8.172 -26.521 615 HD2 HIS 74 HD2 HIS 74 -5.491 9.968 -29.612 616 HE1 HIS 74 HE1 HIS 74 -5.374 5.986 -31.010 617 HE2 HIS 74 HE2 HIS 74 -5.850 8.392 -31.657 618 H HIS 75 HN HIS 75 -1.831 9.510 -26.691 619 HA HIS 75 HA HIS 75 -0.927 11.330 -28.771 620 HB2 HIS 75 HB2 HIS 75 0.283 10.682 -26.575 621 HB3 HIS 75 HB1 HIS 75 0.774 9.221 -27.430 622 HD2 HIS 75 HD2 HIS 75 3.278 11.107 -26.856 623 HE1 HIS 75 HE1 HIS 75 2.778 12.682 -30.742 624 HE2 HIS 75 HE2 HIS 75 4.384 12.463 -28.790 625 H HIS 76 HN HIS 76 1.226 9.004 -29.202 626 HA HIS 76 HA HIS 76 1.723 7.767 -31.144 627 HB2 HIS 76 HB2 HIS 76 -0.879 6.493 -30.235 628 HB3 HIS 76 HB1 HIS 76 0.292 5.748 -31.325 629 HD2 HIS 76 HD2 HIS 76 -0.438 5.317 -27.765 630 HE1 HIS 76 HE1 HIS 76 3.786 5.327 -27.832 631 HE2 HIS 76 HE2 HIS 76 1.741 4.763 -26.441 632 H HIS 77 HN HIS 77 0.598 10.164 -31.864 633 HA HIS 77 HA HIS 77 -0.685 11.274 -33.475 634 HB2 HIS 77 HB2 HIS 77 -0.479 10.188 -35.747 635 HB3 HIS 77 HB1 HIS 77 1.048 10.425 -34.901 636 HD2 HIS 77 HD2 HIS 77 2.418 8.056 -34.261 637 HE1 HIS 77 HE1 HIS 77 -0.478 5.381 -35.773 638 HE2 HIS 77 HE2 HIS 77 1.873 5.571 -34.840 639 H1 MET 1 HT1 MET 1 -8.770 -9.957 -16.958 640 H2 MET 1 HT2 MET 1 -8.879 -10.167 -15.276 641 H3 MET 1 HT3 MET 1 -8.075 -11.320 -16.230 642 HA MET 1 HA MET 1 -6.169 -10.242 -16.055 643 HB2 MET 1 HB2 MET 1 -7.016 -8.884 -17.969 644 HB3 MET 1 HB1 MET 1 -7.697 -7.734 -16.819 645 HG2 MET 1 HG2 MET 1 -5.461 -7.301 -15.900 646 HG3 MET 1 HG1 MET 1 -4.763 -8.484 -17.003 647 HE1 MET 1 HE1 MET 1 -5.789 -8.177 -19.812 648 HE2 MET 1 HE2 MET 1 -4.125 -8.192 -19.236 649 HE3 MET 1 HE3 MET 1 -4.643 -6.955 -20.374 650 H GLU 2 HN GLU 2 -5.987 -10.535 -13.807 651 HA GLU 2 HA GLU 2 -7.251 -8.622 -11.989 652 HB2 GLU 2 HB2 GLU 2 -7.012 -11.021 -11.383 653 HB3 GLU 2 HB1 GLU 2 -5.263 -10.841 -11.413 654 HG2 GLU 2 HG2 GLU 2 -6.198 -10.700 -9.109 655 HG3 GLU 2 HG1 GLU 2 -5.353 -9.231 -9.575 656 H LEU 3 HN LEU 3 -5.992 -7.370 -10.422 657 HA LEU 3 HA LEU 3 -4.122 -5.621 -11.542 658 HB2 LEU 3 HB2 LEU 3 -5.411 -5.588 -9.250 659 HB3 LEU 3 HB1 LEU 3 -3.965 -6.370 -8.620 660 HG LEU 3 HG LEU 3 -4.011 -3.746 -10.133 661 HD11 LEU 3 HD11 LEU 3 -3.837 -4.424 -7.192 662 HD12 LEU 3 HD12 LEU 3 -4.960 -3.325 -7.994 663 HD13 LEU 3 HD13 LEU 3 -3.261 -2.884 -7.831 664 HD21 LEU 3 HD21 LEU 3 -1.883 -4.654 -10.539 665 HD22 LEU 3 HD22 LEU 3 -1.814 -5.452 -8.966 666 HD23 LEU 3 HD23 LEU 3 -1.610 -3.708 -9.080 667 H SER 4 HN SER 4 -3.312 -8.267 -9.254 668 HA SER 4 HA SER 4 -0.498 -8.062 -9.597 669 HB2 SER 4 HB2 SER 4 -0.395 -10.246 -8.527 670 HB3 SER 4 HB1 SER 4 -1.639 -9.277 -7.739 671 HG SER 4 HG SER 4 -2.654 -11.144 -8.162 672 H ASN 5 HN ASN 5 -2.948 -9.829 -11.422 673 HA ASN 5 HA ASN 5 -1.161 -11.504 -12.898 674 HB2 ASN 5 HB2 ASN 5 -3.642 -11.782 -12.791 675 HB3 ASN 5 HB1 ASN 5 -3.809 -10.353 -13.809 676 HD21 ASN 5 HD21 ASN 5 -2.529 -13.680 -13.763 677 HD22 ASN 5 HD22 ASN 5 -2.500 -13.870 -15.449 678 H GLU 6 HN GLU 6 -2.521 -8.282 -13.626 679 HA GLU 6 HA GLU 6 -1.126 -8.053 -16.150 680 HB2 GLU 6 HB2 GLU 6 -3.197 -6.772 -15.571 681 HB3 GLU 6 HB1 GLU 6 -2.255 -5.854 -14.398 682 HG2 GLU 6 HG2 GLU 6 -2.411 -4.590 -16.480 683 HG3 GLU 6 HG1 GLU 6 -0.744 -5.105 -16.234 684 H LEU 7 HN LEU 7 -0.465 -6.993 -12.836 685 HA LEU 7 HA LEU 7 1.807 -5.371 -13.422 686 HB2 LEU 7 HB2 LEU 7 0.628 -5.401 -11.233 687 HB3 LEU 7 HB1 LEU 7 1.254 -7.021 -10.939 688 HG LEU 7 HG LEU 7 3.573 -6.132 -11.099 689 HD11 LEU 7 HD11 LEU 7 3.597 -3.496 -10.817 690 HD12 LEU 7 HD12 LEU 7 2.066 -3.596 -11.680 691 HD13 LEU 7 HD13 LEU 7 3.542 -4.217 -12.421 692 HD21 LEU 7 HD21 LEU 7 1.672 -4.896 -9.094 693 HD22 LEU 7 HD22 LEU 7 3.421 -4.719 -8.968 694 HD23 LEU 7 HD23 LEU 7 2.691 -6.321 -8.887 695 H LYS 8 HN LYS 8 1.525 -8.829 -12.636 696 HA LYS 8 HA LYS 8 4.330 -9.394 -12.655 697 HB2 LYS 8 HB2 LYS 8 2.571 -10.890 -11.704 698 HB3 LYS 8 HB1 LYS 8 2.047 -11.256 -13.349 699 HG2 LYS 8 HG2 LYS 8 4.246 -12.172 -13.889 700 HG3 LYS 8 HG1 LYS 8 4.846 -11.735 -12.289 701 HD2 LYS 8 HD2 LYS 8 3.167 -13.233 -11.257 702 HD3 LYS 8 HD1 LYS 8 2.603 -13.693 -12.863 703 HE2 LYS 8 HE2 LYS 8 5.456 -14.050 -11.907 704 HE3 LYS 8 HE1 LYS 8 4.237 -15.325 -11.869 705 HZ1 LYS 8 HZ1 LYS 8 4.342 -15.609 -14.078 706 HZ2 LYS 8 HZ2 LYS 8 5.864 -14.865 -13.939 707 HZ3 LYS 8 HZ3 LYS 8 4.508 -13.952 -14.403 708 H VAL 9 HN VAL 9 1.877 -9.385 -15.203 709 HA VAL 9 HA VAL 9 3.438 -10.580 -17.260 710 HB VAL 9 HB VAL 9 1.172 -8.577 -17.330 711 HG11 VAL 9 HG11 VAL 9 1.008 -9.347 -19.780 712 HG12 VAL 9 HG12 VAL 9 2.670 -9.910 -19.594 713 HG13 VAL 9 HG13 VAL 9 2.290 -8.199 -19.392 714 HG21 VAL 9 HG21 VAL 9 -0.214 -10.438 -17.752 715 HG22 VAL 9 HG22 VAL 9 0.911 -11.045 -16.538 716 HG23 VAL 9 HG23 VAL 9 1.139 -11.461 -18.233 717 H GLU 10 HN GLU 10 3.077 -7.143 -16.316 718 HA GLU 10 HA GLU 10 4.754 -6.138 -18.392 719 HB2 GLU 10 HB2 GLU 10 3.951 -5.069 -15.694 720 HB3 GLU 10 HB1 GLU 10 4.964 -4.149 -16.804 721 HG2 GLU 10 HG2 GLU 10 2.311 -5.321 -17.669 722 HG3 GLU 10 HG1 GLU 10 2.420 -3.728 -16.922 723 H ARG 11 HN ARG 11 5.446 -7.388 -15.178 724 HA ARG 11 HA ARG 11 8.177 -6.575 -15.009 725 HB2 ARG 11 HB2 ARG 11 6.711 -7.595 -13.169 726 HB3 ARG 11 HB1 ARG 11 7.068 -9.161 -13.902 727 HG2 ARG 11 HG2 ARG 11 9.478 -8.738 -13.650 728 HG3 ARG 11 HG1 ARG 11 9.134 -7.176 -12.906 729 HD2 ARG 11 HD2 ARG 11 9.534 -8.705 -11.105 730 HD3 ARG 11 HD1 ARG 11 7.791 -8.450 -11.158 731 HE ARG 11 HE ARG 11 8.332 -10.688 -12.783 732 HH11 ARG 11 HH21 ARG 11 8.660 -9.687 -9.497 733 HH12 ARG 11 HH22 ARG 11 8.468 -11.283 -8.855 734 HH21 ARG 11 HH11 ARG 11 8.088 -12.772 -11.962 735 HH22 ARG 11 HH12 ARG 11 8.153 -13.033 -10.252 736 H ILE 12 HN ILE 12 6.614 -9.396 -16.455 737 HA ILE 12 HA ILE 12 9.007 -10.823 -17.153 738 HB ILE 12 HB ILE 12 6.220 -10.869 -18.345 739 HG12 ILE 12 HG12 ILE 12 7.621 -12.854 -16.529 740 HG13 ILE 12 HG11 ILE 12 6.553 -11.580 -15.936 741 HG21 ILE 12 HG21 ILE 12 8.672 -12.558 -18.882 742 HG22 ILE 12 HG22 ILE 12 7.645 -11.726 -20.049 743 HG23 ILE 12 HG23 ILE 12 7.043 -13.151 -19.204 744 HD11 ILE 12 HD11 ILE 12 4.764 -12.488 -17.478 745 HD12 ILE 12 HD12 ILE 12 5.220 -13.575 -16.165 746 HD13 ILE 12 HD13 ILE 12 5.828 -13.857 -17.797 747 H ARG 13 HN ARG 13 6.981 -8.493 -18.923 748 HA ARG 13 HA ARG 13 8.238 -8.617 -21.436 749 HB2 ARG 13 HB2 ARG 13 7.012 -6.286 -19.941 750 HB3 ARG 13 HB1 ARG 13 7.540 -6.177 -21.621 751 HG2 ARG 13 HG2 ARG 13 6.002 -7.961 -22.264 752 HG3 ARG 13 HG1 ARG 13 5.537 -8.207 -20.581 753 HD2 ARG 13 HD2 ARG 13 3.812 -6.859 -21.501 754 HD3 ARG 13 HD1 ARG 13 4.806 -5.750 -20.587 755 HE ARG 13 HE ARG 13 4.831 -6.016 -23.559 756 HH11 ARG 13 HH21 ARG 13 5.627 -4.272 -20.652 757 HH12 ARG 13 HH22 ARG 13 6.075 -2.838 -21.501 758 HH21 ARG 13 HH11 ARG 13 5.422 -4.139 -24.635 759 HH22 ARG 13 HH12 ARG 13 5.965 -2.761 -23.738 760 H LEU 14 HN LEU 14 9.162 -6.718 -18.560 761 HA LEU 14 HA LEU 14 11.586 -5.733 -19.935 762 HB2 LEU 14 HB2 LEU 14 10.504 -5.370 -17.130 763 HB3 LEU 14 HB1 LEU 14 12.003 -4.645 -17.701 764 HG LEU 14 HG LEU 14 9.335 -4.239 -19.077 765 HD11 LEU 14 HD11 LEU 14 9.607 -1.889 -17.936 766 HD12 LEU 14 HD12 LEU 14 10.611 -2.764 -16.779 767 HD13 LEU 14 HD13 LEU 14 8.925 -3.227 -17.012 768 HD21 LEU 14 HD21 LEU 14 12.104 -3.069 -19.371 769 HD22 LEU 14 HD22 LEU 14 10.702 -2.096 -19.799 770 HD23 LEU 14 HD23 LEU 14 10.992 -3.624 -20.620 771 H SER 15 HN SER 15 10.657 -8.522 -18.391 772 HA SER 15 HA SER 15 11.797 -10.275 -17.350 773 HB2 SER 15 HB2 SER 15 14.091 -9.279 -19.055 774 HB3 SER 15 HB1 SER 15 13.843 -10.916 -18.456 775 HG SER 15 HG SER 15 12.336 -9.470 -20.365 776 H LEU 16 HN LEU 16 11.738 -9.078 -15.277 777 HA LEU 16 HA LEU 16 14.357 -7.910 -14.448 778 HB2 LEU 16 HB2 LEU 16 11.548 -7.740 -13.440 779 HB3 LEU 16 HB1 LEU 16 12.830 -7.605 -12.242 780 HG LEU 16 HG LEU 16 13.840 -5.764 -13.478 781 HD11 LEU 16 HD11 LEU 16 13.460 -6.212 -15.742 782 HD12 LEU 16 HD12 LEU 16 12.383 -4.853 -15.437 783 HD13 LEU 16 HD13 LEU 16 11.735 -6.491 -15.505 784 HD21 LEU 16 HD21 LEU 16 11.976 -5.328 -11.867 785 HD22 LEU 16 HD22 LEU 16 10.846 -5.345 -13.221 786 HD23 LEU 16 HD23 LEU 16 12.095 -4.103 -13.128 787 H THR 17 HN THR 17 15.667 -8.869 -12.994 788 HA THR 17 HA THR 17 15.056 -11.682 -12.301 789 HB THR 17 HB THR 17 17.479 -11.591 -11.450 790 HG1 THR 17 HG1 THR 17 17.150 -9.051 -12.616 791 HG21 THR 17 HG21 THR 17 16.876 -10.980 -14.358 792 HG22 THR 17 HG22 THR 17 16.860 -12.576 -13.608 793 HG23 THR 17 HG23 THR 17 18.378 -11.691 -13.762 794 H ALA 18 HN ALA 18 14.721 -12.384 -10.233 795 HA ALA 18 HA ALA 18 13.798 -10.580 -8.231 796 HB1 ALA 18 HB1 ALA 18 13.139 -12.947 -8.321 797 HB2 ALA 18 HB2 ALA 18 13.852 -12.569 -6.754 798 HB3 ALA 18 HB3 ALA 18 14.799 -13.428 -7.967 799 H LYS 19 HN LYS 19 16.952 -12.112 -8.755 800 HA LYS 19 HA LYS 19 18.141 -11.326 -6.273 801 HB2 LYS 19 HB2 LYS 19 19.085 -13.021 -7.851 802 HB3 LYS 19 HB1 LYS 19 19.495 -11.709 -8.955 803 HG2 LYS 19 HG2 LYS 19 20.934 -10.686 -7.254 804 HG3 LYS 19 HG1 LYS 19 20.502 -11.956 -6.106 805 HD2 LYS 19 HD2 LYS 19 21.474 -13.654 -7.614 806 HD3 LYS 19 HD1 LYS 19 21.914 -12.385 -8.756 807 HE2 LYS 19 HE2 LYS 19 23.853 -12.956 -7.376 808 HE3 LYS 19 HE1 LYS 19 23.315 -11.320 -7.000 809 HZ1 LYS 19 HZ1 LYS 19 22.186 -12.117 -5.068 810 HZ2 LYS 19 HZ2 LYS 19 23.785 -12.689 -5.018 811 HZ3 LYS 19 HZ3 LYS 19 22.521 -13.732 -5.464 812 H SER 20 HN SER 20 18.223 -9.788 -9.504 813 HA SER 20 HA SER 20 19.785 -7.530 -8.738 814 HB2 SER 20 HB2 SER 20 17.646 -7.718 -10.880 815 HB3 SER 20 HB1 SER 20 18.897 -6.483 -10.779 816 HG SER 20 HG SER 20 19.986 -8.938 -10.600 817 H VAL 21 HN VAL 21 16.259 -7.995 -8.867 818 HA VAL 21 HA VAL 21 15.605 -5.338 -7.989 819 HB VAL 21 HB VAL 21 14.043 -7.929 -7.881 820 HG11 VAL 21 HG11 VAL 21 13.276 -5.082 -7.218 821 HG12 VAL 21 HG12 VAL 21 13.024 -6.541 -6.256 822 HG13 VAL 21 HG13 VAL 21 12.072 -6.274 -7.716 823 HG21 VAL 21 HG21 VAL 21 14.752 -6.880 -10.130 824 HG22 VAL 21 HG22 VAL 21 13.643 -5.570 -9.727 825 HG23 VAL 21 HG23 VAL 21 13.035 -7.215 -9.905 826 H ALA 22 HN ALA 22 15.955 -8.431 -6.262 827 HA ALA 22 HA ALA 22 15.119 -7.568 -3.707 828 HB1 ALA 22 HB1 ALA 22 15.471 -9.896 -4.051 829 HB2 ALA 22 HB2 ALA 22 16.702 -9.402 -2.889 830 HB3 ALA 22 HB3 ALA 22 17.136 -9.637 -4.583 831 H GLU 23 HN GLU 23 18.453 -7.654 -5.008 832 HA GLU 23 HA GLU 23 19.664 -6.522 -2.701 833 HB2 GLU 23 HB2 GLU 23 20.512 -6.355 -5.602 834 HB3 GLU 23 HB1 GLU 23 21.542 -5.979 -4.226 835 HG2 GLU 23 HG2 GLU 23 20.248 -8.669 -4.718 836 HG3 GLU 23 HG1 GLU 23 21.919 -8.281 -5.130 837 H GLU 24 HN GLU 24 18.642 -4.925 -5.740 838 HA GLU 24 HA GLU 24 19.379 -2.306 -4.866 839 HB2 GLU 24 HB2 GLU 24 18.681 -3.304 -7.241 840 HB3 GLU 24 HB1 GLU 24 17.099 -2.685 -6.783 841 HG2 GLU 24 HG2 GLU 24 18.183 -0.920 -7.978 842 HG3 GLU 24 HG1 GLU 24 18.261 -0.466 -6.276 843 H MET 25 HN MET 25 16.328 -4.109 -4.634 844 HA MET 25 HA MET 25 14.768 -1.953 -3.572 845 HB2 MET 25 HB2 MET 25 14.529 -4.966 -3.438 846 HB3 MET 25 HB1 MET 25 13.374 -3.911 -2.623 847 HG2 MET 25 HG2 MET 25 14.049 -3.623 -5.554 848 HG3 MET 25 HG1 MET 25 12.721 -4.626 -4.982 849 HE1 MET 25 HE1 MET 25 10.039 -2.760 -3.911 850 HE2 MET 25 HE2 MET 25 11.115 -2.516 -2.537 851 HE3 MET 25 HE3 MET 25 11.149 -4.039 -3.409 852 H GLY 26 HN GLY 26 16.895 -4.355 -2.099 853 HA2 GLY 26 HA2 GLY 26 18.084 -3.965 -0.039 854 HA3 GLY 26 HA1 GLY 26 16.878 -2.762 0.408 855 H ILE 27 HN ILE 27 15.794 -5.804 -0.892 856 HA ILE 27 HA ILE 27 15.081 -6.747 1.861 857 HB ILE 27 HB ILE 27 12.911 -7.497 0.987 858 HG12 ILE 27 HG12 ILE 27 13.623 -5.956 -1.521 859 HG13 ILE 27 HG11 ILE 27 13.694 -7.709 -1.416 860 HG21 ILE 27 HG21 ILE 27 13.340 -4.575 0.343 861 HG22 ILE 27 HG22 ILE 27 13.281 -5.200 1.991 862 HG23 ILE 27 HG23 ILE 27 11.868 -5.336 0.944 863 HD11 ILE 27 HD11 ILE 27 11.271 -7.657 -0.671 864 HD12 ILE 27 HD12 ILE 27 11.559 -7.181 -2.344 865 HD13 ILE 27 HD13 ILE 27 11.258 -5.951 -1.115 866 H SER 28 HN SER 28 14.517 -9.092 1.896 867 HA SER 28 HA SER 28 16.552 -10.593 0.452 868 HB2 SER 28 HB2 SER 28 16.108 -11.192 2.745 869 HB3 SER 28 HB1 SER 28 14.391 -11.396 2.413 870 HG SER 28 HG SER 28 15.068 -13.070 0.902 871 H ARG 29 HN ARG 29 15.947 -12.673 -0.654 872 HA ARG 29 HA ARG 29 14.132 -12.196 -2.818 873 HB2 ARG 29 HB2 ARG 29 15.321 -14.797 -1.815 874 HB3 ARG 29 HB1 ARG 29 14.555 -14.567 -3.387 875 HG2 ARG 29 HG2 ARG 29 16.277 -12.669 -3.736 876 HG3 ARG 29 HG1 ARG 29 17.132 -13.370 -2.361 877 HD2 ARG 29 HD2 ARG 29 16.363 -14.853 -4.890 878 HD3 ARG 29 HD1 ARG 29 17.968 -14.261 -4.514 879 HE ARG 29 HE ARG 29 16.562 -16.353 -2.878 880 HH11 ARG 29 HH21 ARG 29 19.449 -15.039 -4.332 881 HH12 ARG 29 HH22 ARG 29 20.457 -16.299 -3.722 882 HH21 ARG 29 HH11 ARG 29 17.902 -17.977 -2.113 883 HH22 ARG 29 HH12 ARG 29 19.595 -17.949 -2.478 884 H GLN 30 HN GLN 30 13.852 -13.986 0.222 885 HA GLN 30 HA GLN 30 11.328 -15.225 -0.316 886 HB2 GLN 30 HB2 GLN 30 12.815 -15.888 1.553 887 HB3 GLN 30 HB1 GLN 30 12.488 -14.344 2.342 888 HG2 GLN 30 HG2 GLN 30 10.135 -14.874 2.548 889 HG3 GLN 30 HG1 GLN 30 10.336 -16.343 1.595 890 HE21 GLN 30 HE21 GLN 30 9.285 -16.487 4.234 891 HE22 GLN 30 HE22 GLN 30 10.420 -17.257 5.235 892 H GLN 31 HN GLN 31 12.196 -12.069 1.070 893 HA GLN 31 HA GLN 31 9.574 -11.274 1.862 894 HB2 GLN 31 HB2 GLN 31 11.674 -10.072 2.472 895 HB3 GLN 31 HB1 GLN 31 11.818 -9.539 0.800 896 HG2 GLN 31 HG2 GLN 31 10.791 -7.766 2.122 897 HG3 GLN 31 HG1 GLN 31 9.593 -8.416 1.006 898 HE21 GLN 31 HE21 GLN 31 7.690 -8.099 2.260 899 HE22 GLN 31 HE22 GLN 31 7.445 -8.818 3.778 900 H LEU 32 HN LEU 32 11.351 -10.831 -1.176 901 HA LEU 32 HA LEU 32 9.267 -9.432 -2.545 902 HB2 LEU 32 HB2 LEU 32 11.649 -9.510 -3.292 903 HB3 LEU 32 HB1 LEU 32 11.432 -11.209 -3.702 904 HG LEU 32 HG LEU 32 9.606 -10.554 -5.283 905 HD11 LEU 32 HD11 LEU 32 8.780 -8.484 -4.556 906 HD12 LEU 32 HD12 LEU 32 9.764 -8.017 -5.936 907 HD13 LEU 32 HD13 LEU 32 10.389 -7.815 -4.301 908 HD21 LEU 32 HD21 LEU 32 12.222 -9.116 -5.817 909 HD22 LEU 32 HD22 LEU 32 11.106 -9.766 -7.017 910 HD23 LEU 32 HD23 LEU 32 12.009 -10.860 -5.972 911 H CYS 33 HN CYS 33 10.075 -12.853 -2.208 912 HA CYS 33 HA CYS 33 8.282 -13.946 -4.095 913 HB2 CYS 33 HB2 CYS 33 10.085 -14.981 -2.363 914 HB3 CYS 33 HB1 CYS 33 8.608 -15.388 -1.496 915 HG CYS 33 HG CYS 33 9.221 -16.351 -4.414 916 H ASN 34 HN ASN 34 7.728 -12.967 -0.721 917 HA ASN 34 HA ASN 34 5.068 -13.960 -0.477 918 HB2 ASN 34 HB2 ASN 34 6.228 -11.456 0.779 919 HB3 ASN 34 HB1 ASN 34 4.852 -12.386 1.370 920 HD21 ASN 34 HD21 ASN 34 7.901 -11.829 2.213 921 HD22 ASN 34 HD22 ASN 34 8.388 -13.354 2.777 922 H ILE 35 HN ILE 35 6.310 -10.803 -1.577 923 HA ILE 35 HA ILE 35 3.754 -9.585 -1.986 924 HB ILE 35 HB ILE 35 6.327 -9.056 -3.502 925 HG12 ILE 35 HG12 ILE 35 5.316 -7.717 -0.971 926 HG13 ILE 35 HG11 ILE 35 6.539 -8.988 -0.979 927 HG21 ILE 35 HG21 ILE 35 5.277 -6.714 -3.554 928 HG22 ILE 35 HG22 ILE 35 3.780 -7.491 -3.048 929 HG23 ILE 35 HG23 ILE 35 4.528 -7.932 -4.582 930 HD11 ILE 35 HD11 ILE 35 7.836 -7.510 -2.640 931 HD12 ILE 35 HD12 ILE 35 7.774 -6.952 -0.971 932 HD13 ILE 35 HD13 ILE 35 6.725 -6.217 -2.183 933 H GLU 36 HN GLU 36 5.912 -11.367 -4.191 934 HA GLU 36 HA GLU 36 4.142 -11.136 -6.459 935 HB2 GLU 36 HB2 GLU 36 6.613 -11.581 -6.589 936 HB3 GLU 36 HB1 GLU 36 6.295 -13.206 -5.983 937 HG2 GLU 36 HG2 GLU 36 4.884 -13.708 -7.893 938 HG3 GLU 36 HG1 GLU 36 5.023 -12.048 -8.477 939 H GLN 37 HN GLN 37 4.144 -13.159 -3.666 940 HA GLN 37 HA GLN 37 2.479 -15.235 -5.002 941 HB2 GLN 37 HB2 GLN 37 4.341 -15.825 -3.376 942 HB3 GLN 37 HB1 GLN 37 3.364 -15.091 -2.104 943 HG2 GLN 37 HG2 GLN 37 2.951 -17.478 -2.109 944 HG3 GLN 37 HG1 GLN 37 1.506 -16.669 -2.706 945 HE21 GLN 37 HE21 GLN 37 0.713 -18.220 -4.199 946 HE22 GLN 37 HE22 GLN 37 1.610 -18.798 -5.520 947 H SER 38 HN SER 38 2.187 -12.364 -3.169 948 HA SER 38 HA SER 38 -0.727 -12.651 -3.123 949 HB2 SER 38 HB2 SER 38 -0.882 -12.132 -0.683 950 HB3 SER 38 HB1 SER 38 -0.167 -13.711 -0.989 951 HG SER 38 HG SER 38 1.261 -11.296 -0.534 952 H GLU 39 HN GLU 39 0.792 -10.951 -4.632 953 HA GLU 39 HA GLU 39 1.529 -8.478 -3.540 954 HB2 GLU 39 HB2 GLU 39 1.776 -9.258 -5.954 955 HB3 GLU 39 HB1 GLU 39 0.090 -8.835 -6.194 956 HG2 GLU 39 HG2 GLU 39 1.858 -6.721 -4.997 957 HG3 GLU 39 HG1 GLU 39 2.110 -7.104 -6.693 958 H THR 40 HN THR 40 -1.484 -8.624 -5.414 959 HA THR 40 HA THR 40 -3.538 -7.591 -5.070 960 HB THR 40 HB THR 40 -3.005 -8.301 -2.174 961 HG1 THR 40 HG1 THR 40 -3.117 -9.846 -4.285 962 HG21 THR 40 HG21 THR 40 -4.938 -6.898 -2.355 963 HG22 THR 40 HG22 THR 40 -5.542 -8.551 -2.238 964 HG23 THR 40 HG23 THR 40 -5.493 -7.738 -3.803 965 H ALA 41 HN ALA 41 -4.619 -5.680 -4.143 966 HA ALA 41 HA ALA 41 -2.641 -3.589 -3.612 967 HB1 ALA 41 HB1 ALA 41 -4.538 -3.312 -5.241 968 HB2 ALA 41 HB2 ALA 41 -4.363 -2.016 -4.059 969 HB3 ALA 41 HB3 ALA 41 -5.616 -3.238 -3.846 970 HA PRO 42 HA PRO 42 -3.667 -3.868 0.801 971 HB2 PRO 42 HB2 PRO 42 -1.893 -2.045 1.740 972 HB3 PRO 42 HB1 PRO 42 -1.372 -3.632 1.132 973 HG2 PRO 42 HG2 PRO 42 -1.329 -0.979 -0.242 974 HG3 PRO 42 HG1 PRO 42 -0.093 -2.250 -0.212 975 HD2 PRO 42 HD2 PRO 42 -1.855 -1.899 -2.298 976 HD3 PRO 42 HD1 PRO 42 -1.115 -3.471 -1.886 977 H VAL 43 HN VAL 43 -4.570 -2.424 2.490 978 HA VAL 43 HA VAL 43 -6.534 -0.619 1.530 979 HB VAL 43 HB VAL 43 -6.661 -1.714 3.735 980 HG11 VAL 43 HG11 VAL 43 -4.273 -1.561 4.327 981 HG12 VAL 43 HG12 VAL 43 -5.283 -0.868 5.595 982 HG13 VAL 43 HG13 VAL 43 -4.417 0.188 4.482 983 HG21 VAL 43 HG21 VAL 43 -7.518 0.185 4.975 984 HG22 VAL 43 HG22 VAL 43 -7.887 0.428 3.267 985 HG23 VAL 43 HG23 VAL 43 -6.548 1.301 4.012 986 H VAL 44 HN VAL 44 -3.173 -0.165 2.130 987 HA VAL 44 HA VAL 44 -3.073 2.624 2.680 988 HB VAL 44 HB VAL 44 -1.140 0.865 1.150 989 HG11 VAL 44 HG11 VAL 44 -0.908 3.669 2.241 990 HG12 VAL 44 HG12 VAL 44 -0.554 3.097 0.610 991 HG13 VAL 44 HG13 VAL 44 0.510 2.661 1.948 992 HG21 VAL 44 HG21 VAL 44 -1.372 -0.007 3.347 993 HG22 VAL 44 HG22 VAL 44 -1.457 1.603 4.062 994 HG23 VAL 44 HG23 VAL 44 0.070 1.007 3.412 995 H VAL 45 HN VAL 45 -3.095 0.863 -0.416 996 HA VAL 45 HA VAL 45 -2.833 3.136 -2.117 997 HB VAL 45 HB VAL 45 -4.175 0.458 -2.565 998 HG11 VAL 45 HG11 VAL 45 -5.119 1.921 -4.195 999 HG12 VAL 45 HG12 VAL 45 -3.801 1.091 -5.021 1000 HG13 VAL 45 HG13 VAL 45 -3.583 2.747 -4.454 1001 HG21 VAL 45 HG21 VAL 45 -1.485 1.547 -3.454 1002 HG22 VAL 45 HG22 VAL 45 -2.102 -0.078 -3.747 1003 HG23 VAL 45 HG23 VAL 45 -1.725 0.438 -2.103 1004 H LYS 46 HN LYS 46 -5.697 1.541 -0.738 1005 HA LYS 46 HA LYS 46 -7.683 3.021 -2.118 1006 HB2 LYS 46 HB2 LYS 46 -7.671 1.859 0.680 1007 HB3 LYS 46 HB1 LYS 46 -9.112 2.497 -0.111 1008 HG2 LYS 46 HG2 LYS 46 -8.822 0.869 -1.950 1009 HG3 LYS 46 HG1 LYS 46 -7.387 0.229 -1.149 1010 HD2 LYS 46 HD2 LYS 46 -8.745 -0.414 0.804 1011 HD3 LYS 46 HD1 LYS 46 -10.186 0.243 0.024 1012 HE2 LYS 46 HE2 LYS 46 -9.924 -1.362 -1.827 1013 HE3 LYS 46 HE1 LYS 46 -8.479 -2.019 -1.057 1014 HZ1 LYS 46 HZ1 LYS 46 -9.723 -3.266 0.263 1015 HZ2 LYS 46 HZ2 LYS 46 -11.089 -2.792 -0.629 1016 HZ3 LYS 46 HZ3 LYS 46 -10.645 -1.935 0.769 1017 H TYR 47 HN TYR 47 -5.928 3.767 0.890 1018 HA TYR 47 HA TYR 47 -7.369 6.141 1.539 1019 HB2 TYR 47 HB2 TYR 47 -5.380 4.706 2.736 1020 HB3 TYR 47 HB1 TYR 47 -4.437 6.066 2.145 1021 HD1 TYR 47 HD1 TYR 47 -6.631 8.195 2.343 1022 HD2 TYR 47 HD2 TYR 47 -5.320 5.153 5.072 1023 HE1 TYR 47 HE1 TYR 47 -7.447 9.551 4.242 1024 HE2 TYR 47 HE2 TYR 47 -6.129 6.518 6.977 1025 HH TYR 47 HH TYR 47 -6.637 9.534 6.995 1026 H ILE 48 HN ILE 48 -4.400 5.647 -0.370 1027 HA ILE 48 HA ILE 48 -3.890 8.377 -0.956 1028 HB ILE 48 HB ILE 48 -3.290 5.860 -2.534 1029 HG12 ILE 48 HG12 ILE 48 -1.467 7.592 -0.837 1030 HG13 ILE 48 HG11 ILE 48 -2.281 6.153 -0.223 1031 HG21 ILE 48 HG21 ILE 48 -2.439 8.732 -2.942 1032 HG22 ILE 48 HG22 ILE 48 -3.169 7.636 -4.115 1033 HG23 ILE 48 HG23 ILE 48 -1.509 7.379 -3.583 1034 HD11 ILE 48 HD11 ILE 48 -0.453 6.160 -2.643 1035 HD12 ILE 48 HD12 ILE 48 -1.158 4.748 -1.855 1036 HD13 ILE 48 HD13 ILE 48 0.061 5.709 -1.017 1037 H ALA 49 HN ALA 49 -5.849 5.961 -2.697 1038 HA ALA 49 HA ALA 49 -6.540 7.645 -4.898 1039 HB1 ALA 49 HB1 ALA 49 -6.931 5.287 -5.076 1040 HB2 ALA 49 HB2 ALA 49 -8.515 6.061 -5.096 1041 HB3 ALA 49 HB3 ALA 49 -7.934 5.283 -3.624 1042 H PHE 50 HN PHE 50 -8.033 7.175 -1.709 1043 HA PHE 50 HA PHE 50 -10.404 8.699 -2.182 1044 HB2 PHE 50 HB2 PHE 50 -8.841 7.831 0.226 1045 HB3 PHE 50 HB1 PHE 50 -10.044 9.098 0.458 1046 HD1 PHE 50 HD1 PHE 50 -10.135 6.207 -1.910 1047 HD2 PHE 50 HD2 PHE 50 -11.775 8.026 1.620 1048 HE1 PHE 50 HE1 PHE 50 -11.934 4.501 -1.873 1049 HE2 PHE 50 HE2 PHE 50 -13.582 6.317 1.656 1050 HZ PHE 50 HZ PHE 50 -13.660 4.558 -0.092 1051 H LEU 51 HN LEU 51 -7.234 9.645 -0.879 1052 HA LEU 51 HA LEU 51 -7.875 12.387 -0.429 1053 HB2 LEU 51 HB2 LEU 51 -5.214 11.086 -1.081 1054 HB3 LEU 51 HB1 LEU 51 -5.408 12.714 -0.445 1055 HG LEU 51 HG LEU 51 -6.311 10.171 0.933 1056 HD11 LEU 51 HD11 LEU 51 -4.478 10.537 2.464 1057 HD12 LEU 51 HD12 LEU 51 -4.063 12.060 1.676 1058 HD13 LEU 51 HD13 LEU 51 -3.830 10.534 0.824 1059 HD21 LEU 51 HD21 LEU 51 -6.652 13.091 1.557 1060 HD22 LEU 51 HD22 LEU 51 -6.416 11.968 2.895 1061 HD23 LEU 51 HD23 LEU 51 -7.778 11.753 1.799 1062 H ARG 52 HN ARG 52 -6.631 10.670 -3.251 1063 HA ARG 52 HA ARG 52 -6.015 12.945 -4.836 1064 HB2 ARG 52 HB2 ARG 52 -5.515 10.430 -5.221 1065 HB3 ARG 52 HB1 ARG 52 -7.111 10.354 -5.949 1066 HG2 ARG 52 HG2 ARG 52 -5.177 12.474 -6.883 1067 HG3 ARG 52 HG1 ARG 52 -4.979 10.825 -7.443 1068 HD2 ARG 52 HD2 ARG 52 -7.347 10.845 -8.231 1069 HD3 ARG 52 HD1 ARG 52 -7.464 12.537 -7.768 1070 HE ARG 52 HE ARG 52 -5.845 11.447 -10.006 1071 HH11 ARG 52 HH21 ARG 52 -6.840 14.142 -8.064 1072 HH12 ARG 52 HH22 ARG 52 -6.318 15.318 -9.218 1073 HH21 ARG 52 HH11 ARG 52 -5.165 12.973 -11.491 1074 HH22 ARG 52 HH12 ARG 52 -5.369 14.661 -11.153 1075 H SER 53 HN SER 53 -9.039 11.060 -4.569 1076 HA SER 53 HA SER 53 -10.484 12.559 -6.528 1077 HB2 SER 53 HB2 SER 53 -11.842 11.305 -4.155 1078 HB3 SER 53 HB1 SER 53 -12.366 11.359 -5.837 1079 HG SER 53 HG SER 53 -10.161 10.111 -6.003 1080 H LYS 54 HN LYS 54 -9.471 13.367 -3.362 1081 HA LYS 54 HA LYS 54 -11.600 15.367 -2.950 1082 HB2 LYS 54 HB2 LYS 54 -9.166 14.556 -1.343 1083 HB3 LYS 54 HB1 LYS 54 -10.248 15.863 -0.860 1084 HG2 LYS 54 HG2 LYS 54 -12.144 14.297 -0.843 1085 HG3 LYS 54 HG1 LYS 54 -11.086 12.991 -1.374 1086 HD2 LYS 54 HD2 LYS 54 -9.743 13.244 0.685 1087 HD3 LYS 54 HD1 LYS 54 -10.817 14.538 1.220 1088 HE2 LYS 54 HE2 LYS 54 -12.718 12.986 1.227 1089 HE3 LYS 54 HE1 LYS 54 -11.678 11.688 0.642 1090 HZ1 LYS 54 HZ1 LYS 54 -10.312 12.004 2.657 1091 HZ2 LYS 54 HZ2 LYS 54 -11.898 11.499 2.998 1092 HZ3 LYS 54 HZ3 LYS 54 -11.450 13.121 3.229 1093 H GLY 55 HN GLY 55 -9.104 15.293 -4.985 1094 HA2 GLY 55 HA2 GLY 55 -8.201 17.099 -6.230 1095 HA3 GLY 55 HA1 GLY 55 -8.859 18.216 -5.038 1096 H VAL 56 HN VAL 56 -7.087 15.638 -3.641 1097 HA VAL 56 HA VAL 56 -5.059 17.496 -2.704 1098 HB VAL 56 HB VAL 56 -5.118 14.479 -2.407 1099 HG11 VAL 56 HG11 VAL 56 -3.877 16.568 -0.590 1100 HG12 VAL 56 HG12 VAL 56 -2.962 15.779 -1.871 1101 HG13 VAL 56 HG13 VAL 56 -3.631 14.824 -0.550 1102 HG21 VAL 56 HG21 VAL 56 -6.344 14.843 -0.368 1103 HG22 VAL 56 HG22 VAL 56 -7.193 15.727 -1.627 1104 HG23 VAL 56 HG23 VAL 56 -6.154 16.586 -0.502 1105 H ASP 57 HN ASP 57 -2.992 17.758 -3.435 1106 HA ASP 57 HA ASP 57 -2.340 16.639 -6.056 1107 HB2 ASP 57 HB2 ASP 57 -0.307 18.086 -5.835 1108 HB3 ASP 57 HB1 ASP 57 -1.825 18.962 -5.642 1109 H LEU 58 HN LEU 58 -2.148 14.355 -5.333 1110 HA LEU 58 HA LEU 58 -0.071 13.531 -3.503 1111 HB2 LEU 58 HB2 LEU 58 -1.755 12.180 -5.593 1112 HB3 LEU 58 HB1 LEU 58 -0.392 11.307 -4.904 1113 HG LEU 58 HG LEU 58 -2.601 10.925 -3.736 1114 HD11 LEU 58 HD11 LEU 58 -1.584 10.664 -1.678 1115 HD12 LEU 58 HD12 LEU 58 -0.824 12.251 -1.716 1116 HD13 LEU 58 HD13 LEU 58 -0.143 10.926 -2.653 1117 HD21 LEU 58 HD21 LEU 58 -2.216 13.702 -2.623 1118 HD22 LEU 58 HD22 LEU 58 -3.627 12.657 -2.485 1119 HD23 LEU 58 HD23 LEU 58 -3.234 13.406 -4.030 1120 H ASN 59 HN ASN 59 -0.244 13.924 -7.024 1121 HA ASN 59 HA ASN 59 2.185 12.804 -7.802 1122 HB2 ASN 59 HB2 ASN 59 1.520 15.480 -8.977 1123 HB3 ASN 59 HB1 ASN 59 1.917 13.966 -9.785 1124 HD21 ASN 59 HD21 ASN 59 -0.009 12.203 -8.802 1125 HD22 ASN 59 HD22 ASN 59 -1.564 12.763 -9.193 1126 H ALA 60 HN ALA 60 1.639 16.096 -6.562 1127 HA ALA 60 HA ALA 60 4.362 16.944 -6.705 1128 HB1 ALA 60 HB1 ALA 60 2.394 17.913 -4.635 1129 HB2 ALA 60 HB2 ALA 60 2.220 18.339 -6.338 1130 HB3 ALA 60 HB3 ALA 60 3.666 18.821 -5.451 1131 H LEU 61 HN LEU 61 2.520 15.283 -4.184 1132 HA LEU 61 HA LEU 61 4.426 15.510 -2.090 1133 HB2 LEU 61 HB2 LEU 61 2.109 14.681 -1.804 1134 HB3 LEU 61 HB1 LEU 61 2.532 13.219 -2.684 1135 HG LEU 61 HG LEU 61 4.352 13.849 -0.407 1136 HD11 LEU 61 HD11 LEU 61 2.761 13.003 1.294 1137 HD12 LEU 61 HD12 LEU 61 1.473 13.031 0.088 1138 HD13 LEU 61 HD13 LEU 61 2.232 14.538 0.604 1139 HD21 LEU 61 HD21 LEU 61 2.831 11.350 -1.239 1140 HD22 LEU 61 HD22 LEU 61 4.082 11.422 0.001 1141 HD23 LEU 61 HD23 LEU 61 4.494 11.732 -1.682 1142 H PHE 62 HN PHE 62 4.063 13.067 -4.645 1143 HA PHE 62 HA PHE 62 6.283 11.462 -3.761 1144 HB2 PHE 62 HB2 PHE 62 4.669 11.690 -6.291 1145 HB3 PHE 62 HB1 PHE 62 6.133 10.708 -6.280 1146 HD1 PHE 62 HD1 PHE 62 2.987 11.273 -4.282 1147 HD2 PHE 62 HD2 PHE 62 6.012 8.486 -5.547 1148 HE1 PHE 62 HE1 PHE 62 1.776 9.432 -3.148 1149 HE2 PHE 62 HE2 PHE 62 4.792 6.650 -4.413 1150 HZ PHE 62 HZ PHE 62 2.678 7.124 -3.210 1151 H ASP 63 HN ASP 63 5.984 14.229 -5.944 1152 HA ASP 63 HA ASP 63 8.563 14.122 -7.119 1153 HB2 ASP 63 HB2 ASP 63 6.651 15.706 -7.707 1154 HB3 ASP 63 HB1 ASP 63 7.140 16.667 -6.312 1155 H ARG 64 HN ARG 64 7.513 15.233 -3.932 1156 HA ARG 64 HA ARG 64 9.848 16.690 -3.207 1157 HB2 ARG 64 HB2 ARG 64 8.099 14.963 -1.422 1158 HB3 ARG 64 HB1 ARG 64 9.206 16.224 -0.880 1159 HG2 ARG 64 HG2 ARG 64 7.911 17.872 -2.252 1160 HG3 ARG 64 HG1 ARG 64 6.773 16.596 -2.632 1161 HD2 ARG 64 HD2 ARG 64 6.143 18.131 -0.672 1162 HD3 ARG 64 HD1 ARG 64 6.031 16.395 -0.397 1163 HE ARG 64 HE ARG 64 7.626 16.690 1.287 1164 HH11 ARG 64 HH21 ARG 64 7.970 19.140 -1.129 1165 HH12 ARG 64 HH22 ARG 64 9.302 19.904 -0.340 1166 HH21 ARG 64 HH11 ARG 64 9.334 17.710 2.333 1167 HH22 ARG 64 HH12 ARG 64 10.062 19.111 1.622 1168 H ILE 65 HN ILE 65 9.147 13.234 -3.250 1169 HA ILE 65 HA ILE 65 11.800 12.596 -2.085 1170 HB ILE 65 HB ILE 65 9.464 10.855 -2.924 1171 HG12 ILE 65 HG12 ILE 65 10.569 11.432 -0.162 1172 HG13 ILE 65 HG11 ILE 65 9.230 12.333 -0.871 1173 HG21 ILE 65 HG21 ILE 65 10.803 9.112 -1.591 1174 HG22 ILE 65 HG22 ILE 65 12.181 10.196 -1.773 1175 HG23 ILE 65 HG23 ILE 65 11.403 9.510 -3.200 1176 HD11 ILE 65 HD11 ILE 65 8.436 10.468 0.561 1177 HD12 ILE 65 HD12 ILE 65 9.283 9.327 -0.482 1178 HD13 ILE 65 HD13 ILE 65 7.937 10.273 -1.120 1179 H ILE 66 HN ILE 66 9.955 11.312 -4.888 1180 HA ILE 66 HA ILE 66 12.471 10.677 -6.241 1181 HB ILE 66 HB ILE 66 10.945 9.876 -8.078 1182 HG12 ILE 66 HG12 ILE 66 8.753 10.389 -6.053 1183 HG13 ILE 66 HG11 ILE 66 9.065 11.473 -7.405 1184 HG21 ILE 66 HG21 ILE 66 10.119 7.951 -6.753 1185 HG22 ILE 66 HG22 ILE 66 10.445 8.848 -5.270 1186 HG23 ILE 66 HG23 ILE 66 11.777 8.374 -6.325 1187 HD11 ILE 66 HD11 ILE 66 8.829 9.445 -8.927 1188 HD12 ILE 66 HD12 ILE 66 7.350 9.980 -8.136 1189 HD13 ILE 66 HD13 ILE 66 8.220 8.574 -7.521 1190 H VAL 67 HN VAL 67 13.393 11.759 -7.920 1191 HA VAL 67 HA VAL 67 12.152 14.354 -8.722 1192 HB VAL 67 HB VAL 67 14.355 14.578 -7.748 1193 HG11 VAL 67 HG11 VAL 67 14.971 12.115 -8.623 1194 HG12 VAL 67 HG12 VAL 67 16.217 13.308 -8.297 1195 HG13 VAL 67 HG13 VAL 67 15.683 13.028 -9.948 1196 HG21 VAL 67 HG21 VAL 67 14.687 14.863 -10.741 1197 HG22 VAL 67 HG22 VAL 67 15.371 15.877 -9.470 1198 HG23 VAL 67 HG23 VAL 67 13.641 15.927 -9.800 1199 H ASN 68 HN ASN 68 10.752 13.451 -10.299 1200 HA ASN 68 HA ASN 68 12.059 12.171 -12.664 1201 HB2 ASN 68 HB2 ASN 68 9.158 12.283 -11.771 1202 HB3 ASN 68 HB1 ASN 68 9.697 11.574 -13.293 1203 HD21 ASN 68 HD21 ASN 68 11.914 11.214 -10.635 1204 HD22 ASN 68 HD22 ASN 68 11.566 9.589 -10.290 1205 H LYS 69 HN LYS 69 11.637 15.132 -11.668 1206 HA LYS 69 HA LYS 69 11.111 17.208 -12.616 1207 HB2 LYS 69 HB2 LYS 69 12.055 15.770 -15.113 1208 HB3 LYS 69 HB1 LYS 69 12.020 17.513 -14.867 1209 HG2 LYS 69 HG2 LYS 69 13.557 15.699 -13.005 1210 HG3 LYS 69 HG1 LYS 69 14.278 16.305 -14.493 1211 HD2 LYS 69 HD2 LYS 69 13.771 18.639 -13.738 1212 HD3 LYS 69 HD1 LYS 69 13.184 17.986 -12.211 1213 HE2 LYS 69 HE2 LYS 69 15.461 18.631 -11.840 1214 HE3 LYS 69 HE1 LYS 69 15.440 16.871 -11.928 1215 HZ1 LYS 69 HZ1 LYS 69 16.340 18.806 -13.970 1216 HZ2 LYS 69 HZ2 LYS 69 15.922 17.213 -14.389 1217 HZ3 LYS 69 HZ3 LYS 69 17.192 17.503 -13.298 1218 H LEU 70 HN LEU 70 8.852 15.467 -12.419 1219 HA LEU 70 HA LEU 70 7.323 15.386 -14.831 1220 HB2 LEU 70 HB2 LEU 70 6.732 14.056 -12.853 1221 HB3 LEU 70 HB1 LEU 70 6.422 15.530 -11.940 1222 HG LEU 70 HG LEU 70 4.578 16.115 -13.437 1223 HD11 LEU 70 HD11 LEU 70 5.127 15.315 -15.571 1224 HD12 LEU 70 HD12 LEU 70 3.875 14.183 -15.071 1225 HD13 LEU 70 HD13 LEU 70 5.574 13.719 -14.968 1226 HD21 LEU 70 HD21 LEU 70 4.425 13.231 -12.503 1227 HD22 LEU 70 HD22 LEU 70 3.045 14.269 -12.859 1228 HD23 LEU 70 HD23 LEU 70 4.109 14.652 -11.506 1229 H GLU 71 HN GLU 71 7.546 17.812 -12.231 1230 HA GLU 71 HA GLU 71 5.662 19.575 -13.676 1231 HB2 GLU 71 HB2 GLU 71 7.154 20.002 -11.066 1232 HB3 GLU 71 HB1 GLU 71 5.857 21.019 -11.699 1233 HG2 GLU 71 HG2 GLU 71 5.580 18.072 -11.034 1234 HG3 GLU 71 HG1 GLU 71 5.026 19.393 -10.005 1235 H HIS 72 HN HIS 72 6.905 20.119 -15.532 1236 HA HIS 72 HA HIS 72 9.549 21.365 -15.184 1237 HB2 HIS 72 HB2 HIS 72 9.208 20.005 -17.164 1238 HB3 HIS 72 HB1 HIS 72 7.771 20.928 -17.602 1239 HD2 HIS 72 HD2 HIS 72 8.464 23.815 -18.109 1240 HE1 HIS 72 HE1 HIS 72 12.355 22.799 -19.395 1241 HE2 HIS 72 HE2 HIS 72 10.612 24.641 -19.337 1242 H HIS 73 HN HIS 73 6.343 22.367 -16.411 1243 HA HIS 73 HA HIS 73 7.128 25.195 -16.363 1244 HB2 HIS 73 HB2 HIS 73 4.542 23.777 -17.030 1245 HB3 HIS 73 HB1 HIS 73 4.721 25.530 -17.064 1246 HD2 HIS 73 HD2 HIS 73 6.780 26.418 -18.990 1247 HE1 HIS 73 HE1 HIS 73 6.462 22.887 -21.284 1248 HE2 HIS 73 HE2 HIS 73 7.363 25.260 -21.253 1249 H HIS 74 HN HIS 74 4.986 26.554 -15.472 1250 HA HIS 74 HA HIS 74 4.158 25.511 -12.847 1251 HB2 HIS 74 HB2 HIS 74 6.477 26.775 -12.731 1252 HB3 HIS 74 HB1 HIS 74 5.483 28.224 -12.868 1253 HD2 HIS 74 HD2 HIS 74 6.940 27.546 -9.951 1254 HE1 HIS 74 HE1 HIS 74 3.052 26.454 -8.712 1255 HE2 HIS 74 HE2 HIS 74 5.379 27.080 -7.914 1256 H HIS 75 HN HIS 75 2.184 26.378 -12.230 1257 HA HIS 75 HA HIS 75 1.012 28.437 -14.067 1258 HB2 HIS 75 HB2 HIS 75 -0.004 26.078 -13.879 1259 HB3 HIS 75 HB1 HIS 75 -0.537 26.565 -12.270 1260 HD2 HIS 75 HD2 HIS 75 -2.774 26.163 -14.748 1261 HE1 HIS 75 HE1 HIS 75 -3.033 30.376 -14.584 1262 HE2 HIS 75 HE2 HIS 75 -4.177 28.265 -15.403 1263 H HIS 76 HN HIS 76 1.101 30.414 -13.114 1264 HA HIS 76 HA HIS 76 -0.193 30.798 -10.526 1265 HB2 HIS 76 HB2 HIS 76 2.790 31.075 -10.870 1266 HB3 HIS 76 HB1 HIS 76 1.950 32.178 -9.779 1267 HD2 HIS 76 HD2 HIS 76 3.890 29.324 -8.973 1268 HE1 HIS 76 HE1 HIS 76 0.283 28.364 -6.996 1269 HE2 HIS 76 HE2 HIS 76 2.754 27.818 -7.168 1270 H HIS 77 HN HIS 77 -1.441 32.538 -10.855 1271 HA HIS 77 HA HIS 77 -0.837 34.394 -13.044 1272 HB2 HIS 77 HB2 HIS 77 -3.009 35.485 -12.153 1273 HB3 HIS 77 HB1 HIS 77 -3.133 33.879 -12.868 1274 HD2 HIS 77 HD2 HIS 77 -5.371 33.320 -11.130 1275 HE1 HIS 77 HE1 HIS 77 -3.074 33.188 -7.590 1276 HE2 HIS 77 HE2 HIS 77 -5.344 32.685 -8.601 Start of MODEL 8 1 H1 MET 1 HT1 MET 1 10.246 15.278 10.127 2 H2 MET 1 HT2 MET 1 10.968 16.079 8.813 3 H3 MET 1 HT3 MET 1 11.163 14.401 9.003 4 HA MET 1 HA MET 1 8.453 15.489 8.753 5 HB2 MET 1 HB2 MET 1 9.885 16.499 6.931 6 HB3 MET 1 HB1 MET 1 10.241 14.860 6.386 7 HG2 MET 1 HG2 MET 1 8.394 15.690 5.067 8 HG3 MET 1 HG1 MET 1 7.760 14.475 6.175 9 HE1 MET 1 HE1 MET 1 6.811 17.672 4.630 10 HE2 MET 1 HE2 MET 1 8.334 18.136 5.383 11 HE3 MET 1 HE3 MET 1 6.834 18.896 5.906 12 H GLU 2 HN GLU 2 7.933 13.581 9.962 13 HA GLU 2 HA GLU 2 8.797 10.961 9.015 14 HB2 GLU 2 HB2 GLU 2 6.562 11.600 10.959 15 HB3 GLU 2 HB1 GLU 2 7.450 10.082 10.811 16 HG2 GLU 2 HG2 GLU 2 8.677 12.743 11.598 17 HG3 GLU 2 HG1 GLU 2 8.270 11.444 12.718 18 H LEU 3 HN LEU 3 7.296 9.316 8.208 19 HA LEU 3 HA LEU 3 5.635 10.250 6.084 20 HB2 LEU 3 HB2 LEU 3 6.694 7.993 6.178 21 HB3 LEU 3 HB1 LEU 3 5.576 7.552 7.467 22 HG LEU 3 HG LEU 3 3.665 7.996 5.925 23 HD11 LEU 3 HD11 LEU 3 4.381 9.515 4.302 24 HD12 LEU 3 HD12 LEU 3 4.457 8.005 3.402 25 HD13 LEU 3 HD13 LEU 3 5.930 8.704 4.073 26 HD21 LEU 3 HD21 LEU 3 5.743 6.028 4.909 27 HD22 LEU 3 HD22 LEU 3 4.026 5.988 4.510 28 HD23 LEU 3 HD23 LEU 3 4.550 5.716 6.171 29 H SER 4 HN SER 4 4.809 8.998 9.320 30 HA SER 4 HA SER 4 1.978 9.114 9.009 31 HB2 SER 4 HB2 SER 4 1.935 9.100 11.486 32 HB3 SER 4 HB1 SER 4 3.069 7.911 10.849 33 HG SER 4 HG SER 4 3.627 10.491 11.889 34 H ASN 5 HN ASN 5 4.346 11.544 9.967 35 HA ASN 5 HA ASN 5 2.489 13.543 10.837 36 HB2 ASN 5 HB2 ASN 5 4.851 13.720 11.370 37 HB3 ASN 5 HB1 ASN 5 5.271 13.769 9.658 38 HD21 ASN 5 HD21 ASN 5 4.028 15.677 12.343 39 HD22 ASN 5 HD22 ASN 5 3.983 17.157 11.512 40 H GLU 6 HN GLU 6 3.885 12.796 7.658 41 HA GLU 6 HA GLU 6 2.902 15.048 6.236 42 HB2 GLU 6 HB2 GLU 6 3.411 12.192 5.380 43 HB3 GLU 6 HB1 GLU 6 3.002 13.471 4.244 44 HG2 GLU 6 HG2 GLU 6 5.293 13.846 6.174 45 HG3 GLU 6 HG1 GLU 6 5.529 12.913 4.699 46 H LEU 7 HN LEU 7 1.437 11.795 6.569 47 HA LEU 7 HA LEU 7 -0.978 12.429 5.182 48 HB2 LEU 7 HB2 LEU 7 -0.173 10.322 7.177 49 HB3 LEU 7 HB1 LEU 7 -1.867 10.465 6.711 50 HG LEU 7 HG LEU 7 -1.237 10.214 4.336 51 HD11 LEU 7 HD11 LEU 7 1.551 9.962 5.494 52 HD12 LEU 7 HD12 LEU 7 0.981 11.165 4.338 53 HD13 LEU 7 HD13 LEU 7 1.129 9.477 3.851 54 HD21 LEU 7 HD21 LEU 7 -0.047 8.054 6.108 55 HD22 LEU 7 HD22 LEU 7 -0.596 7.844 4.445 56 HD23 LEU 7 HD23 LEU 7 -1.759 8.212 5.718 57 H LYS 8 HN LYS 8 -0.095 12.706 8.608 58 HA LYS 8 HA LYS 8 -2.667 13.371 9.617 59 HB2 LYS 8 HB2 LYS 8 -0.644 12.870 11.006 60 HB3 LYS 8 HB1 LYS 8 0.009 14.445 10.553 61 HG2 LYS 8 HG2 LYS 8 -1.895 15.577 11.575 62 HG3 LYS 8 HG1 LYS 8 -2.650 14.027 11.948 63 HD2 LYS 8 HD2 LYS 8 -0.722 13.445 13.391 64 HD3 LYS 8 HD1 LYS 8 0.002 15.016 13.042 65 HE2 LYS 8 HE2 LYS 8 -2.707 14.602 14.342 66 HE3 LYS 8 HE1 LYS 8 -1.227 15.026 15.202 67 HZ1 LYS 8 HZ1 LYS 8 -2.877 16.652 13.419 68 HZ2 LYS 8 HZ2 LYS 8 -1.199 16.918 13.391 69 HZ3 LYS 8 HZ3 LYS 8 -2.065 17.089 14.843 70 H VAL 9 HN VAL 9 -0.137 15.406 8.169 71 HA VAL 9 HA VAL 9 -1.404 17.927 8.630 72 HB VAL 9 HB VAL 9 0.500 16.987 6.472 73 HG11 VAL 9 HG11 VAL 9 -0.570 18.885 5.518 74 HG12 VAL 9 HG12 VAL 9 0.916 19.514 6.231 75 HG13 VAL 9 HG13 VAL 9 -0.622 19.732 7.065 76 HG21 VAL 9 HG21 VAL 9 1.049 18.833 8.803 77 HG22 VAL 9 HG22 VAL 9 2.207 17.947 7.812 78 HG23 VAL 9 HG23 VAL 9 1.185 17.081 8.957 79 H GLU 10 HN GLU 10 -1.548 15.701 5.835 80 HA GLU 10 HA GLU 10 -3.238 17.312 4.211 81 HB2 GLU 10 HB2 GLU 10 -2.723 14.348 4.404 82 HB3 GLU 10 HB1 GLU 10 -3.910 14.973 3.263 83 HG2 GLU 10 HG2 GLU 10 -1.880 14.818 2.044 84 HG3 GLU 10 HG1 GLU 10 -2.048 16.529 2.417 85 H ARG 11 HN ARG 11 -4.061 14.884 6.689 86 HA ARG 11 HA ARG 11 -6.865 14.860 6.224 87 HB2 ARG 11 HB2 ARG 11 -5.266 14.510 8.773 88 HB3 ARG 11 HB1 ARG 11 -7.007 14.243 8.683 89 HG2 ARG 11 HG2 ARG 11 -6.515 12.617 6.764 90 HG3 ARG 11 HG1 ARG 11 -4.818 12.740 7.230 91 HD2 ARG 11 HD2 ARG 11 -5.640 10.845 8.413 92 HD3 ARG 11 HD1 ARG 11 -5.595 12.147 9.603 93 HE ARG 11 HE ARG 11 -8.146 11.700 8.149 94 HH11 ARG 11 HH21 ARG 11 -6.257 11.423 11.042 95 HH12 ARG 11 HH22 ARG 11 -7.634 11.184 12.059 96 HH21 ARG 11 HH11 ARG 11 -9.929 11.376 9.475 97 HH22 ARG 11 HH12 ARG 11 -9.705 11.153 11.179 98 H ILE 12 HN ILE 12 -4.851 16.971 8.247 99 HA ILE 12 HA ILE 12 -7.008 18.565 9.280 100 HB ILE 12 HB ILE 12 -4.063 19.166 8.872 101 HG12 ILE 12 HG12 ILE 12 -5.591 18.563 11.417 102 HG13 ILE 12 HG11 ILE 12 -4.789 17.313 10.467 103 HG21 ILE 12 HG21 ILE 12 -5.148 21.289 8.991 104 HG22 ILE 12 HG22 ILE 12 -4.559 20.966 10.622 105 HG23 ILE 12 HG23 ILE 12 -6.265 20.729 10.237 106 HD11 ILE 12 HD11 ILE 12 -3.333 19.781 11.429 107 HD12 ILE 12 HD12 ILE 12 -2.638 18.278 10.819 108 HD13 ILE 12 HD13 ILE 12 -3.429 18.309 12.396 109 H ARG 13 HN ARG 13 -4.856 18.917 6.461 110 HA ARG 13 HA ARG 13 -5.811 21.450 5.571 111 HB2 ARG 13 HB2 ARG 13 -3.778 20.279 4.685 112 HB3 ARG 13 HB1 ARG 13 -4.839 19.140 3.858 113 HG2 ARG 13 HG2 ARG 13 -5.903 21.117 2.681 114 HG3 ARG 13 HG1 ARG 13 -4.641 22.127 3.382 115 HD2 ARG 13 HD2 ARG 13 -4.059 19.676 1.705 116 HD3 ARG 13 HD1 ARG 13 -4.165 21.301 1.033 117 HE ARG 13 HE ARG 13 -2.330 21.339 3.212 118 HH11 ARG 13 HH21 ARG 13 -2.758 20.087 0.022 119 HH12 ARG 13 HH22 ARG 13 -1.064 20.071 -0.340 120 HH21 ARG 13 HH11 ARG 13 -0.120 21.326 2.750 121 HH22 ARG 13 HH12 ARG 13 0.427 20.773 1.203 122 H LEU 14 HN LEU 14 -6.886 18.145 4.763 123 HA LEU 14 HA LEU 14 -9.168 19.246 3.219 124 HB2 LEU 14 HB2 LEU 14 -8.307 16.382 3.751 125 HB3 LEU 14 HB1 LEU 14 -9.588 16.878 2.645 126 HG LEU 14 HG LEU 14 -6.671 17.689 2.415 127 HD11 LEU 14 HD11 LEU 14 -6.832 16.218 0.326 128 HD12 LEU 14 HD12 LEU 14 -8.332 15.587 1.007 129 HD13 LEU 14 HD13 LEU 14 -6.810 15.370 1.871 130 HD21 LEU 14 HD21 LEU 14 -9.164 18.357 0.855 131 HD22 LEU 14 HD22 LEU 14 -7.615 18.281 0.015 132 HD23 LEU 14 HD23 LEU 14 -7.839 19.413 1.342 133 H SER 15 HN SER 15 -8.463 18.627 6.380 134 HA SER 15 HA SER 15 -9.720 17.960 8.268 135 HB2 SER 15 HB2 SER 15 -10.408 20.356 7.496 136 HB3 SER 15 HB1 SER 15 -11.920 19.592 7.016 137 HG SER 15 HG SER 15 -10.931 18.929 9.523 138 H LEU 16 HN LEU 16 -9.843 15.739 7.049 139 HA LEU 16 HA LEU 16 -12.695 15.046 6.433 140 HB2 LEU 16 HB2 LEU 16 -10.143 13.524 5.825 141 HB3 LEU 16 HB1 LEU 16 -11.770 13.069 5.315 142 HG LEU 16 HG LEU 16 -10.373 15.651 4.564 143 HD11 LEU 16 HD11 LEU 16 -9.331 13.697 3.494 144 HD12 LEU 16 HD12 LEU 16 -10.227 14.643 2.307 145 HD13 LEU 16 HD13 LEU 16 -10.911 13.145 2.939 146 HD21 LEU 16 HD21 LEU 16 -12.341 15.550 2.805 147 HD22 LEU 16 HD22 LEU 16 -12.659 16.155 4.425 148 HD23 LEU 16 HD23 LEU 16 -13.103 14.501 4.000 149 H THR 17 HN THR 17 -13.775 13.665 7.740 150 HA THR 17 HA THR 17 -12.513 12.902 10.270 151 HB THR 17 HB THR 17 -14.841 11.896 10.674 152 HG1 THR 17 HG1 THR 17 -15.069 12.985 8.100 153 HG21 THR 17 HG21 THR 17 -14.651 14.831 9.942 154 HG22 THR 17 HG22 THR 17 -14.122 14.133 11.473 155 HG23 THR 17 HG23 THR 17 -15.831 14.107 11.036 156 H ALA 18 HN ALA 18 -12.549 10.699 11.080 157 HA ALA 18 HA ALA 18 -11.535 8.783 9.177 158 HB1 ALA 18 HB1 ALA 18 -10.711 8.680 11.421 159 HB2 ALA 18 HB2 ALA 18 -11.689 7.229 11.193 160 HB3 ALA 18 HB3 ALA 18 -12.344 8.604 12.083 161 H LYS 19 HN LYS 19 -14.635 9.214 10.839 162 HA LYS 19 HA LYS 19 -15.823 6.742 10.016 163 HB2 LYS 19 HB2 LYS 19 -16.744 8.245 11.785 164 HB3 LYS 19 HB1 LYS 19 -17.204 9.392 10.526 165 HG2 LYS 19 HG2 LYS 19 -18.659 7.723 9.487 166 HG3 LYS 19 HG1 LYS 19 -18.158 6.515 10.670 167 HD2 LYS 19 HD2 LYS 19 -19.083 7.924 12.486 168 HD3 LYS 19 HD1 LYS 19 -19.615 9.104 11.287 169 HE2 LYS 19 HE2 LYS 19 -20.503 6.205 11.405 170 HE3 LYS 19 HE1 LYS 19 -21.462 7.587 11.935 171 HZ1 LYS 19 HZ1 LYS 19 -21.422 8.458 9.703 172 HZ2 LYS 19 HZ2 LYS 19 -22.023 6.870 9.679 173 HZ3 LYS 19 HZ3 LYS 19 -20.431 7.185 9.179 174 H SER 20 HN SER 20 -15.943 9.998 8.552 175 HA SER 20 HA SER 20 -17.603 9.306 6.341 176 HB2 SER 20 HB2 SER 20 -17.237 11.620 6.763 177 HB3 SER 20 HB1 SER 20 -15.487 11.422 6.752 178 HG SER 20 HG SER 20 -15.570 11.046 4.557 179 H VAL 21 HN VAL 21 -14.060 9.338 6.678 180 HA VAL 21 HA VAL 21 -13.511 8.436 4.004 181 HB VAL 21 HB VAL 21 -11.894 8.254 6.560 182 HG11 VAL 21 HG11 VAL 21 -11.217 7.590 3.689 183 HG12 VAL 21 HG12 VAL 21 -10.986 6.594 5.127 184 HG13 VAL 21 HG13 VAL 21 -9.974 8.012 4.868 185 HG21 VAL 21 HG21 VAL 21 -12.480 10.541 5.661 186 HG22 VAL 21 HG22 VAL 21 -11.614 10.117 4.184 187 HG23 VAL 21 HG23 VAL 21 -10.750 10.207 5.718 188 H ALA 22 HN ALA 22 -13.874 6.738 7.108 189 HA ALA 22 HA ALA 22 -13.217 4.128 6.192 190 HB1 ALA 22 HB1 ALA 22 -14.703 3.400 8.138 191 HB2 ALA 22 HB2 ALA 22 -15.030 5.112 8.403 192 HB3 ALA 22 HB3 ALA 22 -13.384 4.497 8.549 193 H GLU 23 HN GLU 23 -16.317 5.884 6.191 194 HA GLU 23 HA GLU 23 -17.944 3.707 5.320 195 HB2 GLU 23 HB2 GLU 23 -18.173 6.705 5.036 196 HB3 GLU 23 HB1 GLU 23 -19.393 5.625 4.359 197 HG2 GLU 23 HG2 GLU 23 -19.697 4.612 6.619 198 HG3 GLU 23 HG1 GLU 23 -18.547 5.783 7.267 199 H GLU 24 HN GLU 24 -16.329 6.273 3.422 200 HA GLU 24 HA GLU 24 -17.098 5.157 0.873 201 HB2 GLU 24 HB2 GLU 24 -16.534 7.496 1.026 202 HB3 GLU 24 HB1 GLU 24 -14.942 7.124 1.682 203 HG2 GLU 24 HG2 GLU 24 -15.702 5.991 -1.007 204 HG3 GLU 24 HG1 GLU 24 -15.234 7.687 -0.898 205 H MET 25 HN MET 25 -14.130 4.974 2.818 206 HA MET 25 HA MET 25 -12.628 3.426 0.931 207 HB2 MET 25 HB2 MET 25 -12.447 3.828 3.921 208 HB3 MET 25 HB1 MET 25 -11.316 2.787 3.054 209 HG2 MET 25 HG2 MET 25 -11.834 5.684 2.335 210 HG3 MET 25 HG1 MET 25 -10.502 5.154 3.357 211 HE1 MET 25 HE1 MET 25 -9.459 2.293 1.701 212 HE2 MET 25 HE2 MET 25 -8.954 3.497 2.882 213 HE3 MET 25 HE3 MET 25 -8.090 3.356 1.356 214 H GLY 26 HN GLY 26 -14.787 2.528 3.605 215 HA2 GLY 26 HA2 GLY 26 -16.059 0.512 3.739 216 HA3 GLY 26 HA1 GLY 26 -15.123 -0.144 2.397 217 H ILE 27 HN ILE 27 -13.630 1.340 5.220 218 HA ILE 27 HA ILE 27 -12.687 -1.370 6.112 219 HB ILE 27 HB ILE 27 -10.537 -0.318 6.705 220 HG12 ILE 27 HG12 ILE 27 -11.626 2.119 5.268 221 HG13 ILE 27 HG11 ILE 27 -11.444 2.001 7.013 222 HG21 ILE 27 HG21 ILE 27 -10.971 -1.366 4.451 223 HG22 ILE 27 HG22 ILE 27 -9.673 -0.171 4.462 224 HG23 ILE 27 HG23 ILE 27 -11.261 0.256 3.823 225 HD11 ILE 27 HD11 ILE 27 -9.217 1.795 4.973 226 HD12 ILE 27 HD12 ILE 27 -9.016 1.575 6.712 227 HD13 ILE 27 HD13 ILE 27 -9.506 3.144 6.072 228 H SER 28 HN SER 28 -11.923 -1.343 8.410 229 HA SER 28 HA SER 28 -13.967 -0.173 10.088 230 HB2 SER 28 HB2 SER 28 -12.526 -1.157 11.936 231 HB3 SER 28 HB1 SER 28 -13.078 -2.307 10.719 232 HG SER 28 HG SER 28 -10.535 -1.114 11.040 233 H ARG 29 HN ARG 29 -13.473 1.211 11.963 234 HA ARG 29 HA ARG 29 -12.053 3.600 11.251 235 HB2 ARG 29 HB2 ARG 29 -13.096 2.548 13.896 236 HB3 ARG 29 HB1 ARG 29 -12.444 4.173 13.681 237 HG2 ARG 29 HG2 ARG 29 -14.160 4.728 12.077 238 HG3 ARG 29 HG1 ARG 29 -14.737 3.060 12.041 239 HD2 ARG 29 HD2 ARG 29 -14.766 4.845 14.495 240 HD3 ARG 29 HD1 ARG 29 -16.163 4.529 13.468 241 HE ARG 29 HE ARG 29 -15.101 2.733 15.478 242 HH11 ARG 29 HH21 ARG 29 -16.654 2.935 12.395 243 HH12 ARG 29 HH22 ARG 29 -17.388 1.371 12.523 244 HH21 ARG 29 HH11 ARG 29 -16.053 0.697 15.647 245 HH22 ARG 29 HH12 ARG 29 -17.050 0.107 14.359 246 H GLN 30 HN GLN 30 -11.233 0.812 13.291 247 HA GLN 30 HA GLN 30 -8.767 1.857 14.320 248 HB2 GLN 30 HB2 GLN 30 -9.960 -0.138 15.243 249 HB3 GLN 30 HB1 GLN 30 -9.519 -1.034 13.791 250 HG2 GLN 30 HG2 GLN 30 -7.933 -1.543 15.577 251 HG3 GLN 30 HG1 GLN 30 -7.111 -0.634 14.311 252 HE21 GLN 30 HE21 GLN 30 -5.561 0.483 15.592 253 HE22 GLN 30 HE22 GLN 30 -5.982 1.566 16.831 254 H GLN 31 HN GLN 31 -9.553 -0.039 11.425 255 HA GLN 31 HA GLN 31 -6.887 -0.542 10.570 256 HB2 GLN 31 HB2 GLN 31 -8.952 -1.593 9.616 257 HB3 GLN 31 HB1 GLN 31 -9.333 -0.057 8.842 258 HG2 GLN 31 HG2 GLN 31 -8.215 -1.502 7.235 259 HG3 GLN 31 HG1 GLN 31 -7.141 -0.166 7.647 260 HE21 GLN 31 HE21 GLN 31 -5.104 -1.207 7.442 261 HE22 GLN 31 HE22 GLN 31 -4.651 -2.565 8.356 262 H LEU 32 HN LEU 32 -9.084 2.171 9.888 263 HA LEU 32 HA LEU 32 -7.309 3.554 8.127 264 HB2 LEU 32 HB2 LEU 32 -9.687 4.112 8.242 265 HB3 LEU 32 HB1 LEU 32 -9.511 4.613 9.922 266 HG LEU 32 HG LEU 32 -8.026 6.441 9.265 267 HD11 LEU 32 HD11 LEU 32 -7.912 6.848 6.675 268 HD12 LEU 32 HD12 LEU 32 -8.224 5.118 6.564 269 HD13 LEU 32 HD13 LEU 32 -6.794 5.706 7.413 270 HD21 LEU 32 HD21 LEU 32 -10.402 6.458 7.394 271 HD22 LEU 32 HD22 LEU 32 -9.647 7.833 8.199 272 HD23 LEU 32 HD23 LEU 32 -10.563 6.654 9.140 273 H CYS 33 HN CYS 33 -7.750 3.663 11.637 274 HA CYS 33 HA CYS 33 -6.065 5.883 12.186 275 HB2 CYS 33 HB2 CYS 33 -6.643 3.397 13.819 276 HB3 CYS 33 HB1 CYS 33 -5.835 4.834 14.449 277 HG CYS 33 HG CYS 33 -8.101 6.163 13.754 278 H ASN 34 HN ASN 34 -5.315 2.442 11.773 279 HA ASN 34 HA ASN 34 -2.569 2.574 12.550 280 HB2 ASN 34 HB2 ASN 34 -3.741 0.446 12.313 281 HB3 ASN 34 HB1 ASN 34 -3.957 0.732 10.586 282 HD21 ASN 34 HD21 ASN 34 -2.514 -0.584 9.473 283 HD22 ASN 34 HD22 ASN 34 -0.890 -0.830 9.900 284 H ILE 35 HN ILE 35 -4.178 3.143 9.443 285 HA ILE 35 HA ILE 35 -1.838 3.301 7.823 286 HB ILE 35 HB ILE 35 -4.515 4.700 7.580 287 HG12 ILE 35 HG12 ILE 35 -3.383 2.335 6.053 288 HG13 ILE 35 HG11 ILE 35 -4.412 2.165 7.472 289 HG21 ILE 35 HG21 ILE 35 -3.765 4.887 5.124 290 HG22 ILE 35 HG22 ILE 35 -2.133 4.584 5.721 291 HG23 ILE 35 HG23 ILE 35 -3.022 6.005 6.267 292 HD11 ILE 35 HD11 ILE 35 -5.585 4.006 5.511 293 HD12 ILE 35 HD12 ILE 35 -6.282 2.572 6.263 294 HD13 ILE 35 HD13 ILE 35 -5.280 2.411 4.824 295 H GLU 36 HN GLU 36 -3.558 5.787 9.704 296 HA GLU 36 HA GLU 36 -1.912 7.965 8.856 297 HB2 GLU 36 HB2 GLU 36 -4.122 8.217 9.966 298 HB3 GLU 36 HB1 GLU 36 -3.402 7.652 11.474 299 HG2 GLU 36 HG2 GLU 36 -2.097 9.573 11.740 300 HG3 GLU 36 HG1 GLU 36 -2.141 9.976 10.024 301 H GLN 37 HN GLN 37 -1.590 5.674 11.552 302 HA GLN 37 HA GLN 37 1.060 6.911 12.226 303 HB2 GLN 37 HB2 GLN 37 0.839 5.896 14.411 304 HB3 GLN 37 HB1 GLN 37 -0.656 6.762 14.059 305 HG2 GLN 37 HG2 GLN 37 -1.616 4.590 13.227 306 HG3 GLN 37 HG1 GLN 37 -0.179 3.780 13.843 307 HE21 GLN 37 HE21 GLN 37 -1.880 2.667 15.287 308 HE22 GLN 37 HE22 GLN 37 -2.309 3.450 16.731 309 H SER 38 HN SER 38 0.225 4.859 10.079 310 HA SER 38 HA SER 38 1.323 2.316 10.757 311 HB2 SER 38 HB2 SER 38 0.072 2.399 8.756 312 HB3 SER 38 HB1 SER 38 0.967 3.790 8.150 313 HG SER 38 HG SER 38 2.366 2.457 7.342 314 H GLU 39 HN GLU 39 2.808 5.237 9.424 315 HA GLU 39 HA GLU 39 5.046 5.854 9.183 316 HB2 GLU 39 HB2 GLU 39 5.036 5.507 11.650 317 HB3 GLU 39 HB1 GLU 39 5.442 3.817 11.408 318 HG2 GLU 39 HG2 GLU 39 7.542 4.766 11.822 319 HG3 GLU 39 HG1 GLU 39 7.502 4.754 10.069 320 H THR 40 HN THR 40 5.914 2.606 10.201 321 HA THR 40 HA THR 40 7.672 2.171 8.048 322 HB THR 40 HB THR 40 6.196 -0.016 9.524 323 HG1 THR 40 HG1 THR 40 6.922 1.184 11.152 324 HG21 THR 40 HG21 THR 40 8.387 -1.155 9.288 325 HG22 THR 40 HG22 THR 40 8.988 0.228 8.372 326 HG23 THR 40 HG23 THR 40 7.676 -0.758 7.724 327 H ALA 41 HN ALA 41 6.784 2.573 6.030 328 HA ALA 41 HA ALA 41 4.226 1.444 5.247 329 HB1 ALA 41 HB1 ALA 41 6.397 2.982 3.842 330 HB2 ALA 41 HB2 ALA 41 4.737 3.473 4.173 331 HB3 ALA 41 HB3 ALA 41 5.069 2.274 2.924 332 HA PRO 42 HA PRO 42 5.707 -2.491 3.836 333 HB2 PRO 42 HB2 PRO 42 3.978 -2.987 1.737 334 HB3 PRO 42 HB1 PRO 42 3.532 -3.140 3.446 335 HG2 PRO 42 HG2 PRO 42 2.981 -0.907 1.546 336 HG3 PRO 42 HG1 PRO 42 1.950 -1.595 2.811 337 HD2 PRO 42 HD2 PRO 42 3.311 0.749 3.140 338 HD3 PRO 42 HD1 PRO 42 2.932 -0.343 4.490 339 H VAL 43 HN VAL 43 6.952 -3.503 2.215 340 HA VAL 43 HA VAL 43 8.579 -1.807 0.593 341 HB VAL 43 HB VAL 43 9.304 -4.006 1.479 342 HG11 VAL 43 HG11 VAL 43 7.152 -5.189 1.121 343 HG12 VAL 43 HG12 VAL 43 8.508 -6.062 0.408 344 HG13 VAL 43 HG13 VAL 43 7.425 -5.130 -0.619 345 HG21 VAL 43 HG21 VAL 43 10.494 -4.733 -0.508 346 HG22 VAL 43 HG22 VAL 43 10.384 -2.973 -0.537 347 HG23 VAL 43 HG23 VAL 43 9.313 -3.941 -1.551 348 H VAL 44 HN VAL 44 5.578 -3.494 -0.066 349 HA VAL 44 HA VAL 44 5.673 -3.716 -2.867 350 HB VAL 44 HB VAL 44 3.824 -4.486 -1.296 351 HG11 VAL 44 HG11 VAL 44 2.586 -1.779 -1.767 352 HG12 VAL 44 HG12 VAL 44 3.624 -2.046 -0.371 353 HG13 VAL 44 HG13 VAL 44 2.159 -3.003 -0.572 354 HG21 VAL 44 HG21 VAL 44 3.565 -4.688 -3.705 355 HG22 VAL 44 HG22 VAL 44 3.108 -2.989 -3.836 356 HG23 VAL 44 HG23 VAL 44 2.038 -4.129 -3.020 357 H VAL 45 HN VAL 45 5.099 -0.856 -0.875 358 HA VAL 45 HA VAL 45 4.210 0.885 -2.967 359 HB VAL 45 HB VAL 45 5.711 1.466 -0.399 360 HG11 VAL 45 HG11 VAL 45 6.076 3.356 -1.805 361 HG12 VAL 45 HG12 VAL 45 4.714 3.795 -0.774 362 HG13 VAL 45 HG13 VAL 45 4.432 3.293 -2.442 363 HG21 VAL 45 HG21 VAL 45 3.361 0.415 -0.352 364 HG22 VAL 45 HG22 VAL 45 2.791 1.941 -1.030 365 HG23 VAL 45 HG23 VAL 45 3.578 1.915 0.549 366 H LYS 46 HN LYS 46 7.443 0.153 -1.680 367 HA LYS 46 HA LYS 46 8.890 1.959 -3.359 368 HB2 LYS 46 HB2 LYS 46 9.692 -0.653 -2.052 369 HB3 LYS 46 HB1 LYS 46 10.827 0.414 -2.878 370 HG2 LYS 46 HG2 LYS 46 10.246 2.246 -1.337 371 HG3 LYS 46 HG1 LYS 46 9.083 1.198 -0.522 372 HD2 LYS 46 HD2 LYS 46 10.925 -0.365 0.057 373 HD3 LYS 46 HD1 LYS 46 12.076 0.737 -0.698 374 HE2 LYS 46 HE2 LYS 46 10.228 1.534 1.565 375 HE3 LYS 46 HE1 LYS 46 11.893 1.001 1.804 376 HZ1 LYS 46 HZ1 LYS 46 11.296 3.176 -0.089 377 HZ2 LYS 46 HZ2 LYS 46 12.733 2.856 0.759 378 HZ3 LYS 46 HZ3 LYS 46 11.390 3.505 1.573 379 H TYR 47 HN TYR 47 7.921 -1.436 -3.787 380 HA TYR 47 HA TYR 47 9.294 -1.903 -6.245 381 HB2 TYR 47 HB2 TYR 47 8.179 -3.640 -4.781 382 HB3 TYR 47 HB1 TYR 47 6.632 -3.091 -5.424 383 HD1 TYR 47 HD2 TYR 47 9.901 -4.597 -6.321 384 HD2 TYR 47 HD1 TYR 47 5.918 -3.679 -7.639 385 HE1 TYR 47 HE2 TYR 47 10.237 -6.013 -8.329 386 HE2 TYR 47 HE1 TYR 47 6.257 -5.097 -9.647 387 HH TYR 47 HH TYR 47 8.440 -7.351 -9.957 388 H ILE 48 HN ILE 48 6.050 -0.612 -5.556 389 HA ILE 48 HA ILE 48 5.166 -0.418 -8.265 390 HB ILE 48 HB ILE 48 4.480 1.195 -5.793 391 HG12 ILE 48 HG12 ILE 48 2.880 -0.900 -7.290 392 HG13 ILE 48 HG11 ILE 48 3.893 -1.263 -5.894 393 HG21 ILE 48 HG21 ILE 48 2.395 1.775 -7.245 394 HG22 ILE 48 HG22 ILE 48 3.431 1.365 -8.605 395 HG23 ILE 48 HG23 ILE 48 3.886 2.671 -7.520 396 HD11 ILE 48 HD11 ILE 48 1.534 0.642 -5.948 397 HD12 ILE 48 HD12 ILE 48 2.584 0.383 -4.557 398 HD13 ILE 48 HD13 ILE 48 1.583 -0.936 -5.164 399 H ALA 49 HN ALA 49 6.911 1.875 -6.176 400 HA ALA 49 HA ALA 49 7.034 4.009 -8.071 401 HB1 ALA 49 HB1 ALA 49 8.911 4.826 -6.689 402 HB2 ALA 49 HB2 ALA 49 8.980 3.266 -5.869 403 HB3 ALA 49 HB3 ALA 49 7.562 4.298 -5.682 404 H PHE 50 HN PHE 50 8.876 1.063 -7.672 405 HA PHE 50 HA PHE 50 11.155 1.756 -9.242 406 HB2 PHE 50 HB2 PHE 50 10.686 -0.339 -7.749 407 HB3 PHE 50 HB1 PHE 50 9.967 -1.024 -9.204 408 HD1 PHE 50 HD2 PHE 50 13.073 0.481 -7.822 409 HD2 PHE 50 HD1 PHE 50 11.335 -1.862 -10.973 410 HE1 PHE 50 HE2 PHE 50 15.339 -0.074 -8.654 411 HE2 PHE 50 HE1 PHE 50 13.604 -2.419 -11.809 412 HZ PHE 50 HZ PHE 50 15.606 -1.524 -10.649 413 H LEU 51 HN LEU 51 8.114 0.114 -10.166 414 HA LEU 51 HA LEU 51 8.809 0.105 -13.001 415 HB2 LEU 51 HB2 LEU 51 6.139 -0.352 -11.633 416 HB3 LEU 51 HB1 LEU 51 6.517 -0.741 -13.311 417 HG LEU 51 HG LEU 51 7.908 -1.924 -10.887 418 HD11 LEU 51 HD11 LEU 51 5.699 -2.825 -10.970 419 HD12 LEU 51 HD12 LEU 51 6.735 -4.033 -11.730 420 HD13 LEU 51 HD13 LEU 51 5.744 -2.968 -12.727 421 HD21 LEU 51 HD21 LEU 51 9.504 -2.066 -12.597 422 HD22 LEU 51 HD22 LEU 51 8.287 -2.206 -13.866 423 HD23 LEU 51 HD23 LEU 51 8.633 -3.580 -12.816 424 H ARG 52 HN ARG 52 7.297 2.303 -10.808 425 HA ARG 52 HA ARG 52 5.687 3.808 -12.623 426 HB2 ARG 52 HB2 ARG 52 5.816 3.961 -10.054 427 HB3 ARG 52 HB1 ARG 52 7.221 4.998 -10.301 428 HG2 ARG 52 HG2 ARG 52 5.863 6.527 -11.674 429 HG3 ARG 52 HG1 ARG 52 4.456 5.485 -11.459 430 HD2 ARG 52 HD2 ARG 52 4.871 5.807 -8.912 431 HD3 ARG 52 HD1 ARG 52 5.880 7.169 -9.400 432 HE ARG 52 HE ARG 52 2.949 7.006 -9.628 433 HH11 ARG 52 HH21 ARG 52 5.893 8.585 -10.514 434 HH12 ARG 52 HH22 ARG 52 5.109 10.068 -10.945 435 HH21 ARG 52 HH11 ARG 52 1.929 8.915 -10.183 436 HH22 ARG 52 HH12 ARG 52 2.863 10.257 -10.758 437 H SER 53 HN SER 53 9.097 4.064 -11.675 438 HA SER 53 HA SER 53 9.760 6.398 -13.153 439 HB2 SER 53 HB2 SER 53 11.549 3.998 -12.691 440 HB3 SER 53 HB1 SER 53 12.057 5.660 -12.970 441 HG SER 53 HG SER 53 10.596 4.639 -10.756 442 H LYS 54 HN LYS 54 9.425 3.024 -14.128 443 HA LYS 54 HA LYS 54 10.570 3.437 -16.770 444 HB2 LYS 54 HB2 LYS 54 9.060 1.231 -15.377 445 HB3 LYS 54 HB1 LYS 54 9.250 1.162 -17.128 446 HG2 LYS 54 HG2 LYS 54 11.081 -0.065 -16.093 447 HG3 LYS 54 HG1 LYS 54 11.730 1.405 -16.819 448 HD2 LYS 54 HD2 LYS 54 11.760 2.517 -14.652 449 HD3 LYS 54 HD1 LYS 54 10.969 1.133 -13.898 450 HE2 LYS 54 HE2 LYS 54 12.901 -0.284 -14.445 451 HE3 LYS 54 HE1 LYS 54 13.686 1.079 -15.242 452 HZ1 LYS 54 HZ1 LYS 54 14.123 2.104 -13.275 453 HZ2 LYS 54 HZ2 LYS 54 14.177 0.489 -12.749 454 HZ3 LYS 54 HZ3 LYS 54 12.786 1.427 -12.479 455 H GLY 55 HN GLY 55 7.850 4.644 -15.405 456 HA2 GLY 55 HA2 GLY 55 5.927 5.630 -16.301 457 HA3 GLY 55 HA1 GLY 55 6.713 5.505 -17.874 458 H VAL 56 HN VAL 56 5.996 2.705 -15.816 459 HA VAL 56 HA VAL 56 4.726 1.299 -17.961 460 HB VAL 56 HB VAL 56 4.569 0.913 -14.959 461 HG11 VAL 56 HG11 VAL 56 3.517 -0.742 -17.258 462 HG12 VAL 56 HG12 VAL 56 2.652 -0.183 -15.826 463 HG13 VAL 56 HG13 VAL 56 3.871 -1.451 -15.681 464 HG21 VAL 56 HG21 VAL 56 6.802 0.564 -15.708 465 HG22 VAL 56 HG22 VAL 56 6.266 -0.250 -17.177 466 HG23 VAL 56 HG23 VAL 56 6.095 -1.048 -15.615 467 H ASP 57 HN ASP 57 3.586 3.676 -15.754 468 HA ASP 57 HA ASP 57 1.533 4.765 -15.590 469 HB2 ASP 57 HB2 ASP 57 1.693 4.521 -18.159 470 HB3 ASP 57 HB1 ASP 57 0.567 3.185 -17.978 471 H LEU 58 HN LEU 58 1.197 3.568 -13.631 472 HA LEU 58 HA LEU 58 -0.490 1.137 -13.775 473 HB2 LEU 58 HB2 LEU 58 0.782 2.647 -11.483 474 HB3 LEU 58 HB1 LEU 58 -0.225 1.217 -11.271 475 HG LEU 58 HG LEU 58 2.233 1.267 -13.042 476 HD11 LEU 58 HD11 LEU 58 1.906 0.546 -10.131 477 HD12 LEU 58 HD12 LEU 58 3.010 1.730 -10.839 478 HD13 LEU 58 HD13 LEU 58 3.277 0.005 -11.100 479 HD21 LEU 58 HD21 LEU 58 2.015 -1.288 -12.407 480 HD22 LEU 58 HD22 LEU 58 0.990 -0.624 -13.672 481 HD23 LEU 58 HD23 LEU 58 0.341 -0.868 -12.052 482 H ASN 59 HN ASN 59 -0.715 4.562 -13.055 483 HA ASN 59 HA ASN 59 -3.007 4.810 -11.524 484 HB2 ASN 59 HB2 ASN 59 -3.576 6.781 -13.174 485 HB3 ASN 59 HB1 ASN 59 -2.092 6.855 -12.224 486 HD21 ASN 59 HD21 ASN 59 -3.336 6.877 -15.434 487 HD22 ASN 59 HD22 ASN 59 -1.854 6.724 -16.249 488 H ALA 60 HN ALA 60 -2.824 4.000 -14.963 489 HA ALA 60 HA ALA 60 -5.683 3.807 -15.355 490 HB1 ALA 60 HB1 ALA 60 -4.409 4.085 -17.330 491 HB2 ALA 60 HB2 ALA 60 -4.861 2.381 -17.377 492 HB3 ALA 60 HB3 ALA 60 -3.240 2.853 -16.856 493 H LEU 61 HN LEU 61 -3.091 1.490 -14.582 494 HA LEU 61 HA LEU 61 -4.695 -0.875 -14.674 495 HB2 LEU 61 HB2 LEU 61 -2.096 -0.548 -14.452 496 HB3 LEU 61 HB1 LEU 61 -2.414 -0.534 -12.721 497 HG LEU 61 HG LEU 61 -3.260 -2.738 -14.628 498 HD11 LEU 61 HD11 LEU 61 -1.468 -4.052 -13.653 499 HD12 LEU 61 HD12 LEU 61 -1.064 -2.749 -12.534 500 HD13 LEU 61 HD13 LEU 61 -0.786 -2.545 -14.264 501 HD21 LEU 61 HD21 LEU 61 -3.476 -3.909 -12.265 502 HD22 LEU 61 HD22 LEU 61 -4.781 -2.895 -12.863 503 HD23 LEU 61 HD23 LEU 61 -3.642 -2.255 -11.678 504 H PHE 62 HN PHE 62 -3.764 1.194 -11.922 505 HA PHE 62 HA PHE 62 -5.286 -0.210 -9.968 506 HB2 PHE 62 HB2 PHE 62 -4.232 2.614 -10.144 507 HB3 PHE 62 HB1 PHE 62 -5.163 2.072 -8.749 508 HD1 PHE 62 HD1 PHE 62 -4.365 -0.387 -7.873 509 HD2 PHE 62 HD2 PHE 62 -1.909 2.477 -9.936 510 HE1 PHE 62 HE1 PHE 62 -2.337 -1.434 -6.920 511 HE2 PHE 62 HE2 PHE 62 0.115 1.430 -8.969 512 HZ PHE 62 HZ PHE 62 -0.096 -0.529 -7.467 513 H ASP 63 HN ASP 63 -6.089 2.604 -11.979 514 HA ASP 63 HA ASP 63 -8.593 3.251 -10.917 515 HB2 ASP 63 HB2 ASP 63 -7.405 4.466 -12.760 516 HB3 ASP 63 HB1 ASP 63 -7.903 3.183 -13.864 517 H ARG 64 HN ARG 64 -7.760 0.631 -13.168 518 HA ARG 64 HA ARG 64 -10.509 -0.141 -13.635 519 HB2 ARG 64 HB2 ARG 64 -7.899 -1.638 -13.984 520 HB3 ARG 64 HB1 ARG 64 -9.467 -2.280 -14.477 521 HG2 ARG 64 HG2 ARG 64 -9.798 -0.271 -15.920 522 HG3 ARG 64 HG1 ARG 64 -8.183 0.282 -15.477 523 HD2 ARG 64 HD2 ARG 64 -7.214 -1.787 -16.428 524 HD3 ARG 64 HD1 ARG 64 -8.831 -2.326 -16.888 525 HE ARG 64 HE ARG 64 -8.100 0.310 -17.940 526 HH11 ARG 64 HH21 ARG 64 -8.118 -3.117 -18.385 527 HH12 ARG 64 HH22 ARG 64 -7.993 -3.020 -20.110 528 HH21 ARG 64 HH11 ARG 64 -7.937 0.444 -20.180 529 HH22 ARG 64 HH12 ARG 64 -7.891 -1.007 -21.125 530 H ILE 65 HN ILE 65 -8.517 -0.415 -10.921 531 HA ILE 65 HA ILE 65 -9.881 -2.873 -9.920 532 HB ILE 65 HB ILE 65 -7.595 -1.246 -8.765 533 HG12 ILE 65 HG12 ILE 65 -7.619 -3.996 -10.059 534 HG13 ILE 65 HG11 ILE 65 -7.096 -2.520 -10.868 535 HG21 ILE 65 HG21 ILE 65 -8.814 -2.311 -6.968 536 HG22 ILE 65 HG22 ILE 65 -7.370 -3.273 -7.263 537 HG23 ILE 65 HG23 ILE 65 -8.931 -3.819 -7.873 538 HD11 ILE 65 HD11 ILE 65 -5.081 -3.450 -10.069 539 HD12 ILE 65 HD12 ILE 65 -5.810 -3.939 -8.541 540 HD13 ILE 65 HD13 ILE 65 -5.479 -2.238 -8.852 541 H ILE 66 HN ILE 66 -9.490 0.580 -9.245 542 HA ILE 66 HA ILE 66 -10.955 0.625 -6.779 543 HB ILE 66 HB ILE 66 -10.304 2.690 -8.894 544 HG12 ILE 66 HG12 ILE 66 -9.142 3.712 -6.819 545 HG13 ILE 66 HG11 ILE 66 -9.411 2.154 -6.045 546 HG21 ILE 66 HG21 ILE 66 -12.128 2.997 -6.509 547 HG22 ILE 66 HG22 ILE 66 -12.380 3.535 -8.170 548 HG23 ILE 66 HG23 ILE 66 -11.217 4.371 -7.143 549 HD11 ILE 66 HD11 ILE 66 -7.170 2.341 -7.147 550 HD12 ILE 66 HD12 ILE 66 -7.987 2.536 -8.694 551 HD13 ILE 66 HD13 ILE 66 -8.143 1.023 -7.798 552 H VAL 67 HN VAL 67 -11.933 1.134 -10.155 553 HA VAL 67 HA VAL 67 -14.580 1.880 -9.844 554 HB VAL 67 HB VAL 67 -14.994 0.663 -12.009 555 HG11 VAL 67 HG11 VAL 67 -13.120 1.954 -13.222 556 HG12 VAL 67 HG12 VAL 67 -12.580 2.442 -11.615 557 HG13 VAL 67 HG13 VAL 67 -14.188 2.895 -12.180 558 HG21 VAL 67 HG21 VAL 67 -13.561 -1.269 -11.697 559 HG22 VAL 67 HG22 VAL 67 -12.146 -0.243 -11.485 560 HG23 VAL 67 HG23 VAL 67 -12.930 -0.343 -13.057 561 H ASN 68 HN ASN 68 -16.568 0.777 -9.661 562 HA ASN 68 HA ASN 68 -16.511 -1.539 -7.921 563 HB2 ASN 68 HB2 ASN 68 -18.246 0.386 -8.010 564 HB3 ASN 68 HB1 ASN 68 -18.962 -0.503 -9.353 565 HD21 ASN 68 HD21 ASN 68 -19.819 -0.035 -6.387 566 HD22 ASN 68 HD22 ASN 68 -20.209 -1.596 -5.844 567 H LYS 69 HN LYS 69 -16.202 -3.563 -8.647 568 HA LYS 69 HA LYS 69 -17.490 -4.421 -11.204 569 HB2 LYS 69 HB2 LYS 69 -15.065 -3.903 -11.586 570 HB3 LYS 69 HB1 LYS 69 -14.654 -5.103 -10.362 571 HG2 LYS 69 HG2 LYS 69 -15.740 -6.857 -11.670 572 HG3 LYS 69 HG1 LYS 69 -16.241 -5.674 -12.878 573 HD2 LYS 69 HD2 LYS 69 -13.871 -5.148 -13.345 574 HD3 LYS 69 HD1 LYS 69 -13.374 -6.346 -12.149 575 HE2 LYS 69 HE2 LYS 69 -13.285 -7.316 -14.403 576 HE3 LYS 69 HE1 LYS 69 -14.538 -8.107 -13.447 577 HZ1 LYS 69 HZ1 LYS 69 -15.032 -7.248 -15.847 578 HZ2 LYS 69 HZ2 LYS 69 -15.263 -5.764 -15.052 579 HZ3 LYS 69 HZ3 LYS 69 -16.201 -7.117 -14.625 580 H LEU 70 HN LEU 70 -16.539 -5.022 -7.947 581 HA LEU 70 HA LEU 70 -16.941 -6.811 -6.494 582 HB2 LEU 70 HB2 LEU 70 -19.081 -7.525 -8.524 583 HB3 LEU 70 HB1 LEU 70 -19.016 -8.048 -6.843 584 HG LEU 70 HG LEU 70 -19.265 -5.176 -7.780 585 HD11 LEU 70 HD11 LEU 70 -21.279 -6.722 -8.064 586 HD12 LEU 70 HD12 LEU 70 -21.544 -5.279 -7.085 587 HD13 LEU 70 HD13 LEU 70 -21.311 -6.844 -6.305 588 HD21 LEU 70 HD21 LEU 70 -19.856 -4.941 -5.234 589 HD22 LEU 70 HD22 LEU 70 -18.163 -5.035 -5.703 590 HD23 LEU 70 HD23 LEU 70 -18.981 -6.462 -5.063 591 H GLU 71 HN GLU 71 -15.049 -7.965 -6.726 592 HA GLU 71 HA GLU 71 -14.972 -10.126 -8.803 593 HB2 GLU 71 HB2 GLU 71 -12.783 -8.757 -7.205 594 HB3 GLU 71 HB1 GLU 71 -12.509 -10.143 -8.264 595 HG2 GLU 71 HG2 GLU 71 -13.346 -8.876 -10.186 596 HG3 GLU 71 HG1 GLU 71 -13.720 -7.504 -9.142 597 H HIS 72 HN HIS 72 -14.745 -9.403 -5.359 598 HA HIS 72 HA HIS 72 -15.585 -12.050 -4.629 599 HB2 HIS 72 HB2 HIS 72 -13.607 -13.012 -3.756 600 HB3 HIS 72 HB1 HIS 72 -13.093 -12.343 -5.301 601 HD2 HIS 72 HD2 HIS 72 -11.879 -12.278 -1.753 602 HE1 HIS 72 HE1 HIS 72 -10.540 -8.624 -3.388 603 HE2 HIS 72 HE2 HIS 72 -10.309 -10.221 -1.432 604 H HIS 73 HN HIS 73 -14.340 -12.045 -1.999 605 HA HIS 73 HA HIS 73 -15.227 -9.426 -0.859 606 HB2 HIS 73 HB2 HIS 73 -16.025 -12.049 0.405 607 HB3 HIS 73 HB1 HIS 73 -16.670 -10.435 0.711 608 HD2 HIS 73 HD2 HIS 73 -16.622 -12.880 -2.449 609 HE1 HIS 73 HE1 HIS 73 -20.206 -10.647 -2.459 610 HE2 HIS 73 HE2 HIS 73 -18.895 -12.457 -3.658 611 H HIS 74 HN HIS 74 -14.239 -8.913 1.162 612 HA HIS 74 HA HIS 74 -11.732 -10.450 1.684 613 HB2 HIS 74 HB2 HIS 74 -12.492 -7.738 2.785 614 HB3 HIS 74 HB1 HIS 74 -10.883 -8.452 2.674 615 HD2 HIS 74 HD2 HIS 74 -13.569 -6.847 0.246 616 HE1 HIS 74 HE1 HIS 74 -9.867 -7.062 -1.777 617 HE2 HIS 74 HE2 HIS 74 -12.253 -6.210 -1.914 618 H HIS 75 HN HIS 75 -11.784 -11.829 3.380 619 HA HIS 75 HA HIS 75 -13.715 -11.328 5.618 620 HB2 HIS 75 HB2 HIS 75 -13.976 -13.483 4.455 621 HB3 HIS 75 HB1 HIS 75 -12.281 -13.863 4.760 622 HD2 HIS 75 HD2 HIS 75 -11.889 -15.195 7.143 623 HE1 HIS 75 HE1 HIS 75 -15.554 -14.204 8.992 624 HE2 HIS 75 HE2 HIS 75 -13.414 -15.543 9.231 625 H HIS 76 HN HIS 76 -10.449 -11.152 4.754 626 HA HIS 76 HA HIS 76 -8.434 -11.135 5.987 627 HB2 HIS 76 HB2 HIS 76 -9.578 -8.913 6.364 628 HB3 HIS 76 HB1 HIS 76 -10.170 -9.554 7.897 629 HD2 HIS 76 HD2 HIS 76 -8.336 -9.316 9.976 630 HE1 HIS 76 HE1 HIS 76 -4.919 -8.485 7.635 631 HE2 HIS 76 HE2 HIS 76 -5.805 -8.679 10.004 632 H HIS 77 HN HIS 77 -8.158 -13.305 6.669 633 HA HIS 77 HA HIS 77 -9.413 -14.191 9.193 634 HB2 HIS 77 HB2 HIS 77 -9.231 -15.828 7.407 635 HB3 HIS 77 HB1 HIS 77 -7.499 -15.536 7.260 636 HD2 HIS 77 HD2 HIS 77 -7.600 -18.494 8.012 637 HE1 HIS 77 HE1 HIS 77 -7.816 -17.506 12.114 638 HE2 HIS 77 HE2 HIS 77 -7.362 -19.374 10.457 639 H1 MET 1 HT1 MET 1 -9.940 -9.607 -12.715 640 H2 MET 1 HT2 MET 1 -10.054 -10.112 -14.332 641 H3 MET 1 HT3 MET 1 -9.967 -8.457 -13.962 642 HA MET 1 HA MET 1 -7.860 -10.418 -14.191 643 HB2 MET 1 HB2 MET 1 -7.973 -7.384 -14.275 644 HB3 MET 1 HB1 MET 1 -6.582 -8.365 -14.740 645 HG2 MET 1 HG2 MET 1 -9.325 -8.548 -16.014 646 HG3 MET 1 HG1 MET 1 -7.960 -7.679 -16.708 647 HE1 MET 1 HE1 MET 1 -5.358 -9.757 -16.190 648 HE2 MET 1 HE2 MET 1 -5.883 -8.517 -17.325 649 HE3 MET 1 HE3 MET 1 -5.517 -10.137 -17.908 650 H GLU 2 HN GLU 2 -6.749 -11.135 -12.469 651 HA GLU 2 HA GLU 2 -7.017 -9.917 -9.859 652 HB2 GLU 2 HB2 GLU 2 -5.228 -12.127 -10.900 653 HB3 GLU 2 HB1 GLU 2 -5.305 -11.645 -9.204 654 HG2 GLU 2 HG2 GLU 2 -7.726 -12.115 -9.175 655 HG3 GLU 2 HG1 GLU 2 -7.654 -12.590 -10.871 656 H LEU 3 HN LEU 3 -5.377 -8.923 -8.613 657 HA LEU 3 HA LEU 3 -3.718 -7.046 -9.989 658 HB2 LEU 3 HB2 LEU 3 -4.569 -6.733 -7.678 659 HB3 LEU 3 HB1 LEU 3 -3.528 -8.044 -7.130 660 HG LEU 3 HG LEU 3 -1.538 -6.761 -7.882 661 HD11 LEU 3 HD11 LEU 3 -2.186 -5.340 -9.608 662 HD12 LEU 3 HD12 LEU 3 -2.129 -4.205 -8.262 663 HD13 LEU 3 HD13 LEU 3 -3.676 -4.857 -8.800 664 HD21 LEU 3 HD21 LEU 3 -3.308 -5.086 -6.080 665 HD22 LEU 3 HD22 LEU 3 -1.547 -5.189 -6.058 666 HD23 LEU 3 HD23 LEU 3 -2.518 -6.573 -5.554 667 H SER 4 HN SER 4 -2.957 -10.128 -8.364 668 HA SER 4 HA SER 4 -0.125 -9.981 -8.776 669 HB2 SER 4 HB2 SER 4 -0.176 -12.411 -8.295 670 HB3 SER 4 HB1 SER 4 -1.141 -11.495 -7.140 671 HG SER 4 HG SER 4 -2.042 -12.937 -9.413 672 H ASN 5 HN ASN 5 -2.744 -11.406 -10.711 673 HA ASN 5 HA ASN 5 -1.054 -12.643 -12.664 674 HB2 ASN 5 HB2 ASN 5 -3.383 -13.262 -12.507 675 HB3 ASN 5 HB1 ASN 5 -3.894 -11.605 -12.819 676 HD21 ASN 5 HD21 ASN 5 -1.644 -13.941 -14.434 677 HD22 ASN 5 HD22 ASN 5 -2.256 -13.663 -15.992 678 H GLU 6 HN GLU 6 -2.644 -9.449 -12.610 679 HA GLU 6 HA GLU 6 -1.598 -8.615 -15.164 680 HB2 GLU 6 HB2 GLU 6 -2.824 -7.209 -12.794 681 HB3 GLU 6 HB1 GLU 6 -2.146 -6.271 -14.123 682 HG2 GLU 6 HG2 GLU 6 -4.120 -8.503 -14.638 683 HG3 GLU 6 HG1 GLU 6 -4.666 -6.876 -14.232 684 H LEU 7 HN LEU 7 -0.475 -8.332 -11.832 685 HA LEU 7 HA LEU 7 1.665 -6.512 -12.311 686 HB2 LEU 7 HB2 LEU 7 0.761 -7.211 -10.056 687 HB3 LEU 7 HB1 LEU 7 1.599 -8.745 -10.266 688 HG LEU 7 HG LEU 7 3.741 -7.465 -10.566 689 HD11 LEU 7 HD11 LEU 7 3.515 -5.065 -9.439 690 HD12 LEU 7 HD12 LEU 7 1.870 -5.166 -10.058 691 HD13 LEU 7 HD13 LEU 7 3.238 -5.274 -11.165 692 HD21 LEU 7 HD21 LEU 7 2.969 -8.483 -8.387 693 HD22 LEU 7 HD22 LEU 7 2.343 -6.898 -7.934 694 HD23 LEU 7 HD23 LEU 7 4.073 -7.122 -8.195 695 H LYS 8 HN LYS 8 1.500 -10.056 -12.428 696 HA LYS 8 HA LYS 8 4.281 -10.490 -12.962 697 HB2 LYS 8 HB2 LYS 8 1.774 -12.050 -13.022 698 HB3 LYS 8 HB1 LYS 8 2.976 -12.633 -14.162 699 HG2 LYS 8 HG2 LYS 8 3.569 -12.117 -11.233 700 HG3 LYS 8 HG1 LYS 8 3.065 -13.686 -11.856 701 HD2 LYS 8 HD2 LYS 8 5.078 -13.302 -13.559 702 HD3 LYS 8 HD1 LYS 8 5.647 -12.201 -12.309 703 HE2 LYS 8 HE2 LYS 8 5.265 -14.153 -10.671 704 HE3 LYS 8 HE1 LYS 8 5.166 -15.165 -12.116 705 HZ1 LYS 8 HZ1 LYS 8 7.460 -14.180 -10.846 706 HZ2 LYS 8 HZ2 LYS 8 7.369 -13.476 -12.389 707 HZ3 LYS 8 HZ3 LYS 8 7.360 -15.165 -12.223 708 H VAL 9 HN VAL 9 1.516 -9.907 -15.077 709 HA VAL 9 HA VAL 9 2.769 -10.499 -17.550 710 HB VAL 9 HB VAL 9 0.633 -8.478 -16.827 711 HG11 VAL 9 HG11 VAL 9 1.502 -7.704 -18.898 712 HG12 VAL 9 HG12 VAL 9 0.099 -8.679 -19.331 713 HG13 VAL 9 HG13 VAL 9 1.723 -9.343 -19.510 714 HG21 VAL 9 HG21 VAL 9 0.315 -11.109 -18.282 715 HG22 VAL 9 HG22 VAL 9 -0.920 -10.145 -17.474 716 HG23 VAL 9 HG23 VAL 9 0.278 -11.018 -16.522 717 H GLU 10 HN GLU 10 2.656 -7.450 -15.693 718 HA GLU 10 HA GLU 10 4.111 -5.908 -17.612 719 HB2 GLU 10 HB2 GLU 10 3.857 -5.609 -14.608 720 HB3 GLU 10 HB1 GLU 10 4.560 -4.388 -15.668 721 HG2 GLU 10 HG2 GLU 10 2.364 -4.472 -16.982 722 HG3 GLU 10 HG1 GLU 10 1.713 -5.406 -15.637 723 H ARG 11 HN ARG 11 5.216 -7.799 -14.781 724 HA ARG 11 HA ARG 11 7.976 -7.081 -14.954 725 HB2 ARG 11 HB2 ARG 11 6.950 -8.317 -13.043 726 HB3 ARG 11 HB1 ARG 11 6.789 -9.734 -14.079 727 HG2 ARG 11 HG2 ARG 11 9.270 -9.712 -14.427 728 HG3 ARG 11 HG1 ARG 11 9.384 -8.376 -13.282 729 HD2 ARG 11 HD2 ARG 11 8.564 -9.731 -11.487 730 HD3 ARG 11 HD1 ARG 11 8.084 -11.013 -12.599 731 HE ARG 11 HE ARG 11 10.969 -10.295 -12.447 732 HH11 ARG 11 HH21 ARG 11 8.376 -12.502 -11.792 733 HH12 ARG 11 HH22 ARG 11 9.430 -13.837 -11.483 734 HH21 ARG 11 HH11 ARG 11 12.334 -12.041 -12.033 735 HH22 ARG 11 HH12 ARG 11 11.657 -13.579 -11.614 736 H ILE 12 HN ILE 12 6.151 -9.757 -16.433 737 HA ILE 12 HA ILE 12 8.382 -10.920 -17.815 738 HB ILE 12 HB ILE 12 5.403 -10.993 -18.399 739 HG12 ILE 12 HG12 ILE 12 7.199 -13.147 -17.251 740 HG13 ILE 12 HG11 ILE 12 6.347 -11.989 -16.230 741 HG21 ILE 12 HG21 ILE 12 6.477 -11.530 -20.461 742 HG22 ILE 12 HG22 ILE 12 6.105 -13.085 -19.717 743 HG23 ILE 12 HG23 ILE 12 7.748 -12.445 -19.648 744 HD11 ILE 12 HD11 ILE 12 5.112 -13.977 -18.155 745 HD12 ILE 12 HD12 ILE 12 4.200 -12.702 -17.346 746 HD13 ILE 12 HD13 ILE 12 4.974 -13.971 -16.395 747 H ARG 13 HN ARG 13 5.953 -8.500 -18.713 748 HA ARG 13 HA ARG 13 6.657 -8.132 -21.426 749 HB2 ARG 13 HB2 ARG 13 4.732 -7.036 -20.175 750 HB3 ARG 13 HB1 ARG 13 5.913 -5.946 -19.466 751 HG2 ARG 13 HG2 ARG 13 5.284 -4.661 -21.277 752 HG3 ARG 13 HG1 ARG 13 6.610 -5.545 -22.011 753 HD2 ARG 13 HD2 ARG 13 5.118 -6.160 -23.619 754 HD3 ARG 13 HD1 ARG 13 4.383 -7.221 -22.423 755 HE ARG 13 HE ARG 13 2.552 -5.756 -22.428 756 HH11 ARG 13 HH21 ARG 13 5.466 -4.118 -23.294 757 HH12 ARG 13 HH22 ARG 13 4.678 -2.608 -23.612 758 HH21 ARG 13 HH11 ARG 13 1.514 -3.797 -22.833 759 HH22 ARG 13 HH12 ARG 13 2.439 -2.428 -23.352 760 H LEU 14 HN LEU 14 7.976 -6.600 -18.492 761 HA LEU 14 HA LEU 14 10.117 -5.306 -20.087 762 HB2 LEU 14 HB2 LEU 14 9.507 -5.231 -17.112 763 HB3 LEU 14 HB1 LEU 14 10.703 -4.235 -17.938 764 HG LEU 14 HG LEU 14 7.722 -4.225 -18.513 765 HD11 LEU 14 HD11 LEU 14 8.232 -3.244 -16.326 766 HD12 LEU 14 HD12 LEU 14 7.791 -1.977 -17.466 767 HD13 LEU 14 HD13 LEU 14 9.483 -2.234 -17.049 768 HD21 LEU 14 HD21 LEU 14 10.094 -2.806 -19.720 769 HD22 LEU 14 HD22 LEU 14 8.527 -1.997 -19.684 770 HD23 LEU 14 HD23 LEU 14 8.704 -3.532 -20.526 771 H SER 15 HN SER 15 9.516 -8.257 -18.756 772 HA SER 15 HA SER 15 10.842 -9.965 -17.802 773 HB2 SER 15 HB2 SER 15 12.697 -8.988 -19.988 774 HB3 SER 15 HB1 SER 15 12.618 -10.615 -19.317 775 HG SER 15 HG SER 15 11.049 -11.001 -20.646 776 H LEU 16 HN LEU 16 11.195 -8.579 -15.820 777 HA LEU 16 HA LEU 16 13.983 -7.521 -15.601 778 HB2 LEU 16 HB2 LEU 16 11.637 -7.262 -13.696 779 HB3 LEU 16 HB1 LEU 16 13.197 -6.454 -13.537 780 HG LEU 16 HG LEU 16 11.279 -6.108 -15.860 781 HD11 LEU 16 HD11 LEU 16 10.839 -3.899 -14.934 782 HD12 LEU 16 HD12 LEU 16 11.997 -4.178 -13.634 783 HD13 LEU 16 HD13 LEU 16 10.504 -5.114 -13.699 784 HD21 LEU 16 HD21 LEU 16 13.384 -5.645 -16.779 785 HD22 LEU 16 HD22 LEU 16 14.037 -5.054 -15.250 786 HD23 LEU 16 HD23 LEU 16 12.917 -4.057 -16.178 787 H THR 17 HN THR 17 15.467 -8.441 -14.282 788 HA THR 17 HA THR 17 14.903 -11.136 -13.295 789 HB THR 17 HB THR 17 17.356 -10.963 -12.566 790 HG1 THR 17 HG1 THR 17 17.189 -8.612 -14.140 791 HG21 THR 17 HG21 THR 17 16.722 -10.413 -15.479 792 HG22 THR 17 HG22 THR 17 16.569 -11.990 -14.702 793 HG23 THR 17 HG23 THR 17 18.154 -11.232 -14.856 794 H ALA 18 HN ALA 18 14.616 -11.727 -11.192 795 HA ALA 18 HA ALA 18 13.856 -9.783 -9.232 796 HB1 ALA 18 HB1 ALA 18 14.020 -11.809 -7.671 797 HB2 ALA 18 HB2 ALA 18 14.526 -12.724 -9.090 798 HB3 ALA 18 HB3 ALA 18 12.931 -11.971 -9.049 799 H LYS 19 HN LYS 19 16.865 -11.548 -9.823 800 HA LYS 19 HA LYS 19 18.215 -10.832 -7.412 801 HB2 LYS 19 HB2 LYS 19 18.979 -12.567 -9.042 802 HB3 LYS 19 HB1 LYS 19 19.413 -11.274 -10.160 803 HG2 LYS 19 HG2 LYS 19 20.997 -10.357 -8.535 804 HG3 LYS 19 HG1 LYS 19 20.537 -11.591 -7.363 805 HD2 LYS 19 HD2 LYS 19 21.317 -13.353 -8.915 806 HD3 LYS 19 HD1 LYS 19 21.794 -12.112 -10.074 807 HE2 LYS 19 HE2 LYS 19 23.739 -12.846 -8.759 808 HE3 LYS 19 HE1 LYS 19 23.356 -11.162 -8.403 809 HZ1 LYS 19 HZ1 LYS 19 23.722 -12.282 -6.355 810 HZ2 LYS 19 HZ2 LYS 19 22.665 -13.544 -6.774 811 HZ3 LYS 19 HZ3 LYS 19 22.057 -11.987 -6.473 812 H SER 20 HN SER 20 18.206 -9.273 -10.627 813 HA SER 20 HA SER 20 19.957 -7.126 -9.948 814 HB2 SER 20 HB2 SER 20 19.339 -7.736 -12.266 815 HB3 SER 20 HB1 SER 20 17.693 -7.186 -11.963 816 HG SER 20 HG SER 20 19.192 -5.221 -11.199 817 H VAL 21 HN VAL 21 16.394 -7.323 -9.921 818 HA VAL 21 HA VAL 21 15.997 -4.632 -8.991 819 HB VAL 21 HB VAL 21 14.234 -7.088 -8.815 820 HG11 VAL 21 HG11 VAL 21 12.425 -5.253 -8.595 821 HG12 VAL 21 HG12 VAL 21 13.748 -4.188 -8.123 822 HG13 VAL 21 HG13 VAL 21 13.385 -5.626 -7.166 823 HG21 VAL 21 HG21 VAL 21 13.094 -6.065 -10.742 824 HG22 VAL 21 HG22 VAL 21 14.797 -6.338 -11.108 825 HG23 VAL 21 HG23 VAL 21 14.230 -4.715 -10.712 826 H ALA 22 HN ALA 22 16.167 -7.763 -7.312 827 HA ALA 22 HA ALA 22 15.594 -6.786 -4.696 828 HB1 ALA 22 HB1 ALA 22 16.608 -8.873 -3.912 829 HB2 ALA 22 HB2 ALA 22 17.348 -9.124 -5.493 830 HB3 ALA 22 HB3 ALA 22 15.594 -9.185 -5.322 831 H GLU 23 HN GLU 23 18.638 -7.032 -6.498 832 HA GLU 23 HA GLU 23 20.352 -6.372 -4.293 833 HB2 GLU 23 HB2 GLU 23 20.912 -7.317 -6.673 834 HB3 GLU 23 HB1 GLU 23 20.977 -5.623 -7.153 835 HG2 GLU 23 HG2 GLU 23 23.209 -6.246 -6.542 836 HG3 GLU 23 HG1 GLU 23 22.591 -5.260 -5.215 837 H GLU 24 HN GLU 24 18.862 -4.377 -6.843 838 HA GLU 24 HA GLU 24 19.966 -1.906 -5.801 839 HB2 GLU 24 HB2 GLU 24 19.343 -2.216 -8.180 840 HB3 GLU 24 HB1 GLU 24 17.649 -2.335 -7.704 841 HG2 GLU 24 HG2 GLU 24 17.525 -0.083 -7.067 842 HG3 GLU 24 HG1 GLU 24 19.271 0.067 -6.869 843 H MET 25 HN MET 25 16.905 -3.623 -5.436 844 HA MET 25 HA MET 25 15.491 -1.540 -4.066 845 HB2 MET 25 HB2 MET 25 15.234 -4.545 -4.181 846 HB3 MET 25 HB1 MET 25 14.195 -3.593 -3.125 847 HG2 MET 25 HG2 MET 25 14.504 -3.014 -6.078 848 HG3 MET 25 HG1 MET 25 13.241 -4.063 -5.433 849 HE1 MET 25 HE1 MET 25 11.973 -2.966 -2.941 850 HE2 MET 25 HE2 MET 25 11.210 -3.454 -4.451 851 HE3 MET 25 HE3 MET 25 10.766 -1.924 -3.702 852 H GLY 26 HN GLY 26 17.698 -4.084 -2.965 853 HA2 GLY 26 HA2 GLY 26 19.059 -3.925 -0.993 854 HA3 GLY 26 HA1 GLY 26 18.017 -2.632 -0.400 855 H ILE 27 HN ILE 27 16.563 -5.533 -1.673 856 HA ILE 27 HA ILE 27 15.930 -6.440 1.120 857 HB ILE 27 HB ILE 27 13.702 -7.092 0.305 858 HG12 ILE 27 HG12 ILE 27 14.550 -5.723 -2.267 859 HG13 ILE 27 HG11 ILE 27 14.321 -7.457 -2.072 860 HG21 ILE 27 HG21 ILE 27 12.764 -4.911 0.305 861 HG22 ILE 27 HG22 ILE 27 14.191 -4.211 -0.460 862 HG23 ILE 27 HG23 ILE 27 14.267 -4.756 1.215 863 HD11 ILE 27 HD11 ILE 27 12.241 -5.279 -1.971 864 HD12 ILE 27 HD12 ILE 27 11.941 -6.863 -1.255 865 HD13 ILE 27 HD13 ILE 27 12.271 -6.724 -2.981 866 H SER 28 HN SER 28 15.263 -8.761 1.190 867 HA SER 28 HA SER 28 17.228 -10.370 -0.181 868 HB2 SER 28 HB2 SER 28 16.462 -12.135 1.168 869 HB3 SER 28 HB1 SER 28 16.145 -10.712 2.156 870 HG SER 28 HG SER 28 14.217 -11.623 2.173 871 H ARG 29 HN ARG 29 16.693 -12.248 -1.516 872 HA ARG 29 HA ARG 29 15.017 -11.614 -3.746 873 HB2 ARG 29 HB2 ARG 29 16.989 -13.134 -3.831 874 HB3 ARG 29 HB1 ARG 29 16.091 -14.313 -2.876 875 HG2 ARG 29 HG2 ARG 29 14.425 -14.551 -4.614 876 HG3 ARG 29 HG1 ARG 29 15.144 -13.236 -5.543 877 HD2 ARG 29 HD2 ARG 29 17.179 -14.526 -5.892 878 HD3 ARG 29 HD1 ARG 29 16.579 -15.816 -4.847 879 HE ARG 29 HE ARG 29 14.640 -15.526 -6.839 880 HH11 ARG 29 HH21 ARG 29 18.027 -16.150 -6.648 881 HH12 ARG 29 HH22 ARG 29 18.056 -17.144 -8.066 882 HH21 ARG 29 HH11 ARG 29 14.660 -16.825 -8.682 883 HH22 ARG 29 HH12 ARG 29 16.150 -17.527 -9.218 884 H GLN 30 HN GLN 30 14.556 -13.713 -0.922 885 HA GLN 30 HA GLN 30 12.063 -14.860 -1.695 886 HB2 GLN 30 HB2 GLN 30 13.447 -15.649 0.213 887 HB3 GLN 30 HB1 GLN 30 13.042 -14.172 1.090 888 HG2 GLN 30 HG2 GLN 30 10.668 -14.752 1.045 889 HG3 GLN 30 HG1 GLN 30 11.014 -16.190 0.083 890 HE21 GLN 30 HE21 GLN 30 9.744 -16.425 2.615 891 HE22 GLN 30 HE22 GLN 30 10.814 -17.178 3.698 892 H GLN 31 HN GLN 31 12.824 -11.856 0.054 893 HA GLN 31 HA GLN 31 10.132 -11.122 0.685 894 HB2 GLN 31 HB2 GLN 31 12.647 -9.498 0.208 895 HB3 GLN 31 HB1 GLN 31 11.126 -8.767 0.721 896 HG2 GLN 31 HG2 GLN 31 12.394 -11.069 2.219 897 HG3 GLN 31 HG1 GLN 31 12.773 -9.385 2.584 898 HE21 GLN 31 HE21 GLN 31 10.187 -8.231 2.187 899 HE22 GLN 31 HE22 GLN 31 9.136 -8.839 3.375 900 H LEU 32 HN LEU 32 12.160 -10.519 -2.167 901 HA LEU 32 HA LEU 32 10.331 -8.776 -3.506 902 HB2 LEU 32 HB2 LEU 32 12.770 -9.207 -4.111 903 HB3 LEU 32 HB1 LEU 32 12.231 -10.720 -4.831 904 HG LEU 32 HG LEU 32 10.518 -9.213 -6.129 905 HD11 LEU 32 HD11 LEU 32 11.512 -6.952 -6.615 906 HD12 LEU 32 HD12 LEU 32 12.631 -7.206 -5.283 907 HD13 LEU 32 HD13 LEU 32 10.898 -7.113 -4.974 908 HD21 LEU 32 HD21 LEU 32 13.488 -9.376 -6.681 909 HD22 LEU 32 HD22 LEU 32 12.350 -8.691 -7.843 910 HD23 LEU 32 HD23 LEU 32 12.200 -10.377 -7.352 911 H CYS 33 HN CYS 33 10.723 -12.299 -3.536 912 HA CYS 33 HA CYS 33 8.804 -12.874 -5.564 913 HB2 CYS 33 HB2 CYS 33 9.681 -14.494 -3.155 914 HB3 CYS 33 HB1 CYS 33 8.716 -15.134 -4.486 915 HG CYS 33 HG CYS 33 11.504 -13.888 -5.127 916 H ASN 34 HN ASN 34 8.479 -12.305 -2.097 917 HA ASN 34 HA ASN 34 5.753 -13.111 -1.814 918 HB2 ASN 34 HB2 ASN 34 7.131 -12.705 0.139 919 HB3 ASN 34 HB1 ASN 34 7.392 -11.029 -0.340 920 HD21 ASN 34 HD21 ASN 34 5.720 -12.713 1.882 921 HD22 ASN 34 HD22 ASN 34 4.317 -11.765 2.012 922 H ILE 35 HN ILE 35 7.252 -10.044 -2.761 923 HA ILE 35 HA ILE 35 4.857 -8.485 -2.855 924 HB ILE 35 HB ILE 35 7.452 -8.271 -4.411 925 HG12 ILE 35 HG12 ILE 35 6.428 -6.669 -2.047 926 HG13 ILE 35 HG11 ILE 35 7.498 -8.059 -1.883 927 HG21 ILE 35 HG21 ILE 35 6.655 -5.840 -4.664 928 HG22 ILE 35 HG22 ILE 35 5.055 -6.436 -4.223 929 HG23 ILE 35 HG23 ILE 35 5.851 -7.041 -5.675 930 HD11 ILE 35 HD11 ILE 35 9.025 -6.795 -3.587 931 HD12 ILE 35 HD12 ILE 35 9.002 -6.252 -1.913 932 HD13 ILE 35 HD13 ILE 35 8.077 -5.379 -3.134 933 H GLU 36 HN GLU 36 6.533 -10.426 -5.326 934 HA GLU 36 HA GLU 36 4.669 -9.817 -7.438 935 HB2 GLU 36 HB2 GLU 36 7.102 -10.883 -7.477 936 HB3 GLU 36 HB1 GLU 36 6.219 -12.403 -7.370 937 HG2 GLU 36 HG2 GLU 36 6.497 -11.982 -9.700 938 HG3 GLU 36 HG1 GLU 36 4.821 -11.559 -9.344 939 H GLN 37 HN GLN 37 4.840 -12.301 -4.949 940 HA GLN 37 HA GLN 37 2.450 -13.688 -6.020 941 HB2 GLN 37 HB2 GLN 37 4.229 -14.231 -3.620 942 HB3 GLN 37 HB1 GLN 37 2.878 -15.251 -4.114 943 HG2 GLN 37 HG2 GLN 37 5.261 -14.590 -5.873 944 HG3 GLN 37 HG1 GLN 37 5.085 -16.085 -4.953 945 HE21 GLN 37 HE21 GLN 37 3.175 -17.489 -5.532 946 HE22 GLN 37 HE22 GLN 37 2.549 -17.417 -7.108 947 H SER 38 HN SER 38 2.693 -10.893 -4.594 948 HA SER 38 HA SER 38 1.354 -10.998 -2.109 949 HB2 SER 38 HB2 SER 38 2.364 -8.936 -2.937 950 HB3 SER 38 HB1 SER 38 1.230 -8.891 -4.284 951 HG SER 38 HG SER 38 -0.243 -8.114 -2.996 952 H GLU 39 HN GLU 39 -0.770 -11.255 -1.540 953 HA GLU 39 HA GLU 39 -2.725 -11.790 -3.742 954 HB2 GLU 39 HB2 GLU 39 -2.058 -13.400 -1.650 955 HB3 GLU 39 HB1 GLU 39 -3.375 -12.504 -0.901 956 HG2 GLU 39 HG2 GLU 39 -4.311 -14.477 -1.939 957 HG3 GLU 39 HG1 GLU 39 -4.800 -13.087 -2.910 958 H THR 40 HN THR 40 -3.024 -10.638 -0.354 959 HA THR 40 HA THR 40 -5.086 -8.710 -1.293 960 HB THR 40 HB THR 40 -5.522 -8.411 1.144 961 HG1 THR 40 HG1 THR 40 -3.428 -8.912 1.869 962 HG21 THR 40 HG21 THR 40 -6.287 -10.816 1.513 963 HG22 THR 40 HG22 THR 40 -5.501 -11.201 -0.019 964 HG23 THR 40 HG23 THR 40 -6.843 -10.056 0.021 965 H ALA 41 HN ALA 41 -4.375 -6.726 -1.832 966 HA ALA 41 HA ALA 41 -1.769 -5.767 -1.047 967 HB1 ALA 41 HB1 ALA 41 -2.495 -5.002 -3.149 968 HB2 ALA 41 HB2 ALA 41 -2.714 -3.588 -2.120 969 HB3 ALA 41 HB3 ALA 41 -4.100 -4.592 -2.546 970 HA PRO 42 HA PRO 42 -2.836 -3.781 2.773 971 HB2 PRO 42 HB2 PRO 42 -1.099 -1.626 2.746 972 HB3 PRO 42 HB1 PRO 42 -0.613 -3.286 3.121 973 HG2 PRO 42 HG2 PRO 42 -0.323 -1.774 0.568 974 HG3 PRO 42 HG1 PRO 42 0.790 -2.916 1.334 975 HD2 PRO 42 HD2 PRO 42 -0.801 -3.608 -0.772 976 HD3 PRO 42 HD1 PRO 42 -0.301 -4.769 0.477 977 H VAL 43 HN VAL 43 -4.029 -2.036 3.649 978 HA VAL 43 HA VAL 43 -5.790 -0.664 1.838 979 HB VAL 43 HB VAL 43 -6.537 0.535 3.923 980 HG11 VAL 43 HG11 VAL 43 -7.279 -1.583 5.084 981 HG12 VAL 43 HG12 VAL 43 -6.234 -2.481 3.984 982 HG13 VAL 43 HG13 VAL 43 -7.598 -1.560 3.349 983 HG21 VAL 43 HG21 VAL 43 -5.499 0.113 6.010 984 HG22 VAL 43 HG22 VAL 43 -4.140 0.370 4.923 985 HG23 VAL 43 HG23 VAL 43 -4.598 -1.267 5.387 986 H VAL 44 HN VAL 44 -2.669 0.109 3.086 987 HA VAL 44 HA VAL 44 -2.730 2.930 3.148 988 HB VAL 44 HB VAL 44 -0.805 1.399 3.794 989 HG11 VAL 44 HG11 VAL 44 0.070 1.620 0.917 990 HG12 VAL 44 HG12 VAL 44 -0.933 0.274 1.436 991 HG13 VAL 44 HG13 VAL 44 0.646 0.522 2.172 992 HG21 VAL 44 HG21 VAL 44 -0.117 3.708 1.949 993 HG22 VAL 44 HG22 VAL 44 0.897 3.061 3.239 994 HG23 VAL 44 HG23 VAL 44 -0.614 3.883 3.632 995 H VAL 45 HN VAL 45 -2.301 0.732 0.385 996 HA VAL 45 HA VAL 45 -1.755 2.749 -1.565 997 HB VAL 45 HB VAL 45 -3.047 0.022 -1.846 998 HG11 VAL 45 HG11 VAL 45 -2.010 1.999 -3.887 999 HG12 VAL 45 HG12 VAL 45 -3.611 1.259 -3.810 1000 HG13 VAL 45 HG13 VAL 45 -2.208 0.281 -4.243 1001 HG21 VAL 45 HG21 VAL 45 -0.198 0.992 -2.241 1002 HG22 VAL 45 HG22 VAL 45 -0.774 -0.637 -2.596 1003 HG23 VAL 45 HG23 VAL 45 -0.769 -0.045 -0.935 1004 H LYS 46 HN LYS 46 -4.790 1.230 -0.494 1005 HA LYS 46 HA LYS 46 -6.513 2.611 -2.311 1006 HB2 LYS 46 HB2 LYS 46 -7.011 1.482 0.457 1007 HB3 LYS 46 HB1 LYS 46 -8.287 2.081 -0.604 1008 HG2 LYS 46 HG2 LYS 46 -7.667 0.434 -2.315 1009 HG3 LYS 46 HG1 LYS 46 -6.348 -0.144 -1.298 1010 HD2 LYS 46 HD2 LYS 46 -7.997 -0.767 0.455 1011 HD3 LYS 46 HD1 LYS 46 -9.301 -0.255 -0.618 1012 HE2 LYS 46 HE2 LYS 46 -7.256 -2.363 -1.352 1013 HE3 LYS 46 HE1 LYS 46 -8.841 -2.734 -0.673 1014 HZ1 LYS 46 HZ1 LYS 46 -9.914 -2.023 -2.550 1015 HZ2 LYS 46 HZ2 LYS 46 -8.496 -2.661 -3.233 1016 HZ3 LYS 46 HZ3 LYS 46 -8.661 -0.983 -3.024 1017 H TYR 47 HN TYR 47 -5.374 3.399 0.962 1018 HA TYR 47 HA TYR 47 -6.926 5.765 1.334 1019 HB2 TYR 47 HB2 TYR 47 -5.650 4.578 3.127 1020 HB3 TYR 47 HB1 TYR 47 -4.152 5.166 2.404 1021 HD1 TYR 47 HD2 TYR 47 -7.411 6.309 3.814 1022 HD2 TYR 47 HD1 TYR 47 -3.334 7.329 2.922 1023 HE1 TYR 47 HE2 TYR 47 -7.684 8.458 5.017 1024 HE2 TYR 47 HE1 TYR 47 -3.609 9.475 4.134 1025 HH TYR 47 HH TYR 47 -5.036 10.452 5.850 1026 H ILE 48 HN ILE 48 -3.678 5.273 -0.033 1027 HA ILE 48 HA ILE 48 -3.082 8.028 -0.503 1028 HB ILE 48 HB ILE 48 -2.157 5.507 -1.913 1029 HG12 ILE 48 HG12 ILE 48 -0.679 7.286 0.042 1030 HG13 ILE 48 HG11 ILE 48 -1.607 5.880 0.554 1031 HG21 ILE 48 HG21 ILE 48 -0.233 7.062 -2.610 1032 HG22 ILE 48 HG22 ILE 48 -1.315 8.393 -2.186 1033 HG23 ILE 48 HG23 ILE 48 -1.764 7.262 -3.465 1034 HD11 ILE 48 HD11 ILE 48 -0.244 4.480 -1.033 1035 HD12 ILE 48 HD12 ILE 48 0.703 5.194 0.273 1036 HD13 ILE 48 HD13 ILE 48 0.757 5.899 -1.343 1037 H ALA 49 HN ALA 49 -4.625 5.554 -2.547 1038 HA ALA 49 HA ALA 49 -4.883 7.055 -4.922 1039 HB1 ALA 49 HB1 ALA 49 -6.947 5.611 -5.288 1040 HB2 ALA 49 HB2 ALA 49 -6.659 4.952 -3.678 1041 HB3 ALA 49 HB3 ALA 49 -5.455 4.733 -4.948 1042 H PHE 50 HN PHE 50 -6.907 7.031 -2.016 1043 HA PHE 50 HA PHE 50 -9.011 8.663 -3.044 1044 HB2 PHE 50 HB2 PHE 50 -8.811 7.307 -0.805 1045 HB3 PHE 50 HB1 PHE 50 -8.109 8.790 -0.162 1046 HD1 PHE 50 HD1 PHE 50 -11.033 7.621 -2.191 1047 HD2 PHE 50 HD2 PHE 50 -9.563 10.422 0.714 1048 HE1 PHE 50 HE1 PHE 50 -13.314 8.553 -1.939 1049 HE2 PHE 50 HE2 PHE 50 -11.848 11.358 0.965 1050 HZ PHE 50 HZ PHE 50 -13.723 10.422 -0.361 1051 H LEU 51 HN LEU 51 -6.039 9.520 -1.253 1052 HA LEU 51 HA LEU 51 -6.511 12.352 -1.254 1053 HB2 LEU 51 HB2 LEU 51 -3.929 10.773 -1.100 1054 HB3 LEU 51 HB1 LEU 51 -4.059 12.502 -0.785 1055 HG LEU 51 HG LEU 51 -5.585 10.355 0.720 1056 HD11 LEU 51 HD11 LEU 51 -3.354 10.066 1.399 1057 HD12 LEU 51 HD12 LEU 51 -3.989 11.186 2.603 1058 HD13 LEU 51 HD13 LEU 51 -2.989 11.788 1.282 1059 HD21 LEU 51 HD21 LEU 51 -5.745 12.455 2.347 1060 HD22 LEU 51 HD22 LEU 51 -6.880 12.275 1.016 1061 HD23 LEU 51 HD23 LEU 51 -5.502 13.364 0.854 1062 H ARG 52 HN ARG 52 -4.770 10.223 -3.505 1063 HA ARG 52 HA ARG 52 -3.719 12.298 -5.174 1064 HB2 ARG 52 HB2 ARG 52 -4.448 9.417 -5.756 1065 HB3 ARG 52 HB1 ARG 52 -3.624 10.461 -6.913 1066 HG2 ARG 52 HG2 ARG 52 -1.849 10.854 -5.156 1067 HG3 ARG 52 HG1 ARG 52 -2.630 9.609 -4.180 1068 HD2 ARG 52 HD2 ARG 52 -1.432 9.256 -6.948 1069 HD3 ARG 52 HD1 ARG 52 -0.824 8.577 -5.439 1070 HE ARG 52 HE ARG 52 -3.492 7.690 -5.748 1071 HH11 ARG 52 HH21 ARG 52 -0.399 7.423 -7.250 1072 HH12 ARG 52 HH22 ARG 52 -0.711 5.852 -7.910 1073 HH21 ARG 52 HH11 ARG 52 -3.915 5.648 -6.608 1074 HH22 ARG 52 HH12 ARG 52 -2.700 4.847 -7.547 1075 H SER 53 HN SER 53 -6.796 10.541 -5.186 1076 HA SER 53 HA SER 53 -7.793 11.517 -7.671 1077 HB2 SER 53 HB2 SER 53 -9.984 10.882 -6.826 1078 HB3 SER 53 HB1 SER 53 -8.811 9.670 -6.317 1079 HG SER 53 HG SER 53 -9.186 10.205 -4.323 1080 H LYS 54 HN LYS 54 -7.292 13.085 -4.640 1081 HA LYS 54 HA LYS 54 -9.156 15.301 -5.314 1082 HB2 LYS 54 HB2 LYS 54 -7.420 14.742 -2.885 1083 HB3 LYS 54 HB1 LYS 54 -8.460 16.159 -3.059 1084 HG2 LYS 54 HG2 LYS 54 -10.429 14.704 -3.311 1085 HG3 LYS 54 HG1 LYS 54 -9.402 13.276 -3.187 1086 HD2 LYS 54 HD2 LYS 54 -8.710 14.000 -0.912 1087 HD3 LYS 54 HD1 LYS 54 -9.811 15.374 -1.036 1088 HE2 LYS 54 HE2 LYS 54 -10.623 12.455 -1.211 1089 HE3 LYS 54 HE1 LYS 54 -10.859 13.498 0.190 1090 HZ1 LYS 54 HZ1 LYS 54 -12.213 13.542 -2.410 1091 HZ2 LYS 54 HZ2 LYS 54 -12.021 15.007 -1.573 1092 HZ3 LYS 54 HZ3 LYS 54 -12.862 13.718 -0.853 1093 H GLY 55 HN GLY 55 -6.131 14.411 -6.209 1094 HA2 GLY 55 HA2 GLY 55 -4.467 15.625 -7.339 1095 HA3 GLY 55 HA1 GLY 55 -5.450 17.072 -7.124 1096 H VAL 56 HN VAL 56 -4.543 15.170 -4.317 1097 HA VAL 56 HA VAL 56 -3.369 17.415 -3.005 1098 HB VAL 56 HB VAL 56 -3.104 14.442 -2.517 1099 HG11 VAL 56 HG11 VAL 56 -1.943 16.809 -1.052 1100 HG12 VAL 56 HG12 VAL 56 -1.179 15.275 -1.468 1101 HG13 VAL 56 HG13 VAL 56 -2.372 15.340 -0.173 1102 HG21 VAL 56 HG21 VAL 56 -5.334 15.666 -2.265 1103 HG22 VAL 56 HG22 VAL 56 -4.583 16.556 -0.939 1104 HG23 VAL 56 HG23 VAL 56 -4.762 14.805 -0.837 1105 H ASP 57 HN ASP 57 -2.217 15.743 -5.590 1106 HA ASP 57 HA ASP 57 -0.143 15.611 -6.651 1107 HB2 ASP 57 HB2 ASP 57 0.366 17.957 -4.799 1108 HB3 ASP 57 HB1 ASP 57 1.502 17.421 -6.029 1109 H LEU 58 HN LEU 58 -0.090 13.508 -5.359 1110 HA LEU 58 HA LEU 58 1.683 13.408 -3.045 1111 HB2 LEU 58 HB2 LEU 58 -0.251 11.784 -3.729 1112 HB3 LEU 58 HB1 LEU 58 0.956 11.041 -4.774 1113 HG LEU 58 HG LEU 58 2.428 11.108 -2.534 1114 HD11 LEU 58 HD11 LEU 58 0.672 12.313 -1.254 1115 HD12 LEU 58 HD12 LEU 58 1.058 10.750 -0.537 1116 HD13 LEU 58 HD13 LEU 58 -0.416 10.945 -1.485 1117 HD21 LEU 58 HD21 LEU 58 2.152 8.980 -3.405 1118 HD22 LEU 58 HD22 LEU 58 0.404 9.123 -3.519 1119 HD23 LEU 58 HD23 LEU 58 1.163 8.815 -1.957 1120 H ASN 59 HN ASN 59 2.226 13.942 -6.242 1121 HA ASN 59 HA ASN 59 4.395 12.216 -6.914 1122 HB2 ASN 59 HB2 ASN 59 4.129 15.104 -7.789 1123 HB3 ASN 59 HB1 ASN 59 4.844 13.760 -8.682 1124 HD21 ASN 59 HD21 ASN 59 3.287 12.030 -9.455 1125 HD22 ASN 59 HD22 ASN 59 1.668 12.454 -9.734 1126 H ALA 60 HN ALA 60 4.321 15.393 -5.321 1127 HA ALA 60 HA ALA 60 7.182 15.671 -5.124 1128 HB1 ALA 60 HB1 ALA 60 6.706 17.545 -3.685 1129 HB2 ALA 60 HB2 ALA 60 5.087 16.936 -3.341 1130 HB3 ALA 60 HB3 ALA 60 5.479 17.534 -4.953 1131 H LEU 61 HN LEU 61 4.698 14.397 -2.933 1132 HA LEU 61 HA LEU 61 6.346 14.121 -0.642 1133 HB2 LEU 61 HB2 LEU 61 3.780 13.788 -0.938 1134 HB3 LEU 61 HB1 LEU 61 4.183 12.132 -1.365 1135 HG LEU 61 HG LEU 61 5.221 13.396 1.189 1136 HD11 LEU 61 HD11 LEU 61 3.268 12.167 2.289 1137 HD12 LEU 61 HD12 LEU 61 2.541 12.095 0.684 1138 HD13 LEU 61 HD13 LEU 61 2.873 13.658 1.432 1139 HD21 LEU 61 HD21 LEU 61 6.342 11.350 0.724 1140 HD22 LEU 61 HD22 LEU 61 4.867 10.566 0.162 1141 HD23 LEU 61 HD23 LEU 61 5.084 10.912 1.874 1142 H PHE 62 HN PHE 62 5.587 11.694 -3.164 1143 HA PHE 62 HA PHE 62 7.333 9.680 -2.129 1144 HB2 PHE 62 HB2 PHE 62 5.902 10.207 -4.693 1145 HB3 PHE 62 HB1 PHE 62 7.279 9.115 -4.808 1146 HD1 PHE 62 HD2 PHE 62 4.574 9.700 -2.260 1147 HD2 PHE 62 HD1 PHE 62 6.625 6.876 -4.765 1148 HE1 PHE 62 HE2 PHE 62 3.199 7.863 -1.321 1149 HE2 PHE 62 HE1 PHE 62 5.248 5.042 -3.826 1150 HZ PHE 62 HZ PHE 62 3.536 5.535 -2.103 1151 H ASP 63 HN ASP 63 7.868 12.337 -4.411 1152 HA ASP 63 HA ASP 63 10.455 11.573 -5.272 1153 HB2 ASP 63 HB2 ASP 63 9.069 14.234 -4.959 1154 HB3 ASP 63 HB1 ASP 63 10.753 14.159 -5.478 1155 H ARG 64 HN ARG 64 9.329 12.811 -2.213 1156 HA ARG 64 HA ARG 64 12.045 13.557 -1.348 1157 HB2 ARG 64 HB2 ARG 64 9.817 14.685 -0.655 1158 HB3 ARG 64 HB1 ARG 64 9.607 13.304 0.421 1159 HG2 ARG 64 HG2 ARG 64 11.562 13.835 1.664 1160 HG3 ARG 64 HG1 ARG 64 12.139 14.966 0.440 1161 HD2 ARG 64 HD2 ARG 64 9.603 15.331 2.050 1162 HD3 ARG 64 HD1 ARG 64 11.140 16.124 2.406 1163 HE ARG 64 HE ARG 64 10.433 16.629 -0.319 1164 HH11 ARG 64 HH21 ARG 64 9.541 17.378 2.928 1165 HH12 ARG 64 HH22 ARG 64 8.862 18.919 2.522 1166 HH21 ARG 64 HH11 ARG 64 9.547 18.630 -0.863 1167 HH22 ARG 64 HH12 ARG 64 8.865 19.629 0.378 1168 H ILE 65 HN ILE 65 9.821 10.835 -1.044 1169 HA ILE 65 HA ILE 65 11.278 9.520 1.097 1170 HB ILE 65 HB ILE 65 9.463 8.244 -0.961 1171 HG12 ILE 65 HG12 ILE 65 8.263 10.090 0.018 1172 HG13 ILE 65 HG11 ILE 65 7.680 8.616 0.772 1173 HG21 ILE 65 HG21 ILE 65 9.016 6.687 0.965 1174 HG22 ILE 65 HG22 ILE 65 10.313 7.490 1.850 1175 HG23 ILE 65 HG23 ILE 65 10.671 6.616 0.360 1176 HD11 ILE 65 HD11 ILE 65 9.482 9.113 2.592 1177 HD12 ILE 65 HD12 ILE 65 7.996 10.058 2.599 1178 HD13 ILE 65 HD13 ILE 65 9.471 10.745 1.925 1179 H ILE 66 HN ILE 66 11.260 9.191 -2.443 1180 HA ILE 66 HA ILE 66 12.988 6.975 -2.678 1181 HB ILE 66 HB ILE 66 13.532 7.886 -4.931 1182 HG12 ILE 66 HG12 ILE 66 11.912 10.273 -4.005 1183 HG13 ILE 66 HG11 ILE 66 13.659 10.282 -4.214 1184 HG21 ILE 66 HG21 ILE 66 10.612 8.346 -4.301 1185 HG22 ILE 66 HG22 ILE 66 11.323 6.733 -4.340 1186 HG23 ILE 66 HG23 ILE 66 11.315 7.730 -5.795 1187 HD11 ILE 66 HD11 ILE 66 13.362 9.678 -6.603 1188 HD12 ILE 66 HD12 ILE 66 12.576 11.207 -6.210 1189 HD13 ILE 66 HD13 ILE 66 11.613 9.740 -6.385 1190 H VAL 67 HN VAL 67 13.670 9.863 -1.178 1191 HA VAL 67 HA VAL 67 16.164 10.738 -1.922 1192 HB VAL 67 HB VAL 67 14.770 11.460 0.079 1193 HG11 VAL 67 HG11 VAL 67 15.038 10.400 2.172 1194 HG12 VAL 67 HG12 VAL 67 16.424 9.462 1.614 1195 HG13 VAL 67 HG13 VAL 67 14.801 9.065 1.042 1196 HG21 VAL 67 HG21 VAL 67 16.894 12.034 1.428 1197 HG22 VAL 67 HG22 VAL 67 16.798 12.603 -0.238 1198 HG23 VAL 67 HG23 VAL 67 17.758 11.182 0.153 1199 H ASN 68 HN ASN 68 18.117 9.824 -2.204 1200 HA ASN 68 HA ASN 68 18.565 7.043 -1.295 1201 HB2 ASN 68 HB2 ASN 68 20.472 7.080 -2.797 1202 HB3 ASN 68 HB1 ASN 68 19.089 7.776 -3.642 1203 HD21 ASN 68 HD21 ASN 68 22.058 8.698 -1.845 1204 HD22 ASN 68 HD22 ASN 68 22.220 10.215 -2.590 1205 H LYS 69 HN LYS 69 18.714 9.746 0.324 1206 HA LYS 69 HA LYS 69 21.491 9.737 1.252 1207 HB2 LYS 69 HB2 LYS 69 19.008 11.194 2.192 1208 HB3 LYS 69 HB1 LYS 69 20.595 11.392 2.939 1209 HG2 LYS 69 HG2 LYS 69 21.533 12.114 0.779 1210 HG3 LYS 69 HG1 LYS 69 19.960 11.901 0.016 1211 HD2 LYS 69 HD2 LYS 69 18.995 13.594 1.539 1212 HD3 LYS 69 HD1 LYS 69 20.578 13.818 2.282 1213 HE2 LYS 69 HE2 LYS 69 21.505 14.534 0.116 1214 HE3 LYS 69 HE1 LYS 69 19.931 14.297 -0.642 1215 HZ1 LYS 69 HZ1 LYS 69 20.799 16.599 0.488 1216 HZ2 LYS 69 HZ2 LYS 69 19.829 15.935 1.714 1217 HZ3 LYS 69 HZ3 LYS 69 19.178 16.214 0.170 1218 H LEU 70 HN LEU 70 21.966 7.806 2.253 1219 HA LEU 70 HA LEU 70 21.735 5.976 3.726 1220 HB2 LEU 70 HB2 LEU 70 21.083 8.294 5.570 1221 HB3 LEU 70 HB1 LEU 70 21.689 6.713 6.066 1222 HG LEU 70 HG LEU 70 23.149 8.654 4.244 1223 HD11 LEU 70 HD11 LEU 70 24.669 8.969 6.144 1224 HD12 LEU 70 HD12 LEU 70 23.701 7.865 7.120 1225 HD13 LEU 70 HD13 LEU 70 23.025 9.409 6.602 1226 HD21 LEU 70 HD21 LEU 70 23.955 6.541 3.611 1227 HD22 LEU 70 HD22 LEU 70 23.744 5.864 5.227 1228 HD23 LEU 70 HD23 LEU 70 25.073 6.974 4.901 1229 H GLU 71 HN GLU 71 19.868 4.994 2.791 1230 HA GLU 71 HA GLU 71 17.214 5.699 3.893 1231 HB2 GLU 71 HB2 GLU 71 18.105 3.656 1.839 1232 HB3 GLU 71 HB1 GLU 71 16.428 3.891 2.333 1233 HG2 GLU 71 HG2 GLU 71 16.670 6.322 1.663 1234 HG3 GLU 71 HG1 GLU 71 18.243 5.905 0.979 1235 H HIS 72 HN HIS 72 19.756 3.924 4.990 1236 HA HIS 72 HA HIS 72 18.465 1.474 5.778 1237 HB2 HIS 72 HB2 HIS 72 21.008 2.078 5.722 1238 HB3 HIS 72 HB1 HIS 72 20.727 2.730 7.335 1239 HD2 HIS 72 HD2 HIS 72 19.630 -0.749 5.691 1240 HE1 HIS 72 HE1 HIS 72 21.211 -1.459 9.542 1241 HE2 HIS 72 HE2 HIS 72 20.181 -2.548 7.495 1242 H HIS 73 HN HIS 73 17.385 4.355 6.491 1243 HA HIS 73 HA HIS 73 17.154 4.231 9.404 1244 HB2 HIS 73 HB2 HIS 73 15.891 5.951 7.257 1245 HB3 HIS 73 HB1 HIS 73 15.470 6.106 8.962 1246 HD2 HIS 73 HD2 HIS 73 19.165 5.344 8.821 1247 HE1 HIS 73 HE1 HIS 73 18.909 9.559 8.733 1248 HE2 HIS 73 HE2 HIS 73 20.475 7.588 9.053 1249 H HIS 74 HN HIS 74 15.674 2.697 6.785 1250 HA HIS 74 HA HIS 74 13.052 2.400 8.153 1251 HB2 HIS 74 HB2 HIS 74 13.937 1.257 5.497 1252 HB3 HIS 74 HB1 HIS 74 12.288 1.407 6.106 1253 HD2 HIS 74 HD2 HIS 74 11.760 4.387 6.718 1254 HE1 HIS 74 HE1 HIS 74 14.036 5.483 3.332 1255 HE2 HIS 74 HE2 HIS 74 12.340 6.295 5.037 1256 H HIS 75 HN HIS 75 13.331 0.948 9.816 1257 HA HIS 75 HA HIS 75 14.784 -1.591 9.305 1258 HB2 HIS 75 HB2 HIS 75 15.250 -0.592 11.445 1259 HB3 HIS 75 HB1 HIS 75 13.540 -0.348 11.778 1260 HD2 HIS 75 HD2 HIS 75 12.210 -3.230 11.668 1261 HE1 HIS 75 HE1 HIS 75 15.569 -4.738 13.723 1262 HE2 HIS 75 HE2 HIS 75 13.196 -5.240 12.986 1263 H HIS 76 HN HIS 76 13.615 -3.311 8.537 1264 HA HIS 76 HA HIS 76 11.013 -3.961 9.608 1265 HB2 HIS 76 HB2 HIS 76 9.707 -2.727 8.194 1266 HB3 HIS 76 HB1 HIS 76 11.109 -2.219 7.261 1267 HD2 HIS 76 HD2 HIS 76 7.976 -4.211 6.628 1268 HE1 HIS 76 HE1 HIS 76 10.826 -5.882 3.996 1269 HE2 HIS 76 HE2 HIS 76 8.359 -5.774 4.573 1270 H HIS 77 HN HIS 77 10.473 -6.096 9.124 1271 HA HIS 77 HA HIS 77 12.549 -7.859 8.276 1272 HB2 HIS 77 HB2 HIS 77 10.543 -8.417 9.720 1273 HB3 HIS 77 HB1 HIS 77 9.575 -8.424 8.247 1274 HD2 HIS 77 HD2 HIS 77 11.902 -10.790 10.188 1275 HE1 HIS 77 HE1 HIS 77 11.325 -12.532 6.385 1276 HE2 HIS 77 HE2 HIS 77 12.239 -12.919 8.719 Start of MODEL 9 1 H1 MET 1 HT1 MET 1 10.704 13.760 7.290 2 H2 MET 1 HT2 MET 1 12.075 12.786 7.534 3 H3 MET 1 HT3 MET 1 12.073 14.403 8.057 4 HA MET 1 HA MET 1 11.765 12.755 9.870 5 HB2 MET 1 HB2 MET 1 9.319 14.488 9.510 6 HB3 MET 1 HB1 MET 1 10.180 14.103 10.999 7 HG2 MET 1 HG2 MET 1 10.892 16.303 10.504 8 HG3 MET 1 HG1 MET 1 12.204 15.296 9.900 9 HE1 MET 1 HE1 MET 1 9.013 16.984 9.346 10 HE2 MET 1 HE2 MET 1 8.542 16.037 7.938 11 HE3 MET 1 HE3 MET 1 9.067 17.706 7.735 12 H GLU 2 HN GLU 2 11.314 10.820 8.256 13 HA GLU 2 HA GLU 2 10.023 8.933 7.825 14 HB2 GLU 2 HB2 GLU 2 8.084 9.949 9.907 15 HB3 GLU 2 HB1 GLU 2 8.405 8.281 9.433 16 HG2 GLU 2 HG2 GLU 2 10.901 8.958 10.213 17 HG3 GLU 2 HG1 GLU 2 9.996 10.090 11.217 18 H LEU 3 HN LEU 3 8.345 8.331 6.490 19 HA LEU 3 HA LEU 3 7.128 10.343 4.868 20 HB2 LEU 3 HB2 LEU 3 7.628 8.046 4.103 21 HB3 LEU 3 HB1 LEU 3 6.387 7.415 5.180 22 HG LEU 3 HG LEU 3 5.472 9.581 3.330 23 HD11 LEU 3 HD11 LEU 3 6.973 8.298 1.841 24 HD12 LEU 3 HD12 LEU 3 5.281 8.063 1.403 25 HD13 LEU 3 HD13 LEU 3 6.143 6.809 2.294 26 HD21 LEU 3 HD21 LEU 3 3.893 8.377 4.795 27 HD22 LEU 3 HD22 LEU 3 4.388 6.842 4.085 28 HD23 LEU 3 HD23 LEU 3 3.535 8.033 3.105 29 H SER 4 HN SER 4 5.857 8.400 7.559 30 HA SER 4 HA SER 4 3.130 9.062 7.340 31 HB2 SER 4 HB2 SER 4 2.967 8.564 9.712 32 HB3 SER 4 HB1 SER 4 4.109 7.441 8.978 33 HG SER 4 HG SER 4 5.707 9.174 9.615 34 H ASN 5 HN ASN 5 5.773 10.938 8.813 35 HA ASN 5 HA ASN 5 4.112 12.956 9.973 36 HB2 ASN 5 HB2 ASN 5 6.619 12.543 10.358 37 HB3 ASN 5 HB1 ASN 5 6.884 13.440 8.863 38 HD21 ASN 5 HD21 ASN 5 7.366 15.587 9.315 39 HD22 ASN 5 HD22 ASN 5 6.675 16.504 10.565 40 H GLU 6 HN GLU 6 5.749 12.800 6.802 41 HA GLU 6 HA GLU 6 4.693 15.339 5.910 42 HB2 GLU 6 HB2 GLU 6 6.724 13.903 5.018 43 HB3 GLU 6 HB1 GLU 6 5.502 13.144 4.002 44 HG2 GLU 6 HG2 GLU 6 6.392 14.961 2.729 45 HG3 GLU 6 HG1 GLU 6 4.811 15.497 3.300 46 H LEU 7 HN LEU 7 3.718 11.953 5.446 47 HA LEU 7 HA LEU 7 1.539 12.449 3.665 48 HB2 LEU 7 HB2 LEU 7 2.547 10.202 4.125 49 HB3 LEU 7 HB1 LEU 7 1.827 10.238 5.731 50 HG LEU 7 HG LEU 7 -0.431 10.450 4.663 51 HD11 LEU 7 HD11 LEU 7 -0.353 9.619 2.152 52 HD12 LEU 7 HD12 LEU 7 1.267 10.315 2.178 53 HD13 LEU 7 HD13 LEU 7 -0.135 11.328 2.518 54 HD21 LEU 7 HD21 LEU 7 -0.372 8.051 3.701 55 HD22 LEU 7 HD22 LEU 7 0.169 8.261 5.367 56 HD23 LEU 7 HD23 LEU 7 1.352 8.079 4.071 57 H LYS 8 HN LYS 8 1.741 12.296 7.211 58 HA LYS 8 HA LYS 8 -1.036 12.549 7.775 59 HB2 LYS 8 HB2 LYS 8 0.733 11.993 9.457 60 HB3 LYS 8 HB1 LYS 8 1.276 13.670 9.391 61 HG2 LYS 8 HG2 LYS 8 -0.916 14.442 10.152 62 HG3 LYS 8 HG1 LYS 8 -1.525 12.785 10.149 63 HD2 LYS 8 HD2 LYS 8 0.181 12.167 11.834 64 HD3 LYS 8 HD1 LYS 8 0.747 13.838 11.860 65 HE2 LYS 8 HE2 LYS 8 -2.100 13.013 12.490 66 HE3 LYS 8 HE1 LYS 8 -0.860 13.281 13.716 67 HZ1 LYS 8 HZ1 LYS 8 -1.081 15.410 11.792 68 HZ2 LYS 8 HZ2 LYS 8 -1.005 15.481 13.488 69 HZ3 LYS 8 HZ3 LYS 8 -2.488 15.184 12.711 70 H VAL 9 HN VAL 9 1.458 14.999 7.141 71 HA VAL 9 HA VAL 9 -0.118 17.298 7.743 72 HB VAL 9 HB VAL 9 2.148 16.874 5.774 73 HG11 VAL 9 HG11 VAL 9 0.985 18.791 4.943 74 HG12 VAL 9 HG12 VAL 9 2.301 19.433 5.929 75 HG13 VAL 9 HG13 VAL 9 0.659 19.388 6.572 76 HG21 VAL 9 HG21 VAL 9 3.524 17.799 7.487 77 HG22 VAL 9 HG22 VAL 9 2.474 16.651 8.316 78 HG23 VAL 9 HG23 VAL 9 2.130 18.380 8.399 79 H GLU 10 HN GLU 10 0.292 15.477 4.697 80 HA GLU 10 HA GLU 10 -1.308 17.123 3.043 81 HB2 GLU 10 HB2 GLU 10 -0.902 14.117 3.029 82 HB3 GLU 10 HB1 GLU 10 -1.710 15.000 1.733 83 HG2 GLU 10 HG2 GLU 10 1.029 15.879 2.645 84 HG3 GLU 10 HG1 GLU 10 0.874 14.506 1.552 85 H ARG 11 HN ARG 11 -2.261 14.461 5.222 86 HA ARG 11 HA ARG 11 -5.027 14.416 4.541 87 HB2 ARG 11 HB2 ARG 11 -3.720 12.805 6.074 88 HB3 ARG 11 HB1 ARG 11 -3.969 13.999 7.348 89 HG2 ARG 11 HG2 ARG 11 -6.397 13.860 7.053 90 HG3 ARG 11 HG1 ARG 11 -6.192 12.736 5.711 91 HD2 ARG 11 HD2 ARG 11 -4.770 11.424 7.647 92 HD3 ARG 11 HD1 ARG 11 -5.992 12.230 8.634 93 HE ARG 11 HE ARG 11 -7.098 10.877 6.294 94 HH11 ARG 11 HH21 ARG 11 -6.066 10.660 9.574 95 HH12 ARG 11 HH22 ARG 11 -7.053 9.284 9.933 96 HH21 ARG 11 HH11 ARG 11 -8.389 9.083 6.741 97 HH22 ARG 11 HH12 ARG 11 -8.371 8.389 8.328 98 H ILE 12 HN ILE 12 -3.233 16.323 6.947 99 HA ILE 12 HA ILE 12 -5.553 17.793 7.870 100 HB ILE 12 HB ILE 12 -2.584 18.381 8.074 101 HG12 ILE 12 HG12 ILE 12 -4.498 17.346 10.180 102 HG13 ILE 12 HG11 ILE 12 -3.525 16.278 9.167 103 HG21 ILE 12 HG21 ILE 12 -3.377 19.852 9.996 104 HG22 ILE 12 HG22 ILE 12 -5.009 19.678 9.348 105 HG23 ILE 12 HG23 ILE 12 -3.754 20.455 8.382 106 HD11 ILE 12 HD11 ILE 12 -2.463 16.820 11.385 107 HD12 ILE 12 HD12 ILE 12 -2.367 18.504 10.867 108 HD13 ILE 12 HD13 ILE 12 -1.472 17.259 9.992 109 H ARG 13 HN ARG 13 -3.297 18.149 5.218 110 HA ARG 13 HA ARG 13 -3.593 20.928 4.700 111 HB2 ARG 13 HB2 ARG 13 -1.946 19.436 3.561 112 HB3 ARG 13 HB1 ARG 13 -3.271 18.688 2.673 113 HG2 ARG 13 HG2 ARG 13 -3.834 20.856 1.658 114 HG3 ARG 13 HG1 ARG 13 -2.528 21.626 2.562 115 HD2 ARG 13 HD2 ARG 13 -2.116 19.322 0.638 116 HD3 ARG 13 HD1 ARG 13 -1.900 21.014 0.196 117 HE ARG 13 HE ARG 13 -0.125 19.428 1.937 118 HH11 ARG 13 HH21 ARG 13 -1.124 22.511 0.738 119 HH12 ARG 13 HH22 ARG 13 0.362 23.295 1.152 120 HH21 ARG 13 HH11 ARG 13 1.814 20.447 2.483 121 HH22 ARG 13 HH12 ARG 13 2.020 22.132 2.139 122 H LEU 14 HN LEU 14 -5.527 18.139 3.607 123 HA LEU 14 HA LEU 14 -7.605 20.026 2.570 124 HB2 LEU 14 HB2 LEU 14 -7.271 17.033 2.222 125 HB3 LEU 14 HB1 LEU 14 -8.590 17.985 1.542 126 HG LEU 14 HG LEU 14 -5.646 18.425 0.958 127 HD11 LEU 14 HD11 LEU 14 -6.630 16.295 0.046 128 HD12 LEU 14 HD12 LEU 14 -6.091 17.421 -1.201 129 HD13 LEU 14 HD13 LEU 14 -7.808 17.275 -0.828 130 HD21 LEU 14 HD21 LEU 14 -6.875 19.735 -1.018 131 HD22 LEU 14 HD22 LEU 14 -6.597 20.512 0.538 132 HD23 LEU 14 HD23 LEU 14 -8.183 19.837 0.161 133 H SER 15 HN SER 15 -6.811 18.593 5.396 134 HA SER 15 HA SER 15 -8.006 17.886 7.286 135 HB2 SER 15 HB2 SER 15 -10.218 19.215 7.535 136 HB3 SER 15 HB1 SER 15 -8.715 20.127 7.459 137 HG SER 15 HG SER 15 -9.113 20.369 5.199 138 H LEU 16 HN LEU 16 -8.267 15.686 6.271 139 HA LEU 16 HA LEU 16 -11.016 15.129 5.256 140 HB2 LEU 16 HB2 LEU 16 -8.398 13.665 5.165 141 HB3 LEU 16 HB1 LEU 16 -9.863 12.690 5.180 142 HG LEU 16 HG LEU 16 -10.696 14.107 3.235 143 HD11 LEU 16 HD11 LEU 16 -7.807 15.003 3.302 144 HD12 LEU 16 HD12 LEU 16 -9.230 16.025 3.506 145 HD13 LEU 16 HD13 LEU 16 -8.904 15.264 1.947 146 HD21 LEU 16 HD21 LEU 16 -9.148 12.940 1.605 147 HD22 LEU 16 HD22 LEU 16 -9.876 11.890 2.823 148 HD23 LEU 16 HD23 LEU 16 -8.200 12.416 2.997 149 H THR 17 HN THR 17 -12.255 13.380 6.214 150 HA THR 17 HA THR 17 -11.861 13.222 9.178 151 HB THR 17 HB THR 17 -14.291 12.349 9.041 152 HG1 THR 17 HG1 THR 17 -13.680 12.588 6.476 153 HG21 THR 17 HG21 THR 17 -13.911 14.543 9.893 154 HG22 THR 17 HG22 THR 17 -15.148 14.722 8.649 155 HG23 THR 17 HG23 THR 17 -13.477 15.163 8.300 156 H ALA 18 HN ALA 18 -11.421 11.274 10.115 157 HA ALA 18 HA ALA 18 -10.617 9.035 8.524 158 HB1 ALA 18 HB1 ALA 18 -10.530 7.833 10.724 159 HB2 ALA 18 HB2 ALA 18 -11.285 9.237 11.476 160 HB3 ALA 18 HB3 ALA 18 -9.688 9.379 10.744 161 H LYS 19 HN LYS 19 -13.613 9.769 10.273 162 HA LYS 19 HA LYS 19 -14.848 7.212 9.960 163 HB2 LYS 19 HB2 LYS 19 -15.663 9.025 11.474 164 HB3 LYS 19 HB1 LYS 19 -16.192 9.929 10.056 165 HG2 LYS 19 HG2 LYS 19 -17.703 8.111 9.423 166 HG3 LYS 19 HG1 LYS 19 -17.142 7.144 10.788 167 HD2 LYS 19 HD2 LYS 19 -17.951 8.891 12.346 168 HD3 LYS 19 HD1 LYS 19 -18.542 9.828 10.972 169 HE2 LYS 19 HE2 LYS 19 -19.442 7.023 11.692 170 HE3 LYS 19 HE1 LYS 19 -20.357 8.499 12.003 171 HZ1 LYS 19 HZ1 LYS 19 -21.229 8.077 10.002 172 HZ2 LYS 19 HZ2 LYS 19 -19.951 7.063 9.528 173 HZ3 LYS 19 HZ3 LYS 19 -19.794 8.750 9.400 174 H SER 20 HN SER 20 -15.052 10.155 7.931 175 HA SER 20 HA SER 20 -16.849 9.086 6.000 176 HB2 SER 20 HB2 SER 20 -14.637 11.106 5.514 177 HB3 SER 20 HB1 SER 20 -16.089 10.881 4.542 178 HG SER 20 HG SER 20 -17.317 11.658 6.188 179 H VAL 21 HN VAL 21 -13.282 9.091 6.075 180 HA VAL 21 HA VAL 21 -12.923 7.840 3.537 181 HB VAL 21 HB VAL 21 -11.189 7.795 6.023 182 HG11 VAL 21 HG11 VAL 21 -10.702 6.847 3.192 183 HG12 VAL 21 HG12 VAL 21 -10.467 5.953 4.695 184 HG13 VAL 21 HG13 VAL 21 -9.380 7.276 4.277 185 HG21 VAL 21 HG21 VAL 21 -11.733 10.013 4.890 186 HG22 VAL 21 HG22 VAL 21 -10.889 9.397 3.471 187 HG23 VAL 21 HG23 VAL 21 -10.018 9.615 4.987 188 H ALA 22 HN ALA 22 -13.124 6.422 6.813 189 HA ALA 22 HA ALA 22 -12.768 3.712 5.979 190 HB1 ALA 22 HB1 ALA 22 -13.973 3.192 8.163 191 HB2 ALA 22 HB2 ALA 22 -14.164 4.934 8.374 192 HB3 ALA 22 HB3 ALA 22 -12.551 4.223 8.310 193 H GLU 23 HN GLU 23 -15.738 5.631 6.490 194 HA GLU 23 HA GLU 23 -17.525 3.486 5.780 195 HB2 GLU 23 HB2 GLU 23 -17.908 6.499 5.758 196 HB3 GLU 23 HB1 GLU 23 -19.210 5.320 5.577 197 HG2 GLU 23 HG2 GLU 23 -17.322 5.382 7.945 198 HG3 GLU 23 HG1 GLU 23 -18.908 6.155 7.940 199 H GLU 24 HN GLU 24 -16.147 6.203 3.920 200 HA GLU 24 HA GLU 24 -17.532 5.582 1.474 201 HB2 GLU 24 HB2 GLU 24 -15.035 7.158 2.122 202 HB3 GLU 24 HB1 GLU 24 -15.584 6.947 0.459 203 HG2 GLU 24 HG2 GLU 24 -17.422 7.973 2.630 204 HG3 GLU 24 HG1 GLU 24 -16.405 9.054 1.676 205 H MET 25 HN MET 25 -14.266 4.753 2.652 206 HA MET 25 HA MET 25 -13.499 3.308 0.302 207 HB2 MET 25 HB2 MET 25 -12.556 3.214 3.167 208 HB3 MET 25 HB1 MET 25 -11.837 2.208 1.909 209 HG2 MET 25 HG2 MET 25 -11.299 4.223 0.598 210 HG3 MET 25 HG1 MET 25 -12.037 5.232 1.839 211 HE1 MET 25 HE1 MET 25 -9.550 1.959 2.435 212 HE2 MET 25 HE2 MET 25 -8.159 2.886 1.884 213 HE3 MET 25 HE3 MET 25 -9.564 2.715 0.838 214 H GLY 26 HN GLY 26 -15.105 2.314 3.304 215 HA2 GLY 26 HA2 GLY 26 -16.749 0.513 3.301 216 HA3 GLY 26 HA1 GLY 26 -15.894 -0.234 1.950 217 H ILE 27 HN ILE 27 -14.163 1.067 4.703 218 HA ILE 27 HA ILE 27 -13.614 -1.720 5.675 219 HB ILE 27 HB ILE 27 -11.306 -0.996 6.181 220 HG12 ILE 27 HG12 ILE 27 -12.002 1.507 4.621 221 HG13 ILE 27 HG11 ILE 27 -11.846 1.459 6.374 222 HG21 ILE 27 HG21 ILE 27 -11.961 -0.421 3.284 223 HG22 ILE 27 HG22 ILE 27 -11.980 -2.046 3.970 224 HG23 ILE 27 HG23 ILE 27 -10.478 -1.121 3.937 225 HD11 ILE 27 HD11 ILE 27 -9.749 2.219 5.311 226 HD12 ILE 27 HD12 ILE 27 -9.667 0.708 4.406 227 HD13 ILE 27 HD13 ILE 27 -9.520 0.691 6.163 228 H SER 28 HN SER 28 -12.896 -1.761 7.964 229 HA SER 28 HA SER 28 -14.638 -0.105 9.590 230 HB2 SER 28 HB2 SER 28 -14.016 -1.509 11.367 231 HB3 SER 28 HB1 SER 28 -13.844 -2.569 9.969 232 HG SER 28 HG SER 28 -11.577 -1.421 10.069 233 H ARG 29 HN ARG 29 -13.887 1.264 11.347 234 HA ARG 29 HA ARG 29 -11.816 3.090 10.565 235 HB2 ARG 29 HB2 ARG 29 -13.414 2.700 13.099 236 HB3 ARG 29 HB1 ARG 29 -12.109 3.886 13.026 237 HG2 ARG 29 HG2 ARG 29 -13.166 5.019 11.155 238 HG3 ARG 29 HG1 ARG 29 -14.413 3.779 11.058 239 HD2 ARG 29 HD2 ARG 29 -14.065 5.226 13.665 240 HD3 ARG 29 HD1 ARG 29 -14.868 6.069 12.340 241 HE ARG 29 HE ARG 29 -16.148 3.618 12.421 242 HH11 ARG 29 HH21 ARG 29 -15.362 6.074 14.706 243 HH12 ARG 29 HH22 ARG 29 -16.809 5.861 15.634 244 HH21 ARG 29 HH11 ARG 29 -18.051 3.339 13.607 245 HH22 ARG 29 HH12 ARG 29 -18.333 4.314 15.011 246 H GLN 30 HN GLN 30 -11.831 0.177 12.488 247 HA GLN 30 HA GLN 30 -9.399 0.576 13.929 248 HB2 GLN 30 HB2 GLN 30 -10.651 -1.975 12.852 249 HB3 GLN 30 HB1 GLN 30 -9.303 -1.930 13.991 250 HG2 GLN 30 HG2 GLN 30 -11.975 -0.601 14.501 251 HG3 GLN 30 HG1 GLN 30 -11.552 -2.209 15.088 252 HE21 GLN 30 HE21 GLN 30 -8.926 -1.909 15.939 253 HE22 GLN 30 HE22 GLN 30 -8.833 -0.739 17.164 254 H GLN 31 HN GLN 31 -10.014 -0.831 10.704 255 HA GLN 31 HA GLN 31 -7.257 -1.415 10.142 256 HB2 GLN 31 HB2 GLN 31 -9.604 -0.876 8.293 257 HB3 GLN 31 HB1 GLN 31 -8.029 -1.458 7.751 258 HG2 GLN 31 HG2 GLN 31 -8.247 -3.451 9.154 259 HG3 GLN 31 HG1 GLN 31 -9.786 -2.861 9.782 260 HE21 GLN 31 HE21 GLN 31 -8.494 -4.913 7.466 261 HE22 GLN 31 HE22 GLN 31 -9.801 -4.953 6.384 262 H LEU 32 HN LEU 32 -9.331 1.382 9.419 263 HA LEU 32 HA LEU 32 -7.355 2.863 7.975 264 HB2 LEU 32 HB2 LEU 32 -9.769 3.410 7.932 265 HB3 LEU 32 HB1 LEU 32 -9.696 3.867 9.631 266 HG LEU 32 HG LEU 32 -8.108 5.668 9.095 267 HD11 LEU 32 HD11 LEU 32 -8.266 4.422 6.357 268 HD12 LEU 32 HD12 LEU 32 -6.853 5.007 7.236 269 HD13 LEU 32 HD13 LEU 32 -7.967 6.154 6.497 270 HD21 LEU 32 HD21 LEU 32 -10.463 6.231 9.046 271 HD22 LEU 32 HD22 LEU 32 -10.632 5.586 7.416 272 HD23 LEU 32 HD23 LEU 32 -9.690 7.050 7.689 273 H CYS 33 HN CYS 33 -8.223 2.743 11.416 274 HA CYS 33 HA CYS 33 -6.483 4.817 12.312 275 HB2 CYS 33 HB2 CYS 33 -7.480 2.329 13.733 276 HB3 CYS 33 HB1 CYS 33 -6.645 3.661 14.533 277 HG CYS 33 HG CYS 33 -9.515 3.793 13.356 278 H ASN 34 HN ASN 34 -5.908 1.387 11.649 279 HA ASN 34 HA ASN 34 -3.353 1.185 12.898 280 HB2 ASN 34 HB2 ASN 34 -4.606 -0.250 10.547 281 HB3 ASN 34 HB1 ASN 34 -2.981 -0.638 11.114 282 HD21 ASN 34 HD21 ASN 34 -5.093 -2.559 11.286 283 HD22 ASN 34 HD22 ASN 34 -5.451 -2.819 12.925 284 H ILE 35 HN ILE 35 -4.267 2.212 9.607 285 HA ILE 35 HA ILE 35 -1.593 2.510 8.628 286 HB ILE 35 HB ILE 35 -4.158 3.945 7.873 287 HG12 ILE 35 HG12 ILE 35 -2.667 1.732 6.436 288 HG13 ILE 35 HG11 ILE 35 -3.982 1.422 7.569 289 HG21 ILE 35 HG21 ILE 35 -2.835 4.347 5.702 290 HG22 ILE 35 HG22 ILE 35 -1.395 3.958 6.642 291 HG23 ILE 35 HG23 ILE 35 -2.393 5.341 7.090 292 HD11 ILE 35 HD11 ILE 35 -4.951 1.476 5.363 293 HD12 ILE 35 HD12 ILE 35 -4.123 2.984 4.978 294 HD13 ILE 35 HD13 ILE 35 -5.423 2.970 6.170 295 H GLU 36 HN GLU 36 -3.808 4.821 10.196 296 HA GLU 36 HA GLU 36 -1.953 7.029 10.096 297 HB2 GLU 36 HB2 GLU 36 -4.448 7.227 10.400 298 HB3 GLU 36 HB1 GLU 36 -4.241 6.614 12.041 299 HG2 GLU 36 HG2 GLU 36 -2.703 8.491 12.538 300 HG3 GLU 36 HG1 GLU 36 -2.962 9.120 10.908 301 H GLN 37 HN GLN 37 -2.642 4.495 12.470 302 HA GLN 37 HA GLN 37 -0.656 5.655 14.357 303 HB2 GLN 37 HB2 GLN 37 -2.483 3.249 14.631 304 HB3 GLN 37 HB1 GLN 37 -1.486 3.941 15.911 305 HG2 GLN 37 HG2 GLN 37 -3.679 5.428 14.435 306 HG3 GLN 37 HG1 GLN 37 -3.851 4.713 16.036 307 HE21 GLN 37 HE21 GLN 37 -3.000 5.877 17.829 308 HE22 GLN 37 HE22 GLN 37 -2.211 7.373 17.681 309 H SER 38 HN SER 38 0.366 4.594 11.879 310 HA SER 38 HA SER 38 2.291 2.690 12.990 311 HB2 SER 38 HB2 SER 38 0.342 1.255 12.274 312 HB3 SER 38 HB1 SER 38 0.587 1.836 10.630 313 HG SER 38 HG SER 38 2.719 0.746 12.115 314 H GLU 39 HN GLU 39 4.222 3.280 12.133 315 HA GLU 39 HA GLU 39 4.264 5.003 9.732 316 HB2 GLU 39 HB2 GLU 39 5.630 5.304 11.957 317 HB3 GLU 39 HB1 GLU 39 6.730 4.132 11.239 318 HG2 GLU 39 HG2 GLU 39 6.009 6.891 10.263 319 HG3 GLU 39 HG1 GLU 39 7.603 6.208 10.544 320 H THR 40 HN THR 40 6.389 2.313 10.750 321 HA THR 40 HA THR 40 7.566 1.596 8.405 322 HB THR 40 HB THR 40 7.426 -0.806 9.174 323 HG1 THR 40 HG1 THR 40 5.306 0.131 10.394 324 HG21 THR 40 HG21 THR 40 9.182 0.705 9.978 325 HG22 THR 40 HG22 THR 40 8.665 -0.373 11.275 326 HG23 THR 40 HG23 THR 40 8.108 1.300 11.243 327 H ALA 41 HN ALA 41 6.522 1.774 6.470 328 HA ALA 41 HA ALA 41 3.872 0.510 6.098 329 HB1 ALA 41 HB1 ALA 41 5.555 2.485 4.590 330 HB2 ALA 41 HB2 ALA 41 3.852 2.582 5.035 331 HB3 ALA 41 HB3 ALA 41 4.354 1.560 3.689 332 HA PRO 42 HA PRO 42 5.493 -3.155 4.204 333 HB2 PRO 42 HB2 PRO 42 3.637 -3.591 2.188 334 HB3 PRO 42 HB1 PRO 42 3.350 -3.953 3.901 335 HG2 PRO 42 HG2 PRO 42 2.501 -1.573 2.308 336 HG3 PRO 42 HG1 PRO 42 1.604 -2.489 3.530 337 HD2 PRO 42 HD2 PRO 42 2.768 -0.105 4.094 338 HD3 PRO 42 HD1 PRO 42 2.659 -1.405 5.303 339 H VAL 43 HN VAL 43 6.705 -3.898 2.405 340 HA VAL 43 HA VAL 43 7.993 -1.891 0.808 341 HB VAL 43 HB VAL 43 8.959 -3.902 -0.398 342 HG11 VAL 43 HG11 VAL 43 9.965 -2.884 1.659 343 HG12 VAL 43 HG12 VAL 43 10.279 -4.613 1.516 344 HG13 VAL 43 HG13 VAL 43 9.043 -4.032 2.631 345 HG21 VAL 43 HG21 VAL 43 6.904 -5.317 -0.014 346 HG22 VAL 43 HG22 VAL 43 7.368 -5.431 1.683 347 HG23 VAL 43 HG23 VAL 43 8.414 -6.110 0.437 348 H VAL 44 HN VAL 44 5.087 -3.693 0.351 349 HA VAL 44 HA VAL 44 4.944 -3.915 -2.459 350 HB VAL 44 HB VAL 44 3.287 -4.775 -0.723 351 HG11 VAL 44 HG11 VAL 44 1.630 -3.362 0.153 352 HG12 VAL 44 HG12 VAL 44 1.936 -2.098 -1.038 353 HG13 VAL 44 HG13 VAL 44 3.088 -2.383 0.263 354 HG21 VAL 44 HG21 VAL 44 2.185 -3.273 -3.119 355 HG22 VAL 44 HG22 VAL 44 1.348 -4.557 -2.247 356 HG23 VAL 44 HG23 VAL 44 2.828 -4.915 -3.135 357 H VAL 45 HN VAL 45 4.216 -1.130 -0.362 358 HA VAL 45 HA VAL 45 3.195 0.580 -2.411 359 HB VAL 45 HB VAL 45 4.660 1.256 0.160 360 HG11 VAL 45 HG11 VAL 45 4.787 3.193 -1.245 361 HG12 VAL 45 HG12 VAL 45 3.426 3.471 -0.159 362 HG13 VAL 45 HG13 VAL 45 3.137 2.964 -1.823 363 HG21 VAL 45 HG21 VAL 45 1.701 1.270 -0.511 364 HG22 VAL 45 HG22 VAL 45 2.426 1.567 1.069 365 HG23 VAL 45 HG23 VAL 45 2.514 -0.039 0.345 366 H LYS 46 HN LYS 46 6.488 0.157 -1.112 367 HA LYS 46 HA LYS 46 7.735 2.086 -2.819 368 HB2 LYS 46 HB2 LYS 46 8.830 -0.413 -1.494 369 HB3 LYS 46 HB1 LYS 46 9.830 0.780 -2.322 370 HG2 LYS 46 HG2 LYS 46 9.008 2.537 -0.796 371 HG3 LYS 46 HG1 LYS 46 8.009 1.343 0.035 372 HD2 LYS 46 HD2 LYS 46 10.001 0.081 0.687 373 HD3 LYS 46 HD1 LYS 46 11.028 1.204 -0.205 374 HE2 LYS 46 HE2 LYS 46 11.045 1.781 2.174 375 HE3 LYS 46 HE1 LYS 46 10.237 3.052 1.258 376 HZ1 LYS 46 HZ1 LYS 46 8.683 0.833 2.414 377 HZ2 LYS 46 HZ2 LYS 46 8.169 2.400 2.003 378 HZ3 LYS 46 HZ3 LYS 46 9.132 2.152 3.381 379 H TYR 47 HN TYR 47 7.025 -1.360 -3.207 380 HA TYR 47 HA TYR 47 8.465 -1.814 -5.609 381 HB2 TYR 47 HB2 TYR 47 7.339 -3.579 -4.211 382 HB3 TYR 47 HB1 TYR 47 5.790 -3.034 -4.857 383 HD1 TYR 47 HD1 TYR 47 9.145 -4.314 -5.857 384 HD2 TYR 47 HD2 TYR 47 5.031 -3.793 -6.977 385 HE1 TYR 47 HE1 TYR 47 9.518 -5.710 -7.869 386 HE2 TYR 47 HE2 TYR 47 5.405 -5.193 -8.992 387 HH TYR 47 HH TYR 47 8.416 -5.936 -10.180 388 H ILE 48 HN ILE 48 5.175 -0.566 -5.077 389 HA ILE 48 HA ILE 48 4.426 -0.416 -7.831 390 HB ILE 48 HB ILE 48 3.583 1.241 -5.433 391 HG12 ILE 48 HG12 ILE 48 2.130 -0.969 -6.912 392 HG13 ILE 48 HG11 ILE 48 3.112 -1.251 -5.474 393 HG21 ILE 48 HG21 ILE 48 3.051 2.576 -7.335 394 HG22 ILE 48 HG22 ILE 48 1.560 1.717 -6.944 395 HG23 ILE 48 HG23 ILE 48 2.573 1.164 -8.275 396 HD11 ILE 48 HD11 ILE 48 1.707 0.335 -4.203 397 HD12 ILE 48 HD12 ILE 48 0.740 -0.982 -4.866 398 HD13 ILE 48 HD13 ILE 48 0.718 0.602 -5.638 399 H ALA 49 HN ALA 49 6.016 1.942 -5.677 400 HA ALA 49 HA ALA 49 6.169 4.078 -7.560 401 HB1 ALA 49 HB1 ALA 49 6.659 4.399 -5.170 402 HB2 ALA 49 HB2 ALA 49 8.036 4.910 -6.145 403 HB3 ALA 49 HB3 ALA 49 8.078 3.359 -5.308 404 H PHE 50 HN PHE 50 8.259 1.275 -6.991 405 HA PHE 50 HA PHE 50 10.437 2.065 -8.642 406 HB2 PHE 50 HB2 PHE 50 10.326 0.071 -7.061 407 HB3 PHE 50 HB1 PHE 50 9.419 -0.768 -8.317 408 HD1 PHE 50 HD1 PHE 50 12.656 0.830 -7.492 409 HD2 PHE 50 HD2 PHE 50 10.504 -1.615 -10.292 410 HE1 PHE 50 HE1 PHE 50 14.787 0.242 -8.613 411 HE2 PHE 50 HE2 PHE 50 12.638 -2.206 -11.412 412 HZ PHE 50 HZ PHE 50 14.777 -1.276 -10.574 413 H LEU 51 HN LEU 51 7.486 0.202 -9.447 414 HA LEU 51 HA LEU 51 8.121 -0.169 -12.211 415 HB2 LEU 51 HB2 LEU 51 5.453 0.002 -10.781 416 HB3 LEU 51 HB1 LEU 51 5.622 -0.458 -12.471 417 HG LEU 51 HG LEU 51 7.008 -1.882 -10.181 418 HD11 LEU 51 HD11 LEU 51 4.374 -2.392 -11.570 419 HD12 LEU 51 HD12 LEU 51 4.713 -2.318 -9.840 420 HD13 LEU 51 HD13 LEU 51 5.269 -3.697 -10.788 421 HD21 LEU 51 HD21 LEU 51 6.895 -2.271 -13.164 422 HD22 LEU 51 HD22 LEU 51 6.991 -3.700 -12.137 423 HD23 LEU 51 HD23 LEU 51 8.252 -2.475 -12.057 424 H ARG 52 HN ARG 52 6.359 2.411 -10.506 425 HA ARG 52 HA ARG 52 5.591 3.896 -12.816 426 HB2 ARG 52 HB2 ARG 52 4.641 4.407 -10.632 427 HB3 ARG 52 HB1 ARG 52 6.230 4.839 -10.001 428 HG2 ARG 52 HG2 ARG 52 6.378 6.742 -11.493 429 HG3 ARG 52 HG1 ARG 52 4.905 6.257 -12.333 430 HD2 ARG 52 HD2 ARG 52 4.856 6.784 -9.366 431 HD3 ARG 52 HD1 ARG 52 4.760 8.123 -10.510 432 HE ARG 52 HE ARG 52 2.854 6.020 -11.131 433 HH11 ARG 52 HH21 ARG 52 3.599 8.741 -9.169 434 HH12 ARG 52 HH22 ARG 52 1.946 9.178 -8.898 435 HH21 ARG 52 HH11 ARG 52 0.674 6.572 -10.796 436 HH22 ARG 52 HH12 ARG 52 0.288 7.949 -9.821 437 H SER 53 HN SER 53 8.545 4.004 -10.831 438 HA SER 53 HA SER 53 9.780 6.218 -12.110 439 HB2 SER 53 HB2 SER 53 10.641 5.160 -10.033 440 HB3 SER 53 HB1 SER 53 11.117 3.743 -10.963 441 HG SER 53 HG SER 53 12.547 5.029 -12.114 442 H LYS 54 HN LYS 54 9.137 3.034 -13.261 443 HA LYS 54 HA LYS 54 11.186 3.209 -15.405 444 HB2 LYS 54 HB2 LYS 54 9.125 1.074 -14.776 445 HB3 LYS 54 HB1 LYS 54 10.375 0.952 -16.013 446 HG2 LYS 54 HG2 LYS 54 12.125 1.131 -14.315 447 HG3 LYS 54 HG1 LYS 54 10.914 1.384 -13.060 448 HD2 LYS 54 HD2 LYS 54 11.326 -0.899 -12.817 449 HD3 LYS 54 HD1 LYS 54 9.955 -0.929 -13.919 450 HE2 LYS 54 HE2 LYS 54 11.853 -0.833 -15.778 451 HE3 LYS 54 HE1 LYS 54 12.850 -1.489 -14.478 452 HZ1 LYS 54 HZ1 LYS 54 11.458 -3.029 -16.053 453 HZ2 LYS 54 HZ2 LYS 54 10.229 -2.693 -14.928 454 HZ3 LYS 54 HZ3 LYS 54 11.685 -3.404 -14.417 455 H GLY 55 HN GLY 55 8.242 4.529 -14.887 456 HA2 GLY 55 HA2 GLY 55 7.020 5.794 -16.509 457 HA3 GLY 55 HA1 GLY 55 7.731 4.815 -17.789 458 H VAL 56 HN VAL 56 6.579 2.876 -15.241 459 HA VAL 56 HA VAL 56 4.493 1.766 -16.920 460 HB VAL 56 HB VAL 56 5.009 1.303 -13.963 461 HG11 VAL 56 HG11 VAL 56 2.777 0.543 -14.769 462 HG12 VAL 56 HG12 VAL 56 3.815 -0.819 -14.348 463 HG13 VAL 56 HG13 VAL 56 3.570 -0.387 -16.040 464 HG21 VAL 56 HG21 VAL 56 5.934 -0.309 -16.348 465 HG22 VAL 56 HG22 VAL 56 6.387 -0.547 -14.662 466 HG23 VAL 56 HG23 VAL 56 6.947 0.878 -15.533 467 H ASP 57 HN ASP 57 2.342 2.264 -16.948 468 HA ASP 57 HA ASP 57 1.459 4.603 -15.392 469 HB2 ASP 57 HB2 ASP 57 0.342 3.012 -17.694 470 HB3 ASP 57 HB1 ASP 57 -0.716 4.093 -16.790 471 H LEU 58 HN LEU 58 0.755 4.236 -13.356 472 HA LEU 58 HA LEU 58 -0.591 1.688 -12.668 473 HB2 LEU 58 HB2 LEU 58 0.423 4.043 -11.070 474 HB3 LEU 58 HB1 LEU 58 -0.617 2.826 -10.337 475 HG LEU 58 HG LEU 58 1.872 2.432 -10.059 476 HD11 LEU 58 HD11 LEU 58 -0.061 0.613 -10.158 477 HD12 LEU 58 HD12 LEU 58 1.625 0.114 -10.125 478 HD13 LEU 58 HD13 LEU 58 0.748 0.135 -11.649 479 HD21 LEU 58 HD21 LEU 58 2.380 3.197 -12.432 480 HD22 LEU 58 HD22 LEU 58 1.765 1.636 -12.973 481 HD23 LEU 58 HD23 LEU 58 3.183 1.712 -11.927 482 H ASN 59 HN ASN 59 -1.427 4.787 -13.727 483 HA ASN 59 HA ASN 59 -3.845 5.249 -12.273 484 HB2 ASN 59 HB2 ASN 59 -4.459 6.561 -14.431 485 HB3 ASN 59 HB1 ASN 59 -3.044 7.088 -13.520 486 HD21 ASN 59 HD21 ASN 59 -1.582 7.759 -15.124 487 HD22 ASN 59 HD22 ASN 59 -1.112 6.806 -16.447 488 H ALA 60 HN ALA 60 -3.156 3.417 -15.241 489 HA ALA 60 HA ALA 60 -5.867 2.828 -15.920 490 HB1 ALA 60 HB1 ALA 60 -3.311 1.268 -16.417 491 HB2 ALA 60 HB2 ALA 60 -4.103 2.390 -17.524 492 HB3 ALA 60 HB3 ALA 60 -4.871 0.853 -17.130 493 H LEU 61 HN LEU 61 -3.497 0.977 -13.979 494 HA LEU 61 HA LEU 61 -5.245 -1.188 -13.325 495 HB2 LEU 61 HB2 LEU 61 -2.764 -0.011 -12.073 496 HB3 LEU 61 HB1 LEU 61 -3.634 -1.293 -11.235 497 HG LEU 61 HG LEU 61 -1.763 -2.098 -12.726 498 HD11 LEU 61 HD11 LEU 61 -4.167 -3.292 -12.215 499 HD12 LEU 61 HD12 LEU 61 -2.879 -4.048 -13.142 500 HD13 LEU 61 HD13 LEU 61 -4.211 -3.253 -13.978 501 HD21 LEU 61 HD21 LEU 61 -3.610 -1.391 -15.016 502 HD22 LEU 61 HD22 LEU 61 -1.932 -1.931 -15.094 503 HD23 LEU 61 HD23 LEU 61 -2.311 -0.316 -14.498 504 H PHE 62 HN PHE 62 -4.529 1.845 -11.600 505 HA PHE 62 HA PHE 62 -6.272 1.284 -9.379 506 HB2 PHE 62 HB2 PHE 62 -4.931 3.763 -10.460 507 HB3 PHE 62 HB1 PHE 62 -6.072 3.875 -9.120 508 HD1 PHE 62 HD2 PHE 62 -3.368 1.378 -10.030 509 HD2 PHE 62 HD1 PHE 62 -4.938 4.097 -7.088 510 HE1 PHE 62 HE2 PHE 62 -1.618 0.675 -8.442 511 HE2 PHE 62 HE1 PHE 62 -3.164 3.392 -5.508 512 HZ PHE 62 HZ PHE 62 -1.505 1.683 -6.190 513 H ASP 63 HN ASP 63 -6.683 3.152 -12.376 514 HA ASP 63 HA ASP 63 -9.333 4.084 -11.819 515 HB2 ASP 63 HB2 ASP 63 -7.821 3.583 -14.394 516 HB3 ASP 63 HB1 ASP 63 -9.457 4.245 -14.372 517 H ARG 64 HN ARG 64 -8.074 1.126 -13.266 518 HA ARG 64 HA ARG 64 -10.527 0.055 -14.228 519 HB2 ARG 64 HB2 ARG 64 -8.136 -0.809 -14.615 520 HB3 ARG 64 HB1 ARG 64 -8.278 -1.590 -13.042 521 HG2 ARG 64 HG2 ARG 64 -8.910 -3.199 -14.741 522 HG3 ARG 64 HG1 ARG 64 -10.358 -2.734 -13.854 523 HD2 ARG 64 HD2 ARG 64 -11.303 -1.711 -15.685 524 HD3 ARG 64 HD1 ARG 64 -9.766 -1.058 -16.247 525 HE ARG 64 HE ARG 64 -10.973 -3.477 -17.194 526 HH11 ARG 64 HH21 ARG 64 -7.987 -2.095 -16.176 527 HH12 ARG 64 HH22 ARG 64 -7.019 -3.057 -17.242 528 HH21 ARG 64 HH11 ARG 64 -9.721 -4.743 -18.609 529 HH22 ARG 64 HH12 ARG 64 -7.999 -4.551 -18.621 530 H ILE 65 HN ILE 65 -8.926 -0.261 -11.054 531 HA ILE 65 HA ILE 65 -10.997 -1.947 -9.941 532 HB ILE 65 HB ILE 65 -8.924 -0.209 -8.569 533 HG12 ILE 65 HG12 ILE 65 -8.920 -3.200 -9.062 534 HG13 ILE 65 HG11 ILE 65 -8.111 -2.047 -10.125 535 HG21 ILE 65 HG21 ILE 65 -10.803 -2.360 -7.566 536 HG22 ILE 65 HG22 ILE 65 -10.647 -0.703 -6.981 537 HG23 ILE 65 HG23 ILE 65 -9.360 -1.871 -6.680 538 HD11 ILE 65 HD11 ILE 65 -6.648 -1.319 -8.372 539 HD12 ILE 65 HD12 ILE 65 -6.636 -3.082 -8.331 540 HD13 ILE 65 HD13 ILE 65 -7.584 -2.180 -7.149 541 H ILE 66 HN ILE 66 -10.113 1.344 -8.852 542 HA ILE 66 HA ILE 66 -12.850 1.778 -7.904 543 HB ILE 66 HB ILE 66 -11.877 4.107 -7.374 544 HG12 ILE 66 HG12 ILE 66 -9.255 2.702 -7.917 545 HG13 ILE 66 HG11 ILE 66 -10.010 3.753 -9.110 546 HG21 ILE 66 HG21 ILE 66 -12.088 2.441 -5.634 547 HG22 ILE 66 HG22 ILE 66 -10.483 3.159 -5.493 548 HG23 ILE 66 HG23 ILE 66 -10.676 1.569 -6.229 549 HD11 ILE 66 HD11 ILE 66 -9.433 4.632 -6.274 550 HD12 ILE 66 HD12 ILE 66 -9.911 5.645 -7.637 551 HD13 ILE 66 HD13 ILE 66 -8.315 4.893 -7.613 552 H VAL 67 HN VAL 67 -14.439 2.864 -8.974 553 HA VAL 67 HA VAL 67 -13.728 4.261 -11.537 554 HB VAL 67 HB VAL 67 -16.114 2.534 -10.832 555 HG11 VAL 67 HG11 VAL 67 -15.720 4.535 -13.062 556 HG12 VAL 67 HG12 VAL 67 -17.118 4.330 -12.006 557 HG13 VAL 67 HG13 VAL 67 -16.783 3.143 -13.265 558 HG21 VAL 67 HG21 VAL 67 -14.180 2.409 -13.163 559 HG22 VAL 67 HG22 VAL 67 -15.352 1.183 -12.678 560 HG23 VAL 67 HG23 VAL 67 -13.944 1.509 -11.666 561 H ASN 68 HN ASN 68 -14.380 6.339 -11.690 562 HA ASN 68 HA ASN 68 -15.495 7.700 -9.412 563 HB2 ASN 68 HB2 ASN 68 -14.861 8.488 -12.256 564 HB3 ASN 68 HB1 ASN 68 -15.691 9.615 -11.181 565 HD21 ASN 68 HD21 ASN 68 -12.809 7.428 -11.081 566 HD22 ASN 68 HD22 ASN 68 -11.835 8.517 -10.217 567 H LYS 69 HN LYS 69 -17.389 9.389 -10.105 568 HA LYS 69 HA LYS 69 -19.690 9.633 -10.386 569 HB2 LYS 69 HB2 LYS 69 -19.038 9.202 -12.771 570 HB3 LYS 69 HB1 LYS 69 -19.383 7.493 -12.506 571 HG2 LYS 69 HG2 LYS 69 -21.700 8.007 -11.932 572 HG3 LYS 69 HG1 LYS 69 -21.379 9.735 -12.084 573 HD2 LYS 69 HD2 LYS 69 -20.816 9.419 -14.469 574 HD3 LYS 69 HD1 LYS 69 -21.155 7.695 -14.318 575 HE2 LYS 69 HE2 LYS 69 -23.160 8.602 -15.189 576 HE3 LYS 69 HE1 LYS 69 -23.487 8.418 -13.467 577 HZ1 LYS 69 HZ1 LYS 69 -24.189 10.574 -14.112 578 HZ2 LYS 69 HZ2 LYS 69 -22.718 10.900 -14.899 579 HZ3 LYS 69 HZ3 LYS 69 -22.768 10.771 -13.206 580 H LEU 70 HN LEU 70 -19.895 8.614 -8.225 581 HA LEU 70 HA LEU 70 -20.736 5.781 -8.175 582 HB2 LEU 70 HB2 LEU 70 -19.332 6.602 -6.344 583 HB3 LEU 70 HB1 LEU 70 -20.499 7.871 -5.985 584 HG LEU 70 HG LEU 70 -22.178 6.195 -5.362 585 HD11 LEU 70 HD11 LEU 70 -20.069 4.289 -6.371 586 HD12 LEU 70 HD12 LEU 70 -21.798 4.311 -6.714 587 HD13 LEU 70 HD13 LEU 70 -21.221 3.763 -5.143 588 HD21 LEU 70 HD21 LEU 70 -20.993 5.248 -3.376 589 HD22 LEU 70 HD22 LEU 70 -20.657 6.962 -3.616 590 HD23 LEU 70 HD23 LEU 70 -19.461 5.756 -4.088 591 H GLU 71 HN GLU 71 -22.172 8.641 -6.637 592 HA GLU 71 HA GLU 71 -24.383 9.289 -6.351 593 HB2 GLU 71 HB2 GLU 71 -24.550 8.075 -9.114 594 HB3 GLU 71 HB1 GLU 71 -25.876 8.950 -8.355 595 HG2 GLU 71 HG2 GLU 71 -24.284 10.897 -8.055 596 HG3 GLU 71 HG1 GLU 71 -23.133 10.017 -9.061 597 H HIS 72 HN HIS 72 -26.666 8.412 -6.178 598 HA HIS 72 HA HIS 72 -26.604 5.496 -5.458 599 HB2 HIS 72 HB2 HIS 72 -26.773 7.108 -3.533 600 HB3 HIS 72 HB1 HIS 72 -28.296 7.681 -4.214 601 HD2 HIS 72 HD2 HIS 72 -27.068 3.931 -3.607 602 HE1 HIS 72 HE1 HIS 72 -30.923 4.427 -1.955 603 HE2 HIS 72 HE2 HIS 72 -29.059 2.762 -2.391 604 H HIS 73 HN HIS 73 -27.954 4.282 -6.665 605 HA HIS 73 HA HIS 73 -30.606 5.301 -7.414 606 HB2 HIS 73 HB2 HIS 73 -28.353 5.095 -9.336 607 HB3 HIS 73 HB1 HIS 73 -29.812 4.278 -9.882 608 HD2 HIS 73 HD2 HIS 73 -31.880 5.984 -10.697 609 HE1 HIS 73 HE1 HIS 73 -29.979 9.622 -9.702 610 HE2 HIS 73 HE2 HIS 73 -31.993 8.585 -10.845 611 H HIS 74 HN HIS 74 -28.970 2.720 -9.130 612 HA HIS 74 HA HIS 74 -30.848 0.758 -7.946 613 HB2 HIS 74 HB2 HIS 74 -30.545 0.763 -10.383 614 HB3 HIS 74 HB1 HIS 74 -28.809 0.532 -10.187 615 HD2 HIS 74 HD2 HIS 74 -28.369 -2.048 -8.525 616 HE1 HIS 74 HE1 HIS 74 -31.644 -3.845 -10.493 617 HE2 HIS 74 HE2 HIS 74 -29.597 -4.284 -9.062 618 H HIS 75 HN HIS 75 -30.187 -0.709 -6.407 619 HA HIS 75 HA HIS 75 -27.247 -1.118 -6.005 620 HB2 HIS 75 HB2 HIS 75 -29.249 -0.064 -4.101 621 HB3 HIS 75 HB1 HIS 75 -28.335 -1.420 -3.449 622 HD2 HIS 75 HD2 HIS 75 -27.392 2.058 -5.187 623 HE1 HIS 75 HE1 HIS 75 -24.330 0.939 -2.502 624 HE2 HIS 75 HE2 HIS 75 -25.106 2.730 -4.122 625 H HIS 76 HN HIS 76 -26.709 -3.179 -6.125 626 HA HIS 76 HA HIS 76 -28.658 -5.265 -6.465 627 HB2 HIS 76 HB2 HIS 76 -25.666 -5.298 -5.991 628 HB3 HIS 76 HB1 HIS 76 -26.608 -6.768 -6.244 629 HD2 HIS 76 HD2 HIS 76 -24.411 -5.539 -8.556 630 HE1 HIS 76 HE1 HIS 76 -27.945 -4.956 -10.794 631 HE2 HIS 76 HE2 HIS 76 -25.417 -5.119 -10.925 632 H HIS 77 HN HIS 77 -26.617 -4.227 -3.753 633 HA HIS 77 HA HIS 77 -28.468 -5.478 -1.860 634 HB2 HIS 77 HB2 HIS 77 -27.029 -7.386 -2.451 635 HB3 HIS 77 HB1 HIS 77 -25.595 -6.432 -2.070 636 HD2 HIS 77 HD2 HIS 77 -24.802 -6.729 0.553 637 HE1 HIS 77 HE1 HIS 77 -28.473 -8.070 2.148 638 HE2 HIS 77 HE2 HIS 77 -26.041 -7.588 2.680 639 H1 MET 1 HT1 MET 1 -8.620 -7.149 -14.563 640 H2 MET 1 HT2 MET 1 -10.217 -7.631 -14.242 641 H3 MET 1 HT3 MET 1 -9.451 -8.118 -15.679 642 HA MET 1 HA MET 1 -9.629 -9.818 -13.810 643 HB2 MET 1 HB2 MET 1 -7.217 -10.553 -14.273 644 HB3 MET 1 HB1 MET 1 -8.240 -10.316 -15.689 645 HG2 MET 1 HG2 MET 1 -7.281 -8.140 -16.104 646 HG3 MET 1 HG1 MET 1 -6.403 -8.180 -14.575 647 HE1 MET 1 HE1 MET 1 -7.129 -9.679 -17.859 648 HE2 MET 1 HE2 MET 1 -6.743 -11.288 -17.255 649 HE3 MET 1 HE3 MET 1 -5.668 -10.509 -18.413 650 H GLU 2 HN GLU 2 -7.462 -10.574 -12.371 651 HA GLU 2 HA GLU 2 -7.607 -8.870 -10.047 652 HB2 GLU 2 HB2 GLU 2 -5.923 -11.282 -10.742 653 HB3 GLU 2 HB1 GLU 2 -5.816 -10.462 -9.183 654 HG2 GLU 2 HG2 GLU 2 -8.159 -10.885 -8.730 655 HG3 GLU 2 HG1 GLU 2 -8.397 -11.540 -10.352 656 H LEU 3 HN LEU 3 -6.133 -7.413 -9.254 657 HA LEU 3 HA LEU 3 -4.352 -6.094 -11.061 658 HB2 LEU 3 HB2 LEU 3 -5.378 -4.973 -9.128 659 HB3 LEU 3 HB1 LEU 3 -4.471 -6.004 -8.027 660 HG LEU 3 HG LEU 3 -2.796 -4.552 -10.030 661 HD11 LEU 3 HD11 LEU 3 -4.447 -2.799 -9.532 662 HD12 LEU 3 HD12 LEU 3 -2.894 -2.415 -8.790 663 HD13 LEU 3 HD13 LEU 3 -4.210 -3.051 -7.802 664 HD21 LEU 3 HD21 LEU 3 -2.062 -5.966 -7.976 665 HD22 LEU 3 HD22 LEU 3 -2.532 -4.566 -7.015 666 HD23 LEU 3 HD23 LEU 3 -1.262 -4.416 -8.227 667 H SER 4 HN SER 4 -3.768 -8.460 -8.460 668 HA SER 4 HA SER 4 -0.933 -8.412 -8.534 669 HB2 SER 4 HB2 SER 4 -2.806 -10.736 -7.988 670 HB3 SER 4 HB1 SER 4 -1.078 -10.739 -7.643 671 HG SER 4 HG SER 4 -1.565 -9.758 -5.861 672 H ASN 5 HN ASN 5 -3.249 -10.316 -10.468 673 HA ASN 5 HA ASN 5 -1.298 -11.829 -11.904 674 HB2 ASN 5 HB2 ASN 5 -3.649 -12.453 -11.936 675 HB3 ASN 5 HB1 ASN 5 -4.079 -10.928 -12.708 676 HD21 ASN 5 HD21 ASN 5 -4.354 -11.131 -14.919 677 HD22 ASN 5 HD22 ASN 5 -3.543 -12.242 -15.913 678 H GLU 6 HN GLU 6 -2.851 -8.701 -12.665 679 HA GLU 6 HA GLU 6 -1.450 -8.391 -15.173 680 HB2 GLU 6 HB2 GLU 6 -3.520 -7.182 -14.808 681 HB3 GLU 6 HB1 GLU 6 -2.864 -6.387 -13.384 682 HG2 GLU 6 HG2 GLU 6 -2.826 -4.852 -15.292 683 HG3 GLU 6 HG1 GLU 6 -1.174 -5.247 -14.831 684 H LEU 7 HN LEU 7 -0.745 -7.524 -11.839 685 HA LEU 7 HA LEU 7 1.404 -5.715 -12.329 686 HB2 LEU 7 HB2 LEU 7 0.350 -6.114 -10.098 687 HB3 LEU 7 HB1 LEU 7 1.110 -7.703 -10.051 688 HG LEU 7 HG LEU 7 3.341 -6.606 -10.219 689 HD11 LEU 7 HD11 LEU 7 3.173 -4.043 -9.551 690 HD12 LEU 7 HD12 LEU 7 1.602 -4.152 -10.342 691 HD13 LEU 7 HD13 LEU 7 3.072 -4.525 -11.242 692 HD21 LEU 7 HD21 LEU 7 1.494 -5.758 -7.970 693 HD22 LEU 7 HD22 LEU 7 3.249 -5.601 -7.898 694 HD23 LEU 7 HD23 LEU 7 2.511 -7.198 -8.028 695 H LYS 8 HN LYS 8 1.386 -9.261 -11.910 696 HA LYS 8 HA LYS 8 4.213 -9.606 -12.231 697 HB2 LYS 8 HB2 LYS 8 2.654 -11.332 -11.302 698 HB3 LYS 8 HB1 LYS 8 2.011 -11.573 -12.926 699 HG2 LYS 8 HG2 LYS 8 4.227 -12.236 -13.735 700 HG3 LYS 8 HG1 LYS 8 4.918 -11.935 -12.139 701 HD2 LYS 8 HD2 LYS 8 3.429 -13.657 -11.175 702 HD3 LYS 8 HD1 LYS 8 2.765 -13.973 -12.778 703 HE2 LYS 8 HE2 LYS 8 5.002 -14.619 -13.584 704 HE3 LYS 8 HE1 LYS 8 5.673 -14.298 -11.985 705 HZ1 LYS 8 HZ1 LYS 8 5.218 -16.632 -12.223 706 HZ2 LYS 8 HZ2 LYS 8 3.604 -16.320 -12.654 707 HZ3 LYS 8 HZ3 LYS 8 4.150 -15.972 -11.083 708 H VAL 9 HN VAL 9 1.530 -9.518 -14.557 709 HA VAL 9 HA VAL 9 2.978 -10.374 -16.849 710 HB VAL 9 HB VAL 9 0.636 -8.463 -16.596 711 HG11 VAL 9 HG11 VAL 9 1.965 -9.712 -19.012 712 HG12 VAL 9 HG12 VAL 9 1.613 -8.007 -18.730 713 HG13 VAL 9 HG13 VAL 9 0.298 -9.138 -19.046 714 HG21 VAL 9 HG21 VAL 9 0.475 -10.934 -15.850 715 HG22 VAL 9 HG22 VAL 9 0.650 -11.332 -17.559 716 HG23 VAL 9 HG23 VAL 9 -0.723 -10.369 -17.014 717 H GLU 10 HN GLU 10 2.520 -7.065 -15.521 718 HA GLU 10 HA GLU 10 3.961 -5.721 -17.583 719 HB2 GLU 10 HB2 GLU 10 3.649 -5.026 -14.642 720 HB3 GLU 10 HB1 GLU 10 4.234 -3.918 -15.886 721 HG2 GLU 10 HG2 GLU 10 1.542 -5.304 -15.984 722 HG3 GLU 10 HG1 GLU 10 1.783 -3.660 -15.394 723 H ARG 11 HN ARG 11 5.032 -7.375 -14.634 724 HA ARG 11 HA ARG 11 7.733 -6.472 -14.625 725 HB2 ARG 11 HB2 ARG 11 6.657 -7.793 -12.792 726 HB3 ARG 11 HB1 ARG 11 6.705 -9.219 -13.830 727 HG2 ARG 11 HG2 ARG 11 9.136 -9.107 -13.948 728 HG3 ARG 11 HG1 ARG 11 9.135 -7.603 -13.038 729 HD2 ARG 11 HD2 ARG 11 9.620 -9.135 -11.355 730 HD3 ARG 11 HD1 ARG 11 7.866 -9.036 -11.220 731 HE ARG 11 HE ARG 11 8.159 -11.111 -12.968 732 HH11 ARG 11 HH21 ARG 11 9.677 -10.274 -9.983 733 HH12 ARG 11 HH22 ARG 11 9.981 -11.914 -9.523 734 HH21 ARG 11 HH11 ARG 11 8.550 -13.264 -12.372 735 HH22 ARG 11 HH12 ARG 11 9.343 -13.603 -10.871 736 H ILE 12 HN ILE 12 6.218 -9.251 -16.241 737 HA ILE 12 HA ILE 12 8.611 -10.255 -17.479 738 HB ILE 12 HB ILE 12 5.680 -10.521 -18.221 739 HG12 ILE 12 HG12 ILE 12 7.535 -12.548 -16.950 740 HG13 ILE 12 HG11 ILE 12 6.551 -11.439 -15.995 741 HG21 ILE 12 HG21 ILE 12 8.170 -11.829 -19.333 742 HG22 ILE 12 HG22 ILE 12 6.878 -11.017 -20.217 743 HG23 ILE 12 HG23 ILE 12 6.583 -12.586 -19.465 744 HD11 ILE 12 HD11 ILE 12 4.520 -12.351 -16.824 745 HD12 ILE 12 HD12 ILE 12 5.538 -13.751 -16.482 746 HD13 ILE 12 HD13 ILE 12 5.343 -13.190 -18.142 747 H ARG 13 HN ARG 13 6.023 -8.068 -18.619 748 HA ARG 13 HA ARG 13 7.084 -7.685 -21.252 749 HB2 ARG 13 HB2 ARG 13 5.292 -5.960 -19.526 750 HB3 ARG 13 HB1 ARG 13 5.736 -5.522 -21.177 751 HG2 ARG 13 HG2 ARG 13 4.820 -7.662 -21.996 752 HG3 ARG 13 HG1 ARG 13 4.366 -8.096 -20.348 753 HD2 ARG 13 HD2 ARG 13 2.841 -6.204 -20.217 754 HD3 ARG 13 HD1 ARG 13 3.364 -5.632 -21.801 755 HE ARG 13 HE ARG 13 2.316 -8.357 -21.854 756 HH11 ARG 13 HH21 ARG 13 1.627 -4.985 -21.899 757 HH12 ARG 13 HH22 ARG 13 0.161 -5.156 -22.805 758 HH21 ARG 13 HH11 ARG 13 0.405 -8.606 -23.048 759 HH22 ARG 13 HH12 ARG 13 -0.531 -7.207 -23.457 760 H LEU 14 HN LEU 14 7.703 -6.101 -18.171 761 HA LEU 14 HA LEU 14 9.451 -4.083 -19.361 762 HB2 LEU 14 HB2 LEU 14 8.998 -4.982 -16.500 763 HB3 LEU 14 HB1 LEU 14 10.023 -3.624 -16.951 764 HG LEU 14 HG LEU 14 7.120 -3.796 -17.800 765 HD11 LEU 14 HD11 LEU 14 8.156 -2.243 -15.416 766 HD12 LEU 14 HD12 LEU 14 7.444 -3.848 -15.259 767 HD13 LEU 14 HD13 LEU 14 6.481 -2.519 -15.888 768 HD21 LEU 14 HD21 LEU 14 8.235 -2.155 -19.092 769 HD22 LEU 14 HD22 LEU 14 9.237 -1.635 -17.740 770 HD23 LEU 14 HD23 LEU 14 7.525 -1.225 -17.780 771 H SER 15 HN SER 15 9.686 -7.352 -18.803 772 HA SER 15 HA SER 15 11.481 -8.840 -18.416 773 HB2 SER 15 HB2 SER 15 11.646 -7.834 -20.824 774 HB3 SER 15 HB1 SER 15 13.053 -6.983 -20.195 775 HG SER 15 HG SER 15 13.866 -9.046 -19.548 776 H LEU 16 HN LEU 16 11.459 -7.442 -16.173 777 HA LEU 16 HA LEU 16 14.202 -6.262 -15.822 778 HB2 LEU 16 HB2 LEU 16 13.328 -5.074 -13.948 779 HB3 LEU 16 HB1 LEU 16 12.138 -4.932 -15.235 780 HG LEU 16 HG LEU 16 11.055 -7.052 -14.179 781 HD11 LEU 16 HD11 LEU 16 13.204 -6.560 -12.271 782 HD12 LEU 16 HD12 LEU 16 12.058 -7.893 -12.342 783 HD13 LEU 16 HD13 LEU 16 11.642 -6.423 -11.472 784 HD21 LEU 16 HD21 LEU 16 10.965 -4.252 -13.046 785 HD22 LEU 16 HD22 LEU 16 9.897 -5.511 -12.438 786 HD23 LEU 16 HD23 LEU 16 9.818 -5.035 -14.134 787 H THR 17 HN THR 17 15.524 -6.977 -14.071 788 HA THR 17 HA THR 17 15.013 -9.796 -13.301 789 HB THR 17 HB THR 17 17.398 -9.609 -12.412 790 HG1 THR 17 HG1 THR 17 16.916 -7.087 -12.799 791 HG21 THR 17 HG21 THR 17 18.371 -9.674 -14.693 792 HG22 THR 17 HG22 THR 17 16.865 -9.021 -15.337 793 HG23 THR 17 HG23 THR 17 16.884 -10.616 -14.587 794 H ALA 18 HN ALA 18 14.644 -10.453 -11.236 795 HA ALA 18 HA ALA 18 13.692 -8.584 -9.289 796 HB1 ALA 18 HB1 ALA 18 12.807 -10.773 -9.139 797 HB2 ALA 18 HB2 ALA 18 13.878 -10.655 -7.746 798 HB3 ALA 18 HB3 ALA 18 14.405 -11.517 -9.189 799 H LYS 19 HN LYS 19 16.827 -10.199 -9.719 800 HA LYS 19 HA LYS 19 17.963 -9.522 -7.208 801 HB2 LYS 19 HB2 LYS 19 19.230 -9.873 -9.933 802 HB3 LYS 19 HB1 LYS 19 20.143 -9.738 -8.436 803 HG2 LYS 19 HG2 LYS 19 18.875 -11.698 -7.538 804 HG3 LYS 19 HG1 LYS 19 18.112 -11.877 -9.115 805 HD2 LYS 19 HD2 LYS 19 21.114 -11.911 -8.698 806 HD3 LYS 19 HD1 LYS 19 20.123 -13.367 -8.745 807 HE2 LYS 19 HE2 LYS 19 19.281 -12.521 -11.025 808 HE3 LYS 19 HE1 LYS 19 20.627 -11.382 -10.967 809 HZ1 LYS 19 HZ1 LYS 19 21.569 -13.164 -12.022 810 HZ2 LYS 19 HZ2 LYS 19 20.684 -14.313 -11.136 811 HZ3 LYS 19 HZ3 LYS 19 21.985 -13.494 -10.412 812 H SER 20 HN SER 20 17.950 -7.737 -10.302 813 HA SER 20 HA SER 20 19.547 -5.550 -9.397 814 HB2 SER 20 HB2 SER 20 19.010 -5.951 -11.782 815 HB3 SER 20 HB1 SER 20 17.324 -5.548 -11.467 816 HG SER 20 HG SER 20 18.925 -3.638 -10.478 817 H VAL 21 HN VAL 21 16.019 -6.046 -9.392 818 HA VAL 21 HA VAL 21 15.350 -3.498 -8.269 819 HB VAL 21 HB VAL 21 13.915 -6.168 -8.141 820 HG11 VAL 21 HG11 VAL 21 13.022 -4.849 -6.366 821 HG12 VAL 21 HG12 VAL 21 11.903 -4.647 -7.713 822 HG13 VAL 21 HG13 VAL 21 13.067 -3.377 -7.338 823 HG21 VAL 21 HG21 VAL 21 12.480 -4.930 -9.885 824 HG22 VAL 21 HG22 VAL 21 14.072 -5.477 -10.404 825 HG23 VAL 21 HG23 VAL 21 13.812 -3.784 -9.997 826 H ALA 22 HN ALA 22 15.961 -6.666 -6.754 827 HA ALA 22 HA ALA 22 15.395 -5.907 -4.085 828 HB1 ALA 22 HB1 ALA 22 15.724 -8.228 -4.561 829 HB2 ALA 22 HB2 ALA 22 17.046 -7.756 -3.495 830 HB3 ALA 22 HB3 ALA 22 17.333 -7.933 -5.226 831 H GLU 23 HN GLU 23 18.528 -5.791 -5.843 832 HA GLU 23 HA GLU 23 19.959 -4.666 -3.618 833 HB2 GLU 23 HB2 GLU 23 20.524 -4.645 -6.589 834 HB3 GLU 23 HB1 GLU 23 21.626 -3.961 -5.394 835 HG2 GLU 23 HG2 GLU 23 21.647 -6.186 -4.232 836 HG3 GLU 23 HG1 GLU 23 20.694 -6.836 -5.567 837 H GLU 24 HN GLU 24 18.462 -3.141 -6.485 838 HA GLU 24 HA GLU 24 19.242 -0.476 -5.773 839 HB2 GLU 24 HB2 GLU 24 17.026 -1.563 -7.519 840 HB3 GLU 24 HB1 GLU 24 17.326 0.166 -7.328 841 HG2 GLU 24 HG2 GLU 24 19.588 -0.073 -8.165 842 HG3 GLU 24 HG1 GLU 24 19.429 -1.828 -8.208 843 H MET 25 HN MET 25 16.194 -2.261 -5.191 844 HA MET 25 HA MET 25 14.943 -0.089 -3.785 845 HB2 MET 25 HB2 MET 25 14.461 -3.071 -3.805 846 HB3 MET 25 HB1 MET 25 13.511 -1.982 -2.793 847 HG2 MET 25 HG2 MET 25 12.850 -0.696 -4.788 848 HG3 MET 25 HG1 MET 25 13.814 -1.768 -5.803 849 HE1 MET 25 HE1 MET 25 11.339 -2.854 -2.656 850 HE2 MET 25 HE2 MET 25 9.903 -2.533 -3.625 851 HE3 MET 25 HE3 MET 25 11.092 -1.258 -3.379 852 H GLY 26 HN GLY 26 16.964 -2.812 -2.736 853 HA2 GLY 26 HA2 GLY 26 18.446 -2.659 -0.828 854 HA3 GLY 26 HA1 GLY 26 17.430 -1.380 -0.163 855 H ILE 27 HN ILE 27 16.167 -4.399 -1.476 856 HA ILE 27 HA ILE 27 15.457 -5.282 1.302 857 HB ILE 27 HB ILE 27 13.302 -6.094 0.424 858 HG12 ILE 27 HG12 ILE 27 13.980 -4.595 -2.119 859 HG13 ILE 27 HG11 ILE 27 14.127 -6.345 -1.973 860 HG21 ILE 27 HG21 ILE 27 13.403 -3.861 1.416 861 HG22 ILE 27 HG22 ILE 27 12.264 -3.863 0.071 862 HG23 ILE 27 HG23 ILE 27 13.873 -3.169 -0.136 863 HD11 ILE 27 HD11 ILE 27 11.772 -6.573 -1.488 864 HD12 ILE 27 HD12 ILE 27 11.933 -5.588 -2.945 865 HD13 ILE 27 HD13 ILE 27 11.574 -4.822 -1.396 866 H SER 28 HN SER 28 14.992 -7.631 1.425 867 HA SER 28 HA SER 28 17.053 -9.123 0.001 868 HB2 SER 28 HB2 SER 28 15.028 -9.816 2.127 869 HB3 SER 28 HB1 SER 28 16.007 -11.062 1.360 870 HG SER 28 HG SER 28 17.350 -8.794 2.217 871 H ARG 29 HN ARG 29 16.604 -11.098 -1.192 872 HA ARG 29 HA ARG 29 14.620 -10.788 -3.218 873 HB2 ARG 29 HB2 ARG 29 16.303 -13.145 -2.339 874 HB3 ARG 29 HB1 ARG 29 15.170 -13.255 -3.685 875 HG2 ARG 29 HG2 ARG 29 16.317 -11.414 -4.833 876 HG3 ARG 29 HG1 ARG 29 17.425 -11.237 -3.472 877 HD2 ARG 29 HD2 ARG 29 17.132 -13.850 -4.960 878 HD3 ARG 29 HD1 ARG 29 18.272 -12.612 -5.477 879 HE ARG 29 HE ARG 29 18.480 -14.252 -3.030 880 HH11 ARG 29 HH21 ARG 29 19.527 -11.532 -4.892 881 HH12 ARG 29 HH22 ARG 29 21.051 -11.401 -4.083 882 HH21 ARG 29 HH11 ARG 29 20.473 -14.078 -1.965 883 HH22 ARG 29 HH12 ARG 29 21.584 -12.833 -2.432 884 H GLN 30 HN GLN 30 14.659 -12.587 -0.176 885 HA GLN 30 HA GLN 30 12.294 -14.117 -0.583 886 HB2 GLN 30 HB2 GLN 30 13.913 -14.420 1.306 887 HB3 GLN 30 HB1 GLN 30 13.284 -12.941 2.031 888 HG2 GLN 30 HG2 GLN 30 11.028 -13.940 2.113 889 HG3 GLN 30 HG1 GLN 30 11.663 -15.424 1.400 890 HE21 GLN 30 HE21 GLN 30 10.469 -15.503 3.970 891 HE22 GLN 30 HE22 GLN 30 11.672 -15.808 5.129 892 H GLN 31 HN GLN 31 12.745 -10.808 0.675 893 HA GLN 31 HA GLN 31 10.012 -10.370 1.394 894 HB2 GLN 31 HB2 GLN 31 12.168 -8.435 0.493 895 HB3 GLN 31 HB1 GLN 31 10.599 -7.935 1.130 896 HG2 GLN 31 HG2 GLN 31 11.043 -9.091 3.232 897 HG3 GLN 31 HG1 GLN 31 12.574 -9.698 2.600 898 HE21 GLN 31 HE21 GLN 31 11.245 -7.207 4.443 899 HE22 GLN 31 HE22 GLN 31 12.501 -6.077 4.292 900 H LEU 32 HN LEU 32 11.787 -9.699 -1.626 901 HA LEU 32 HA LEU 32 9.547 -8.595 -3.022 902 HB2 LEU 32 HB2 LEU 32 11.824 -8.277 -3.833 903 HB3 LEU 32 HB1 LEU 32 12.020 -10.012 -4.059 904 HG LEU 32 HG LEU 32 10.310 -10.022 -5.801 905 HD11 LEU 32 HD11 LEU 32 9.510 -7.652 -6.560 906 HD12 LEU 32 HD12 LEU 32 9.941 -7.158 -4.922 907 HD13 LEU 32 HD13 LEU 32 8.717 -8.404 -5.179 908 HD21 LEU 32 HD21 LEU 32 11.551 -8.880 -7.484 909 HD22 LEU 32 HD22 LEU 32 12.740 -9.290 -6.249 910 HD23 LEU 32 HD23 LEU 32 12.105 -7.649 -6.349 911 H CYS 33 HN CYS 33 10.774 -11.916 -2.727 912 HA CYS 33 HA CYS 33 9.025 -13.142 -4.603 913 HB2 CYS 33 HB2 CYS 33 10.199 -14.245 -2.029 914 HB3 CYS 33 HB1 CYS 33 9.420 -15.222 -3.275 915 HG CYS 33 HG CYS 33 12.100 -13.670 -3.695 916 H ASN 34 HN ASN 34 8.546 -12.248 -1.207 917 HA ASN 34 HA ASN 34 6.070 -13.621 -0.817 918 HB2 ASN 34 HB2 ASN 34 7.115 -11.040 0.398 919 HB3 ASN 34 HB1 ASN 34 5.685 -11.903 0.973 920 HD21 ASN 34 HD21 ASN 34 7.782 -11.630 2.782 921 HD22 ASN 34 HD22 ASN 34 8.574 -13.116 2.994 922 H ILE 35 HN ILE 35 6.836 -10.405 -2.098 923 HA ILE 35 HA ILE 35 4.149 -9.474 -2.371 924 HB ILE 35 HB ILE 35 6.533 -8.799 -4.122 925 HG12 ILE 35 HG12 ILE 35 5.588 -7.454 -1.569 926 HG13 ILE 35 HG11 ILE 35 6.956 -8.563 -1.651 927 HG21 ILE 35 HG21 ILE 35 3.981 -7.305 -3.442 928 HG22 ILE 35 HG22 ILE 35 4.399 -7.994 -5.011 929 HG23 ILE 35 HG23 ILE 35 5.322 -6.636 -4.368 930 HD11 ILE 35 HD11 ILE 35 6.677 -5.844 -2.937 931 HD12 ILE 35 HD12 ILE 35 7.885 -7.006 -3.484 932 HD13 ILE 35 HD13 ILE 35 7.927 -6.405 -1.829 933 H GLU 36 HN GLU 36 6.275 -11.238 -4.637 934 HA GLU 36 HA GLU 36 4.483 -11.231 -6.852 935 HB2 GLU 36 HB2 GLU 36 6.968 -12.001 -6.731 936 HB3 GLU 36 HB1 GLU 36 6.310 -13.561 -6.235 937 HG2 GLU 36 HG2 GLU 36 4.761 -13.273 -8.350 938 HG3 GLU 36 HG1 GLU 36 5.984 -12.110 -8.858 939 H GLN 37 HN GLN 37 4.734 -13.385 -4.044 940 HA GLN 37 HA GLN 37 2.689 -15.212 -5.069 941 HB2 GLN 37 HB2 GLN 37 3.884 -14.933 -2.290 942 HB3 GLN 37 HB1 GLN 37 2.863 -16.264 -2.836 943 HG2 GLN 37 HG2 GLN 37 5.518 -15.507 -4.086 944 HG3 GLN 37 HG1 GLN 37 5.288 -16.826 -2.939 945 HE21 GLN 37 HE21 GLN 37 5.673 -16.382 -6.156 946 HE22 GLN 37 HE22 GLN 37 4.704 -17.636 -6.760 947 H SER 38 HN SER 38 2.524 -12.127 -3.933 948 HA SER 38 HA SER 38 0.301 -12.319 -2.099 949 HB2 SER 38 HB2 SER 38 1.848 -10.345 -2.264 950 HB3 SER 38 HB1 SER 38 1.120 -9.959 -3.820 951 HG SER 38 HG SER 38 0.045 -9.827 -1.235 952 H GLU 39 HN GLU 39 -1.895 -12.244 -2.538 953 HA GLU 39 HA GLU 39 -2.692 -12.459 -5.419 954 HB2 GLU 39 HB2 GLU 39 -4.446 -13.127 -3.045 955 HB3 GLU 39 HB1 GLU 39 -4.575 -13.703 -4.705 956 HG2 GLU 39 HG2 GLU 39 -2.331 -14.394 -2.783 957 HG3 GLU 39 HG1 GLU 39 -3.673 -15.453 -3.211 958 H THR 40 HN THR 40 -3.698 -10.988 -2.334 959 HA THR 40 HA THR 40 -5.278 -8.947 -3.850 960 HB THR 40 HB THR 40 -6.416 -8.534 -1.733 961 HG1 THR 40 HG1 THR 40 -4.202 -9.755 -0.793 962 HG21 THR 40 HG21 THR 40 -7.448 -10.743 -1.382 963 HG22 THR 40 HG22 THR 40 -6.110 -11.508 -2.242 964 HG23 THR 40 HG23 THR 40 -7.212 -10.433 -3.102 965 H ALA 41 HN ALA 41 -5.099 -6.693 -2.998 966 HA ALA 41 HA ALA 41 -2.290 -6.096 -2.182 967 HB1 ALA 41 HB1 ALA 41 -4.381 -4.220 -3.320 968 HB2 ALA 41 HB2 ALA 41 -3.203 -5.092 -4.301 969 HB3 ALA 41 HB3 ALA 41 -2.660 -3.893 -3.126 970 HA PRO 42 HA PRO 42 -3.890 -4.870 1.826 971 HB2 PRO 42 HB2 PRO 42 -1.898 -3.071 2.575 972 HB3 PRO 42 HB1 PRO 42 -1.776 -4.833 2.728 973 HG2 PRO 42 HG2 PRO 42 -0.606 -3.033 0.675 974 HG3 PRO 42 HG1 PRO 42 0.027 -4.538 1.354 975 HD2 PRO 42 HD2 PRO 42 -1.131 -4.353 -1.144 976 HD3 PRO 42 HD1 PRO 42 -1.088 -5.848 -0.187 977 H VAL 43 HN VAL 43 -4.756 -2.968 2.975 978 HA VAL 43 HA VAL 43 -6.137 -1.146 1.265 979 HB VAL 43 HB VAL 43 -6.654 0.067 3.439 980 HG11 VAL 43 HG11 VAL 43 -8.009 -1.796 4.318 981 HG12 VAL 43 HG12 VAL 43 -7.070 -2.937 3.355 982 HG13 VAL 43 HG13 VAL 43 -8.085 -1.734 2.558 983 HG21 VAL 43 HG21 VAL 43 -5.146 -2.262 4.656 984 HG22 VAL 43 HG22 VAL 43 -5.905 -0.916 5.507 985 HG23 VAL 43 HG23 VAL 43 -4.470 -0.640 4.517 986 H VAL 44 HN VAL 44 -3.065 -0.851 2.973 987 HA VAL 44 HA VAL 44 -2.623 1.896 3.037 988 HB VAL 44 HB VAL 44 -1.009 0.114 3.745 989 HG11 VAL 44 HG11 VAL 44 -0.066 -0.025 0.887 990 HG12 VAL 44 HG12 VAL 44 -1.381 -1.066 1.430 991 HG13 VAL 44 HG13 VAL 44 0.199 -1.166 2.205 992 HG21 VAL 44 HG21 VAL 44 0.196 2.094 1.782 993 HG22 VAL 44 HG22 VAL 44 1.008 1.347 3.157 994 HG23 VAL 44 HG23 VAL 44 -0.297 2.502 3.426 995 H VAL 45 HN VAL 45 -2.502 -0.264 0.232 996 HA VAL 45 HA VAL 45 -1.551 1.686 -1.652 997 HB VAL 45 HB VAL 45 -3.239 -0.813 -2.015 998 HG11 VAL 45 HG11 VAL 45 -1.992 1.083 -4.009 999 HG12 VAL 45 HG12 VAL 45 -3.662 0.524 -3.942 1000 HG13 VAL 45 HG13 VAL 45 -2.378 -0.586 -4.424 1001 HG21 VAL 45 HG21 VAL 45 -0.286 -0.179 -2.243 1002 HG22 VAL 45 HG22 VAL 45 -1.000 -1.630 -2.947 1003 HG23 VAL 45 HG23 VAL 45 -1.061 -1.376 -1.204 1004 H LYS 46 HN LYS 46 -4.785 0.624 -0.657 1005 HA LYS 46 HA LYS 46 -6.267 2.340 -2.402 1006 HB2 LYS 46 HB2 LYS 46 -7.021 1.350 0.372 1007 HB3 LYS 46 HB1 LYS 46 -8.134 1.971 -0.846 1008 HG2 LYS 46 HG2 LYS 46 -6.384 -0.476 -1.211 1009 HG3 LYS 46 HG1 LYS 46 -8.088 -0.521 -0.761 1010 HD2 LYS 46 HD2 LYS 46 -8.460 0.908 -2.911 1011 HD3 LYS 46 HD1 LYS 46 -6.850 0.352 -3.370 1012 HE2 LYS 46 HE2 LYS 46 -8.267 -1.263 -4.322 1013 HE3 LYS 46 HE1 LYS 46 -7.737 -2.023 -2.821 1014 HZ1 LYS 46 HZ1 LYS 46 -10.334 -0.764 -3.438 1015 HZ2 LYS 46 HZ2 LYS 46 -9.813 -0.940 -1.831 1016 HZ3 LYS 46 HZ3 LYS 46 -10.023 -2.310 -2.812 1017 H TYR 47 HN TYR 47 -4.734 2.819 0.725 1018 HA TYR 47 HA TYR 47 -5.941 5.273 1.468 1019 HB2 TYR 47 HB2 TYR 47 -4.286 3.817 2.796 1020 HB3 TYR 47 HB1 TYR 47 -3.012 4.626 1.888 1021 HD1 TYR 47 HD2 TYR 47 -5.757 5.091 4.316 1022 HD2 TYR 47 HD1 TYR 47 -2.441 6.946 2.312 1023 HE1 TYR 47 HE2 TYR 47 -5.871 6.997 5.894 1024 HE2 TYR 47 HE1 TYR 47 -2.555 8.851 3.899 1025 HH TYR 47 HH TYR 47 -4.686 8.788 6.693 1026 H ILE 48 HN ILE 48 -3.053 4.645 -0.547 1027 HA ILE 48 HA ILE 48 -2.489 7.400 -1.094 1028 HB ILE 48 HB ILE 48 -1.889 4.884 -2.680 1029 HG12 ILE 48 HG12 ILE 48 -0.116 6.644 -0.956 1030 HG13 ILE 48 HG11 ILE 48 -0.866 5.150 -0.399 1031 HG21 ILE 48 HG21 ILE 48 -0.129 6.429 -3.753 1032 HG22 ILE 48 HG22 ILE 48 -1.082 7.767 -3.117 1033 HG23 ILE 48 HG23 ILE 48 -1.797 6.648 -4.277 1034 HD11 ILE 48 HD11 ILE 48 1.250 5.499 -2.528 1035 HD12 ILE 48 HD12 ILE 48 0.279 4.029 -2.417 1036 HD13 ILE 48 HD13 ILE 48 1.312 4.508 -1.071 1037 H ALA 49 HN ALA 49 -4.445 4.989 -2.849 1038 HA ALA 49 HA ALA 49 -5.120 6.646 -5.064 1039 HB1 ALA 49 HB1 ALA 49 -6.773 5.029 -5.580 1040 HB2 ALA 49 HB2 ALA 49 -6.979 4.573 -3.889 1041 HB3 ALA 49 HB3 ALA 49 -5.512 4.118 -4.755 1042 H PHE 50 HN PHE 50 -6.680 6.262 -1.888 1043 HA PHE 50 HA PHE 50 -9.007 7.797 -2.480 1044 HB2 PHE 50 HB2 PHE 50 -8.366 6.344 -0.377 1045 HB3 PHE 50 HB1 PHE 50 -7.727 7.860 0.253 1046 HD1 PHE 50 HD2 PHE 50 -10.733 6.032 -0.778 1047 HD2 PHE 50 HD1 PHE 50 -9.231 9.758 0.750 1048 HE1 PHE 50 HE2 PHE 50 -13.035 6.699 -0.152 1049 HE2 PHE 50 HE1 PHE 50 -11.537 10.424 1.375 1050 HZ PHE 50 HZ PHE 50 -13.439 8.896 0.924 1051 H LEU 51 HN LEU 51 -5.884 8.805 -1.045 1052 HA LEU 51 HA LEU 51 -6.571 11.570 -0.813 1053 HB2 LEU 51 HB2 LEU 51 -3.879 10.213 -1.160 1054 HB3 LEU 51 HB1 LEU 51 -4.074 11.920 -0.776 1055 HG LEU 51 HG LEU 51 -5.164 9.637 0.898 1056 HD11 LEU 51 HD11 LEU 51 -2.812 9.554 1.158 1057 HD12 LEU 51 HD12 LEU 51 -3.363 10.532 2.518 1058 HD13 LEU 51 HD13 LEU 51 -2.658 11.311 1.104 1059 HD21 LEU 51 HD21 LEU 51 -6.539 11.415 1.487 1060 HD22 LEU 51 HD22 LEU 51 -5.334 12.633 1.075 1061 HD23 LEU 51 HD23 LEU 51 -5.191 11.724 2.577 1062 H ARG 52 HN ARG 52 -5.063 9.716 -3.454 1063 HA ARG 52 HA ARG 52 -4.572 11.968 -5.150 1064 HB2 ARG 52 HB2 ARG 52 -5.014 9.035 -5.739 1065 HB3 ARG 52 HB1 ARG 52 -4.743 10.215 -7.020 1066 HG2 ARG 52 HG2 ARG 52 -2.623 10.892 -5.944 1067 HG3 ARG 52 HG1 ARG 52 -2.893 9.701 -4.676 1068 HD2 ARG 52 HD2 ARG 52 -1.347 9.044 -6.662 1069 HD3 ARG 52 HD1 ARG 52 -2.560 7.881 -6.130 1070 HE ARG 52 HE ARG 52 -3.508 8.068 -8.265 1071 HH11 ARG 52 HH21 ARG 52 -1.765 10.945 -7.459 1072 HH12 ARG 52 HH22 ARG 52 -2.127 11.732 -8.956 1073 HH21 ARG 52 HH11 ARG 52 -3.970 9.086 -10.217 1074 HH22 ARG 52 HH12 ARG 52 -3.369 10.683 -10.517 1075 H SER 53 HN SER 53 -7.433 9.956 -4.646 1076 HA SER 53 HA SER 53 -8.960 10.885 -6.851 1077 HB2 SER 53 HB2 SER 53 -10.881 10.069 -5.681 1078 HB3 SER 53 HB1 SER 53 -9.554 9.008 -5.219 1079 HG SER 53 HG SER 53 -10.690 9.676 -3.386 1080 H LYS 54 HN LYS 54 -7.920 12.481 -3.981 1081 HA LYS 54 HA LYS 54 -9.949 14.644 -4.274 1082 HB2 LYS 54 HB2 LYS 54 -7.736 14.330 -2.222 1083 HB3 LYS 54 HB1 LYS 54 -9.068 15.482 -2.164 1084 HG2 LYS 54 HG2 LYS 54 -9.396 12.467 -2.147 1085 HG3 LYS 54 HG1 LYS 54 -9.456 13.491 -0.713 1086 HD2 LYS 54 HD2 LYS 54 -11.315 14.795 -1.970 1087 HD3 LYS 54 HD1 LYS 54 -11.396 13.383 -3.025 1088 HE2 LYS 54 HE2 LYS 54 -13.003 12.935 -1.355 1089 HE3 LYS 54 HE1 LYS 54 -11.594 11.998 -0.856 1090 HZ1 LYS 54 HZ1 LYS 54 -11.338 13.233 0.962 1091 HZ2 LYS 54 HZ2 LYS 54 -12.913 13.802 0.676 1092 HZ3 LYS 54 HZ3 LYS 54 -11.573 14.693 0.131 1093 H GLY 55 HN GLY 55 -7.025 13.846 -5.598 1094 HA2 GLY 55 HA2 GLY 55 -5.732 15.177 -7.074 1095 HA3 GLY 55 HA1 GLY 55 -6.582 16.605 -6.493 1096 H VAL 56 HN VAL 56 -5.138 14.426 -4.157 1097 HA VAL 56 HA VAL 56 -3.518 16.561 -3.077 1098 HB VAL 56 HB VAL 56 -3.521 13.575 -2.545 1099 HG11 VAL 56 HG11 VAL 56 -2.013 15.846 -1.223 1100 HG12 VAL 56 HG12 VAL 56 -1.343 14.367 -1.911 1101 HG13 VAL 56 HG13 VAL 56 -2.293 14.298 -0.427 1102 HG21 VAL 56 HG21 VAL 56 -4.477 15.799 -0.737 1103 HG22 VAL 56 HG22 VAL 56 -4.898 14.091 -0.689 1104 HG23 VAL 56 HG23 VAL 56 -5.540 15.117 -1.968 1105 H ASP 57 HN ASP 57 -2.709 13.636 -4.962 1106 HA ASP 57 HA ASP 57 -0.846 13.159 -6.294 1107 HB2 ASP 57 HB2 ASP 57 0.089 16.015 -6.046 1108 HB3 ASP 57 HB1 ASP 57 0.201 14.918 -7.421 1109 H LEU 58 HN LEU 58 -0.390 12.223 -3.923 1110 HA LEU 58 HA LEU 58 1.954 13.499 -2.646 1111 HB2 LEU 58 HB2 LEU 58 1.810 11.471 -1.115 1112 HB3 LEU 58 HB1 LEU 58 0.427 12.563 -1.070 1113 HG LEU 58 HG LEU 58 0.289 10.323 -3.065 1114 HD11 LEU 58 HD11 LEU 58 0.298 9.926 -0.075 1115 HD12 LEU 58 HD12 LEU 58 1.054 8.942 -1.328 1116 HD13 LEU 58 HD13 LEU 58 -0.693 8.896 -1.106 1117 HD21 LEU 58 HD21 LEU 58 -2.043 10.448 -2.606 1118 HD22 LEU 58 HD22 LEU 58 -1.499 12.123 -2.556 1119 HD23 LEU 58 HD23 LEU 58 -1.776 11.245 -1.056 1120 H ASN 59 HN ASN 59 1.442 11.539 -5.249 1121 HA ASN 59 HA ASN 59 3.337 9.460 -5.003 1122 HB2 ASN 59 HB2 ASN 59 3.577 9.957 -7.608 1123 HB3 ASN 59 HB1 ASN 59 2.063 9.323 -6.961 1124 HD21 ASN 59 HD21 ASN 59 0.941 10.431 -8.808 1125 HD22 ASN 59 HD22 ASN 59 0.646 12.101 -8.720 1126 H ALA 60 HN ALA 60 3.804 12.777 -6.273 1127 HA ALA 60 HA ALA 60 6.688 12.409 -6.438 1128 HB1 ALA 60 HB1 ALA 60 6.696 14.862 -6.943 1129 HB2 ALA 60 HB2 ALA 60 4.952 14.883 -6.666 1130 HB3 ALA 60 HB3 ALA 60 5.628 13.935 -7.992 1131 H LEU 61 HN LEU 61 4.460 13.456 -3.989 1132 HA LEU 61 HA LEU 61 6.081 15.166 -2.435 1133 HB2 LEU 61 HB2 LEU 61 3.743 14.816 -1.893 1134 HB3 LEU 61 HB1 LEU 61 4.020 13.106 -1.592 1135 HG LEU 61 HG LEU 61 5.470 13.679 0.338 1136 HD11 LEU 61 HD11 LEU 61 6.412 15.776 -0.178 1137 HD12 LEU 61 HD12 LEU 61 5.250 16.157 1.094 1138 HD13 LEU 61 HD13 LEU 61 4.849 16.480 -0.592 1139 HD21 LEU 61 HD21 LEU 61 2.828 13.534 0.378 1140 HD22 LEU 61 HD22 LEU 61 2.940 15.258 0.734 1141 HD23 LEU 61 HD23 LEU 61 3.705 14.084 1.804 1142 H PHE 62 HN PHE 62 5.758 11.592 -2.098 1143 HA PHE 62 HA PHE 62 8.112 11.605 -0.326 1144 HB2 PHE 62 HB2 PHE 62 7.750 9.154 -0.199 1145 HB3 PHE 62 HB1 PHE 62 6.327 10.088 0.251 1146 HD1 PHE 62 HD2 PHE 62 7.904 8.206 -2.543 1147 HD2 PHE 62 HD1 PHE 62 4.272 9.850 -0.932 1148 HE1 PHE 62 HE2 PHE 62 6.591 6.999 -4.266 1149 HE2 PHE 62 HE1 PHE 62 2.964 8.639 -2.652 1150 HZ PHE 62 HZ PHE 62 4.117 7.209 -4.313 1151 H ASP 63 HN ASP 63 7.460 11.051 -3.713 1152 HA ASP 63 HA ASP 63 9.627 9.385 -4.400 1153 HB2 ASP 63 HB2 ASP 63 7.832 10.397 -5.952 1154 HB3 ASP 63 HB1 ASP 63 8.878 11.813 -6.040 1155 H ARG 64 HN ARG 64 9.604 12.843 -3.588 1156 HA ARG 64 HA ARG 64 12.257 13.446 -4.438 1157 HB2 ARG 64 HB2 ARG 64 10.783 14.562 -2.026 1158 HB3 ARG 64 HB1 ARG 64 12.201 15.281 -2.790 1159 HG2 ARG 64 HG2 ARG 64 10.765 15.235 -4.969 1160 HG3 ARG 64 HG1 ARG 64 9.402 15.029 -3.869 1161 HD2 ARG 64 HD2 ARG 64 11.157 17.409 -4.283 1162 HD3 ARG 64 HD1 ARG 64 9.431 17.338 -3.928 1163 HE ARG 64 HE ARG 64 11.592 17.433 -1.960 1164 HH11 ARG 64 HH21 ARG 64 8.360 16.491 -2.682 1165 HH12 ARG 64 HH22 ARG 64 7.819 16.599 -1.040 1166 HH21 ARG 64 HH11 ARG 64 10.913 17.580 0.184 1167 HH22 ARG 64 HH12 ARG 64 9.268 17.220 0.586 1168 H ILE 65 HN ILE 65 11.039 11.836 -1.550 1169 HA ILE 65 HA ILE 65 13.448 11.888 -0.011 1170 HB ILE 65 HB ILE 65 11.320 9.730 -0.058 1171 HG12 ILE 65 HG12 ILE 65 11.482 12.200 1.691 1172 HG13 ILE 65 HG11 ILE 65 10.462 12.091 0.256 1173 HG21 ILE 65 HG21 ILE 65 12.035 9.432 2.312 1174 HG22 ILE 65 HG22 ILE 65 13.323 10.606 2.043 1175 HG23 ILE 65 HG23 ILE 65 13.330 9.074 1.168 1176 HD11 ILE 65 HD11 ILE 65 9.078 11.518 2.135 1177 HD12 ILE 65 HD12 ILE 65 10.292 10.405 2.765 1178 HD13 ILE 65 HD13 ILE 65 9.423 10.015 1.281 1179 H ILE 66 HN ILE 66 12.223 9.504 -2.372 1180 HA ILE 66 HA ILE 66 14.544 7.783 -2.078 1181 HB ILE 66 HB ILE 66 12.390 7.932 -4.207 1182 HG12 ILE 66 HG12 ILE 66 12.799 5.935 -1.963 1183 HG13 ILE 66 HG11 ILE 66 11.740 7.338 -1.829 1184 HG21 ILE 66 HG21 ILE 66 14.634 5.952 -3.745 1185 HG22 ILE 66 HG22 ILE 66 14.280 6.860 -5.215 1186 HG23 ILE 66 HG23 ILE 66 13.200 5.565 -4.697 1187 HD11 ILE 66 HD11 ILE 66 10.320 6.552 -3.586 1188 HD12 ILE 66 HD12 ILE 66 10.602 5.169 -2.528 1189 HD13 ILE 66 HD13 ILE 66 11.477 5.306 -4.054 1190 H VAL 67 HN VAL 67 16.489 8.041 -3.033 1191 HA VAL 67 HA VAL 67 16.914 10.293 -4.869 1192 HB VAL 67 HB VAL 67 19.313 9.648 -4.688 1193 HG11 VAL 67 HG11 VAL 67 19.544 10.226 -2.325 1194 HG12 VAL 67 HG12 VAL 67 17.871 9.757 -2.021 1195 HG13 VAL 67 HG13 VAL 67 18.225 11.158 -3.032 1196 HG21 VAL 67 HG21 VAL 67 18.145 7.394 -3.029 1197 HG22 VAL 67 HG22 VAL 67 19.839 7.869 -2.952 1198 HG23 VAL 67 HG23 VAL 67 19.163 7.256 -4.460 1199 H ASN 68 HN ASN 68 17.067 10.130 -7.044 1200 HA ASN 68 HA ASN 68 16.655 7.521 -8.314 1201 HB2 ASN 68 HB2 ASN 68 15.595 9.753 -9.019 1202 HB3 ASN 68 HB1 ASN 68 17.162 10.142 -9.730 1203 HD21 ASN 68 HD21 ASN 68 17.041 6.868 -9.988 1204 HD22 ASN 68 HD22 ASN 68 16.318 6.712 -11.516 1205 H LYS 69 HN LYS 69 18.167 6.345 -9.437 1206 HA LYS 69 HA LYS 69 20.279 5.626 -10.149 1207 HB2 LYS 69 HB2 LYS 69 19.858 7.609 -11.698 1208 HB3 LYS 69 HB1 LYS 69 20.862 8.560 -10.602 1209 HG2 LYS 69 HG2 LYS 69 22.751 7.061 -10.953 1210 HG3 LYS 69 HG1 LYS 69 21.758 5.990 -11.943 1211 HD2 LYS 69 HD2 LYS 69 21.431 7.814 -13.581 1212 HD3 LYS 69 HD1 LYS 69 22.444 8.872 -12.597 1213 HE2 LYS 69 HE2 LYS 69 23.808 7.918 -14.375 1214 HE3 LYS 69 HE1 LYS 69 24.312 7.224 -12.833 1215 HZ1 LYS 69 HZ1 LYS 69 24.041 5.550 -14.590 1216 HZ2 LYS 69 HZ2 LYS 69 22.396 5.955 -14.714 1217 HZ3 LYS 69 HZ3 LYS 69 23.002 5.279 -13.278 1218 H LEU 70 HN LEU 70 21.549 4.863 -8.535 1219 HA LEU 70 HA LEU 70 22.560 6.676 -6.434 1220 HB2 LEU 70 HB2 LEU 70 22.564 3.689 -6.862 1221 HB3 LEU 70 HB1 LEU 70 23.600 4.414 -5.635 1222 HG LEU 70 HG LEU 70 21.334 3.652 -4.796 1223 HD11 LEU 70 HD11 LEU 70 21.215 5.359 -3.238 1224 HD12 LEU 70 HD12 LEU 70 21.415 6.633 -4.437 1225 HD13 LEU 70 HD13 LEU 70 22.809 5.697 -3.902 1226 HD21 LEU 70 HD21 LEU 70 20.169 4.425 -6.933 1227 HD22 LEU 70 HD22 LEU 70 20.287 6.065 -6.296 1228 HD23 LEU 70 HD23 LEU 70 19.356 4.844 -5.426 1229 H GLU 71 HN GLU 71 24.680 7.338 -6.255 1230 HA GLU 71 HA GLU 71 26.734 6.139 -8.048 1231 HB2 GLU 71 HB2 GLU 71 26.011 9.086 -7.948 1232 HB3 GLU 71 HB1 GLU 71 27.484 8.460 -8.684 1233 HG2 GLU 71 HG2 GLU 71 26.157 7.121 -10.254 1234 HG3 GLU 71 HG1 GLU 71 24.667 7.684 -9.496 1235 H HIS 72 HN HIS 72 27.735 9.116 -6.886 1236 HA HIS 72 HA HIS 72 29.179 9.749 -5.165 1237 HB2 HIS 72 HB2 HIS 72 27.784 7.616 -3.528 1238 HB3 HIS 72 HB1 HIS 72 28.594 9.068 -2.941 1239 HD2 HIS 72 HD2 HIS 72 26.798 11.119 -2.509 1240 HE1 HIS 72 HE1 HIS 72 23.819 9.912 -5.250 1241 HE2 HIS 72 HE2 HIS 72 24.445 11.645 -3.506 1242 H HIS 73 HN HIS 73 31.255 9.247 -4.644 1243 HA HIS 73 HA HIS 73 32.541 6.977 -5.718 1244 HB2 HIS 73 HB2 HIS 73 33.262 9.139 -3.789 1245 HB3 HIS 73 HB1 HIS 73 34.298 7.716 -3.765 1246 HD2 HIS 73 HD2 HIS 73 36.397 8.153 -5.467 1247 HE1 HIS 73 HE1 HIS 73 34.361 10.359 -8.437 1248 HE2 HIS 73 HE2 HIS 73 36.599 9.375 -7.763 1249 H HIS 74 HN HIS 74 32.618 7.522 -2.206 1250 HA HIS 74 HA HIS 74 33.154 4.933 -1.423 1251 HB2 HIS 74 HB2 HIS 74 31.203 6.686 0.100 1252 HB3 HIS 74 HB1 HIS 74 32.324 5.497 0.755 1253 HD2 HIS 74 HD2 HIS 74 35.187 6.358 0.153 1254 HE1 HIS 74 HE1 HIS 74 34.078 10.427 0.418 1255 HE2 HIS 74 HE2 HIS 74 36.035 8.812 0.417 1256 H HIS 75 HN HIS 75 29.918 5.784 -0.440 1257 HA HIS 75 HA HIS 75 28.295 4.372 -2.211 1258 HB2 HIS 75 HB2 HIS 75 29.948 2.605 -0.527 1259 HB3 HIS 75 HB1 HIS 75 28.233 2.307 -0.265 1260 HD2 HIS 75 HD2 HIS 75 26.917 2.241 -3.114 1261 HE1 HIS 75 HE1 HIS 75 30.223 0.002 -4.490 1262 HE2 HIS 75 HE2 HIS 75 27.840 0.701 -5.007 1263 H HIS 76 HN HIS 76 29.049 5.945 0.575 1264 HA HIS 76 HA HIS 76 27.840 6.814 2.362 1265 HB2 HIS 76 HB2 HIS 76 26.662 7.595 0.068 1266 HB3 HIS 76 HB1 HIS 76 25.316 6.680 0.737 1267 HD2 HIS 76 HD2 HIS 76 24.459 9.650 0.831 1268 HE1 HIS 76 HE1 HIS 76 26.222 10.057 4.647 1269 HE2 HIS 76 HE2 HIS 76 24.621 11.110 2.985 1270 H HIS 77 HN HIS 77 27.711 3.750 1.717 1271 HA HIS 77 HA HIS 77 26.033 3.135 4.009 1272 HB2 HIS 77 HB2 HIS 77 24.673 3.255 1.604 1273 HB3 HIS 77 HB1 HIS 77 25.091 1.549 1.672 1274 HD2 HIS 77 HD2 HIS 77 24.389 0.539 4.538 1275 HE1 HIS 77 HE1 HIS 77 20.934 2.969 4.514 1276 HE2 HIS 77 HE2 HIS 77 22.090 1.030 5.670 Start of MODEL 10 1 H1 MET 1 HT1 MET 1 8.190 11.601 12.060 2 H2 MET 1 HT2 MET 1 7.139 10.757 11.027 3 H3 MET 1 HT3 MET 1 6.543 11.477 12.446 4 HA MET 1 HA MET 1 5.899 13.034 10.930 5 HB2 MET 1 HB2 MET 1 8.774 13.735 11.621 6 HB3 MET 1 HB1 MET 1 7.603 14.880 10.977 7 HG2 MET 1 HG2 MET 1 7.255 13.331 13.556 8 HG3 MET 1 HG1 MET 1 7.780 15.009 13.456 9 HE1 MET 1 HE1 MET 1 4.836 17.058 12.519 10 HE2 MET 1 HE2 MET 1 5.933 16.472 11.274 11 HE3 MET 1 HE3 MET 1 6.563 16.903 12.862 12 H GLU 2 HN GLU 2 7.861 14.570 9.264 13 HA GLU 2 HA GLU 2 8.506 14.570 7.015 14 HB2 GLU 2 HB2 GLU 2 9.495 11.885 7.981 15 HB3 GLU 2 HB1 GLU 2 9.806 12.473 6.352 16 HG2 GLU 2 HG2 GLU 2 10.462 14.169 8.760 17 HG3 GLU 2 HG1 GLU 2 11.593 12.953 8.169 18 H LEU 3 HN LEU 3 8.298 11.222 6.470 19 HA LEU 3 HA LEU 3 6.407 11.478 4.360 20 HB2 LEU 3 HB2 LEU 3 8.131 9.556 5.061 21 HB3 LEU 3 HB1 LEU 3 6.711 8.865 5.830 22 HG LEU 3 HG LEU 3 6.853 7.948 3.613 23 HD11 LEU 3 HD11 LEU 3 4.776 10.117 3.372 24 HD12 LEU 3 HD12 LEU 3 4.597 8.777 4.504 25 HD13 LEU 3 HD13 LEU 3 4.711 8.462 2.771 26 HD21 LEU 3 HD21 LEU 3 7.406 9.096 1.716 27 HD22 LEU 3 HD22 LEU 3 8.174 10.194 2.850 28 HD23 LEU 3 HD23 LEU 3 6.580 10.571 2.200 29 H SER 4 HN SER 4 5.979 10.303 7.712 30 HA SER 4 HA SER 4 3.169 9.775 7.495 31 HB2 SER 4 HB2 SER 4 4.567 8.939 9.371 32 HB3 SER 4 HB1 SER 4 4.763 10.592 9.944 33 HG SER 4 HG SER 4 2.591 10.689 10.363 34 H ASN 5 HN ASN 5 4.996 12.653 8.478 35 HA ASN 5 HA ASN 5 2.766 14.259 9.234 36 HB2 ASN 5 HB2 ASN 5 5.075 14.885 9.777 37 HB3 ASN 5 HB1 ASN 5 5.445 15.084 8.062 38 HD21 ASN 5 HD21 ASN 5 4.189 16.691 10.856 39 HD22 ASN 5 HD22 ASN 5 3.654 18.101 10.077 40 H GLU 6 HN GLU 6 4.347 13.800 6.067 41 HA GLU 6 HA GLU 6 2.903 15.810 4.669 42 HB2 GLU 6 HB2 GLU 6 4.106 13.192 3.754 43 HB3 GLU 6 HB1 GLU 6 3.379 14.346 2.637 44 HG2 GLU 6 HG2 GLU 6 5.566 15.097 4.592 45 HG3 GLU 6 HG1 GLU 6 5.890 14.588 2.935 46 H LEU 7 HN LEU 7 2.138 12.311 4.973 47 HA LEU 7 HA LEU 7 -0.346 12.501 3.545 48 HB2 LEU 7 HB2 LEU 7 0.799 10.539 5.528 49 HB3 LEU 7 HB1 LEU 7 -0.880 10.381 5.018 50 HG LEU 7 HG LEU 7 -0.224 10.186 2.696 51 HD11 LEU 7 HD11 LEU 7 2.505 10.898 3.772 52 HD12 LEU 7 HD12 LEU 7 1.604 11.679 2.476 53 HD13 LEU 7 HD13 LEU 7 2.313 10.088 2.220 54 HD21 LEU 7 HD21 LEU 7 1.482 8.493 4.548 55 HD22 LEU 7 HD22 LEU 7 1.226 8.136 2.840 56 HD23 LEU 7 HD23 LEU 7 -0.137 8.111 3.960 57 H LYS 8 HN LYS 8 0.446 12.800 6.992 58 HA LYS 8 HA LYS 8 -2.231 13.038 7.944 59 HB2 LYS 8 HB2 LYS 8 -0.208 12.678 9.372 60 HB3 LYS 8 HB1 LYS 8 0.266 14.347 9.062 61 HG2 LYS 8 HG2 LYS 8 -1.813 15.151 10.086 62 HG3 LYS 8 HG1 LYS 8 -2.340 13.487 10.354 63 HD2 LYS 8 HD2 LYS 8 -0.365 13.091 11.784 64 HD3 LYS 8 HD1 LYS 8 0.148 14.759 11.532 65 HE2 LYS 8 HE2 LYS 8 -1.938 15.565 12.571 66 HE3 LYS 8 HE1 LYS 8 -2.459 13.898 12.821 67 HZ1 LYS 8 HZ1 LYS 8 0.186 14.497 13.813 68 HZ2 LYS 8 HZ2 LYS 8 -1.083 13.638 14.547 69 HZ3 LYS 8 HZ3 LYS 8 -1.059 15.336 14.601 70 H VAL 9 HN VAL 9 0.087 15.490 6.803 71 HA VAL 9 HA VAL 9 -1.538 17.768 7.374 72 HB VAL 9 HB VAL 9 0.655 17.292 5.342 73 HG11 VAL 9 HG11 VAL 9 -0.926 19.795 5.962 74 HG12 VAL 9 HG12 VAL 9 -0.601 19.073 4.386 75 HG13 VAL 9 HG13 VAL 9 0.699 19.862 5.279 76 HG21 VAL 9 HG21 VAL 9 0.700 19.058 7.800 77 HG22 VAL 9 HG22 VAL 9 2.064 18.379 6.912 78 HG23 VAL 9 HG23 VAL 9 1.054 17.333 7.908 79 H GLU 10 HN GLU 10 -1.274 15.789 4.396 80 HA GLU 10 HA GLU 10 -3.102 17.374 2.865 81 HB2 GLU 10 HB2 GLU 10 -2.490 14.407 2.668 82 HB3 GLU 10 HB1 GLU 10 -3.329 15.353 1.438 83 HG2 GLU 10 HG2 GLU 10 -0.526 15.937 2.438 84 HG3 GLU 10 HG1 GLU 10 -0.895 15.084 0.940 85 H ARG 11 HN ARG 11 -3.616 14.648 5.079 86 HA ARG 11 HA ARG 11 -6.398 14.275 4.579 87 HB2 ARG 11 HB2 ARG 11 -5.152 12.678 5.928 88 HB3 ARG 11 HB1 ARG 11 -4.771 13.922 7.118 89 HG2 ARG 11 HG2 ARG 11 -7.123 14.128 7.723 90 HG3 ARG 11 HG1 ARG 11 -7.579 13.000 6.446 91 HD2 ARG 11 HD2 ARG 11 -6.585 11.168 7.553 92 HD3 ARG 11 HD1 ARG 11 -5.641 12.210 8.620 93 HE ARG 11 HE ARG 11 -8.190 12.886 9.312 94 HH11 ARG 11 HH21 ARG 11 -6.669 9.841 8.737 95 HH12 ARG 11 HH22 ARG 11 -7.547 9.024 9.985 96 HH21 ARG 11 HH11 ARG 11 -9.327 11.839 10.949 97 HH22 ARG 11 HH12 ARG 11 -9.050 10.153 11.238 98 H ILE 12 HN ILE 12 -4.666 16.459 6.767 99 HA ILE 12 HA ILE 12 -6.994 17.640 7.957 100 HB ILE 12 HB ILE 12 -4.170 18.686 7.600 101 HG12 ILE 12 HG12 ILE 12 -5.583 17.646 10.073 102 HG13 ILE 12 HG11 ILE 12 -4.600 16.622 9.025 103 HG21 ILE 12 HG21 ILE 12 -5.531 20.623 7.910 104 HG22 ILE 12 HG22 ILE 12 -4.900 20.237 9.510 105 HG23 ILE 12 HG23 ILE 12 -6.558 19.805 9.088 106 HD11 ILE 12 HD11 ILE 12 -2.629 17.912 9.464 107 HD12 ILE 12 HD12 ILE 12 -3.381 17.606 11.029 108 HD13 ILE 12 HD13 ILE 12 -3.560 19.181 10.258 109 H ARG 13 HN ARG 13 -5.015 18.560 5.127 110 HA ARG 13 HA ARG 13 -6.234 21.036 4.566 111 HB2 ARG 13 HB2 ARG 13 -5.134 18.930 2.694 112 HB3 ARG 13 HB1 ARG 13 -5.689 20.505 2.134 113 HG2 ARG 13 HG2 ARG 13 -4.078 21.602 3.665 114 HG3 ARG 13 HG1 ARG 13 -3.500 20.013 4.172 115 HD2 ARG 13 HD2 ARG 13 -2.811 19.499 1.880 116 HD3 ARG 13 HD1 ARG 13 -3.463 21.043 1.325 117 HE ARG 13 HE ARG 13 -1.378 21.172 3.424 118 HH11 ARG 13 HH21 ARG 13 -2.263 21.373 0.083 119 HH12 ARG 13 HH22 ARG 13 -0.883 22.323 -0.352 120 HH21 ARG 13 HH11 ARG 13 0.421 22.406 2.855 121 HH22 ARG 13 HH12 ARG 13 0.632 22.905 1.210 122 H LEU 14 HN LEU 14 -7.283 17.775 3.558 123 HA LEU 14 HA LEU 14 -9.723 18.933 2.343 124 HB2 LEU 14 HB2 LEU 14 -8.898 16.032 2.691 125 HB3 LEU 14 HB1 LEU 14 -10.227 16.627 1.698 126 HG LEU 14 HG LEU 14 -7.309 17.336 1.299 127 HD11 LEU 14 HD11 LEU 14 -7.722 15.969 -0.846 128 HD12 LEU 14 HD12 LEU 14 -9.144 15.332 -0.022 129 HD13 LEU 14 HD13 LEU 14 -7.538 15.067 0.657 130 HD21 LEU 14 HD21 LEU 14 -9.880 18.155 -0.052 131 HD22 LEU 14 HD22 LEU 14 -8.394 18.068 -0.999 132 HD23 LEU 14 HD23 LEU 14 -8.490 19.146 0.390 133 H SER 15 HN SER 15 -8.692 18.135 5.394 134 HA SER 15 HA SER 15 -9.799 17.683 7.416 135 HB2 SER 15 HB2 SER 15 -10.805 19.859 6.807 136 HB3 SER 15 HB1 SER 15 -12.068 19.020 5.912 137 HG SER 15 HG SER 15 -11.900 17.937 8.326 138 H LEU 16 HN LEU 16 -9.727 15.312 6.802 139 HA LEU 16 HA LEU 16 -12.485 14.235 6.245 140 HB2 LEU 16 HB2 LEU 16 -9.733 13.280 5.554 141 HB3 LEU 16 HB1 LEU 16 -10.954 12.053 5.869 142 HG LEU 16 HG LEU 16 -10.732 12.756 3.450 143 HD11 LEU 16 HD11 LEU 16 -12.975 12.394 3.034 144 HD12 LEU 16 HD12 LEU 16 -13.512 13.508 4.285 145 HD13 LEU 16 HD13 LEU 16 -12.931 11.905 4.724 146 HD21 LEU 16 HD21 LEU 16 -10.470 15.251 4.204 147 HD22 LEU 16 HD22 LEU 16 -12.232 15.261 4.196 148 HD23 LEU 16 HD23 LEU 16 -11.349 14.890 2.721 149 H THR 17 HN THR 17 -13.442 12.948 7.719 150 HA THR 17 HA THR 17 -12.185 12.734 10.381 151 HB THR 17 HB THR 17 -14.382 11.899 11.088 152 HG1 THR 17 HG1 THR 17 -14.638 10.844 8.908 153 HG21 THR 17 HG21 THR 17 -13.998 14.361 10.760 154 HG22 THR 17 HG22 THR 17 -15.686 13.872 10.612 155 HG23 THR 17 HG23 THR 17 -14.737 14.208 9.165 156 H ALA 18 HN ALA 18 -12.083 10.640 11.499 157 HA ALA 18 HA ALA 18 -10.942 8.579 9.842 158 HB1 ALA 18 HB1 ALA 18 -11.742 8.736 12.748 159 HB2 ALA 18 HB2 ALA 18 -10.123 8.628 12.061 160 HB3 ALA 18 HB3 ALA 18 -11.180 7.216 12.050 161 H LYS 19 HN LYS 19 -14.112 9.044 11.342 162 HA LYS 19 HA LYS 19 -15.155 6.443 10.775 163 HB2 LYS 19 HB2 LYS 19 -16.209 8.071 12.326 164 HB3 LYS 19 HB1 LYS 19 -16.650 9.080 10.950 165 HG2 LYS 19 HG2 LYS 19 -17.506 6.218 10.767 166 HG3 LYS 19 HG1 LYS 19 -18.304 7.167 12.017 167 HD2 LYS 19 HD2 LYS 19 -18.968 8.847 10.345 168 HD3 LYS 19 HD1 LYS 19 -18.156 7.928 9.080 169 HE2 LYS 19 HE2 LYS 19 -19.642 6.008 9.505 170 HE3 LYS 19 HE1 LYS 19 -20.454 6.920 10.779 171 HZ1 LYS 19 HZ1 LYS 19 -20.339 7.643 7.902 172 HZ2 LYS 19 HZ2 LYS 19 -21.055 8.593 9.115 173 HZ3 LYS 19 HZ3 LYS 19 -21.696 7.065 8.738 174 H SER 20 HN SER 20 -15.309 9.476 8.875 175 HA SER 20 HA SER 20 -16.867 8.409 6.742 176 HB2 SER 20 HB2 SER 20 -14.729 10.558 6.649 177 HB3 SER 20 HB1 SER 20 -15.914 10.256 5.384 178 HG SER 20 HG SER 20 -16.915 11.736 6.577 179 H VAL 21 HN VAL 21 -13.315 8.565 7.145 180 HA VAL 21 HA VAL 21 -12.745 7.259 4.645 181 HB VAL 21 HB VAL 21 -11.107 7.460 7.188 182 HG11 VAL 21 HG11 VAL 21 -10.480 6.393 4.432 183 HG12 VAL 21 HG12 VAL 21 -10.152 5.655 6.000 184 HG13 VAL 21 HG13 VAL 21 -9.209 7.045 5.466 185 HG21 VAL 21 HG21 VAL 21 -9.925 9.234 5.875 186 HG22 VAL 21 HG22 VAL 21 -11.614 9.630 6.188 187 HG23 VAL 21 HG23 VAL 21 -11.126 9.044 4.598 188 H ALA 22 HN ALA 22 -13.040 6.037 7.986 189 HA ALA 22 HA ALA 22 -12.447 3.309 7.350 190 HB1 ALA 22 HB1 ALA 22 -13.734 2.832 9.493 191 HB2 ALA 22 HB2 ALA 22 -14.066 4.562 9.580 192 HB3 ALA 22 HB3 ALA 22 -12.403 3.978 9.658 193 H GLU 23 HN GLU 23 -15.482 5.151 7.372 194 HA GLU 23 HA GLU 23 -17.192 2.898 6.851 195 HB2 GLU 23 HB2 GLU 23 -18.080 5.031 7.679 196 HB3 GLU 23 HB1 GLU 23 -17.560 5.844 6.204 197 HG2 GLU 23 HG2 GLU 23 -19.383 3.452 5.989 198 HG3 GLU 23 HG1 GLU 23 -20.065 5.008 6.454 199 H GLU 24 HN GLU 24 -15.503 5.205 4.735 200 HA GLU 24 HA GLU 24 -16.574 4.095 2.281 201 HB2 GLU 24 HB2 GLU 24 -14.069 5.722 2.810 202 HB3 GLU 24 HB1 GLU 24 -14.710 5.368 1.208 203 HG2 GLU 24 HG2 GLU 24 -16.808 6.494 2.928 204 HG3 GLU 24 HG1 GLU 24 -15.414 7.567 2.868 205 H MET 25 HN MET 25 -13.383 3.806 3.874 206 HA MET 25 HA MET 25 -12.386 1.798 2.081 207 HB2 MET 25 HB2 MET 25 -11.618 2.620 4.889 208 HB3 MET 25 HB1 MET 25 -10.762 1.353 4.009 209 HG2 MET 25 HG2 MET 25 -10.239 2.923 2.199 210 HG3 MET 25 HG1 MET 25 -11.153 4.192 3.014 211 HE1 MET 25 HE1 MET 25 -8.430 1.460 3.806 212 HE2 MET 25 HE2 MET 25 -7.027 2.510 3.985 213 HE3 MET 25 HE3 MET 25 -7.907 2.481 2.459 214 H GLY 26 HN GLY 26 -14.095 1.616 5.190 215 HA2 GLY 26 HA2 GLY 26 -15.505 -0.181 5.894 216 HA3 GLY 26 HA1 GLY 26 -14.890 -1.157 4.558 217 H ILE 27 HN ILE 27 -12.998 0.579 7.019 218 HA ILE 27 HA ILE 27 -12.021 -2.066 8.053 219 HB ILE 27 HB ILE 27 -9.778 -1.047 8.290 220 HG12 ILE 27 HG12 ILE 27 -10.906 1.246 6.654 221 HG13 ILE 27 HG11 ILE 27 -10.622 1.341 8.392 222 HG21 ILE 27 HG21 ILE 27 -10.511 -2.326 6.234 223 HG22 ILE 27 HG22 ILE 27 -9.179 -1.200 5.965 224 HG23 ILE 27 HG23 ILE 27 -10.813 -0.770 5.459 225 HD11 ILE 27 HD11 ILE 27 -8.721 2.254 7.052 226 HD12 ILE 27 HD12 ILE 27 -8.491 0.651 6.350 227 HD13 ILE 27 HD13 ILE 27 -8.250 0.899 8.080 228 H SER 28 HN SER 28 -11.036 -1.863 10.256 229 HA SER 28 HA SER 28 -12.850 -0.528 12.040 230 HB2 SER 28 HB2 SER 28 -11.735 -2.575 12.727 231 HB3 SER 28 HB1 SER 28 -10.154 -1.825 12.528 232 HG SER 28 HG SER 28 -10.817 -1.784 14.702 233 H ARG 29 HN ARG 29 -12.358 1.172 13.542 234 HA ARG 29 HA ARG 29 -10.992 3.416 12.389 235 HB2 ARG 29 HB2 ARG 29 -11.766 2.941 15.287 236 HB3 ARG 29 HB1 ARG 29 -11.369 4.500 14.567 237 HG2 ARG 29 HG2 ARG 29 -13.274 4.158 12.955 238 HG3 ARG 29 HG1 ARG 29 -13.724 2.722 13.877 239 HD2 ARG 29 HD2 ARG 29 -13.532 5.542 14.977 240 HD3 ARG 29 HD1 ARG 29 -15.026 4.672 14.626 241 HE ARG 29 HE ARG 29 -13.584 3.031 16.390 242 HH11 ARG 29 HH21 ARG 29 -14.949 6.189 16.255 243 HH12 ARG 29 HH22 ARG 29 -15.180 6.313 17.966 244 HH21 ARG 29 HH11 ARG 29 -13.865 3.171 18.637 245 HH22 ARG 29 HH12 ARG 29 -14.564 4.603 19.317 246 H GLN 30 HN GLN 30 -10.056 0.995 14.798 247 HA GLN 30 HA GLN 30 -7.627 2.194 15.666 248 HB2 GLN 30 HB2 GLN 30 -8.726 0.202 16.719 249 HB3 GLN 30 HB1 GLN 30 -8.202 -0.767 15.343 250 HG2 GLN 30 HG2 GLN 30 -6.595 -1.060 17.134 251 HG3 GLN 30 HG1 GLN 30 -5.831 -0.103 15.865 252 HE21 GLN 30 HE21 GLN 30 -4.425 1.178 17.163 253 HE22 GLN 30 HE22 GLN 30 -4.977 2.244 18.364 254 H GLN 31 HN GLN 31 -8.291 0.014 12.921 255 HA GLN 31 HA GLN 31 -5.573 -0.285 12.088 256 HB2 GLN 31 HB2 GLN 31 -8.158 -0.356 10.505 257 HB3 GLN 31 HB1 GLN 31 -6.586 -0.799 9.836 258 HG2 GLN 31 HG2 GLN 31 -6.331 -2.564 11.498 259 HG3 GLN 31 HG1 GLN 31 -7.840 -2.088 12.276 260 HE21 GLN 31 HE21 GLN 31 -6.573 -4.280 10.066 261 HE22 GLN 31 HE22 GLN 31 -7.998 -4.660 9.227 262 H LEU 32 HN LEU 32 -8.057 2.120 11.284 263 HA LEU 32 HA LEU 32 -6.511 3.511 9.330 264 HB2 LEU 32 HB2 LEU 32 -8.979 3.822 9.722 265 HB3 LEU 32 HB1 LEU 32 -8.579 4.707 11.193 266 HG LEU 32 HG LEU 32 -7.219 6.294 9.822 267 HD11 LEU 32 HD11 LEU 32 -6.585 5.282 7.837 268 HD12 LEU 32 HD12 LEU 32 -7.994 6.163 7.264 269 HD13 LEU 32 HD13 LEU 32 -8.123 4.445 7.637 270 HD21 LEU 32 HD21 LEU 32 -9.528 6.830 10.434 271 HD22 LEU 32 HD22 LEU 32 -10.125 5.973 9.013 272 HD23 LEU 32 HD23 LEU 32 -9.172 7.445 8.820 273 H CYS 33 HN CYS 33 -6.748 3.862 12.860 274 HA CYS 33 HA CYS 33 -5.223 6.234 13.138 275 HB2 CYS 33 HB2 CYS 33 -5.310 3.806 14.955 276 HB3 CYS 33 HB1 CYS 33 -4.673 5.385 15.412 277 HG CYS 33 HG CYS 33 -7.571 5.475 14.401 278 H ASN 34 HN ASN 34 -4.157 2.844 12.899 279 HA ASN 34 HA ASN 34 -1.360 3.391 13.236 280 HB2 ASN 34 HB2 ASN 34 -2.472 1.118 13.353 281 HB3 ASN 34 HB1 ASN 34 -2.585 1.157 11.593 282 HD21 ASN 34 HD21 ASN 34 -1.100 -0.878 12.034 283 HD22 ASN 34 HD22 ASN 34 0.571 -0.578 12.061 284 H ILE 35 HN ILE 35 -3.440 3.215 10.349 285 HA ILE 35 HA ILE 35 -1.343 3.582 8.433 286 HB ILE 35 HB ILE 35 -4.295 4.262 8.299 287 HG12 ILE 35 HG12 ILE 35 -2.733 1.977 7.050 288 HG13 ILE 35 HG11 ILE 35 -3.581 1.841 8.589 289 HG21 ILE 35 HG21 ILE 35 -3.819 4.181 5.782 290 HG22 ILE 35 HG22 ILE 35 -2.113 4.319 6.201 291 HG23 ILE 35 HG23 ILE 35 -3.234 5.609 6.633 292 HD11 ILE 35 HD11 ILE 35 -5.115 1.022 6.965 293 HD12 ILE 35 HD12 ILE 35 -4.759 2.341 5.851 294 HD13 ILE 35 HD13 ILE 35 -5.670 2.655 7.327 295 H GLU 36 HN GLU 36 -3.461 5.912 10.101 296 HA GLU 36 HA GLU 36 -2.635 8.268 8.784 297 HB2 GLU 36 HB2 GLU 36 -3.449 7.761 11.654 298 HB3 GLU 36 HB1 GLU 36 -3.169 9.381 11.017 299 HG2 GLU 36 HG2 GLU 36 -4.950 9.191 9.457 300 HG3 GLU 36 HG1 GLU 36 -5.062 7.444 9.673 301 H GLN 37 HN GLN 37 -1.188 6.673 11.627 302 HA GLN 37 HA GLN 37 1.122 8.538 11.490 303 HB2 GLN 37 HB2 GLN 37 1.804 7.544 13.605 304 HB3 GLN 37 HB1 GLN 37 0.089 7.942 13.702 305 HG2 GLN 37 HG2 GLN 37 -0.426 5.562 13.052 306 HG3 GLN 37 HG1 GLN 37 1.296 5.208 13.191 307 HE21 GLN 37 HE21 GLN 37 0.464 3.688 14.977 308 HE22 GLN 37 HE22 GLN 37 0.266 4.343 16.530 309 H SER 38 HN SER 38 0.429 6.292 9.515 310 HA SER 38 HA SER 38 2.032 4.051 9.620 311 HB2 SER 38 HB2 SER 38 2.392 4.389 7.116 312 HB3 SER 38 HB1 SER 38 0.716 4.422 7.659 313 HG SER 38 HG SER 38 2.403 6.542 6.880 314 H GLU 39 HN GLU 39 4.022 4.088 10.573 315 HA GLU 39 HA GLU 39 5.912 6.212 10.416 316 HB2 GLU 39 HB2 GLU 39 5.951 4.379 12.110 317 HB3 GLU 39 HB1 GLU 39 6.470 3.262 10.849 318 HG2 GLU 39 HG2 GLU 39 8.478 4.646 10.450 319 HG3 GLU 39 HG1 GLU 39 7.959 5.757 11.717 320 H THR 40 HN THR 40 6.727 3.025 9.085 321 HA THR 40 HA THR 40 7.962 4.399 6.734 322 HB THR 40 HB THR 40 9.423 2.956 8.125 323 HG1 THR 40 HG1 THR 40 10.103 1.606 6.363 324 HG21 THR 40 HG21 THR 40 7.456 1.405 8.725 325 HG22 THR 40 HG22 THR 40 9.013 0.637 8.415 326 HG23 THR 40 HG23 THR 40 7.760 0.622 7.175 327 H ALA 41 HN ALA 41 7.731 3.301 4.611 328 HA ALA 41 HA ALA 41 4.956 2.389 4.220 329 HB1 ALA 41 HB1 ALA 41 5.351 2.768 1.891 330 HB2 ALA 41 HB2 ALA 41 7.097 2.664 2.099 331 HB3 ALA 41 HB3 ALA 41 6.216 4.056 2.723 332 HA PRO 42 HA PRO 42 6.046 -1.928 4.079 333 HB2 PRO 42 HB2 PRO 42 4.090 -2.922 2.441 334 HB3 PRO 42 HB1 PRO 42 3.772 -2.378 4.100 335 HG2 PRO 42 HG2 PRO 42 3.341 -0.920 1.524 336 HG3 PRO 42 HG1 PRO 42 2.275 -1.044 2.936 337 HD2 PRO 42 HD2 PRO 42 3.831 1.141 2.501 338 HD3 PRO 42 HD1 PRO 42 3.452 0.569 4.138 339 H VAL 43 HN VAL 43 6.701 -3.680 2.545 340 HA VAL 43 HA VAL 43 8.516 -2.744 0.575 341 HB VAL 43 HB VAL 43 8.575 -5.154 -0.165 342 HG11 VAL 43 HG11 VAL 43 8.661 -4.577 2.811 343 HG12 VAL 43 HG12 VAL 43 9.998 -4.416 1.673 344 HG13 VAL 43 HG13 VAL 43 9.353 -6.012 2.056 345 HG21 VAL 43 HG21 VAL 43 6.554 -5.573 2.055 346 HG22 VAL 43 HG22 VAL 43 7.183 -6.778 0.932 347 HG23 VAL 43 HG23 VAL 43 6.100 -5.514 0.353 348 H VAL 44 HN VAL 44 5.114 -3.576 0.353 349 HA VAL 44 HA VAL 44 4.949 -3.915 -2.475 350 HB VAL 44 HB VAL 44 2.906 -2.844 -0.508 351 HG11 VAL 44 HG11 VAL 44 2.135 -2.154 -2.638 352 HG12 VAL 44 HG12 VAL 44 1.310 -3.685 -2.358 353 HG13 VAL 44 HG13 VAL 44 2.715 -3.624 -3.420 354 HG21 VAL 44 HG21 VAL 44 3.807 -5.185 -0.164 355 HG22 VAL 44 HG22 VAL 44 3.165 -5.596 -1.754 356 HG23 VAL 44 HG23 VAL 44 2.071 -5.110 -0.461 357 H VAL 45 HN VAL 45 4.563 -0.977 -0.468 358 HA VAL 45 HA VAL 45 4.038 0.776 -2.671 359 HB VAL 45 HB VAL 45 5.148 1.271 0.101 360 HG11 VAL 45 HG11 VAL 45 4.516 3.206 -2.137 361 HG12 VAL 45 HG12 VAL 45 5.992 3.098 -1.177 362 HG13 VAL 45 HG13 VAL 45 4.505 3.697 -0.443 363 HG21 VAL 45 HG21 VAL 45 2.485 2.004 -1.139 364 HG22 VAL 45 HG22 VAL 45 2.918 2.056 0.568 365 HG23 VAL 45 HG23 VAL 45 2.752 0.503 -0.252 366 H LYS 46 HN LYS 46 7.074 -0.108 -1.024 367 HA LYS 46 HA LYS 46 8.766 1.640 -2.507 368 HB2 LYS 46 HB2 LYS 46 9.284 -1.053 -1.225 369 HB3 LYS 46 HB1 LYS 46 10.562 -0.063 -1.933 370 HG2 LYS 46 HG2 LYS 46 9.983 1.782 -0.405 371 HG3 LYS 46 HG1 LYS 46 8.689 0.805 0.291 372 HD2 LYS 46 HD2 LYS 46 10.302 -0.846 1.078 373 HD3 LYS 46 HD1 LYS 46 11.619 0.027 0.292 374 HE2 LYS 46 HE2 LYS 46 11.569 0.579 2.676 375 HE3 LYS 46 HE1 LYS 46 11.135 1.999 1.725 376 HZ1 LYS 46 HZ1 LYS 46 9.144 2.060 2.667 377 HZ2 LYS 46 HZ2 LYS 46 9.668 0.860 3.750 378 HZ3 LYS 46 HZ3 LYS 46 8.849 0.425 2.327 379 H TYR 47 HN TYR 47 7.682 -1.692 -3.173 380 HA TYR 47 HA TYR 47 9.211 -2.047 -5.560 381 HB2 TYR 47 HB2 TYR 47 8.153 -3.958 -4.507 382 HB3 TYR 47 HB1 TYR 47 6.557 -3.243 -4.715 383 HD1 TYR 47 HD2 TYR 47 9.570 -3.948 -6.865 384 HD2 TYR 47 HD1 TYR 47 5.294 -4.129 -6.471 385 HE1 TYR 47 HE2 TYR 47 9.405 -4.985 -9.111 386 HE2 TYR 47 HE1 TYR 47 5.133 -5.163 -8.717 387 HH TYR 47 HH TYR 47 6.345 -6.215 -10.348 388 H ILE 48 HN ILE 48 5.945 -0.722 -5.025 389 HA ILE 48 HA ILE 48 5.315 -0.316 -7.786 390 HB ILE 48 HB ILE 48 4.411 1.162 -5.295 391 HG12 ILE 48 HG12 ILE 48 2.955 -0.856 -7.029 392 HG13 ILE 48 HG11 ILE 48 3.849 -1.297 -5.574 393 HG21 ILE 48 HG21 ILE 48 4.035 2.668 -7.116 394 HG22 ILE 48 HG22 ILE 48 2.492 1.874 -6.814 395 HG23 ILE 48 HG23 ILE 48 3.493 1.363 -8.173 396 HD11 ILE 48 HD11 ILE 48 1.422 0.495 -5.778 397 HD12 ILE 48 HD12 ILE 48 2.423 0.415 -4.329 398 HD13 ILE 48 HD13 ILE 48 1.570 -1.023 -4.893 399 H ALA 49 HN ALA 49 6.888 1.796 -5.383 400 HA ALA 49 HA ALA 49 7.192 4.063 -7.091 401 HB1 ALA 49 HB1 ALA 49 9.028 3.125 -4.863 402 HB2 ALA 49 HB2 ALA 49 7.595 4.127 -4.638 403 HB3 ALA 49 HB3 ALA 49 8.976 4.752 -5.541 404 H PHE 50 HN PHE 50 9.089 1.123 -6.676 405 HA PHE 50 HA PHE 50 11.390 1.901 -8.162 406 HB2 PHE 50 HB2 PHE 50 10.839 -0.277 -6.751 407 HB3 PHE 50 HB1 PHE 50 10.300 -0.912 -8.302 408 HD1 PHE 50 HD2 PHE 50 13.193 0.550 -6.491 409 HD2 PHE 50 HD1 PHE 50 11.878 -1.560 -9.993 410 HE1 PHE 50 HE2 PHE 50 15.553 0.084 -7.092 411 HE2 PHE 50 HE1 PHE 50 14.239 -2.027 -10.595 412 HZ PHE 50 HZ PHE 50 16.076 -1.207 -9.143 413 H LEU 51 HN LEU 51 8.358 0.328 -9.201 414 HA LEU 51 HA LEU 51 9.028 0.143 -11.979 415 HB2 LEU 51 HB2 LEU 51 6.341 0.371 -10.590 416 HB3 LEU 51 HB1 LEU 51 6.536 -0.016 -12.297 417 HG LEU 51 HG LEU 51 7.740 -1.622 -10.022 418 HD11 LEU 51 HD11 LEU 51 5.421 -2.425 -11.788 419 HD12 LEU 51 HD12 LEU 51 5.189 -1.630 -10.230 420 HD13 LEU 51 HD13 LEU 51 5.984 -3.202 -10.307 421 HD21 LEU 51 HD21 LEU 51 7.815 -1.839 -13.023 422 HD22 LEU 51 HD22 LEU 51 7.793 -3.327 -12.077 423 HD23 LEU 51 HD23 LEU 51 9.088 -2.158 -11.845 424 H ARG 52 HN ARG 52 7.429 2.698 -10.087 425 HA ARG 52 HA ARG 52 6.792 4.398 -12.295 426 HB2 ARG 52 HB2 ARG 52 7.352 4.973 -9.378 427 HB3 ARG 52 HB1 ARG 52 6.904 6.236 -10.522 428 HG2 ARG 52 HG2 ARG 52 4.793 5.172 -10.988 429 HG3 ARG 52 HG1 ARG 52 5.257 3.735 -10.076 430 HD2 ARG 52 HD2 ARG 52 3.718 5.421 -8.885 431 HD3 ARG 52 HD1 ARG 52 5.141 4.877 -8.001 432 HE ARG 52 HE ARG 52 5.991 7.174 -9.313 433 HH11 ARG 52 HH21 ARG 52 3.356 6.314 -7.269 434 HH12 ARG 52 HH22 ARG 52 3.335 7.833 -6.436 435 HH21 ARG 52 HH11 ARG 52 5.996 9.156 -8.229 436 HH22 ARG 52 HH12 ARG 52 4.832 9.441 -6.978 437 H SER 53 HN SER 53 9.726 4.027 -10.349 438 HA SER 53 HA SER 53 11.119 6.305 -11.352 439 HB2 SER 53 HB2 SER 53 12.088 3.637 -10.304 440 HB3 SER 53 HB1 SER 53 13.187 4.936 -10.753 441 HG SER 53 HG SER 53 11.075 5.677 -9.140 442 H LYS 54 HN LYS 54 10.269 3.306 -12.832 443 HA LYS 54 HA LYS 54 12.312 3.611 -14.978 444 HB2 LYS 54 HB2 LYS 54 10.162 1.495 -14.631 445 HB3 LYS 54 HB1 LYS 54 11.509 1.437 -15.763 446 HG2 LYS 54 HG2 LYS 54 11.880 1.579 -12.758 447 HG3 LYS 54 HG1 LYS 54 11.814 0.062 -13.648 448 HD2 LYS 54 HD2 LYS 54 13.754 0.806 -15.019 449 HD3 LYS 54 HD1 LYS 54 13.846 2.281 -14.061 450 HE2 LYS 54 HE2 LYS 54 14.223 0.986 -12.025 451 HE3 LYS 54 HE1 LYS 54 14.074 -0.517 -12.934 452 HZ1 LYS 54 HZ1 LYS 54 15.956 0.363 -14.341 453 HZ2 LYS 54 HZ2 LYS 54 16.358 -0.104 -12.758 454 HZ3 LYS 54 HZ3 LYS 54 16.189 1.541 -13.143 455 H GLY 55 HN GLY 55 9.357 4.915 -14.309 456 HA2 GLY 55 HA2 GLY 55 8.031 6.260 -15.741 457 HA3 GLY 55 HA1 GLY 55 8.971 5.670 -17.110 458 H VAL 56 HN VAL 56 7.451 3.416 -14.867 459 HA VAL 56 HA VAL 56 6.052 2.102 -17.024 460 HB VAL 56 HB VAL 56 5.841 1.894 -14.007 461 HG11 VAL 56 HG11 VAL 56 4.524 -0.227 -14.514 462 HG12 VAL 56 HG12 VAL 56 4.323 0.389 -16.153 463 HG13 VAL 56 HG13 VAL 56 3.657 1.281 -14.787 464 HG21 VAL 56 HG21 VAL 56 6.809 -0.397 -14.568 465 HG22 VAL 56 HG22 VAL 56 7.879 0.971 -14.852 466 HG23 VAL 56 HG23 VAL 56 7.055 0.198 -16.204 467 H ASP 57 HN ASP 57 5.286 4.761 -14.972 468 HA ASP 57 HA ASP 57 3.431 6.186 -14.901 469 HB2 ASP 57 HB2 ASP 57 2.423 4.748 -17.370 470 HB3 ASP 57 HB1 ASP 57 2.071 6.391 -16.850 471 H LEU 58 HN LEU 58 3.027 4.665 -12.995 472 HA LEU 58 HA LEU 58 1.058 2.596 -13.123 473 HB2 LEU 58 HB2 LEU 58 2.695 3.246 -11.197 474 HB3 LEU 58 HB1 LEU 58 1.439 4.383 -10.718 475 HG LEU 58 HG LEU 58 -0.141 2.249 -10.940 476 HD11 LEU 58 HD11 LEU 58 2.579 1.024 -10.371 477 HD12 LEU 58 HD12 LEU 58 1.623 0.763 -11.828 478 HD13 LEU 58 HD13 LEU 58 1.035 0.178 -10.274 479 HD21 LEU 58 HD21 LEU 58 0.582 1.660 -8.494 480 HD22 LEU 58 HD22 LEU 58 -0.019 3.282 -8.831 481 HD23 LEU 58 HD23 LEU 58 1.714 3.002 -8.683 482 H ASN 59 HN ASN 59 0.805 6.090 -12.627 483 HA ASN 59 HA ASN 59 -1.704 6.612 -11.748 484 HB2 ASN 59 HB2 ASN 59 -0.542 7.765 -14.302 485 HB3 ASN 59 HB1 ASN 59 -1.830 8.499 -13.345 486 HD21 ASN 59 HD21 ASN 59 1.640 7.881 -13.472 487 HD22 ASN 59 HD22 ASN 59 2.045 8.823 -12.118 488 H ALA 60 HN ALA 60 -1.126 5.749 -15.175 489 HA ALA 60 HA ALA 60 -3.929 5.524 -15.800 490 HB1 ALA 60 HB1 ALA 60 -2.113 5.879 -17.485 491 HB2 ALA 60 HB2 ALA 60 -3.182 4.536 -17.892 492 HB3 ALA 60 HB3 ALA 60 -1.586 4.219 -17.210 493 H LEU 61 HN LEU 61 -1.483 3.170 -14.744 494 HA LEU 61 HA LEU 61 -2.983 0.805 -15.224 495 HB2 LEU 61 HB2 LEU 61 -0.511 1.127 -14.501 496 HB3 LEU 61 HB1 LEU 61 -1.131 1.175 -12.855 497 HG LEU 61 HG LEU 61 -1.955 -1.133 -14.619 498 HD11 LEU 61 HD11 LEU 61 0.496 -0.948 -14.929 499 HD12 LEU 61 HD12 LEU 61 0.072 -2.374 -13.987 500 HD13 LEU 61 HD13 LEU 61 0.709 -0.945 -13.179 501 HD21 LEU 61 HD21 LEU 61 -2.877 -0.881 -12.315 502 HD22 LEU 61 HD22 LEU 61 -1.237 -0.918 -11.675 503 HD23 LEU 61 HD23 LEU 61 -1.904 -2.339 -12.474 504 H PHE 62 HN PHE 62 -2.806 2.789 -12.233 505 HA PHE 62 HA PHE 62 -4.803 1.151 -10.881 506 HB2 PHE 62 HB2 PHE 62 -3.450 3.782 -10.297 507 HB3 PHE 62 HB1 PHE 62 -4.862 3.314 -9.356 508 HD1 PHE 62 HD1 PHE 62 -2.371 0.888 -10.721 509 HD2 PHE 62 HD2 PHE 62 -3.767 3.010 -7.255 510 HE1 PHE 62 HE1 PHE 62 -0.969 -0.550 -9.281 511 HE2 PHE 62 HE2 PHE 62 -2.361 1.566 -5.815 512 HZ PHE 62 HZ PHE 62 -0.961 -0.213 -6.825 513 H ASP 63 HN ASP 63 -4.869 4.235 -12.643 514 HA ASP 63 HA ASP 63 -7.587 4.885 -12.068 515 HB2 ASP 63 HB2 ASP 63 -5.841 5.539 -14.458 516 HB3 ASP 63 HB1 ASP 63 -7.447 6.226 -14.211 517 H ARG 64 HN ARG 64 -6.177 2.450 -14.013 518 HA ARG 64 HA ARG 64 -8.401 2.105 -15.838 519 HB2 ARG 64 HB2 ARG 64 -5.803 1.119 -15.647 520 HB3 ARG 64 HB1 ARG 64 -6.759 -0.293 -15.230 521 HG2 ARG 64 HG2 ARG 64 -6.480 -0.392 -17.597 522 HG3 ARG 64 HG1 ARG 64 -8.131 0.169 -17.343 523 HD2 ARG 64 HD2 ARG 64 -7.600 2.389 -17.957 524 HD3 ARG 64 HD1 ARG 64 -5.874 2.153 -17.700 525 HE ARG 64 HE ARG 64 -7.396 1.391 -20.099 526 HH11 ARG 64 HH21 ARG 64 -4.547 1.061 -18.179 527 HH12 ARG 64 HH22 ARG 64 -3.563 0.524 -19.498 528 HH21 ARG 64 HH11 ARG 64 -6.120 0.698 -21.831 529 HH22 ARG 64 HH12 ARG 64 -4.451 0.319 -21.562 530 H ILE 65 HN ILE 65 -7.819 1.341 -12.538 531 HA ILE 65 HA ILE 65 -9.918 -0.768 -12.456 532 HB ILE 65 HB ILE 65 -8.375 0.380 -10.118 533 HG12 ILE 65 HG12 ILE 65 -6.707 -0.316 -11.726 534 HG13 ILE 65 HG11 ILE 65 -6.808 -1.558 -10.480 535 HG21 ILE 65 HG21 ILE 65 -9.724 -2.286 -10.645 536 HG22 ILE 65 HG22 ILE 65 -10.297 -1.025 -9.553 537 HG23 ILE 65 HG23 ILE 65 -8.804 -1.892 -9.193 538 HD11 ILE 65 HD11 ILE 65 -8.496 -2.731 -12.047 539 HD12 ILE 65 HD12 ILE 65 -6.797 -2.768 -12.514 540 HD13 ILE 65 HD13 ILE 65 -7.900 -1.634 -13.290 541 H ILE 66 HN ILE 66 -9.200 2.214 -10.595 542 HA ILE 66 HA ILE 66 -11.907 2.453 -9.615 543 HB ILE 66 HB ILE 66 -11.154 4.733 -8.892 544 HG12 ILE 66 HG12 ILE 66 -8.512 3.928 -10.146 545 HG13 ILE 66 HG11 ILE 66 -9.634 5.060 -10.903 546 HG21 ILE 66 HG21 ILE 66 -9.336 2.369 -8.357 547 HG22 ILE 66 HG22 ILE 66 -10.733 2.876 -7.408 548 HG23 ILE 66 HG23 ILE 66 -9.277 3.870 -7.433 549 HD11 ILE 66 HD11 ILE 66 -9.505 6.509 -8.898 550 HD12 ILE 66 HD12 ILE 66 -7.921 6.281 -9.638 551 HD13 ILE 66 HD13 ILE 66 -8.348 5.390 -8.177 552 H VAL 67 HN VAL 67 -10.314 3.418 -12.523 553 HA VAL 67 HA VAL 67 -11.063 4.580 -14.413 554 HB VAL 67 HB VAL 67 -13.790 3.907 -13.289 555 HG11 VAL 67 HG11 VAL 67 -13.985 5.548 -15.035 556 HG12 VAL 67 HG12 VAL 67 -14.355 3.987 -15.769 557 HG13 VAL 67 HG13 VAL 67 -12.774 4.728 -16.020 558 HG21 VAL 67 HG21 VAL 67 -12.046 2.396 -15.261 559 HG22 VAL 67 HG22 VAL 67 -13.622 1.890 -14.654 560 HG23 VAL 67 HG23 VAL 67 -12.235 1.953 -13.565 561 H ASN 68 HN ASN 68 -10.922 6.696 -14.675 562 HA ASN 68 HA ASN 68 -11.081 8.748 -12.908 563 HB2 ASN 68 HB2 ASN 68 -11.964 10.184 -14.888 564 HB3 ASN 68 HB1 ASN 68 -10.429 9.345 -15.080 565 HD21 ASN 68 HD21 ASN 68 -12.732 6.903 -15.208 566 HD22 ASN 68 HD22 ASN 68 -12.968 6.859 -16.884 567 H LYS 69 HN LYS 69 -12.589 9.790 -11.697 568 HA LYS 69 HA LYS 69 -15.412 8.887 -11.900 569 HB2 LYS 69 HB2 LYS 69 -14.053 10.646 -9.829 570 HB3 LYS 69 HB1 LYS 69 -15.688 10.002 -9.715 571 HG2 LYS 69 HG2 LYS 69 -13.274 8.201 -10.008 572 HG3 LYS 69 HG1 LYS 69 -13.853 8.732 -8.433 573 HD2 LYS 69 HD2 LYS 69 -16.074 7.743 -8.923 574 HD3 LYS 69 HD1 LYS 69 -15.476 7.178 -10.480 575 HE2 LYS 69 HE2 LYS 69 -13.762 5.825 -9.361 576 HE3 LYS 69 HE1 LYS 69 -14.335 6.391 -7.792 577 HZ1 LYS 69 HZ1 LYS 69 -15.485 4.447 -7.995 578 HZ2 LYS 69 HZ2 LYS 69 -15.610 4.552 -9.686 579 HZ3 LYS 69 HZ3 LYS 69 -16.602 5.512 -8.697 580 H LEU 70 HN LEU 70 -16.642 10.018 -13.275 581 HA LEU 70 HA LEU 70 -16.748 12.959 -13.031 582 HB2 LEU 70 HB2 LEU 70 -16.612 13.192 -15.542 583 HB3 LEU 70 HB1 LEU 70 -15.092 12.797 -14.747 584 HG LEU 70 HG LEU 70 -16.721 10.436 -15.599 585 HD11 LEU 70 HD11 LEU 70 -15.784 10.676 -17.961 586 HD12 LEU 70 HD12 LEU 70 -15.503 12.373 -17.570 587 HD13 LEU 70 HD13 LEU 70 -17.142 11.726 -17.555 588 HD21 LEU 70 HD21 LEU 70 -14.316 10.534 -14.611 589 HD22 LEU 70 HD22 LEU 70 -13.825 11.024 -16.230 590 HD23 LEU 70 HD23 LEU 70 -14.608 9.463 -15.979 591 H GLU 71 HN GLU 71 -17.962 11.863 -15.960 592 HA GLU 71 HA GLU 71 -20.062 11.167 -16.715 593 HB2 GLU 71 HB2 GLU 71 -20.030 9.775 -14.469 594 HB3 GLU 71 HB1 GLU 71 -21.168 11.001 -13.913 595 HG2 GLU 71 HG2 GLU 71 -22.288 10.455 -16.326 596 HG3 GLU 71 HG1 GLU 71 -21.518 8.901 -16.022 597 H HIS 72 HN HIS 72 -20.308 13.294 -17.525 598 HA HIS 72 HA HIS 72 -22.004 15.134 -15.858 599 HB2 HIS 72 HB2 HIS 72 -21.092 16.471 -18.234 600 HB3 HIS 72 HB1 HIS 72 -20.604 16.793 -16.576 601 HD2 HIS 72 HD2 HIS 72 -18.623 14.329 -15.929 602 HE1 HIS 72 HE1 HIS 72 -16.738 15.183 -19.610 603 HE2 HIS 72 HE2 HIS 72 -16.492 13.978 -17.393 604 H HIS 73 HN HIS 73 -24.092 14.560 -16.339 605 HA HIS 73 HA HIS 73 -24.829 13.638 -19.027 606 HB2 HIS 73 HB2 HIS 73 -27.145 13.571 -18.018 607 HB3 HIS 73 HB1 HIS 73 -25.949 12.593 -17.173 608 HD2 HIS 73 HD2 HIS 73 -26.233 16.507 -16.476 609 HE1 HIS 73 HE1 HIS 73 -27.435 14.430 -13.015 610 HE2 HIS 73 HE2 HIS 73 -26.961 16.714 -13.997 611 H HIS 74 HN HIS 74 -23.858 16.115 -19.474 612 HA HIS 74 HA HIS 74 -25.056 18.496 -19.230 613 HB2 HIS 74 HB2 HIS 74 -23.331 18.032 -20.939 614 HB3 HIS 74 HB1 HIS 74 -24.555 17.276 -21.961 615 HD2 HIS 74 HD2 HIS 74 -22.947 20.597 -21.886 616 HE1 HIS 74 HE1 HIS 74 -26.952 21.492 -22.881 617 HE2 HIS 74 HE2 HIS 74 -24.587 22.404 -22.807 618 H HIS 75 HN HIS 75 -26.314 17.330 -22.258 619 HA HIS 75 HA HIS 75 -29.048 17.001 -21.238 620 HB2 HIS 75 HB2 HIS 75 -28.320 19.374 -22.987 621 HB3 HIS 75 HB1 HIS 75 -29.967 18.854 -22.640 622 HD2 HIS 75 HD2 HIS 75 -30.317 18.727 -19.572 623 HE1 HIS 75 HE1 HIS 75 -27.859 22.137 -19.153 624 HE2 HIS 75 HE2 HIS 75 -29.553 20.653 -17.986 625 H HIS 76 HN HIS 76 -27.102 17.667 -24.155 626 HA HIS 76 HA HIS 76 -28.757 15.699 -25.675 627 HB2 HIS 76 HB2 HIS 76 -27.360 16.648 -27.626 628 HB3 HIS 76 HB1 HIS 76 -28.549 17.724 -26.892 629 HD2 HIS 76 HD2 HIS 76 -27.205 20.160 -26.985 630 HE1 HIS 76 HE1 HIS 76 -23.597 18.879 -25.203 631 HE2 HIS 76 HE2 HIS 76 -24.877 20.892 -26.066 632 H HIS 77 HN HIS 77 -25.864 15.879 -23.934 633 HA HIS 77 HA HIS 77 -25.068 13.222 -24.798 634 HB2 HIS 77 HB2 HIS 77 -24.191 14.827 -26.619 635 HB3 HIS 77 HB1 HIS 77 -23.067 15.411 -25.393 636 HD2 HIS 77 HD2 HIS 77 -21.766 13.717 -27.892 637 HE1 HIS 77 HE1 HIS 77 -21.498 10.516 -25.149 638 HE2 HIS 77 HE2 HIS 77 -20.662 11.412 -27.370 639 H1 MET 1 HT1 MET 1 -9.000 -5.159 -14.649 640 H2 MET 1 HT2 MET 1 -7.533 -5.001 -15.491 641 H3 MET 1 HT3 MET 1 -7.527 -5.361 -13.831 642 HA MET 1 HA MET 1 -9.045 -7.354 -14.893 643 HB2 MET 1 HB2 MET 1 -8.284 -6.587 -17.148 644 HB3 MET 1 HB1 MET 1 -6.617 -6.857 -16.641 645 HG2 MET 1 HG2 MET 1 -7.075 -9.232 -16.278 646 HG3 MET 1 HG1 MET 1 -8.773 -8.988 -16.691 647 HE1 MET 1 HE1 MET 1 -5.129 -9.213 -19.412 648 HE2 MET 1 HE2 MET 1 -5.332 -9.781 -17.757 649 HE3 MET 1 HE3 MET 1 -5.184 -8.055 -18.075 650 H GLU 2 HN GLU 2 -8.358 -7.696 -12.624 651 HA GLU 2 HA GLU 2 -7.058 -8.780 -11.005 652 HB2 GLU 2 HB2 GLU 2 -7.165 -10.565 -12.813 653 HB3 GLU 2 HB1 GLU 2 -5.581 -10.002 -13.350 654 HG2 GLU 2 HG2 GLU 2 -5.170 -11.811 -11.841 655 HG3 GLU 2 HG1 GLU 2 -4.786 -10.335 -10.956 656 H LEU 3 HN LEU 3 -5.730 -7.415 -9.917 657 HA LEU 3 HA LEU 3 -3.718 -5.780 -11.127 658 HB2 LEU 3 HB2 LEU 3 -4.328 -6.605 -8.291 659 HB3 LEU 3 HB1 LEU 3 -2.884 -5.659 -8.642 660 HG LEU 3 HG LEU 3 -5.543 -4.741 -9.734 661 HD11 LEU 3 HD11 LEU 3 -4.519 -4.175 -6.931 662 HD12 LEU 3 HD12 LEU 3 -5.926 -5.165 -7.323 663 HD13 LEU 3 HD13 LEU 3 -5.934 -3.438 -7.684 664 HD21 LEU 3 HD21 LEU 3 -3.281 -3.075 -8.611 665 HD22 LEU 3 HD22 LEU 3 -4.494 -2.620 -9.807 666 HD23 LEU 3 HD23 LEU 3 -3.194 -3.723 -10.246 667 H SER 4 HN SER 4 -3.561 -8.975 -9.573 668 HA SER 4 HA SER 4 -0.747 -9.218 -9.397 669 HB2 SER 4 HB2 SER 4 -2.581 -10.840 -8.575 670 HB3 SER 4 HB1 SER 4 -2.544 -11.511 -10.201 671 HG SER 4 HG SER 4 -0.673 -12.388 -9.785 672 H ASN 5 HN ASN 5 -2.898 -10.018 -12.133 673 HA ASN 5 HA ASN 5 -0.796 -10.955 -13.844 674 HB2 ASN 5 HB2 ASN 5 -3.195 -11.429 -14.249 675 HB3 ASN 5 HB1 ASN 5 -3.458 -9.723 -14.616 676 HD21 ASN 5 HD21 ASN 5 -4.114 -11.277 -16.713 677 HD22 ASN 5 HD22 ASN 5 -2.903 -11.308 -17.900 678 H GLU 6 HN GLU 6 -2.230 -7.729 -13.365 679 HA GLU 6 HA GLU 6 -0.972 -6.399 -15.524 680 HB2 GLU 6 HB2 GLU 6 -1.693 -5.381 -12.766 681 HB3 GLU 6 HB1 GLU 6 -1.147 -4.342 -14.077 682 HG2 GLU 6 HG2 GLU 6 -3.031 -5.067 -15.472 683 HG3 GLU 6 HG1 GLU 6 -3.574 -6.153 -14.191 684 H LEU 7 HN LEU 7 0.237 -6.695 -12.151 685 HA LEU 7 HA LEU 7 2.732 -5.394 -12.693 686 HB2 LEU 7 HB2 LEU 7 1.757 -7.268 -10.542 687 HB3 LEU 7 HB1 LEU 7 3.467 -6.851 -10.617 688 HG LEU 7 HG LEU 7 2.948 -4.478 -10.431 689 HD11 LEU 7 HD11 LEU 7 0.065 -5.415 -10.510 690 HD12 LEU 7 HD12 LEU 7 0.871 -4.359 -11.669 691 HD13 LEU 7 HD13 LEU 7 0.557 -3.790 -10.031 692 HD21 LEU 7 HD21 LEU 7 2.238 -4.450 -8.163 693 HD22 LEU 7 HD22 LEU 7 2.984 -6.034 -8.372 694 HD23 LEU 7 HD23 LEU 7 1.227 -5.878 -8.375 695 H LYS 8 HN LYS 8 1.746 -8.794 -12.846 696 HA LYS 8 HA LYS 8 4.303 -9.922 -13.338 697 HB2 LYS 8 HB2 LYS 8 1.998 -11.062 -12.916 698 HB3 LYS 8 HB1 LYS 8 1.780 -10.925 -14.660 699 HG2 LYS 8 HG2 LYS 8 3.778 -12.239 -15.072 700 HG3 LYS 8 HG1 LYS 8 4.180 -12.243 -13.356 701 HD2 LYS 8 HD2 LYS 8 3.156 -14.370 -13.868 702 HD3 LYS 8 HD1 LYS 8 2.008 -13.433 -12.913 703 HE2 LYS 8 HE2 LYS 8 0.668 -12.937 -14.804 704 HE3 LYS 8 HE1 LYS 8 1.940 -13.399 -15.935 705 HZ1 LYS 8 HZ1 LYS 8 1.667 -15.674 -14.664 706 HZ2 LYS 8 HZ2 LYS 8 0.685 -15.266 -15.990 707 HZ3 LYS 8 HZ3 LYS 8 0.102 -15.074 -14.406 708 H VAL 9 HN VAL 9 1.893 -8.606 -15.618 709 HA VAL 9 HA VAL 9 3.351 -9.219 -18.001 710 HB VAL 9 HB VAL 9 1.364 -7.006 -17.403 711 HG11 VAL 9 HG11 VAL 9 2.573 -6.270 -19.320 712 HG12 VAL 9 HG12 VAL 9 1.116 -7.033 -19.953 713 HG13 VAL 9 HG13 VAL 9 2.651 -7.899 -19.989 714 HG21 VAL 9 HG21 VAL 9 0.708 -9.503 -17.278 715 HG22 VAL 9 HG22 VAL 9 0.935 -9.521 -19.026 716 HG23 VAL 9 HG23 VAL 9 -0.276 -8.461 -18.303 717 H GLU 10 HN GLU 10 3.328 -6.289 -15.948 718 HA GLU 10 HA GLU 10 5.145 -4.804 -17.576 719 HB2 GLU 10 HB2 GLU 10 3.627 -4.067 -15.565 720 HB3 GLU 10 HB1 GLU 10 5.018 -4.503 -14.575 721 HG2 GLU 10 HG2 GLU 10 5.477 -2.262 -15.007 722 HG3 GLU 10 HG1 GLU 10 6.354 -3.028 -16.325 723 H ARG 11 HN ARG 11 5.698 -6.953 -14.781 724 HA ARG 11 HA ARG 11 8.496 -6.489 -14.533 725 HB2 ARG 11 HB2 ARG 11 6.941 -7.797 -12.963 726 HB3 ARG 11 HB1 ARG 11 7.148 -9.158 -14.064 727 HG2 ARG 11 HG2 ARG 11 9.594 -9.039 -13.749 728 HG3 ARG 11 HG1 ARG 11 9.381 -7.688 -12.635 729 HD2 ARG 11 HD2 ARG 11 9.594 -9.687 -11.302 730 HD3 ARG 11 HD1 ARG 11 7.903 -9.184 -11.239 731 HE ARG 11 HE ARG 11 8.273 -11.031 -13.404 732 HH11 ARG 11 HH21 ARG 11 8.126 -10.738 -9.978 733 HH12 ARG 11 HH22 ARG 11 7.629 -12.378 -9.724 734 HH21 ARG 11 HH11 ARG 11 7.631 -13.181 -13.097 735 HH22 ARG 11 HH12 ARG 11 7.352 -13.762 -11.489 736 H ILE 12 HN ILE 12 6.707 -8.924 -16.412 737 HA ILE 12 HA ILE 12 9.028 -10.143 -17.589 738 HB ILE 12 HB ILE 12 6.132 -10.057 -18.480 739 HG12 ILE 12 HG12 ILE 12 7.720 -12.320 -17.236 740 HG13 ILE 12 HG11 ILE 12 6.778 -11.178 -16.277 741 HG21 ILE 12 HG21 ILE 12 8.531 -11.559 -19.550 742 HG22 ILE 12 HG22 ILE 12 7.384 -10.562 -20.445 743 HG23 ILE 12 HG23 ILE 12 6.882 -12.129 -19.807 744 HD11 ILE 12 HD11 ILE 12 5.515 -13.269 -16.831 745 HD12 ILE 12 HD12 ILE 12 5.639 -12.844 -18.538 746 HD13 ILE 12 HD13 ILE 12 4.735 -11.806 -17.434 747 H ARG 13 HN ARG 13 6.821 -7.575 -18.715 748 HA ARG 13 HA ARG 13 7.910 -7.232 -21.311 749 HB2 ARG 13 HB2 ARG 13 5.848 -6.109 -20.638 750 HB3 ARG 13 HB1 ARG 13 6.712 -5.190 -19.408 751 HG2 ARG 13 HG2 ARG 13 8.014 -4.037 -21.152 752 HG3 ARG 13 HG1 ARG 13 7.215 -4.999 -22.397 753 HD2 ARG 13 HD2 ARG 13 5.730 -3.218 -20.457 754 HD3 ARG 13 HD1 ARG 13 6.249 -2.683 -22.054 755 HE ARG 13 HE ARG 13 4.856 -4.877 -22.749 756 HH11 ARG 13 HH21 ARG 13 4.172 -2.425 -20.398 757 HH12 ARG 13 HH22 ARG 13 2.456 -2.575 -20.564 758 HH21 ARG 13 HH11 ARG 13 2.621 -5.059 -22.970 759 HH22 ARG 13 HH12 ARG 13 1.581 -4.057 -22.015 760 H LEU 14 HN LEU 14 8.844 -5.724 -18.223 761 HA LEU 14 HA LEU 14 11.202 -4.481 -19.536 762 HB2 LEU 14 HB2 LEU 14 10.264 -4.359 -16.654 763 HB3 LEU 14 HB1 LEU 14 11.526 -3.363 -17.381 764 HG LEU 14 HG LEU 14 8.619 -3.405 -18.244 765 HD11 LEU 14 HD11 LEU 14 8.680 -2.316 -16.139 766 HD12 LEU 14 HD12 LEU 14 8.753 -1.006 -17.316 767 HD13 LEU 14 HD13 LEU 14 10.221 -1.534 -16.494 768 HD21 LEU 14 HD21 LEU 14 11.085 -1.972 -19.234 769 HD22 LEU 14 HD22 LEU 14 9.505 -1.203 -19.392 770 HD23 LEU 14 HD23 LEU 14 9.806 -2.756 -20.163 771 H SER 15 HN SER 15 10.408 -7.414 -18.304 772 HA SER 15 HA SER 15 11.607 -9.170 -17.283 773 HB2 SER 15 HB2 SER 15 13.800 -8.001 -19.009 774 HB3 SER 15 HB1 SER 15 13.654 -9.675 -18.475 775 HG SER 15 HG SER 15 12.246 -10.014 -20.004 776 H LEU 16 HN LEU 16 11.653 -8.178 -15.112 777 HA LEU 16 HA LEU 16 14.282 -6.941 -14.375 778 HB2 LEU 16 HB2 LEU 16 11.545 -6.940 -13.140 779 HB3 LEU 16 HB1 LEU 16 12.931 -6.736 -12.076 780 HG LEU 16 HG LEU 16 11.922 -4.584 -12.938 781 HD11 LEU 16 HD11 LEU 16 14.715 -4.691 -14.033 782 HD12 LEU 16 HD12 LEU 16 14.483 -5.056 -12.325 783 HD13 LEU 16 HD13 LEU 16 13.965 -3.505 -12.971 784 HD21 LEU 16 HD21 LEU 16 13.257 -5.214 -15.567 785 HD22 LEU 16 HD22 LEU 16 12.051 -3.983 -15.199 786 HD23 LEU 16 HD23 LEU 16 11.579 -5.679 -15.279 787 H THR 17 HN THR 17 15.669 -7.962 -12.978 788 HA THR 17 HA THR 17 15.207 -10.847 -12.533 789 HB THR 17 HB THR 17 17.591 -10.635 -11.540 790 HG1 THR 17 HG1 THR 17 16.955 -8.065 -12.060 791 HG21 THR 17 HG21 THR 17 18.595 -10.488 -13.808 792 HG22 THR 17 HG22 THR 17 17.050 -9.916 -14.434 793 HG23 THR 17 HG23 THR 17 17.184 -11.544 -13.768 794 H ALA 18 HN ALA 18 14.692 -11.722 -10.560 795 HA ALA 18 HA ALA 18 13.753 -10.050 -8.434 796 HB1 ALA 18 HB1 ALA 18 13.010 -12.407 -8.810 797 HB2 ALA 18 HB2 ALA 18 13.533 -12.116 -7.150 798 HB3 ALA 18 HB3 ALA 18 14.598 -12.959 -8.275 799 H LYS 19 HN LYS 19 16.856 -11.677 -8.993 800 HA LYS 19 HA LYS 19 17.971 -11.232 -6.407 801 HB2 LYS 19 HB2 LYS 19 19.257 -11.441 -9.142 802 HB3 LYS 19 HB1 LYS 19 20.156 -11.434 -7.631 803 HG2 LYS 19 HG2 LYS 19 18.980 -13.441 -6.876 804 HG3 LYS 19 HG1 LYS 19 17.996 -13.432 -8.340 805 HD2 LYS 19 HD2 LYS 19 20.046 -13.692 -9.706 806 HD3 LYS 19 HD1 LYS 19 21.008 -13.749 -8.228 807 HE2 LYS 19 HE2 LYS 19 18.746 -15.669 -8.832 808 HE3 LYS 19 HE1 LYS 19 20.441 -16.019 -9.168 809 HZ1 LYS 19 HZ1 LYS 19 19.298 -15.363 -6.507 810 HZ2 LYS 19 HZ2 LYS 19 20.936 -15.682 -6.826 811 HZ3 LYS 19 HZ3 LYS 19 19.773 -16.906 -7.027 812 H SER 20 HN SER 20 18.147 -9.255 -9.393 813 HA SER 20 HA SER 20 19.738 -7.177 -8.222 814 HB2 SER 20 HB2 SER 20 19.441 -7.443 -10.671 815 HB3 SER 20 HB1 SER 20 17.747 -6.993 -10.503 816 HG SER 20 HG SER 20 18.757 -5.061 -9.369 817 H VAL 21 HN VAL 21 16.212 -7.493 -8.667 818 HA VAL 21 HA VAL 21 15.568 -4.979 -7.440 819 HB VAL 21 HB VAL 21 13.923 -7.510 -7.716 820 HG11 VAL 21 HG11 VAL 21 12.882 -6.189 -6.022 821 HG12 VAL 21 HG12 VAL 21 12.007 -5.822 -7.510 822 HG13 VAL 21 HG13 VAL 21 13.209 -4.688 -6.891 823 HG21 VAL 21 HG21 VAL 21 13.022 -6.484 -9.701 824 HG22 VAL 21 HG22 VAL 21 14.779 -6.391 -9.826 825 HG23 VAL 21 HG23 VAL 21 13.851 -4.966 -9.360 826 H ALA 22 HN ALA 22 15.669 -8.303 -6.140 827 HA ALA 22 HA ALA 22 14.865 -7.587 -3.486 828 HB1 ALA 22 HB1 ALA 22 15.733 -9.788 -2.841 829 HB2 ALA 22 HB2 ALA 22 16.588 -9.912 -4.379 830 HB3 ALA 22 HB3 ALA 22 14.825 -9.906 -4.349 831 H GLU 23 HN GLU 23 18.089 -7.871 -4.990 832 HA GLU 23 HA GLU 23 19.559 -7.428 -2.564 833 HB2 GLU 23 HB2 GLU 23 20.476 -8.299 -4.781 834 HB3 GLU 23 HB1 GLU 23 20.441 -6.634 -5.352 835 HG2 GLU 23 HG2 GLU 23 22.636 -6.839 -4.548 836 HG3 GLU 23 HG1 GLU 23 21.802 -6.112 -3.177 837 H GLU 24 HN GLU 24 18.452 -5.198 -5.120 838 HA GLU 24 HA GLU 24 19.510 -2.834 -3.833 839 HB2 GLU 24 HB2 GLU 24 17.331 -3.215 -5.908 840 HB3 GLU 24 HB1 GLU 24 17.947 -1.639 -5.410 841 HG2 GLU 24 HG2 GLU 24 20.192 -2.234 -6.146 842 HG3 GLU 24 HG1 GLU 24 19.663 -3.869 -6.540 843 H MET 25 HN MET 25 16.327 -4.403 -3.887 844 HA MET 25 HA MET 25 14.964 -2.450 -2.280 845 HB2 MET 25 HB2 MET 25 14.474 -5.380 -2.844 846 HB3 MET 25 HB1 MET 25 13.394 -4.422 -1.837 847 HG2 MET 25 HG2 MET 25 14.178 -3.547 -4.617 848 HG3 MET 25 HG1 MET 25 12.786 -4.585 -4.324 849 HE1 MET 25 HE1 MET 25 11.178 -3.680 -1.900 850 HE2 MET 25 HE2 MET 25 10.690 -4.014 -3.559 851 HE3 MET 25 HE3 MET 25 10.154 -2.536 -2.773 852 H GLY 26 HN GLY 26 16.756 -5.417 -1.481 853 HA2 GLY 26 HA2 GLY 26 17.954 -5.785 0.563 854 HA3 GLY 26 HA1 GLY 26 17.081 -4.439 1.297 855 H ILE 27 HN ILE 27 15.510 -7.055 -0.479 856 HA ILE 27 HA ILE 27 14.440 -8.151 2.099 857 HB ILE 27 HB ILE 27 12.228 -8.388 0.994 858 HG12 ILE 27 HG12 ILE 27 13.441 -6.646 -1.170 859 HG13 ILE 27 HG11 ILE 27 13.143 -8.371 -1.355 860 HG21 ILE 27 HG21 ILE 27 12.956 -6.363 2.387 861 HG22 ILE 27 HG22 ILE 27 11.574 -6.123 1.317 862 HG23 ILE 27 HG23 ILE 27 13.163 -5.518 0.853 863 HD11 ILE 27 HD11 ILE 27 10.979 -6.382 -0.626 864 HD12 ILE 27 HD12 ILE 27 10.771 -8.071 -1.084 865 HD13 ILE 27 HD13 ILE 27 11.316 -6.894 -2.276 866 H SER 28 HN SER 28 13.392 -10.339 1.736 867 HA SER 28 HA SER 28 15.264 -12.084 0.393 868 HB2 SER 28 HB2 SER 28 14.111 -12.855 2.390 869 HB3 SER 28 HB1 SER 28 12.543 -12.607 1.627 870 HG SER 28 HG SER 28 12.759 -14.542 0.865 871 H ARG 29 HN ARG 29 14.798 -13.493 -1.399 872 HA ARG 29 HA ARG 29 13.425 -12.224 -3.579 873 HB2 ARG 29 HB2 ARG 29 14.247 -15.133 -3.275 874 HB3 ARG 29 HB1 ARG 29 13.837 -14.330 -4.791 875 HG2 ARG 29 HG2 ARG 29 15.704 -12.702 -4.357 876 HG3 ARG 29 HG1 ARG 29 16.169 -13.683 -2.967 877 HD2 ARG 29 HD2 ARG 29 16.015 -14.660 -5.834 878 HD3 ARG 29 HD1 ARG 29 17.498 -14.278 -4.962 879 HE ARG 29 HE ARG 29 16.000 -16.210 -3.468 880 HH11 ARG 29 HH21 ARG 29 17.894 -15.735 -6.302 881 HH12 ARG 29 HH22 ARG 29 18.344 -17.400 -6.450 882 HH21 ARG 29 HH11 ARG 29 16.562 -18.404 -3.645 883 HH22 ARG 29 HH12 ARG 29 17.586 -18.913 -4.946 884 H GLN 30 HN GLN 30 12.519 -14.765 -1.292 885 HA GLN 30 HA GLN 30 10.097 -15.593 -2.543 886 HB2 GLN 30 HB2 GLN 30 10.788 -15.465 0.407 887 HB3 GLN 30 HB1 GLN 30 9.453 -16.385 -0.283 888 HG2 GLN 30 HG2 GLN 30 12.364 -16.787 -1.021 889 HG3 GLN 30 HG1 GLN 30 11.483 -17.785 0.135 890 HE21 GLN 30 HE21 GLN 30 12.503 -17.910 -2.967 891 HE22 GLN 30 HE22 GLN 30 11.240 -18.799 -3.672 892 H GLN 31 HN GLN 31 10.726 -12.988 -0.184 893 HA GLN 31 HA GLN 31 7.982 -12.241 0.148 894 HB2 GLN 31 HB2 GLN 31 9.876 -11.506 1.629 895 HB3 GLN 31 HB1 GLN 31 10.404 -10.426 0.338 896 HG2 GLN 31 HG2 GLN 31 8.252 -9.256 0.400 897 HG3 GLN 31 HG1 GLN 31 7.668 -10.363 1.642 898 HE21 GLN 31 HE21 GLN 31 7.886 -9.557 3.729 899 HE22 GLN 31 HE22 GLN 31 9.062 -8.439 4.227 900 H LEU 32 HN LEU 32 10.495 -11.102 -2.108 901 HA LEU 32 HA LEU 32 8.897 -9.088 -3.358 902 HB2 LEU 32 HB2 LEU 32 11.351 -9.245 -3.637 903 HB3 LEU 32 HB1 LEU 32 11.155 -10.758 -4.514 904 HG LEU 32 HG LEU 32 9.821 -9.544 -6.243 905 HD11 LEU 32 HD11 LEU 32 8.909 -7.655 -5.172 906 HD12 LEU 32 HD12 LEU 32 10.199 -6.956 -6.142 907 HD13 LEU 32 HD13 LEU 32 10.441 -7.224 -4.418 908 HD21 LEU 32 HD21 LEU 32 12.186 -9.890 -6.641 909 HD22 LEU 32 HD22 LEU 32 12.605 -8.512 -5.623 910 HD23 LEU 32 HD23 LEU 32 11.781 -8.255 -7.160 911 H CYS 33 HN CYS 33 9.390 -12.534 -4.110 912 HA CYS 33 HA CYS 33 7.739 -12.549 -6.457 913 HB2 CYS 33 HB2 CYS 33 9.420 -14.355 -5.335 914 HB3 CYS 33 HB1 CYS 33 7.886 -15.038 -4.805 915 HG CYS 33 HG CYS 33 7.404 -14.591 -7.618 916 H ASN 34 HN ASN 34 6.989 -12.839 -3.021 917 HA ASN 34 HA ASN 34 4.356 -13.915 -3.256 918 HB2 ASN 34 HB2 ASN 34 5.386 -11.949 -1.190 919 HB3 ASN 34 HB1 ASN 34 3.963 -12.975 -1.024 920 HD21 ASN 34 HD21 ASN 34 6.039 -13.219 0.869 921 HD22 ASN 34 HD22 ASN 34 6.834 -14.703 0.644 922 H ILE 35 HN ILE 35 5.498 -10.552 -3.274 923 HA ILE 35 HA ILE 35 2.969 -9.266 -3.301 924 HB ILE 35 HB ILE 35 5.610 -8.412 -4.516 925 HG12 ILE 35 HG12 ILE 35 4.336 -7.624 -1.883 926 HG13 ILE 35 HG11 ILE 35 5.498 -8.943 -2.032 927 HG21 ILE 35 HG21 ILE 35 4.576 -6.092 -4.133 928 HG22 ILE 35 HG22 ILE 35 3.028 -6.926 -3.987 929 HG23 ILE 35 HG23 ILE 35 3.941 -7.017 -5.494 930 HD11 ILE 35 HD11 ILE 35 6.696 -6.930 -1.400 931 HD12 ILE 35 HD12 ILE 35 5.968 -6.032 -2.731 932 HD13 ILE 35 HD13 ILE 35 7.114 -7.330 -3.064 933 H GLU 36 HN GLU 36 5.096 -9.431 -6.148 934 HA GLU 36 HA GLU 36 3.143 -8.714 -8.015 935 HB2 GLU 36 HB2 GLU 36 4.817 -10.477 -9.450 936 HB3 GLU 36 HB1 GLU 36 5.052 -8.743 -9.255 937 HG2 GLU 36 HG2 GLU 36 6.040 -10.707 -7.178 938 HG3 GLU 36 HG1 GLU 36 7.002 -10.287 -8.588 939 H GLN 37 HN GLN 37 3.629 -11.888 -6.562 940 HA GLN 37 HA GLN 37 1.692 -13.078 -8.493 941 HB2 GLN 37 HB2 GLN 37 2.462 -15.179 -7.814 942 HB3 GLN 37 HB1 GLN 37 3.908 -14.180 -7.690 943 HG2 GLN 37 HG2 GLN 37 3.163 -13.807 -5.222 944 HG3 GLN 37 HG1 GLN 37 2.139 -15.218 -5.477 945 HE21 GLN 37 HE21 GLN 37 4.673 -15.807 -7.504 946 HE22 GLN 37 HE22 GLN 37 5.699 -16.658 -6.455 947 H SER 38 HN SER 38 1.474 -11.411 -5.613 948 HA SER 38 HA SER 38 -1.281 -11.991 -5.236 949 HB2 SER 38 HB2 SER 38 0.624 -13.807 -3.849 950 HB3 SER 38 HB1 SER 38 -0.722 -13.217 -2.876 951 HG SER 38 HG SER 38 -2.030 -13.860 -4.798 952 H GLU 39 HN GLU 39 -2.159 -10.804 -3.391 953 HA GLU 39 HA GLU 39 -2.211 -8.866 -2.069 954 HB2 GLU 39 HB2 GLU 39 -1.354 -10.248 -0.357 955 HB3 GLU 39 HB1 GLU 39 0.216 -10.394 -1.136 956 HG2 GLU 39 HG2 GLU 39 0.024 -8.862 0.946 957 HG3 GLU 39 HG1 GLU 39 0.889 -8.239 -0.452 958 H THR 40 HN THR 40 -1.971 -7.215 -3.600 959 HA THR 40 HA THR 40 0.768 -6.033 -3.800 960 HB THR 40 HB THR 40 0.220 -5.384 -6.137 961 HG1 THR 40 HG1 THR 40 -2.138 -5.752 -5.597 962 HG21 THR 40 HG21 THR 40 0.391 -7.708 -7.090 963 HG22 THR 40 HG22 THR 40 0.129 -8.329 -5.459 964 HG23 THR 40 HG23 THR 40 1.561 -7.362 -5.816 965 H ALA 41 HN ALA 41 -2.522 -5.668 -3.100 966 HA ALA 41 HA ALA 41 -2.202 -2.690 -2.928 967 HB1 ALA 41 HB1 ALA 41 -3.689 -3.429 -4.829 968 HB2 ALA 41 HB2 ALA 41 -4.457 -2.371 -3.645 969 HB3 ALA 41 HB3 ALA 41 -4.774 -4.106 -3.615 970 HA PRO 42 HA PRO 42 -3.566 -4.467 1.138 971 HB2 PRO 42 HB2 PRO 42 -1.749 -3.209 2.720 972 HB3 PRO 42 HB1 PRO 42 -1.363 -4.698 1.834 973 HG2 PRO 42 HG2 PRO 42 -0.694 -1.869 1.149 974 HG3 PRO 42 HG1 PRO 42 0.305 -3.327 1.013 975 HD2 PRO 42 HD2 PRO 42 -1.019 -2.189 -1.111 976 HD3 PRO 42 HD1 PRO 42 -0.598 -3.910 -1.037 977 H VAL 43 HN VAL 43 -4.006 -3.076 3.268 978 HA VAL 43 HA VAL 43 -5.894 -1.047 2.569 979 HB VAL 43 HB VAL 43 -6.124 -0.685 4.959 980 HG11 VAL 43 HG11 VAL 43 -5.490 -3.576 4.298 981 HG12 VAL 43 HG12 VAL 43 -7.053 -2.780 4.115 982 HG13 VAL 43 HG13 VAL 43 -6.381 -3.046 5.724 983 HG21 VAL 43 HG21 VAL 43 -4.478 -1.891 6.495 984 HG22 VAL 43 HG22 VAL 43 -3.844 -0.468 5.666 985 HG23 VAL 43 HG23 VAL 43 -3.439 -2.082 5.082 986 H VAL 44 HN VAL 44 -2.498 -0.877 3.531 987 HA VAL 44 HA VAL 44 -2.370 1.916 4.079 988 HB VAL 44 HB VAL 44 -0.277 0.055 2.916 989 HG11 VAL 44 HG11 VAL 44 -0.103 2.861 4.030 990 HG12 VAL 44 HG12 VAL 44 0.447 2.284 2.457 991 HG13 VAL 44 HG13 VAL 44 1.296 1.793 3.923 992 HG21 VAL 44 HG21 VAL 44 -0.564 1.055 5.758 993 HG22 VAL 44 HG22 VAL 44 0.444 -0.268 5.169 994 HG23 VAL 44 HG23 VAL 44 -1.311 -0.445 5.209 995 H VAL 45 HN VAL 45 -1.855 0.148 1.009 996 HA VAL 45 HA VAL 45 -1.321 2.496 -0.550 997 HB VAL 45 HB VAL 45 -2.322 -0.260 -1.313 998 HG11 VAL 45 HG11 VAL 45 -3.113 1.140 -3.073 999 HG12 VAL 45 HG12 VAL 45 -1.578 0.498 -3.655 1000 HG13 VAL 45 HG13 VAL 45 -1.664 2.145 -3.026 1001 HG21 VAL 45 HG21 VAL 45 -0.030 -0.180 -0.471 1002 HG22 VAL 45 HG22 VAL 45 0.344 1.174 -1.534 1003 HG23 VAL 45 HG23 VAL 45 0.016 -0.416 -2.218 1004 H LYS 46 HN LYS 46 -4.331 0.719 0.141 1005 HA LYS 46 HA LYS 46 -6.036 2.196 -1.583 1006 HB2 LYS 46 HB2 LYS 46 -6.595 0.954 1.128 1007 HB3 LYS 46 HB1 LYS 46 -7.847 1.589 0.062 1008 HG2 LYS 46 HG2 LYS 46 -7.158 0.007 -1.700 1009 HG3 LYS 46 HG1 LYS 46 -5.900 -0.628 -0.638 1010 HD2 LYS 46 HD2 LYS 46 -7.607 -1.320 0.993 1011 HD3 LYS 46 HD1 LYS 46 -8.873 -0.665 -0.045 1012 HE2 LYS 46 HE2 LYS 46 -8.238 -2.244 -1.828 1013 HE3 LYS 46 HE1 LYS 46 -6.962 -2.895 -0.799 1014 HZ1 LYS 46 HZ1 LYS 46 -9.363 -2.883 0.647 1015 HZ2 LYS 46 HZ2 LYS 46 -8.437 -4.218 0.151 1016 HZ3 LYS 46 HZ3 LYS 46 -9.661 -3.609 -0.856 1017 H TYR 47 HN TYR 47 -4.932 2.880 1.730 1018 HA TYR 47 HA TYR 47 -6.562 5.175 2.177 1019 HB2 TYR 47 HB2 TYR 47 -5.261 4.061 3.958 1020 HB3 TYR 47 HB1 TYR 47 -3.764 4.603 3.202 1021 HD1 TYR 47 HD1 TYR 47 -6.912 5.777 4.800 1022 HD2 TYR 47 HD2 TYR 47 -2.934 6.819 3.555 1023 HE1 TYR 47 HE1 TYR 47 -7.097 7.933 6.014 1024 HE2 TYR 47 HE2 TYR 47 -3.122 8.975 4.770 1025 HH TYR 47 HH TYR 47 -4.705 10.445 5.677 1026 H ILE 48 HN ILE 48 -3.228 4.941 0.868 1027 HA ILE 48 HA ILE 48 -2.952 7.754 0.399 1028 HB ILE 48 HB ILE 48 -1.646 5.523 -1.196 1029 HG12 ILE 48 HG12 ILE 48 -0.679 6.816 1.378 1030 HG13 ILE 48 HG11 ILE 48 -1.416 5.214 1.291 1031 HG21 ILE 48 HG21 ILE 48 -1.485 8.058 -1.846 1032 HG22 ILE 48 HG22 ILE 48 -0.003 7.111 -1.771 1033 HG23 ILE 48 HG23 ILE 48 -0.432 8.187 -0.441 1034 HD11 ILE 48 HD11 ILE 48 1.182 6.125 0.031 1035 HD12 ILE 48 HD12 ILE 48 0.377 4.620 -0.425 1036 HD13 ILE 48 HD13 ILE 48 0.949 4.851 1.229 1037 H ALA 49 HN ALA 49 -4.015 5.085 -1.724 1038 HA ALA 49 HA ALA 49 -4.485 6.708 -4.037 1039 HB1 ALA 49 HB1 ALA 49 -4.392 4.302 -4.280 1040 HB2 ALA 49 HB2 ALA 49 -6.015 4.826 -4.734 1041 HB3 ALA 49 HB3 ALA 49 -5.734 4.092 -3.154 1042 H PHE 50 HN PHE 50 -6.429 5.970 -1.201 1043 HA PHE 50 HA PHE 50 -8.957 6.893 -2.111 1044 HB2 PHE 50 HB2 PHE 50 -8.420 5.760 0.114 1045 HB3 PHE 50 HB1 PHE 50 -7.819 7.319 0.669 1046 HD1 PHE 50 HD2 PHE 50 -10.826 5.823 -1.002 1047 HD2 PHE 50 HD1 PHE 50 -9.325 8.769 1.744 1048 HE1 PHE 50 HE2 PHE 50 -13.149 6.490 -0.446 1049 HE2 PHE 50 HE1 PHE 50 -11.649 9.432 2.300 1050 HZ PHE 50 HZ PHE 50 -13.561 8.293 1.206 1051 H LEU 51 HN LEU 51 -6.225 8.615 -0.647 1052 HA LEU 51 HA LEU 51 -7.391 11.230 -0.669 1053 HB2 LEU 51 HB2 LEU 51 -4.508 10.304 -0.833 1054 HB3 LEU 51 HB1 LEU 51 -4.980 11.985 -0.604 1055 HG LEU 51 HG LEU 51 -5.840 9.728 1.229 1056 HD11 LEU 51 HD11 LEU 51 -3.600 11.737 1.597 1057 HD12 LEU 51 HD12 LEU 51 -3.388 10.018 1.268 1058 HD13 LEU 51 HD13 LEU 51 -4.120 10.541 2.784 1059 HD21 LEU 51 HD21 LEU 51 -7.359 11.455 1.634 1060 HD22 LEU 51 HD22 LEU 51 -6.204 12.719 1.218 1061 HD23 LEU 51 HD23 LEU 51 -6.080 11.884 2.765 1062 H ARG 52 HN ARG 52 -5.524 9.415 -3.085 1063 HA ARG 52 HA ARG 52 -5.214 11.513 -4.973 1064 HB2 ARG 52 HB2 ARG 52 -3.964 9.453 -5.235 1065 HB3 ARG 52 HB1 ARG 52 -5.454 8.528 -5.419 1066 HG2 ARG 52 HG2 ARG 52 -5.939 9.505 -7.520 1067 HG3 ARG 52 HG1 ARG 52 -4.782 10.805 -7.281 1068 HD2 ARG 52 HD2 ARG 52 -3.845 9.187 -8.838 1069 HD3 ARG 52 HD1 ARG 52 -2.940 9.120 -7.327 1070 HE ARG 52 HE ARG 52 -5.065 7.195 -7.253 1071 HH11 ARG 52 HH21 ARG 52 -2.040 7.940 -8.725 1072 HH12 ARG 52 HH22 ARG 52 -1.603 6.285 -8.983 1073 HH21 ARG 52 HH11 ARG 52 -4.514 5.021 -7.579 1074 HH22 ARG 52 HH12 ARG 52 -3.004 4.632 -8.334 1075 H SER 53 HN SER 53 -7.879 9.223 -4.495 1076 HA SER 53 HA SER 53 -9.374 9.955 -6.811 1077 HB2 SER 53 HB2 SER 53 -11.295 8.978 -5.654 1078 HB3 SER 53 HB1 SER 53 -9.873 7.978 -5.365 1079 HG SER 53 HG SER 53 -9.800 9.731 -3.478 1080 H LYS 54 HN LYS 54 -8.676 11.694 -3.936 1081 HA LYS 54 HA LYS 54 -11.039 13.474 -4.200 1082 HB2 LYS 54 HB2 LYS 54 -8.708 13.510 -2.259 1083 HB3 LYS 54 HB1 LYS 54 -10.123 14.560 -2.172 1084 HG2 LYS 54 HG2 LYS 54 -11.585 12.613 -1.912 1085 HG3 LYS 54 HG1 LYS 54 -10.200 11.531 -2.068 1086 HD2 LYS 54 HD2 LYS 54 -9.186 12.630 -0.054 1087 HD3 LYS 54 HD1 LYS 54 -10.680 13.551 0.140 1088 HE2 LYS 54 HE2 LYS 54 -10.578 10.531 0.028 1089 HE3 LYS 54 HE1 LYS 54 -10.580 11.448 1.532 1090 HZ1 LYS 54 HZ1 LYS 54 -12.675 11.544 -0.570 1091 HZ2 LYS 54 HZ2 LYS 54 -12.676 12.458 0.861 1092 HZ3 LYS 54 HZ3 LYS 54 -12.810 10.766 0.931 1093 H GLY 55 HN GLY 55 -8.127 13.235 -5.744 1094 HA2 GLY 55 HA2 GLY 55 -7.405 14.889 -7.366 1095 HA3 GLY 55 HA1 GLY 55 -8.124 16.154 -6.370 1096 H VAL 56 HN VAL 56 -6.526 14.107 -4.292 1097 HA VAL 56 HA VAL 56 -4.467 16.024 -3.707 1098 HB VAL 56 HB VAL 56 -4.733 13.105 -2.928 1099 HG11 VAL 56 HG11 VAL 56 -3.137 13.860 -1.062 1100 HG12 VAL 56 HG12 VAL 56 -2.784 15.255 -2.081 1101 HG13 VAL 56 HG13 VAL 56 -2.428 13.627 -2.660 1102 HG21 VAL 56 HG21 VAL 56 -5.532 15.734 -1.661 1103 HG22 VAL 56 HG22 VAL 56 -5.311 14.279 -0.691 1104 HG23 VAL 56 HG23 VAL 56 -6.528 14.311 -1.963 1105 H ASP 57 HN ASP 57 -4.456 12.988 -5.535 1106 HA ASP 57 HA ASP 57 -2.932 12.105 -7.058 1107 HB2 ASP 57 HB2 ASP 57 -2.111 15.012 -7.232 1108 HB3 ASP 57 HB1 ASP 57 -1.523 13.747 -8.300 1109 H LEU 58 HN LEU 58 -1.885 10.851 -5.468 1110 HA LEU 58 HA LEU 58 0.292 11.830 -3.849 1111 HB2 LEU 58 HB2 LEU 58 0.732 9.463 -3.378 1112 HB3 LEU 58 HB1 LEU 58 -0.994 9.802 -3.293 1113 HG LEU 58 HG LEU 58 -0.749 9.113 -5.955 1114 HD11 LEU 58 HD11 LEU 58 1.723 8.506 -5.317 1115 HD12 LEU 58 HD12 LEU 58 0.797 7.390 -6.316 1116 HD13 LEU 58 HD13 LEU 58 1.006 7.072 -4.596 1117 HD21 LEU 58 HD21 LEU 58 -1.848 7.078 -5.422 1118 HD22 LEU 58 HD22 LEU 58 -2.324 8.181 -4.136 1119 HD23 LEU 58 HD23 LEU 58 -1.072 6.973 -3.846 1120 H ASN 59 HN ASN 59 0.135 10.248 -7.024 1121 HA ASN 59 HA ASN 59 2.721 9.472 -7.489 1122 HB2 ASN 59 HB2 ASN 59 2.417 10.255 -9.865 1123 HB3 ASN 59 HB1 ASN 59 1.077 9.290 -9.242 1124 HD21 ASN 59 HD21 ASN 59 1.552 11.923 -11.107 1125 HD22 ASN 59 HD22 ASN 59 0.199 12.855 -10.681 1126 H ALA 60 HN ALA 60 1.621 12.857 -7.964 1127 HA ALA 60 HA ALA 60 4.255 13.864 -8.497 1128 HB1 ALA 60 HB1 ALA 60 2.179 15.082 -9.088 1129 HB2 ALA 60 HB2 ALA 60 3.263 16.080 -8.117 1130 HB3 ALA 60 HB3 ALA 60 1.850 15.329 -7.374 1131 H LEU 61 HN LEU 61 2.327 13.758 -5.492 1132 HA LEU 61 HA LEU 61 4.193 15.138 -3.845 1133 HB2 LEU 61 HB2 LEU 61 1.743 14.302 -3.382 1134 HB3 LEU 61 HB1 LEU 61 2.531 12.833 -2.818 1135 HG LEU 61 HG LEU 61 3.079 15.634 -1.785 1136 HD11 LEU 61 HD11 LEU 61 0.863 14.725 -1.140 1137 HD12 LEU 61 HD12 LEU 61 1.942 14.861 0.248 1138 HD13 LEU 61 HD13 LEU 61 1.655 13.288 -0.493 1139 HD21 LEU 61 HD21 LEU 61 4.219 14.146 0.065 1140 HD22 LEU 61 HD22 LEU 61 5.089 14.481 -1.427 1141 HD23 LEU 61 HD23 LEU 61 4.284 12.928 -1.209 1142 H PHE 62 HN PHE 62 3.832 11.644 -4.509 1143 HA PHE 62 HA PHE 62 6.159 10.935 -2.958 1144 HB2 PHE 62 HB2 PHE 62 4.293 9.508 -4.806 1145 HB3 PHE 62 HB1 PHE 62 5.894 8.795 -4.623 1146 HD1 PHE 62 HD1 PHE 62 3.971 10.707 -2.055 1147 HD2 PHE 62 HD2 PHE 62 5.426 6.866 -3.314 1148 HE1 PHE 62 HE1 PHE 62 3.333 9.745 0.140 1149 HE2 PHE 62 HE2 PHE 62 4.782 5.907 -1.123 1150 HZ PHE 62 HZ PHE 62 3.735 7.344 0.606 1151 H ASP 63 HN ASP 63 5.617 11.862 -6.321 1152 HA ASP 63 HA ASP 63 8.009 11.008 -7.506 1153 HB2 ASP 63 HB2 ASP 63 6.104 12.415 -8.562 1154 HB3 ASP 63 HB1 ASP 63 6.967 13.818 -7.938 1155 H ARG 64 HN ARG 64 7.428 13.635 -5.245 1156 HA ARG 64 HA ARG 64 9.979 14.896 -5.374 1157 HB2 ARG 64 HB2 ARG 64 8.010 15.767 -4.102 1158 HB3 ARG 64 HB1 ARG 64 8.222 14.461 -2.936 1159 HG2 ARG 64 HG2 ARG 64 10.442 15.292 -2.354 1160 HG3 ARG 64 HG1 ARG 64 10.319 16.550 -3.587 1161 HD2 ARG 64 HD2 ARG 64 8.377 16.258 -1.286 1162 HD3 ARG 64 HD1 ARG 64 9.766 17.346 -1.262 1163 HE ARG 64 HE ARG 64 8.389 17.989 -3.604 1164 HH11 ARG 64 HH21 ARG 64 7.735 17.760 -0.230 1165 HH12 ARG 64 HH22 ARG 64 6.528 19.002 -0.242 1166 HH21 ARG 64 HH11 ARG 64 6.817 19.611 -3.647 1167 HH22 ARG 64 HH12 ARG 64 6.007 20.051 -2.180 1168 H ILE 65 HN ILE 65 8.821 12.067 -3.557 1169 HA ILE 65 HA ILE 65 11.211 11.578 -2.059 1170 HB ILE 65 HB ILE 65 9.225 9.516 -3.066 1171 HG12 ILE 65 HG12 ILE 65 9.165 11.042 -0.445 1172 HG13 ILE 65 HG11 ILE 65 8.187 11.486 -1.848 1173 HG21 ILE 65 HG21 ILE 65 11.165 8.459 -2.132 1174 HG22 ILE 65 HG22 ILE 65 9.926 8.408 -0.877 1175 HG23 ILE 65 HG23 ILE 65 11.222 9.602 -0.792 1176 HD11 ILE 65 HD11 ILE 65 8.141 8.810 -0.427 1177 HD12 ILE 65 HD12 ILE 65 7.193 9.211 -1.853 1178 HD13 ILE 65 HD13 ILE 65 6.887 10.048 -0.331 1179 H ILE 66 HN ILE 66 10.132 10.337 -5.235 1180 HA ILE 66 HA ILE 66 12.536 8.745 -5.633 1181 HB ILE 66 HB ILE 66 10.369 9.666 -7.540 1182 HG12 ILE 66 HG12 ILE 66 10.931 6.931 -6.343 1183 HG13 ILE 66 HG11 ILE 66 9.782 8.078 -5.658 1184 HG21 ILE 66 HG21 ILE 66 12.793 7.905 -7.938 1185 HG22 ILE 66 HG22 ILE 66 12.245 9.260 -8.925 1186 HG23 ILE 66 HG23 ILE 66 11.355 7.737 -8.947 1187 HD11 ILE 66 HD11 ILE 66 8.619 6.469 -7.102 1188 HD12 ILE 66 HD12 ILE 66 9.661 6.910 -8.454 1189 HD13 ILE 66 HD13 ILE 66 8.527 8.087 -7.794 1190 H VAL 67 HN VAL 67 14.102 9.221 -7.442 1191 HA VAL 67 HA VAL 67 14.336 11.864 -8.563 1192 HB VAL 67 HB VAL 67 14.787 12.494 -6.233 1193 HG11 VAL 67 HG11 VAL 67 16.450 11.505 -4.905 1194 HG12 VAL 67 HG12 VAL 67 17.229 10.734 -6.279 1195 HG13 VAL 67 HG13 VAL 67 15.695 10.122 -5.687 1196 HG21 VAL 67 HG21 VAL 67 17.493 12.491 -7.552 1197 HG22 VAL 67 HG22 VAL 67 16.687 13.776 -6.659 1198 HG23 VAL 67 HG23 VAL 67 16.165 13.386 -8.294 1199 H ASN 68 HN ASN 68 16.171 12.015 -9.975 1200 HA ASN 68 HA ASN 68 17.147 9.548 -11.060 1201 HB2 ASN 68 HB2 ASN 68 18.815 10.990 -12.252 1202 HB3 ASN 68 HB1 ASN 68 17.161 11.572 -12.422 1203 HD21 ASN 68 HD21 ASN 68 17.731 12.350 -9.307 1204 HD22 ASN 68 HD22 ASN 68 18.413 13.891 -9.488 1205 H LYS 69 HN LYS 69 19.508 8.909 -11.100 1206 HA LYS 69 HA LYS 69 20.793 9.400 -8.422 1207 HB2 LYS 69 HB2 LYS 69 20.808 6.925 -10.166 1208 HB3 LYS 69 HB1 LYS 69 21.832 7.130 -8.745 1209 HG2 LYS 69 HG2 LYS 69 19.757 7.530 -7.385 1210 HG3 LYS 69 HG1 LYS 69 18.798 7.125 -8.806 1211 HD2 LYS 69 HD2 LYS 69 20.882 5.278 -7.611 1212 HD3 LYS 69 HD1 LYS 69 19.170 5.199 -7.205 1213 HE2 LYS 69 HE2 LYS 69 18.759 4.993 -9.747 1214 HE3 LYS 69 HE1 LYS 69 20.486 4.659 -9.869 1215 HZ1 LYS 69 HZ1 LYS 69 19.225 2.624 -9.668 1216 HZ2 LYS 69 HZ2 LYS 69 18.543 3.154 -8.205 1217 HZ3 LYS 69 HZ3 LYS 69 20.211 2.842 -8.305 1218 H LEU 70 HN LEU 70 21.657 11.303 -9.760 1219 HA LEU 70 HA LEU 70 23.416 12.311 -10.947 1220 HB2 LEU 70 HB2 LEU 70 24.673 9.979 -9.502 1221 HB3 LEU 70 HB1 LEU 70 25.657 11.066 -10.480 1222 HG LEU 70 HG LEU 70 24.874 12.993 -9.165 1223 HD11 LEU 70 HD11 LEU 70 22.682 12.429 -8.492 1224 HD12 LEU 70 HD12 LEU 70 23.600 12.369 -6.990 1225 HD13 LEU 70 HD13 LEU 70 23.185 10.875 -7.830 1226 HD21 LEU 70 HD21 LEU 70 26.118 12.536 -7.173 1227 HD22 LEU 70 HD22 LEU 70 26.842 11.530 -8.427 1228 HD23 LEU 70 HD23 LEU 70 25.743 10.814 -7.249 1229 H GLU 71 HN GLU 71 25.604 11.290 -12.273 1230 HA GLU 71 HA GLU 71 26.321 10.130 -14.192 1231 HB2 GLU 71 HB2 GLU 71 24.576 8.307 -13.290 1232 HB3 GLU 71 HB1 GLU 71 23.617 8.881 -14.652 1233 HG2 GLU 71 HG2 GLU 71 24.832 7.256 -15.772 1234 HG3 GLU 71 HG1 GLU 71 25.977 8.586 -15.940 1235 H HIS 72 HN HIS 72 24.459 12.619 -13.876 1236 HA HIS 72 HA HIS 72 23.166 12.748 -16.506 1237 HB2 HIS 72 HB2 HIS 72 23.247 14.397 -14.053 1238 HB3 HIS 72 HB1 HIS 72 23.221 15.367 -15.518 1239 HD2 HIS 72 HD2 HIS 72 21.123 13.561 -17.311 1240 HE1 HIS 72 HE1 HIS 72 18.487 14.059 -14.055 1241 HE2 HIS 72 HE2 HIS 72 18.648 13.451 -16.508 1242 H HIS 73 HN HIS 73 24.383 13.012 -18.290 1243 HA HIS 73 HA HIS 73 26.963 14.480 -18.126 1244 HB2 HIS 73 HB2 HIS 73 27.284 13.744 -20.456 1245 HB3 HIS 73 HB1 HIS 73 26.889 12.367 -19.431 1246 HD2 HIS 73 HD2 HIS 73 24.734 14.796 -21.777 1247 HE1 HIS 73 HE1 HIS 73 23.187 10.878 -22.005 1248 HE2 HIS 73 HE2 HIS 73 22.958 13.244 -22.880 1249 H HIS 74 HN HIS 74 24.078 15.510 -17.977 1250 HA HIS 74 HA HIS 74 23.059 16.965 -19.998 1251 HB2 HIS 74 HB2 HIS 74 22.682 17.060 -17.376 1252 HB3 HIS 74 HB1 HIS 74 23.671 18.508 -17.490 1253 HD2 HIS 74 HD2 HIS 74 20.896 17.628 -20.216 1254 HE1 HIS 74 HE1 HIS 74 19.710 21.103 -18.140 1255 HE2 HIS 74 HE2 HIS 74 19.154 19.551 -20.063 1256 H HIS 75 HN HIS 75 23.413 18.998 -21.022 1257 HA HIS 75 HA HIS 75 26.048 20.303 -20.642 1258 HB2 HIS 75 HB2 HIS 75 26.881 19.863 -22.774 1259 HB3 HIS 75 HB1 HIS 75 26.017 18.363 -22.467 1260 HD2 HIS 75 HD2 HIS 75 23.525 18.107 -23.944 1261 HE1 HIS 75 HE1 HIS 75 24.327 21.363 -26.514 1262 HE2 HIS 75 HE2 HIS 75 22.823 19.358 -26.125 1263 H HIS 76 HN HIS 76 26.097 22.305 -22.214 1264 HA HIS 76 HA HIS 76 25.124 24.365 -22.740 1265 HB2 HIS 76 HB2 HIS 76 23.986 22.975 -24.468 1266 HB3 HIS 76 HB1 HIS 76 22.667 22.684 -23.338 1267 HD2 HIS 76 HD2 HIS 76 24.291 26.270 -23.808 1268 HE1 HIS 76 HE1 HIS 76 20.270 26.426 -25.088 1269 HE2 HIS 76 HE2 HIS 76 22.351 27.802 -24.636 1270 H HIS 77 HN HIS 77 22.142 22.810 -21.536 1271 HA HIS 77 HA HIS 77 20.691 23.565 -19.834 1272 HB2 HIS 77 HB2 HIS 77 22.551 22.446 -18.557 1273 HB3 HIS 77 HB1 HIS 77 23.310 24.029 -18.377 1274 HD2 HIS 77 HD2 HIS 77 19.651 24.721 -18.071 1275 HE1 HIS 77 HE1 HIS 77 20.856 23.785 -14.134 1276 HE2 HIS 77 HE2 HIS 77 19.001 24.782 -15.548 Start of MODEL 11 1 H1 MET 1 HT1 MET 1 13.432 13.451 5.930 2 H2 MET 1 HT2 MET 1 12.717 14.544 4.843 3 H3 MET 1 HT3 MET 1 12.324 12.893 4.773 4 HA MET 1 HA MET 1 11.841 14.304 7.290 5 HB2 MET 1 HB2 MET 1 10.182 14.590 4.773 6 HB3 MET 1 HB1 MET 1 9.571 14.949 6.388 7 HG2 MET 1 HG2 MET 1 11.335 16.621 6.708 8 HG3 MET 1 HG1 MET 1 12.007 16.237 5.124 9 HE1 MET 1 HE1 MET 1 8.280 18.637 6.185 10 HE2 MET 1 HE2 MET 1 9.618 18.133 7.214 11 HE3 MET 1 HE3 MET 1 8.415 16.952 6.702 12 H GLU 2 HN GLU 2 10.092 13.216 8.413 13 HA GLU 2 HA GLU 2 10.047 10.369 7.924 14 HB2 GLU 2 HB2 GLU 2 8.562 12.187 9.822 15 HB3 GLU 2 HB1 GLU 2 8.220 10.458 9.753 16 HG2 GLU 2 HG2 GLU 2 10.998 11.607 10.173 17 HG3 GLU 2 HG1 GLU 2 9.936 11.110 11.490 18 H LEU 3 HN LEU 3 8.444 9.096 7.039 19 HA LEU 3 HA LEU 3 6.799 10.215 5.005 20 HB2 LEU 3 HB2 LEU 3 7.551 7.879 4.960 21 HB3 LEU 3 HB1 LEU 3 6.617 7.531 6.411 22 HG LEU 3 HG LEU 3 4.529 7.999 5.225 23 HD11 LEU 3 HD11 LEU 3 4.822 8.255 2.621 24 HD12 LEU 3 HD12 LEU 3 6.421 8.870 3.045 25 HD13 LEU 3 HD13 LEU 3 4.974 9.676 3.652 26 HD21 LEU 3 HD21 LEU 3 5.552 5.728 5.106 27 HD22 LEU 3 HD22 LEU 3 6.325 6.186 3.587 28 HD23 LEU 3 HD23 LEU 3 4.566 6.107 3.694 29 H SER 4 HN SER 4 5.970 9.053 8.272 30 HA SER 4 HA SER 4 3.167 9.483 8.074 31 HB2 SER 4 HB2 SER 4 5.058 9.524 10.435 32 HB3 SER 4 HB1 SER 4 3.312 9.694 10.611 33 HG SER 4 HG SER 4 4.585 7.573 9.216 34 H ASN 5 HN ASN 5 5.812 11.674 8.910 35 HA ASN 5 HA ASN 5 4.230 13.860 9.817 36 HB2 ASN 5 HB2 ASN 5 6.727 13.628 10.024 37 HB3 ASN 5 HB1 ASN 5 6.852 14.003 8.306 38 HD21 ASN 5 HD21 ASN 5 8.082 15.975 9.013 39 HD22 ASN 5 HD22 ASN 5 7.224 17.335 9.554 40 H GLU 6 HN GLU 6 5.430 13.058 6.556 41 HA GLU 6 HA GLU 6 4.201 15.360 5.308 42 HB2 GLU 6 HB2 GLU 6 6.115 13.978 4.374 43 HB3 GLU 6 HB1 GLU 6 4.931 12.723 4.007 44 HG2 GLU 6 HG2 GLU 6 3.632 14.512 2.733 45 HG3 GLU 6 HG1 GLU 6 5.060 15.531 2.897 46 H LEU 7 HN LEU 7 3.248 11.952 5.701 47 HA LEU 7 HA LEU 7 0.891 12.055 4.116 48 HB2 LEU 7 HB2 LEU 7 1.996 9.968 4.973 49 HB3 LEU 7 HB1 LEU 7 1.376 10.350 6.577 50 HG LEU 7 HG LEU 7 -0.943 10.328 5.646 51 HD11 LEU 7 HD11 LEU 7 -0.848 10.741 3.361 52 HD12 LEU 7 HD12 LEU 7 -0.985 8.987 3.340 53 HD13 LEU 7 HD13 LEU 7 0.590 9.747 3.123 54 HD21 LEU 7 HD21 LEU 7 0.627 7.784 5.123 55 HD22 LEU 7 HD22 LEU 7 -1.092 7.896 5.503 56 HD23 LEU 7 HD23 LEU 7 0.111 8.331 6.718 57 H LYS 8 HN LYS 8 1.340 12.589 7.615 58 HA LYS 8 HA LYS 8 -1.437 13.023 8.171 59 HB2 LYS 8 HB2 LYS 8 -0.717 13.377 10.343 60 HB3 LYS 8 HB1 LYS 8 0.780 12.699 9.714 61 HG2 LYS 8 HG2 LYS 8 1.532 15.052 9.187 62 HG3 LYS 8 HG1 LYS 8 0.102 15.635 10.037 63 HD2 LYS 8 HD2 LYS 8 0.860 14.373 12.062 64 HD3 LYS 8 HD1 LYS 8 2.360 14.004 11.209 65 HE2 LYS 8 HE2 LYS 8 1.287 16.755 11.891 66 HE3 LYS 8 HE1 LYS 8 2.734 15.991 12.550 67 HZ1 LYS 8 HZ1 LYS 8 3.037 15.877 9.827 68 HZ2 LYS 8 HZ2 LYS 8 3.832 16.939 10.888 69 HZ3 LYS 8 HZ3 LYS 8 2.401 17.424 10.112 70 H VAL 9 HN VAL 9 1.157 15.148 7.088 71 HA VAL 9 HA VAL 9 -0.087 17.645 7.565 72 HB VAL 9 HB VAL 9 1.862 16.708 5.443 73 HG11 VAL 9 HG11 VAL 9 2.259 19.240 5.154 74 HG12 VAL 9 HG12 VAL 9 0.671 19.444 5.895 75 HG13 VAL 9 HG13 VAL 9 0.829 18.553 4.382 76 HG21 VAL 9 HG21 VAL 9 2.303 17.063 8.088 77 HG22 VAL 9 HG22 VAL 9 2.511 18.732 7.566 78 HG23 VAL 9 HG23 VAL 9 3.525 17.463 6.880 79 H GLU 10 HN GLU 10 -0.303 15.514 4.683 80 HA GLU 10 HA GLU 10 -2.085 17.242 3.242 81 HB2 GLU 10 HB2 GLU 10 -1.531 14.276 3.150 82 HB3 GLU 10 HB1 GLU 10 -2.698 15.033 2.067 83 HG2 GLU 10 HG2 GLU 10 0.049 16.251 2.290 84 HG3 GLU 10 HG1 GLU 10 -0.135 14.772 1.351 85 H ARG 11 HN ARG 11 -2.717 14.463 5.415 86 HA ARG 11 HA ARG 11 -5.551 14.473 5.184 87 HB2 ARG 11 HB2 ARG 11 -4.218 12.682 6.285 88 HB3 ARG 11 HB1 ARG 11 -3.867 13.785 7.615 89 HG2 ARG 11 HG2 ARG 11 -6.294 13.984 8.074 90 HG3 ARG 11 HG1 ARG 11 -6.622 12.852 6.763 91 HD2 ARG 11 HD2 ARG 11 -5.502 11.069 7.897 92 HD3 ARG 11 HD1 ARG 11 -4.816 12.177 9.087 93 HE ARG 11 HE ARG 11 -7.771 12.014 8.980 94 HH11 ARG 11 HH21 ARG 11 -4.781 11.095 10.466 95 HH12 ARG 11 HH22 ARG 11 -5.518 10.676 11.974 96 HH21 ARG 11 HH11 ARG 11 -8.731 11.466 10.946 97 HH22 ARG 11 HH12 ARG 11 -7.744 10.882 12.245 98 H ILE 12 HN ILE 12 -3.414 16.213 7.457 99 HA ILE 12 HA ILE 12 -5.534 17.516 8.897 100 HB ILE 12 HB ILE 12 -2.623 18.257 8.483 101 HG12 ILE 12 HG12 ILE 12 -4.043 17.134 10.917 102 HG13 ILE 12 HG11 ILE 12 -3.221 16.125 9.728 103 HG21 ILE 12 HG21 ILE 12 -3.077 19.677 10.585 104 HG22 ILE 12 HG22 ILE 12 -4.785 19.514 10.178 105 HG23 ILE 12 HG23 ILE 12 -3.681 20.305 9.053 106 HD11 ILE 12 HD11 ILE 12 -1.156 17.600 10.147 107 HD12 ILE 12 HD12 ILE 12 -1.610 16.490 11.439 108 HD13 ILE 12 HD13 ILE 12 -2.017 18.202 11.562 109 H ARG 13 HN ARG 13 -3.554 18.506 6.103 110 HA ARG 13 HA ARG 13 -4.549 21.147 5.823 111 HB2 ARG 13 HB2 ARG 13 -2.620 20.226 4.548 112 HB3 ARG 13 HB1 ARG 13 -3.734 19.213 3.631 113 HG2 ARG 13 HG2 ARG 13 -4.909 21.300 2.855 114 HG3 ARG 13 HG1 ARG 13 -3.670 22.246 3.676 115 HD2 ARG 13 HD2 ARG 13 -2.850 20.131 1.696 116 HD3 ARG 13 HD1 ARG 13 -3.394 21.699 1.117 117 HE ARG 13 HE ARG 13 -0.917 21.176 2.648 118 HH11 ARG 13 HH21 ARG 13 -3.179 23.423 1.295 119 HH12 ARG 13 HH22 ARG 13 -2.061 24.743 1.304 120 HH21 ARG 13 HH11 ARG 13 0.538 22.904 2.668 121 HH22 ARG 13 HH12 ARG 13 0.032 24.454 2.082 122 H LEU 14 HN LEU 14 -5.767 18.089 4.453 123 HA LEU 14 HA LEU 14 -8.101 19.500 3.309 124 HB2 LEU 14 HB2 LEU 14 -7.386 16.551 3.336 125 HB3 LEU 14 HB1 LEU 14 -8.654 17.301 2.366 126 HG LEU 14 HG LEU 14 -5.694 17.954 2.180 127 HD11 LEU 14 HD11 LEU 14 -7.381 16.550 0.104 128 HD12 LEU 14 HD12 LEU 14 -6.509 15.654 1.348 129 HD13 LEU 14 HD13 LEU 14 -5.624 16.658 0.200 130 HD21 LEU 14 HD21 LEU 14 -8.164 19.012 0.804 131 HD22 LEU 14 HD22 LEU 14 -6.621 19.002 -0.051 132 HD23 LEU 14 HD23 LEU 14 -6.785 19.903 1.453 133 H SER 15 HN SER 15 -7.266 18.367 6.300 134 HA SER 15 HA SER 15 -8.474 17.548 8.158 135 HB2 SER 15 HB2 SER 15 -10.718 18.845 8.361 136 HB3 SER 15 HB1 SER 15 -9.224 19.777 8.322 137 HG SER 15 HG SER 15 -9.864 20.634 6.521 138 H LEU 16 HN LEU 16 -8.622 15.390 7.008 139 HA LEU 16 HA LEU 16 -11.356 14.769 5.967 140 HB2 LEU 16 HB2 LEU 16 -8.855 13.058 6.051 141 HB3 LEU 16 HB1 LEU 16 -10.355 12.667 5.210 142 HG LEU 16 HG LEU 16 -8.611 15.074 4.643 143 HD11 LEU 16 HD11 LEU 16 -7.496 13.050 3.914 144 HD12 LEU 16 HD12 LEU 16 -8.157 13.856 2.491 145 HD13 LEU 16 HD13 LEU 16 -8.979 12.452 3.171 146 HD21 LEU 16 HD21 LEU 16 -10.152 14.986 2.498 147 HD22 LEU 16 HD22 LEU 16 -10.750 15.743 3.970 148 HD23 LEU 16 HD23 LEU 16 -11.250 14.101 3.559 149 H THR 17 HN THR 17 -12.762 13.516 7.085 150 HA THR 17 HA THR 17 -12.062 12.822 9.874 151 HB THR 17 HB THR 17 -14.526 12.179 9.943 152 HG1 THR 17 HG1 THR 17 -15.184 13.614 7.788 153 HG21 THR 17 HG21 THR 17 -13.647 14.960 9.144 154 HG22 THR 17 HG22 THR 17 -13.868 14.328 10.776 155 HG23 THR 17 HG23 THR 17 -15.268 14.595 9.736 156 H ALA 18 HN ALA 18 -11.722 10.764 10.575 157 HA ALA 18 HA ALA 18 -11.188 8.652 8.719 158 HB1 ALA 18 HB1 ALA 18 -10.113 8.710 10.902 159 HB2 ALA 18 HB2 ALA 18 -11.064 7.232 10.779 160 HB3 ALA 18 HB3 ALA 18 -11.676 8.598 11.712 161 H LYS 19 HN LYS 19 -14.019 9.451 10.686 162 HA LYS 19 HA LYS 19 -15.466 7.029 10.281 163 HB2 LYS 19 HB2 LYS 19 -16.007 8.902 11.917 164 HB3 LYS 19 HB1 LYS 19 -16.649 9.805 10.546 165 HG2 LYS 19 HG2 LYS 19 -18.589 8.759 11.313 166 HG3 LYS 19 HG1 LYS 19 -18.042 7.587 10.115 167 HD2 LYS 19 HD2 LYS 19 -16.967 6.254 11.876 168 HD3 LYS 19 HD1 LYS 19 -17.425 7.453 13.085 169 HE2 LYS 19 HE2 LYS 19 -19.807 7.040 12.594 170 HE3 LYS 19 HE1 LYS 19 -19.349 5.833 11.391 171 HZ1 LYS 19 HZ1 LYS 19 -18.470 5.675 14.212 172 HZ2 LYS 19 HZ2 LYS 19 -18.435 4.454 13.032 173 HZ3 LYS 19 HZ3 LYS 19 -19.918 4.975 13.674 174 H SER 20 HN SER 20 -15.492 10.094 8.445 175 HA SER 20 HA SER 20 -17.456 9.319 6.538 176 HB2 SER 20 HB2 SER 20 -15.088 11.189 6.224 177 HB3 SER 20 HB1 SER 20 -16.443 11.085 5.103 178 HG SER 20 HG SER 20 -16.661 12.745 6.718 179 H VAL 21 HN VAL 21 -13.905 8.990 6.467 180 HA VAL 21 HA VAL 21 -13.804 7.761 3.870 181 HB VAL 21 HB VAL 21 -11.893 7.614 6.224 182 HG11 VAL 21 HG11 VAL 21 -11.673 6.651 3.368 183 HG12 VAL 21 HG12 VAL 21 -11.384 5.739 4.849 184 HG13 VAL 21 HG13 VAL 21 -10.251 6.997 4.351 185 HG21 VAL 21 HG21 VAL 21 -10.699 9.376 5.128 186 HG22 VAL 21 HG22 VAL 21 -12.393 9.867 5.113 187 HG23 VAL 21 HG23 VAL 21 -11.655 9.202 3.657 188 H ALA 22 HN ALA 22 -13.933 6.436 7.169 189 HA ALA 22 HA ALA 22 -13.680 3.696 6.505 190 HB1 ALA 22 HB1 ALA 22 -15.484 4.679 8.716 191 HB2 ALA 22 HB2 ALA 22 -13.733 4.861 8.818 192 HB3 ALA 22 HB3 ALA 22 -14.443 3.253 8.691 193 H GLU 23 HN GLU 23 -16.638 5.681 6.791 194 HA GLU 23 HA GLU 23 -18.442 3.546 6.155 195 HB2 GLU 23 HB2 GLU 23 -18.716 6.549 5.793 196 HB3 GLU 23 HB1 GLU 23 -20.045 5.398 5.634 197 HG2 GLU 23 HG2 GLU 23 -18.342 5.663 8.129 198 HG3 GLU 23 HG1 GLU 23 -19.892 6.476 7.909 199 H GLU 24 HN GLU 24 -16.721 5.916 4.151 200 HA GLU 24 HA GLU 24 -18.032 5.160 1.692 201 HB2 GLU 24 HB2 GLU 24 -16.359 7.219 2.509 202 HB3 GLU 24 HB1 GLU 24 -15.295 6.294 1.456 203 HG2 GLU 24 HG2 GLU 24 -16.355 7.826 -0.004 204 HG3 GLU 24 HG1 GLU 24 -17.269 6.333 -0.230 205 H MET 25 HN MET 25 -14.801 4.408 3.023 206 HA MET 25 HA MET 25 -14.057 2.621 0.915 207 HB2 MET 25 HB2 MET 25 -13.146 2.946 3.774 208 HB3 MET 25 HB1 MET 25 -12.439 1.734 2.705 209 HG2 MET 25 HG2 MET 25 -11.821 3.498 1.102 210 HG3 MET 25 HG1 MET 25 -12.563 4.712 2.142 211 HE1 MET 25 HE1 MET 25 -10.184 1.529 3.299 212 HE2 MET 25 HE2 MET 25 -8.734 2.328 2.699 213 HE3 MET 25 HE3 MET 25 -10.086 2.040 1.609 214 H GLY 26 HN GLY 26 -15.700 2.100 4.024 215 HA2 GLY 26 HA2 GLY 26 -17.351 0.351 4.330 216 HA3 GLY 26 HA1 GLY 26 -16.601 -0.563 3.019 217 H ILE 27 HN ILE 27 -14.727 0.961 5.587 218 HA ILE 27 HA ILE 27 -14.160 -1.752 6.754 219 HB ILE 27 HB ILE 27 -11.819 -1.021 7.089 220 HG12 ILE 27 HG12 ILE 27 -12.528 1.319 5.296 221 HG13 ILE 27 HG11 ILE 27 -12.373 1.464 7.044 222 HG21 ILE 27 HG21 ILE 27 -12.626 -2.272 5.033 223 HG22 ILE 27 HG22 ILE 27 -11.119 -1.378 4.824 224 HG23 ILE 27 HG23 ILE 27 -12.631 -0.725 4.187 225 HD11 ILE 27 HD11 ILE 27 -10.068 0.850 6.989 226 HD12 ILE 27 HD12 ILE 27 -10.286 2.041 5.707 227 HD13 ILE 27 HD13 ILE 27 -10.174 0.327 5.308 228 H SER 28 HN SER 28 -13.171 -1.552 8.978 229 HA SER 28 HA SER 28 -14.876 0.141 10.602 230 HB2 SER 28 HB2 SER 28 -13.481 -0.847 12.479 231 HB3 SER 28 HB1 SER 28 -14.307 -2.022 11.460 232 HG SER 28 HG SER 28 -11.598 -1.179 11.271 233 H ARG 29 HN ARG 29 -14.146 1.764 12.085 234 HA ARG 29 HA ARG 29 -12.236 3.607 11.001 235 HB2 ARG 29 HB2 ARG 29 -14.163 4.296 12.412 236 HB3 ARG 29 HB1 ARG 29 -13.410 3.516 13.804 237 HG2 ARG 29 HG2 ARG 29 -11.611 5.056 13.835 238 HG3 ARG 29 HG1 ARG 29 -11.952 5.618 12.201 239 HD2 ARG 29 HD2 ARG 29 -12.714 7.308 13.772 240 HD3 ARG 29 HD1 ARG 29 -14.123 6.554 13.032 241 HE ARG 29 HE ARG 29 -13.725 5.086 15.353 242 HH11 ARG 29 HH21 ARG 29 -14.050 8.418 14.505 243 HH12 ARG 29 HH22 ARG 29 -14.817 8.860 15.993 244 HH21 ARG 29 HH11 ARG 29 -14.732 5.651 17.305 245 HH22 ARG 29 HH12 ARG 29 -15.203 7.295 17.574 246 H GLN 30 HN GLN 30 -12.058 1.203 13.608 247 HA GLN 30 HA GLN 30 -9.523 1.904 14.661 248 HB2 GLN 30 HB2 GLN 30 -11.063 0.178 15.621 249 HB3 GLN 30 HB1 GLN 30 -10.630 -0.898 14.292 250 HG2 GLN 30 HG2 GLN 30 -8.261 -0.796 14.978 251 HG3 GLN 30 HG1 GLN 30 -8.693 0.278 16.309 252 HE21 GLN 30 HE21 GLN 30 -7.470 -2.217 16.849 253 HE22 GLN 30 HE22 GLN 30 -8.601 -3.238 17.597 254 H GLN 31 HN GLN 31 -10.363 -0.160 11.881 255 HA GLN 31 HA GLN 31 -7.694 -0.987 11.267 256 HB2 GLN 31 HB2 GLN 31 -10.186 -0.668 9.578 257 HB3 GLN 31 HB1 GLN 31 -8.671 -1.277 8.912 258 HG2 GLN 31 HG2 GLN 31 -9.985 -2.479 11.359 259 HG3 GLN 31 HG1 GLN 31 -10.299 -3.058 9.722 260 HE21 GLN 31 HE21 GLN 31 -8.614 -4.244 8.638 261 HE22 GLN 31 HE22 GLN 31 -7.192 -4.730 9.427 262 H LEU 32 HN LEU 32 -9.614 1.829 10.264 263 HA LEU 32 HA LEU 32 -7.744 2.865 8.380 264 HB2 LEU 32 HB2 LEU 32 -10.183 3.614 8.866 265 HB3 LEU 32 HB1 LEU 32 -9.474 4.607 10.139 266 HG LEU 32 HG LEU 32 -7.837 5.396 8.204 267 HD11 LEU 32 HD11 LEU 32 -10.277 4.424 6.683 268 HD12 LEU 32 HD12 LEU 32 -8.622 3.848 6.487 269 HD13 LEU 32 HD13 LEU 32 -9.044 5.493 6.017 270 HD21 LEU 32 HD21 LEU 32 -9.285 6.954 9.305 271 HD22 LEU 32 HD22 LEU 32 -10.718 6.262 8.545 272 HD23 LEU 32 HD23 LEU 32 -9.550 7.163 7.576 273 H CYS 33 HN CYS 33 -8.082 3.375 11.871 274 HA CYS 33 HA CYS 33 -6.048 5.347 12.146 275 HB2 CYS 33 HB2 CYS 33 -6.998 3.214 14.088 276 HB3 CYS 33 HB1 CYS 33 -5.951 4.565 14.530 277 HG CYS 33 HG CYS 33 -7.886 6.144 14.391 278 H ASN 34 HN ASN 34 -5.894 1.818 12.038 279 HA ASN 34 HA ASN 34 -3.149 1.567 12.808 280 HB2 ASN 34 HB2 ASN 34 -4.735 -0.217 10.933 281 HB3 ASN 34 HB1 ASN 34 -3.280 -0.663 11.826 282 HD21 ASN 34 HD21 ASN 34 -5.689 -2.114 12.219 283 HD22 ASN 34 HD22 ASN 34 -6.273 -1.800 13.781 284 H ILE 35 HN ILE 35 -4.714 2.145 9.673 285 HA ILE 35 HA ILE 35 -2.418 1.762 8.027 286 HB ILE 35 HB ILE 35 -4.833 3.561 7.684 287 HG12 ILE 35 HG12 ILE 35 -4.146 0.895 6.408 288 HG13 ILE 35 HG11 ILE 35 -5.170 1.058 7.833 289 HG21 ILE 35 HG21 ILE 35 -3.180 4.470 6.234 290 HG22 ILE 35 HG22 ILE 35 -4.139 3.400 5.210 291 HG23 ILE 35 HG23 ILE 35 -2.566 2.874 5.807 292 HD11 ILE 35 HD11 ILE 35 -6.720 0.997 6.061 293 HD12 ILE 35 HD12 ILE 35 -5.706 1.991 5.017 294 HD13 ILE 35 HD13 ILE 35 -6.551 2.721 6.379 295 H GLU 36 HN GLU 36 -3.661 4.716 9.615 296 HA GLU 36 HA GLU 36 -1.560 6.387 8.564 297 HB2 GLU 36 HB2 GLU 36 -2.638 8.105 9.676 298 HB3 GLU 36 HB1 GLU 36 -3.933 6.917 9.741 299 HG2 GLU 36 HG2 GLU 36 -2.926 6.182 11.978 300 HG3 GLU 36 HG1 GLU 36 -1.981 7.666 11.917 301 H GLN 37 HN GLN 37 -1.894 4.365 11.421 302 HA GLN 37 HA GLN 37 0.602 5.354 12.620 303 HB2 GLN 37 HB2 GLN 37 -1.332 3.136 13.316 304 HB3 GLN 37 HB1 GLN 37 0.204 3.319 14.162 305 HG2 GLN 37 HG2 GLN 37 -0.395 5.610 14.803 306 HG3 GLN 37 HG1 GLN 37 -1.911 5.479 13.917 307 HE21 GLN 37 HE21 GLN 37 -1.354 5.802 16.915 308 HE22 GLN 37 HE22 GLN 37 -2.229 4.540 17.639 309 H SER 38 HN SER 38 0.406 3.983 9.869 310 HA SER 38 HA SER 38 1.850 1.482 10.154 311 HB2 SER 38 HB2 SER 38 1.472 3.328 7.778 312 HB3 SER 38 HB1 SER 38 2.210 1.731 7.690 313 HG SER 38 HG SER 38 0.287 0.825 8.312 314 H GLU 39 HN GLU 39 2.740 4.683 10.591 315 HA GLU 39 HA GLU 39 4.794 5.809 10.657 316 HB2 GLU 39 HB2 GLU 39 5.619 2.992 11.389 317 HB3 GLU 39 HB1 GLU 39 6.670 4.399 11.550 318 HG2 GLU 39 HG2 GLU 39 4.964 5.470 13.018 319 HG3 GLU 39 HG1 GLU 39 3.992 4.001 12.916 320 H THR 40 HN THR 40 6.252 2.770 9.581 321 HA THR 40 HA THR 40 7.354 4.236 7.226 322 HB THR 40 HB THR 40 8.900 3.018 8.781 323 HG1 THR 40 HG1 THR 40 8.744 1.890 6.187 324 HG21 THR 40 HG21 THR 40 7.231 1.146 9.204 325 HG22 THR 40 HG22 THR 40 8.888 0.628 8.894 326 HG23 THR 40 HG23 THR 40 7.675 0.507 7.621 327 H ALA 41 HN ALA 41 6.808 3.676 5.161 328 HA ALA 41 HA ALA 41 4.456 2.081 4.730 329 HB1 ALA 41 HB1 ALA 41 6.452 3.455 2.942 330 HB2 ALA 41 HB2 ALA 41 4.751 3.836 3.195 331 HB3 ALA 41 HB3 ALA 41 5.204 2.421 2.246 332 HA PRO 42 HA PRO 42 6.329 -1.922 4.146 333 HB2 PRO 42 HB2 PRO 42 4.552 -3.109 2.442 334 HB3 PRO 42 HB1 PRO 42 4.176 -2.774 4.145 335 HG2 PRO 42 HG2 PRO 42 3.417 -1.220 1.703 336 HG3 PRO 42 HG1 PRO 42 2.435 -1.641 3.120 337 HD2 PRO 42 HD2 PRO 42 3.580 0.823 2.813 338 HD3 PRO 42 HD1 PRO 42 3.309 0.085 4.407 339 H VAL 43 HN VAL 43 7.379 -3.317 2.538 340 HA VAL 43 HA VAL 43 8.829 -1.903 0.538 341 HB VAL 43 HB VAL 43 9.353 -4.278 -0.304 342 HG11 VAL 43 HG11 VAL 43 9.757 -3.482 2.591 343 HG12 VAL 43 HG12 VAL 43 10.858 -3.200 1.242 344 HG13 VAL 43 HG13 VAL 43 10.591 -4.839 1.834 345 HG21 VAL 43 HG21 VAL 43 7.844 -5.039 2.207 346 HG22 VAL 43 HG22 VAL 43 8.565 -6.122 1.019 347 HG23 VAL 43 HG23 VAL 43 7.142 -5.169 0.595 348 H VAL 44 HN VAL 44 5.668 -3.298 0.512 349 HA VAL 44 HA VAL 44 5.357 -3.825 -2.276 350 HB VAL 44 HB VAL 44 3.351 -2.893 -0.194 351 HG11 VAL 44 HG11 VAL 44 2.387 -2.369 -2.312 352 HG12 VAL 44 HG12 VAL 44 1.698 -3.926 -1.850 353 HG13 VAL 44 HG13 VAL 44 2.998 -3.857 -3.038 354 HG21 VAL 44 HG21 VAL 44 4.572 -5.128 0.081 355 HG22 VAL 44 HG22 VAL 44 3.736 -5.649 -1.381 356 HG23 VAL 44 HG23 VAL 44 2.810 -5.209 0.053 357 H VAL 45 HN VAL 45 4.787 -0.863 -0.360 358 HA VAL 45 HA VAL 45 3.906 0.756 -2.548 359 HB VAL 45 HB VAL 45 5.262 1.454 0.073 360 HG11 VAL 45 HG11 VAL 45 4.258 3.772 -0.457 361 HG12 VAL 45 HG12 VAL 45 4.178 3.212 -2.128 362 HG13 VAL 45 HG13 VAL 45 5.734 3.314 -1.305 363 HG21 VAL 45 HG21 VAL 45 3.032 2.011 0.807 364 HG22 VAL 45 HG22 VAL 45 2.952 0.409 0.073 365 HG23 VAL 45 HG23 VAL 45 2.390 1.820 -0.823 366 H LYS 46 HN LYS 46 7.129 0.228 -1.124 367 HA LYS 46 HA LYS 46 8.540 2.006 -2.858 368 HB2 LYS 46 HB2 LYS 46 9.430 -0.496 -1.397 369 HB3 LYS 46 HB1 LYS 46 10.537 0.589 -2.243 370 HG2 LYS 46 HG2 LYS 46 9.800 2.464 -0.828 371 HG3 LYS 46 HG1 LYS 46 8.676 1.395 0.014 372 HD2 LYS 46 HD2 LYS 46 10.582 -0.019 0.730 373 HD3 LYS 46 HD1 LYS 46 11.692 1.101 -0.062 374 HE2 LYS 46 HE2 LYS 46 9.747 1.906 2.115 375 HE3 LYS 46 HE1 LYS 46 11.440 1.509 2.405 376 HZ1 LYS 46 HZ1 LYS 46 10.271 3.860 1.170 377 HZ2 LYS 46 HZ2 LYS 46 11.675 3.263 0.423 378 HZ3 LYS 46 HZ3 LYS 46 11.704 3.702 2.063 379 H TYR 47 HN TYR 47 7.662 -1.419 -3.159 380 HA TYR 47 HA TYR 47 9.140 -1.997 -5.520 381 HB2 TYR 47 HB2 TYR 47 7.997 -3.715 -4.129 382 HB3 TYR 47 HB1 TYR 47 6.438 -3.101 -4.684 383 HD1 TYR 47 HD2 TYR 47 9.653 -4.583 -5.846 384 HD2 TYR 47 HD1 TYR 47 5.542 -3.764 -6.784 385 HE1 TYR 47 HE2 TYR 47 9.839 -5.983 -7.884 386 HE2 TYR 47 HE1 TYR 47 5.732 -5.168 -8.818 387 HH TYR 47 HH TYR 47 7.289 -6.099 -10.269 388 H ILE 48 HN ILE 48 5.896 -0.623 -5.064 389 HA ILE 48 HA ILE 48 5.155 -0.537 -7.820 390 HB ILE 48 HB ILE 48 4.365 1.220 -5.476 391 HG12 ILE 48 HG12 ILE 48 2.844 -0.992 -6.891 392 HG13 ILE 48 HG11 ILE 48 3.795 -1.247 -5.426 393 HG21 ILE 48 HG21 ILE 48 3.332 1.091 -8.313 394 HG22 ILE 48 HG22 ILE 48 3.903 2.508 -7.433 395 HG23 ILE 48 HG23 ILE 48 2.377 1.751 -6.988 396 HD11 ILE 48 HD11 ILE 48 2.420 0.588 -4.341 397 HD12 ILE 48 HD12 ILE 48 1.525 -0.882 -4.721 398 HD13 ILE 48 HD13 ILE 48 1.372 0.537 -5.757 399 H ALA 49 HN ALA 49 6.844 1.816 -5.746 400 HA ALA 49 HA ALA 49 7.052 3.913 -7.647 401 HB1 ALA 49 HB1 ALA 49 7.680 4.000 -5.187 402 HB2 ALA 49 HB2 ALA 49 8.838 4.766 -6.274 403 HB3 ALA 49 HB3 ALA 49 9.174 3.164 -5.615 404 H PHE 50 HN PHE 50 8.958 0.974 -7.198 405 HA PHE 50 HA PHE 50 11.122 1.629 -8.932 406 HB2 PHE 50 HB2 PHE 50 10.743 -0.413 -7.321 407 HB3 PHE 50 HB1 PHE 50 9.996 -1.169 -8.726 408 HD1 PHE 50 HD2 PHE 50 13.076 0.679 -7.690 409 HD2 PHE 50 HD1 PHE 50 11.369 -2.279 -10.296 410 HE1 PHE 50 HE2 PHE 50 15.338 0.125 -8.539 411 HE2 PHE 50 HE1 PHE 50 13.633 -2.835 -11.144 412 HZ PHE 50 HZ PHE 50 15.617 -1.634 -10.265 413 H LEU 51 HN LEU 51 8.050 -0.072 -9.585 414 HA LEU 51 HA LEU 51 8.494 -0.412 -12.398 415 HB2 LEU 51 HB2 LEU 51 5.901 -0.142 -10.845 416 HB3 LEU 51 HB1 LEU 51 6.027 -0.727 -12.501 417 HG LEU 51 HG LEU 51 7.357 -1.996 -10.091 418 HD11 LEU 51 HD11 LEU 51 4.818 -2.587 -11.606 419 HD12 LEU 51 HD12 LEU 51 5.075 -2.477 -9.864 420 HD13 LEU 51 HD13 LEU 51 5.682 -3.870 -10.759 421 HD21 LEU 51 HD21 LEU 51 7.460 -2.535 -13.050 422 HD22 LEU 51 HD22 LEU 51 7.513 -3.911 -11.945 423 HD23 LEU 51 HD23 LEU 51 8.739 -2.651 -11.838 424 H ARG 52 HN ARG 52 6.937 2.167 -10.524 425 HA ARG 52 HA ARG 52 6.016 3.712 -12.719 426 HB2 ARG 52 HB2 ARG 52 5.697 3.934 -10.089 427 HB3 ARG 52 HB1 ARG 52 7.084 5.007 -10.210 428 HG2 ARG 52 HG2 ARG 52 4.689 5.391 -12.018 429 HG3 ARG 52 HG1 ARG 52 4.693 6.031 -10.378 430 HD2 ARG 52 HD2 ARG 52 6.762 7.281 -10.856 431 HD3 ARG 52 HD1 ARG 52 6.773 6.637 -12.498 432 HE ARG 52 HE ARG 52 4.972 8.101 -13.052 433 HH11 ARG 52 HH21 ARG 52 5.663 8.028 -9.666 434 HH12 ARG 52 HH22 ARG 52 4.703 9.425 -9.309 435 HH21 ARG 52 HH11 ARG 52 3.704 9.921 -12.593 436 HH22 ARG 52 HH12 ARG 52 3.596 10.492 -10.961 437 H SER 53 HN SER 53 9.112 3.671 -10.992 438 HA SER 53 HA SER 53 10.385 5.780 -12.431 439 HB2 SER 53 HB2 SER 53 11.704 3.285 -11.321 440 HB3 SER 53 HB1 SER 53 12.464 4.849 -11.609 441 HG SER 53 HG SER 53 11.597 5.594 -9.830 442 H LYS 54 HN LYS 54 9.891 2.368 -13.169 443 HA LYS 54 HA LYS 54 11.673 2.354 -15.460 444 HB2 LYS 54 HB2 LYS 54 9.412 0.505 -14.635 445 HB3 LYS 54 HB1 LYS 54 10.528 0.172 -15.957 446 HG2 LYS 54 HG2 LYS 54 11.566 0.763 -13.183 447 HG3 LYS 54 HG1 LYS 54 11.023 -0.858 -13.607 448 HD2 LYS 54 HD2 LYS 54 12.619 -0.910 -15.487 449 HD3 LYS 54 HD1 LYS 54 13.171 0.710 -15.076 450 HE2 LYS 54 HE2 LYS 54 13.896 -0.091 -12.861 451 HE3 LYS 54 HE1 LYS 54 13.351 -1.718 -13.272 452 HZ1 LYS 54 HZ1 LYS 54 15.017 -1.988 -14.803 453 HZ2 LYS 54 HZ2 LYS 54 15.814 -1.040 -13.639 454 HZ3 LYS 54 HZ3 LYS 54 15.220 -0.324 -15.060 455 H GLY 55 HN GLY 55 8.949 4.059 -14.978 456 HA2 GLY 55 HA2 GLY 55 7.680 5.291 -16.543 457 HA3 GLY 55 HA1 GLY 55 8.523 4.440 -17.836 458 H VAL 56 HN VAL 56 7.128 2.412 -15.430 459 HA VAL 56 HA VAL 56 5.420 1.133 -17.353 460 HB VAL 56 HB VAL 56 5.535 0.991 -14.330 461 HG11 VAL 56 HG11 VAL 56 3.301 0.344 -14.862 462 HG12 VAL 56 HG12 VAL 56 4.200 -1.168 -14.731 463 HG13 VAL 56 HG13 VAL 56 3.815 -0.504 -16.319 464 HG21 VAL 56 HG21 VAL 56 6.301 -1.073 -16.406 465 HG22 VAL 56 HG22 VAL 56 6.755 -1.029 -14.703 466 HG23 VAL 56 HG23 VAL 56 7.441 0.141 -15.829 467 H ASP 57 HN ASP 57 3.315 1.532 -17.894 468 HA ASP 57 HA ASP 57 2.113 4.032 -17.106 469 HB2 ASP 57 HB2 ASP 57 0.077 3.010 -18.339 470 HB3 ASP 57 HB1 ASP 57 1.548 3.279 -19.274 471 H LEU 58 HN LEU 58 2.403 3.262 -14.713 472 HA LEU 58 HA LEU 58 0.497 1.436 -13.576 473 HB2 LEU 58 HB2 LEU 58 2.668 2.431 -12.537 474 HB3 LEU 58 HB1 LEU 58 1.659 3.814 -12.117 475 HG LEU 58 HG LEU 58 0.039 1.954 -11.132 476 HD11 LEU 58 HD11 LEU 58 1.338 0.053 -10.182 477 HD12 LEU 58 HD12 LEU 58 2.747 0.581 -11.101 478 HD13 LEU 58 HD13 LEU 58 1.306 0.016 -11.944 479 HD21 LEU 58 HD21 LEU 58 1.148 3.697 -9.802 480 HD22 LEU 58 HD22 LEU 58 2.639 2.758 -9.792 481 HD23 LEU 58 HD23 LEU 58 1.207 2.150 -8.959 482 H ASN 59 HN ASN 59 0.421 4.856 -14.373 483 HA ASN 59 HA ASN 59 -1.858 5.658 -12.899 484 HB2 ASN 59 HB2 ASN 59 -0.727 6.519 -15.570 485 HB3 ASN 59 HB1 ASN 59 -2.181 7.270 -14.912 486 HD21 ASN 59 HD21 ASN 59 1.276 6.664 -14.172 487 HD22 ASN 59 HD22 ASN 59 1.439 7.983 -13.116 488 H ALA 60 HN ALA 60 -1.614 4.130 -16.108 489 HA ALA 60 HA ALA 60 -4.423 4.165 -16.655 490 HB1 ALA 60 HB1 ALA 60 -3.929 2.572 -18.388 491 HB2 ALA 60 HB2 ALA 60 -2.441 2.071 -17.583 492 HB3 ALA 60 HB3 ALA 60 -2.557 3.676 -18.306 493 H LEU 61 HN LEU 61 -2.321 1.724 -15.112 494 HA LEU 61 HA LEU 61 -4.338 -0.251 -14.756 495 HB2 LEU 61 HB2 LEU 61 -1.963 -0.749 -14.425 496 HB3 LEU 61 HB1 LEU 61 -1.890 0.376 -13.072 497 HG LEU 61 HG LEU 61 -3.444 -1.009 -11.789 498 HD11 LEU 61 HD11 LEU 61 -3.912 -3.357 -12.854 499 HD12 LEU 61 HD12 LEU 61 -3.620 -2.533 -14.386 500 HD13 LEU 61 HD13 LEU 61 -4.920 -1.993 -13.322 501 HD21 LEU 61 HD21 LEU 61 -2.002 -2.966 -11.475 502 HD22 LEU 61 HD22 LEU 61 -1.022 -1.520 -11.713 503 HD23 LEU 61 HD23 LEU 61 -1.233 -2.669 -13.034 504 H PHE 62 HN PHE 62 -3.258 2.365 -12.592 505 HA PHE 62 HA PHE 62 -5.171 1.761 -10.517 506 HB2 PHE 62 HB2 PHE 62 -3.363 4.071 -11.180 507 HB3 PHE 62 HB1 PHE 62 -4.598 4.289 -9.941 508 HD1 PHE 62 HD1 PHE 62 -2.336 1.412 -10.879 509 HD2 PHE 62 HD2 PHE 62 -3.664 4.120 -7.815 510 HE1 PHE 62 HE1 PHE 62 -0.893 0.257 -9.230 511 HE2 PHE 62 HE2 PHE 62 -2.219 2.964 -6.172 512 HZ PHE 62 HZ PHE 62 -0.833 1.034 -6.877 513 H ASP 63 HN ASP 63 -5.166 4.010 -13.251 514 HA ASP 63 HA ASP 63 -7.420 5.534 -12.678 515 HB2 ASP 63 HB2 ASP 63 -5.952 5.818 -14.664 516 HB3 ASP 63 HB1 ASP 63 -6.675 4.379 -15.381 517 H ARG 64 HN ARG 64 -7.379 2.310 -14.267 518 HA ARG 64 HA ARG 64 -10.254 2.200 -14.475 519 HB2 ARG 64 HB2 ARG 64 -8.385 -0.178 -14.320 520 HB3 ARG 64 HB1 ARG 64 -9.965 -0.102 -15.100 521 HG2 ARG 64 HG2 ARG 64 -7.393 1.218 -15.976 522 HG3 ARG 64 HG1 ARG 64 -8.375 0.067 -16.870 523 HD2 ARG 64 HD2 ARG 64 -10.236 1.874 -16.752 524 HD3 ARG 64 HD1 ARG 64 -8.936 2.974 -16.304 525 HE ARG 64 HE ARG 64 -7.996 2.733 -18.500 526 HH11 ARG 64 HH21 ARG 64 -10.735 0.700 -17.928 527 HH12 ARG 64 HH22 ARG 64 -11.003 0.375 -19.606 528 HH21 ARG 64 HH11 ARG 64 -8.335 2.306 -20.689 529 HH22 ARG 64 HH12 ARG 64 -9.644 1.276 -21.165 530 H ILE 65 HN ILE 65 -7.960 1.112 -12.010 531 HA ILE 65 HA ILE 65 -9.835 -0.348 -10.422 532 HB ILE 65 HB ILE 65 -7.306 1.147 -9.679 533 HG12 ILE 65 HG12 ILE 65 -7.824 -1.829 -9.935 534 HG13 ILE 65 HG11 ILE 65 -7.190 -0.844 -11.252 535 HG21 ILE 65 HG21 ILE 65 -7.428 -0.389 -7.629 536 HG22 ILE 65 HG22 ILE 65 -9.123 -0.636 -8.050 537 HG23 ILE 65 HG23 ILE 65 -8.541 0.979 -7.650 538 HD11 ILE 65 HD11 ILE 65 -5.802 -0.622 -8.612 539 HD12 ILE 65 HD12 ILE 65 -5.141 -0.566 -10.246 540 HD13 ILE 65 HD13 ILE 65 -5.575 -2.113 -9.525 541 H ILE 66 HN ILE 66 -8.830 3.077 -10.345 542 HA ILE 66 HA ILE 66 -10.812 3.651 -8.226 543 HB ILE 66 HB ILE 66 -8.871 5.414 -9.750 544 HG12 ILE 66 HG12 ILE 66 -8.842 4.488 -6.865 545 HG13 ILE 66 HG11 ILE 66 -7.959 3.670 -8.154 546 HG21 ILE 66 HG21 ILE 66 -9.416 7.035 -7.868 547 HG22 ILE 66 HG22 ILE 66 -10.793 5.999 -7.488 548 HG23 ILE 66 HG23 ILE 66 -10.699 6.801 -9.056 549 HD11 ILE 66 HD11 ILE 66 -7.596 6.535 -7.240 550 HD12 ILE 66 HD12 ILE 66 -6.817 5.848 -8.665 551 HD13 ILE 66 HD13 ILE 66 -6.443 5.213 -7.063 552 H VAL 67 HN VAL 67 -12.894 4.000 -8.799 553 HA VAL 67 HA VAL 67 -13.486 5.128 -11.521 554 HB VAL 67 HB VAL 67 -15.788 4.148 -11.098 555 HG11 VAL 67 HG11 VAL 67 -13.313 2.415 -11.247 556 HG12 VAL 67 HG12 VAL 67 -14.312 2.992 -12.580 557 HG13 VAL 67 HG13 VAL 67 -14.938 1.767 -11.476 558 HG21 VAL 67 HG21 VAL 67 -14.287 2.841 -8.799 559 HG22 VAL 67 HG22 VAL 67 -15.866 2.326 -9.385 560 HG23 VAL 67 HG23 VAL 67 -15.673 3.922 -8.663 561 H ASN 68 HN ASN 68 -14.355 7.107 -11.616 562 HA ASN 68 HA ASN 68 -15.052 8.506 -9.101 563 HB2 ASN 68 HB2 ASN 68 -14.614 9.363 -11.961 564 HB3 ASN 68 HB1 ASN 68 -15.342 10.461 -10.790 565 HD21 ASN 68 HD21 ASN 68 -12.969 11.347 -11.731 566 HD22 ASN 68 HD22 ASN 68 -11.716 11.108 -10.612 567 H LYS 69 HN LYS 69 -16.970 10.279 -9.930 568 HA LYS 69 HA LYS 69 -19.340 8.578 -9.954 569 HB2 LYS 69 HB2 LYS 69 -19.321 10.567 -8.551 570 HB3 LYS 69 HB1 LYS 69 -18.975 11.590 -9.942 571 HG2 LYS 69 HG2 LYS 69 -21.364 11.684 -9.293 572 HG3 LYS 69 HG1 LYS 69 -21.159 11.044 -10.921 573 HD2 LYS 69 HD2 LYS 69 -21.589 8.817 -10.222 574 HD3 LYS 69 HD1 LYS 69 -21.349 9.216 -8.519 575 HE2 LYS 69 HE2 LYS 69 -23.732 8.992 -8.941 576 HE3 LYS 69 HE1 LYS 69 -23.377 10.696 -8.657 577 HZ1 LYS 69 HZ1 LYS 69 -23.182 9.796 -11.411 578 HZ2 LYS 69 HZ2 LYS 69 -23.822 11.237 -10.778 579 HZ3 LYS 69 HZ3 LYS 69 -24.746 9.812 -10.753 580 H LEU 70 HN LEU 70 -19.642 7.645 -11.960 581 HA LEU 70 HA LEU 70 -20.606 9.357 -14.095 582 HB2 LEU 70 HB2 LEU 70 -18.972 8.723 -15.799 583 HB3 LEU 70 HB1 LEU 70 -18.185 9.573 -14.473 584 HG LEU 70 HG LEU 70 -18.005 6.937 -13.615 585 HD11 LEU 70 HD11 LEU 70 -17.458 5.492 -15.399 586 HD12 LEU 70 HD12 LEU 70 -17.308 6.818 -16.552 587 HD13 LEU 70 HD13 LEU 70 -18.900 6.329 -15.972 588 HD21 LEU 70 HD21 LEU 70 -15.639 7.084 -14.277 589 HD22 LEU 70 HD22 LEU 70 -16.200 8.622 -13.619 590 HD23 LEU 70 HD23 LEU 70 -16.018 8.423 -15.362 591 H GLU 71 HN GLU 71 -22.235 8.238 -14.958 592 HA GLU 71 HA GLU 71 -22.220 5.246 -14.756 593 HB2 GLU 71 HB2 GLU 71 -24.657 6.952 -15.295 594 HB3 GLU 71 HB1 GLU 71 -24.574 5.333 -14.606 595 HG2 GLU 71 HG2 GLU 71 -23.561 7.849 -13.238 596 HG3 GLU 71 HG1 GLU 71 -25.091 7.052 -12.892 597 H HIS 72 HN HIS 72 -21.646 7.713 -16.921 598 HA HIS 72 HA HIS 72 -22.095 5.915 -19.224 599 HB2 HIS 72 HB2 HIS 72 -23.548 7.417 -20.419 600 HB3 HIS 72 HB1 HIS 72 -24.258 7.188 -18.820 601 HD2 HIS 72 HD2 HIS 72 -24.930 10.068 -20.261 602 HE1 HIS 72 HE1 HIS 72 -21.925 11.679 -17.763 603 HE2 HIS 72 HE2 HIS 72 -23.904 12.244 -19.247 604 H HIS 73 HN HIS 73 -21.985 8.058 -21.109 605 HA HIS 73 HA HIS 73 -20.293 9.019 -22.422 606 HB2 HIS 73 HB2 HIS 73 -21.067 10.822 -20.861 607 HB3 HIS 73 HB1 HIS 73 -19.716 10.418 -19.801 608 HD2 HIS 73 HD2 HIS 73 -20.384 12.682 -22.782 609 HE1 HIS 73 HE1 HIS 73 -16.200 12.105 -22.723 610 HE2 HIS 73 HE2 HIS 73 -18.086 13.473 -23.727 611 H HIS 74 HN HIS 74 -18.928 7.212 -22.764 612 HA HIS 74 HA HIS 74 -16.726 6.679 -20.882 613 HB2 HIS 74 HB2 HIS 74 -17.532 5.543 -23.569 614 HB3 HIS 74 HB1 HIS 74 -16.024 5.088 -22.774 615 HD2 HIS 74 HD2 HIS 74 -16.612 2.628 -21.640 616 HE1 HIS 74 HE1 HIS 74 -20.316 3.661 -19.889 617 HE2 HIS 74 HE2 HIS 74 -18.577 1.829 -20.120 618 H HIS 75 HN HIS 75 -14.467 6.934 -21.550 619 HA HIS 75 HA HIS 75 -14.101 9.375 -23.201 620 HB2 HIS 75 HB2 HIS 75 -13.013 9.402 -21.049 621 HB3 HIS 75 HB1 HIS 75 -12.271 7.830 -21.342 622 HD2 HIS 75 HD2 HIS 75 -9.766 8.002 -22.477 623 HE1 HIS 75 HE1 HIS 75 -9.981 12.003 -23.807 624 HE2 HIS 75 HE2 HIS 75 -8.475 9.973 -23.587 625 H HIS 76 HN HIS 76 -14.753 7.743 -25.052 626 HA HIS 76 HA HIS 76 -14.106 6.599 -26.984 627 HB2 HIS 76 HB2 HIS 76 -12.738 8.405 -27.580 628 HB3 HIS 76 HB1 HIS 76 -11.643 8.160 -26.227 629 HD2 HIS 76 HD2 HIS 76 -9.388 7.840 -27.959 630 HE1 HIS 76 HE1 HIS 76 -10.736 4.245 -29.719 631 HE2 HIS 76 HE2 HIS 76 -8.755 5.809 -29.469 632 H HIS 77 HN HIS 77 -13.780 4.468 -27.273 633 HA HIS 77 HA HIS 77 -11.519 3.080 -25.999 634 HB2 HIS 77 HB2 HIS 77 -14.402 2.465 -25.298 635 HB3 HIS 77 HB1 HIS 77 -13.064 1.362 -24.974 636 HD2 HIS 77 HD2 HIS 77 -10.858 3.070 -23.542 637 HE1 HIS 77 HE1 HIS 77 -13.892 4.961 -21.291 638 HE2 HIS 77 HE2 HIS 77 -11.397 4.527 -21.447 639 H1 MET 1 HT1 MET 1 -11.002 -6.836 -10.650 640 H2 MET 1 HT2 MET 1 -11.130 -6.180 -12.211 641 H3 MET 1 HT3 MET 1 -10.067 -5.488 -11.083 642 HA MET 1 HA MET 1 -9.818 -8.238 -12.173 643 HB2 MET 1 HB2 MET 1 -9.436 -6.426 -13.860 644 HB3 MET 1 HB1 MET 1 -8.190 -5.759 -12.806 645 HG2 MET 1 HG2 MET 1 -7.106 -7.157 -14.457 646 HG3 MET 1 HG1 MET 1 -7.012 -7.982 -12.903 647 HE1 MET 1 HE1 MET 1 -7.938 -8.261 -16.555 648 HE2 MET 1 HE2 MET 1 -8.015 -10.020 -16.524 649 HE3 MET 1 HE3 MET 1 -6.629 -9.195 -15.817 650 H GLU 2 HN GLU 2 -7.976 -9.337 -11.365 651 HA GLU 2 HA GLU 2 -7.255 -8.678 -8.657 652 HB2 GLU 2 HB2 GLU 2 -5.500 -10.556 -10.183 653 HB3 GLU 2 HB1 GLU 2 -6.268 -10.764 -8.609 654 HG2 GLU 2 HG2 GLU 2 -8.497 -10.855 -9.960 655 HG3 GLU 2 HG1 GLU 2 -7.459 -11.144 -11.356 656 H LEU 3 HN LEU 3 -5.513 -7.577 -7.868 657 HA LEU 3 HA LEU 3 -4.012 -5.829 -9.564 658 HB2 LEU 3 HB2 LEU 3 -4.433 -5.356 -7.179 659 HB3 LEU 3 HB1 LEU 3 -3.446 -6.742 -6.723 660 HG LEU 3 HG LEU 3 -1.472 -5.694 -7.768 661 HD11 LEU 3 HD11 LEU 3 -3.516 -3.632 -8.575 662 HD12 LEU 3 HD12 LEU 3 -2.216 -4.348 -9.527 663 HD13 LEU 3 HD13 LEU 3 -1.844 -3.136 -8.304 664 HD21 LEU 3 HD21 LEU 3 -2.841 -3.708 -5.941 665 HD22 LEU 3 HD22 LEU 3 -1.114 -4.040 -6.075 666 HD23 LEU 3 HD23 LEU 3 -2.191 -5.246 -5.371 667 H SER 4 HN SER 4 -3.179 -8.906 -7.988 668 HA SER 4 HA SER 4 -0.447 -8.976 -8.759 669 HB2 SER 4 HB2 SER 4 -1.446 -10.517 -7.100 670 HB3 SER 4 HB1 SER 4 -2.362 -11.302 -8.384 671 HG SER 4 HG SER 4 -0.475 -12.023 -9.272 672 H ASN 5 HN ASN 5 -3.363 -10.103 -10.458 673 HA ASN 5 HA ASN 5 -2.044 -11.375 -12.636 674 HB2 ASN 5 HB2 ASN 5 -4.499 -11.487 -12.078 675 HB3 ASN 5 HB1 ASN 5 -4.667 -9.857 -12.728 676 HD21 ASN 5 HD21 ASN 5 -2.385 -10.798 -14.738 677 HD22 ASN 5 HD22 ASN 5 -3.277 -11.613 -15.928 678 H GLU 6 HN GLU 6 -3.208 -8.011 -12.305 679 HA GLU 6 HA GLU 6 -2.236 -7.187 -14.897 680 HB2 GLU 6 HB2 GLU 6 -2.806 -5.530 -12.416 681 HB3 GLU 6 HB1 GLU 6 -2.653 -4.910 -14.060 682 HG2 GLU 6 HG2 GLU 6 -4.676 -7.049 -13.378 683 HG3 GLU 6 HG1 GLU 6 -5.050 -5.342 -13.169 684 H LEU 7 HN LEU 7 -0.939 -6.993 -11.596 685 HA LEU 7 HA LEU 7 1.411 -5.509 -12.227 686 HB2 LEU 7 HB2 LEU 7 0.538 -5.907 -9.918 687 HB3 LEU 7 HB1 LEU 7 1.039 -7.590 -10.050 688 HG LEU 7 HG LEU 7 3.385 -6.826 -10.424 689 HD11 LEU 7 HD11 LEU 7 3.342 -4.656 -11.269 690 HD12 LEU 7 HD12 LEU 7 3.690 -4.324 -9.576 691 HD13 LEU 7 HD13 LEU 7 2.048 -4.140 -10.187 692 HD21 LEU 7 HD21 LEU 7 2.870 -7.466 -8.197 693 HD22 LEU 7 HD22 LEU 7 1.897 -6.021 -7.918 694 HD23 LEU 7 HD23 LEU 7 3.651 -5.894 -8.033 695 H LYS 8 HN LYS 8 0.787 -9.010 -12.133 696 HA LYS 8 HA LYS 8 3.465 -9.839 -12.668 697 HB2 LYS 8 HB2 LYS 8 1.629 -11.340 -11.882 698 HB3 LYS 8 HB1 LYS 8 0.897 -11.234 -13.484 699 HG2 LYS 8 HG2 LYS 8 2.925 -12.180 -14.491 700 HG3 LYS 8 HG1 LYS 8 3.693 -12.247 -12.905 701 HD2 LYS 8 HD2 LYS 8 1.931 -13.782 -12.114 702 HD3 LYS 8 HD1 LYS 8 1.170 -13.725 -13.704 703 HE2 LYS 8 HE2 LYS 8 2.569 -15.731 -13.517 704 HE3 LYS 8 HE1 LYS 8 3.247 -14.628 -14.715 705 HZ1 LYS 8 HZ1 LYS 8 5.074 -14.351 -13.505 706 HZ2 LYS 8 HZ2 LYS 8 4.567 -15.679 -12.576 707 HZ3 LYS 8 HZ3 LYS 8 4.203 -14.099 -12.072 708 H VAL 9 HN VAL 9 0.796 -8.945 -14.827 709 HA VAL 9 HA VAL 9 1.994 -9.755 -17.280 710 HB VAL 9 HB VAL 9 0.046 -7.529 -16.615 711 HG11 VAL 9 HG11 VAL 9 1.110 -8.479 -19.278 712 HG12 VAL 9 HG12 VAL 9 1.019 -6.828 -18.664 713 HG13 VAL 9 HG13 VAL 9 -0.454 -7.677 -19.132 714 HG21 VAL 9 HG21 VAL 9 -0.520 -10.049 -16.340 715 HG22 VAL 9 HG22 VAL 9 -0.494 -10.103 -18.101 716 HG23 VAL 9 HG23 VAL 9 -1.640 -9.053 -17.269 717 H GLU 10 HN GLU 10 2.132 -6.614 -15.567 718 HA GLU 10 HA GLU 10 3.848 -5.374 -17.518 719 HB2 GLU 10 HB2 GLU 10 3.012 -4.774 -14.693 720 HB3 GLU 10 HB1 GLU 10 4.372 -3.877 -15.368 721 HG2 GLU 10 HG2 GLU 10 2.381 -2.598 -15.798 722 HG3 GLU 10 HG1 GLU 10 2.890 -3.295 -17.334 723 H ARG 11 HN ARG 11 4.484 -7.164 -14.523 724 HA ARG 11 HA ARG 11 7.270 -6.667 -14.333 725 HB2 ARG 11 HB2 ARG 11 5.872 -7.864 -12.627 726 HB3 ARG 11 HB1 ARG 11 5.810 -9.260 -13.696 727 HG2 ARG 11 HG2 ARG 11 8.541 -8.190 -13.079 728 HG3 ARG 11 HG1 ARG 11 7.695 -8.976 -11.750 729 HD2 ARG 11 HD2 ARG 11 8.272 -10.197 -14.468 730 HD3 ARG 11 HD1 ARG 11 9.048 -10.620 -12.952 731 HE ARG 11 HE ARG 11 6.174 -11.157 -13.597 732 HH11 ARG 11 HH21 ARG 11 9.048 -11.790 -11.724 733 HH12 ARG 11 HH22 ARG 11 8.360 -13.174 -10.950 734 HH21 ARG 11 HH11 ARG 11 5.316 -12.945 -12.568 735 HH22 ARG 11 HH12 ARG 11 6.271 -13.819 -11.418 736 H ILE 12 HN ILE 12 5.490 -9.175 -16.127 737 HA ILE 12 HA ILE 12 7.805 -10.442 -17.256 738 HB ILE 12 HB ILE 12 4.920 -10.323 -18.192 739 HG12 ILE 12 HG12 ILE 12 6.443 -12.591 -16.882 740 HG13 ILE 12 HG11 ILE 12 5.503 -11.417 -15.960 741 HG21 ILE 12 HG21 ILE 12 7.301 -11.893 -19.198 742 HG22 ILE 12 HG22 ILE 12 6.188 -10.889 -20.128 743 HG23 ILE 12 HG23 ILE 12 5.644 -12.431 -19.468 744 HD11 ILE 12 HD11 ILE 12 4.305 -12.957 -18.269 745 HD12 ILE 12 HD12 ILE 12 3.466 -12.075 -16.992 746 HD13 ILE 12 HD13 ILE 12 4.295 -13.588 -16.622 747 H ARG 13 HN ARG 13 5.627 -7.886 -18.474 748 HA ARG 13 HA ARG 13 6.815 -7.608 -21.043 749 HB2 ARG 13 HB2 ARG 13 4.662 -6.567 -20.391 750 HB3 ARG 13 HB1 ARG 13 5.527 -5.466 -19.323 751 HG2 ARG 13 HG2 ARG 13 6.796 -4.607 -21.307 752 HG3 ARG 13 HG1 ARG 13 5.815 -5.648 -22.336 753 HD2 ARG 13 HD2 ARG 13 4.578 -3.645 -20.447 754 HD3 ARG 13 HD1 ARG 13 5.034 -3.215 -22.095 755 HE ARG 13 HE ARG 13 3.498 -5.440 -22.502 756 HH11 ARG 13 HH21 ARG 13 3.121 -2.611 -20.551 757 HH12 ARG 13 HH22 ARG 13 1.399 -2.564 -20.726 758 HH21 ARG 13 HH11 ARG 13 1.254 -5.375 -22.753 759 HH22 ARG 13 HH12 ARG 13 0.343 -4.125 -21.972 760 H LEU 14 HN LEU 14 7.560 -5.900 -17.977 761 HA LEU 14 HA LEU 14 9.804 -4.507 -19.230 762 HB2 LEU 14 HB2 LEU 14 8.659 -4.733 -16.453 763 HB3 LEU 14 HB1 LEU 14 10.228 -3.972 -16.699 764 HG LEU 14 HG LEU 14 8.234 -2.411 -16.690 765 HD11 LEU 14 HD11 LEU 14 10.544 -2.100 -17.979 766 HD12 LEU 14 HD12 LEU 14 9.227 -0.952 -18.200 767 HD13 LEU 14 HD13 LEU 14 9.508 -2.207 -19.404 768 HD21 LEU 14 HD21 LEU 14 6.738 -2.350 -18.551 769 HD22 LEU 14 HD22 LEU 14 6.786 -4.022 -17.994 770 HD23 LEU 14 HD23 LEU 14 7.689 -3.547 -19.431 771 H SER 15 HN SER 15 9.292 -7.635 -18.259 772 HA SER 15 HA SER 15 10.690 -9.368 -17.431 773 HB2 SER 15 HB2 SER 15 12.572 -8.006 -19.379 774 HB3 SER 15 HB1 SER 15 12.574 -9.707 -18.923 775 HG SER 15 HG SER 15 10.476 -8.307 -20.241 776 H LEU 16 HN LEU 16 10.757 -7.666 -15.417 777 HA LEU 16 HA LEU 16 13.413 -6.519 -14.967 778 HB2 LEU 16 HB2 LEU 16 11.125 -6.970 -13.030 779 HB3 LEU 16 HB1 LEU 16 12.537 -5.954 -12.736 780 HG LEU 16 HG LEU 16 10.516 -5.542 -14.962 781 HD11 LEU 16 HD11 LEU 16 9.653 -3.732 -13.681 782 HD12 LEU 16 HD12 LEU 16 10.987 -3.811 -12.530 783 HD13 LEU 16 HD13 LEU 16 9.772 -5.089 -12.560 784 HD21 LEU 16 HD21 LEU 16 11.784 -3.226 -14.930 785 HD22 LEU 16 HD22 LEU 16 12.490 -4.587 -15.794 786 HD23 LEU 16 HD23 LEU 16 13.084 -4.160 -14.188 787 H THR 17 HN THR 17 14.998 -7.265 -13.538 788 HA THR 17 HA THR 17 14.906 -10.197 -13.019 789 HB THR 17 HB THR 17 17.379 -9.804 -12.518 790 HG1 THR 17 HG1 THR 17 16.811 -7.324 -13.761 791 HG21 THR 17 HG21 THR 17 16.681 -10.715 -14.649 792 HG22 THR 17 HG22 THR 17 17.924 -9.501 -14.948 793 HG23 THR 17 HG23 THR 17 16.227 -9.113 -15.231 794 H ALA 18 HN ALA 18 15.016 -11.038 -10.974 795 HA ALA 18 HA ALA 18 14.177 -9.440 -8.755 796 HB1 ALA 18 HB1 ALA 18 15.393 -12.212 -8.894 797 HB2 ALA 18 HB2 ALA 18 13.680 -11.810 -8.813 798 HB3 ALA 18 HB3 ALA 18 14.722 -11.511 -7.422 799 H LYS 19 HN LYS 19 17.360 -10.609 -9.781 800 HA LYS 19 HA LYS 19 18.801 -9.872 -7.433 801 HB2 LYS 19 HB2 LYS 19 19.683 -11.303 -9.273 802 HB3 LYS 19 HB1 LYS 19 19.782 -9.877 -10.305 803 HG2 LYS 19 HG2 LYS 19 21.323 -8.819 -8.699 804 HG3 LYS 19 HG1 LYS 19 21.234 -10.243 -7.665 805 HD2 LYS 19 HD2 LYS 19 22.217 -10.222 -10.537 806 HD3 LYS 19 HD1 LYS 19 23.257 -10.263 -9.116 807 HE2 LYS 19 HE2 LYS 19 21.476 -12.416 -10.223 808 HE3 LYS 19 HE1 LYS 19 23.136 -12.532 -9.644 809 HZ1 LYS 19 HZ1 LYS 19 22.126 -11.947 -7.384 810 HZ2 LYS 19 HZ2 LYS 19 21.903 -13.522 -7.978 811 HZ3 LYS 19 HZ3 LYS 19 20.642 -12.388 -8.077 812 H SER 20 HN SER 20 18.207 -8.058 -10.460 813 HA SER 20 HA SER 20 19.636 -5.712 -9.692 814 HB2 SER 20 HB2 SER 20 18.889 -6.175 -12.009 815 HB3 SER 20 HB1 SER 20 17.215 -5.957 -11.508 816 HG SER 20 HG SER 20 18.960 -3.929 -10.815 817 H VAL 21 HN VAL 21 16.209 -6.598 -9.308 818 HA VAL 21 HA VAL 21 15.399 -4.138 -8.080 819 HB VAL 21 HB VAL 21 14.266 -6.943 -7.839 820 HG11 VAL 21 HG11 VAL 21 13.421 -5.736 -5.974 821 HG12 VAL 21 HG12 VAL 21 12.164 -5.609 -7.203 822 HG13 VAL 21 HG13 VAL 21 13.251 -4.252 -6.913 823 HG21 VAL 21 HG21 VAL 21 12.729 -6.263 -9.563 824 HG22 VAL 21 HG22 VAL 21 14.344 -5.839 -10.129 825 HG23 VAL 21 HG23 VAL 21 13.282 -4.591 -9.477 826 H ALA 22 HN ALA 22 16.522 -7.232 -6.734 827 HA ALA 22 HA ALA 22 16.165 -6.612 -3.993 828 HB1 ALA 22 HB1 ALA 22 18.102 -8.408 -5.453 829 HB2 ALA 22 HB2 ALA 22 16.661 -8.863 -4.544 830 HB3 ALA 22 HB3 ALA 22 18.096 -8.288 -3.693 831 H GLU 23 HN GLU 23 18.990 -6.004 -6.112 832 HA GLU 23 HA GLU 23 20.605 -4.898 -4.011 833 HB2 GLU 23 HB2 GLU 23 20.678 -4.569 -7.018 834 HB3 GLU 23 HB1 GLU 23 21.852 -3.794 -5.956 835 HG2 GLU 23 HG2 GLU 23 22.312 -6.119 -4.990 836 HG3 GLU 23 HG1 GLU 23 21.367 -6.759 -6.336 837 H GLU 24 HN GLU 24 18.333 -3.415 -6.310 838 HA GLU 24 HA GLU 24 18.873 -0.697 -5.521 839 HB2 GLU 24 HB2 GLU 24 16.729 -2.152 -7.024 840 HB3 GLU 24 HB1 GLU 24 16.335 -0.536 -6.449 841 HG2 GLU 24 HG2 GLU 24 18.944 -0.969 -7.898 842 HG3 GLU 24 HG1 GLU 24 17.456 -0.892 -8.839 843 H MET 25 HN MET 25 16.149 -2.863 -4.686 844 HA MET 25 HA MET 25 15.119 -1.132 -2.638 845 HB2 MET 25 HB2 MET 25 14.765 -4.068 -3.250 846 HB3 MET 25 HB1 MET 25 13.949 -3.292 -1.892 847 HG2 MET 25 HG2 MET 25 12.906 -1.677 -3.419 848 HG3 MET 25 HG1 MET 25 13.761 -2.394 -4.785 849 HE1 MET 25 HE1 MET 25 11.645 -3.596 -1.645 850 HE2 MET 25 HE2 MET 25 10.140 -3.935 -2.493 851 HE3 MET 25 HE3 MET 25 10.825 -2.314 -2.546 852 H GLY 26 HN GLY 26 17.398 -3.857 -2.596 853 HA2 GLY 26 HA2 GLY 26 19.169 -4.106 -0.996 854 HA3 GLY 26 HA1 GLY 26 18.362 -2.939 0.056 855 H ILE 27 HN ILE 27 16.841 -5.763 -1.467 856 HA ILE 27 HA ILE 27 16.510 -6.990 1.259 857 HB ILE 27 HB ILE 27 14.256 -7.710 0.568 858 HG12 ILE 27 HG12 ILE 27 14.685 -5.925 -1.851 859 HG13 ILE 27 HG11 ILE 27 14.739 -7.684 -1.914 860 HG21 ILE 27 HG21 ILE 27 14.577 -5.585 1.796 861 HG22 ILE 27 HG22 ILE 27 13.190 -5.503 0.711 862 HG23 ILE 27 HG23 ILE 27 14.709 -4.727 0.261 863 HD11 ILE 27 HD11 ILE 27 12.402 -7.627 -0.840 864 HD12 ILE 27 HD12 ILE 27 12.524 -7.139 -2.529 865 HD13 ILE 27 HD13 ILE 27 12.382 -5.915 -1.267 866 H SER 28 HN SER 28 15.926 -9.348 1.096 867 HA SER 28 HA SER 28 17.869 -10.698 -0.573 868 HB2 SER 28 HB2 SER 28 17.070 -12.719 0.507 869 HB3 SER 28 HB1 SER 28 17.197 -11.444 1.718 870 HG SER 28 HG SER 28 15.172 -11.874 2.076 871 H ARG 29 HN ARG 29 17.299 -12.481 -2.043 872 HA ARG 29 HA ARG 29 15.449 -11.678 -4.083 873 HB2 ARG 29 HB2 ARG 29 16.747 -14.372 -3.547 874 HB3 ARG 29 HB1 ARG 29 15.947 -13.915 -5.051 875 HG2 ARG 29 HG2 ARG 29 17.560 -12.076 -5.361 876 HG3 ARG 29 HG1 ARG 29 18.358 -12.514 -3.851 877 HD2 ARG 29 HD2 ARG 29 18.518 -14.906 -5.014 878 HD3 ARG 29 HD1 ARG 29 18.374 -13.945 -6.488 879 HE ARG 29 HE ARG 29 20.567 -13.157 -6.107 880 HH11 ARG 29 HH21 ARG 29 19.149 -14.495 -3.262 881 HH12 ARG 29 HH22 ARG 29 20.612 -14.425 -2.337 882 HH21 ARG 29 HH11 ARG 29 22.494 -13.066 -4.914 883 HH22 ARG 29 HH12 ARG 29 22.504 -13.616 -3.271 884 H GLN 30 HN GLN 30 15.274 -14.066 -1.462 885 HA GLN 30 HA GLN 30 12.746 -15.200 -2.197 886 HB2 GLN 30 HB2 GLN 30 14.314 -16.246 -0.572 887 HB3 GLN 30 HB1 GLN 30 13.975 -14.943 0.566 888 HG2 GLN 30 HG2 GLN 30 11.613 -15.570 0.637 889 HG3 GLN 30 HG1 GLN 30 11.885 -16.818 -0.581 890 HE21 GLN 30 HE21 GLN 30 10.865 -17.487 2.007 891 HE22 GLN 30 HE22 GLN 30 12.043 -18.389 2.832 892 H GLN 31 HN GLN 31 13.658 -12.434 -0.187 893 HA GLN 31 HA GLN 31 11.069 -11.876 0.874 894 HB2 GLN 31 HB2 GLN 31 13.217 -10.845 1.663 895 HB3 GLN 31 HB1 GLN 31 13.261 -9.893 0.180 896 HG2 GLN 31 HG2 GLN 31 12.291 -8.537 1.947 897 HG3 GLN 31 HG1 GLN 31 11.025 -8.938 0.788 898 HE21 GLN 31 HE21 GLN 31 9.203 -9.030 2.185 899 HE22 GLN 31 HE22 GLN 31 9.086 -10.091 3.504 900 H LEU 32 HN LEU 32 12.664 -10.918 -2.144 901 HA LEU 32 HA LEU 32 10.672 -9.083 -3.028 902 HB2 LEU 32 HB2 LEU 32 12.896 -9.270 -4.077 903 HB3 LEU 32 HB1 LEU 32 12.488 -10.882 -4.662 904 HG LEU 32 HG LEU 32 10.627 -9.915 -5.989 905 HD11 LEU 32 HD11 LEU 32 10.854 -7.304 -6.256 906 HD12 LEU 32 HD12 LEU 32 11.575 -7.386 -4.651 907 HD13 LEU 32 HD13 LEU 32 9.927 -7.958 -4.911 908 HD21 LEU 32 HD21 LEU 32 13.370 -8.697 -6.399 909 HD22 LEU 32 HD22 LEU 32 12.092 -8.689 -7.615 910 HD23 LEU 32 HD23 LEU 32 12.773 -10.220 -7.060 911 H CYS 33 HN CYS 33 11.014 -12.591 -3.484 912 HA CYS 33 HA CYS 33 8.791 -12.946 -5.224 913 HB2 CYS 33 HB2 CYS 33 10.005 -14.795 -3.147 914 HB3 CYS 33 HB1 CYS 33 8.811 -15.304 -4.345 915 HG CYS 33 HG CYS 33 10.793 -14.167 -6.055 916 H ASN 34 HN ASN 34 8.995 -12.764 -1.696 917 HA ASN 34 HA ASN 34 6.287 -13.536 -1.152 918 HB2 ASN 34 HB2 ASN 34 8.321 -13.243 0.462 919 HB3 ASN 34 HB1 ASN 34 7.827 -11.552 0.534 920 HD21 ASN 34 HD21 ASN 34 7.694 -13.420 2.781 921 HD22 ASN 34 HD22 ASN 34 6.059 -13.580 3.203 922 H ILE 35 HN ILE 35 7.786 -10.413 -1.930 923 HA ILE 35 HA ILE 35 5.527 -8.761 -1.351 924 HB ILE 35 HB ILE 35 7.754 -8.452 -3.391 925 HG12 ILE 35 HG12 ILE 35 7.320 -7.123 -0.696 926 HG13 ILE 35 HG11 ILE 35 8.363 -8.522 -0.948 927 HG21 ILE 35 HG21 ILE 35 7.062 -5.994 -3.280 928 HG22 ILE 35 HG22 ILE 35 5.576 -6.545 -2.510 929 HG23 ILE 35 HG23 ILE 35 5.961 -7.057 -4.152 930 HD11 ILE 35 HD11 ILE 35 8.699 -5.721 -2.015 931 HD12 ILE 35 HD12 ILE 35 9.528 -7.083 -2.760 932 HD13 ILE 35 HD13 ILE 35 9.842 -6.677 -1.073 933 H GLU 36 HN GLU 36 6.514 -10.474 -4.301 934 HA GLU 36 HA GLU 36 4.383 -9.533 -5.968 935 HB2 GLU 36 HB2 GLU 36 5.832 -12.198 -6.094 936 HB3 GLU 36 HB1 GLU 36 4.987 -11.395 -7.419 937 HG2 GLU 36 HG2 GLU 36 6.572 -9.561 -7.402 938 HG3 GLU 36 HG1 GLU 36 7.362 -10.202 -5.960 939 H GLN 37 HN GLN 37 4.684 -12.257 -3.738 940 HA GLN 37 HA GLN 37 2.147 -13.465 -4.462 941 HB2 GLN 37 HB2 GLN 37 4.206 -14.540 -3.288 942 HB3 GLN 37 HB1 GLN 37 3.563 -13.824 -1.812 943 HG2 GLN 37 HG2 GLN 37 2.696 -16.058 -1.946 944 HG3 GLN 37 HG1 GLN 37 1.364 -14.970 -2.337 945 HE21 GLN 37 HE21 GLN 37 0.193 -16.267 -3.847 946 HE22 GLN 37 HE22 GLN 37 0.865 -16.852 -5.291 947 H SER 38 HN SER 38 1.964 -10.638 -3.913 948 HA SER 38 HA SER 38 0.935 -10.175 -1.255 949 HB2 SER 38 HB2 SER 38 1.772 -8.343 -2.677 950 HB3 SER 38 HB1 SER 38 0.472 -8.635 -3.828 951 HG SER 38 HG SER 38 0.384 -7.586 -1.224 952 H GLU 39 HN GLU 39 -0.747 -11.548 -0.700 953 HA GLU 39 HA GLU 39 -2.859 -12.313 -2.493 954 HB2 GLU 39 HB2 GLU 39 -2.777 -12.289 0.547 955 HB3 GLU 39 HB1 GLU 39 -3.975 -13.138 -0.432 956 HG2 GLU 39 HG2 GLU 39 -0.982 -13.628 -0.555 957 HG3 GLU 39 HG1 GLU 39 -2.129 -14.641 0.320 958 H THR 40 HN THR 40 -3.898 -10.591 -3.404 959 HA THR 40 HA THR 40 -5.341 -8.761 -3.603 960 HB THR 40 HB THR 40 -6.099 -9.491 -0.755 961 HG1 THR 40 HG1 THR 40 -7.148 -11.068 -1.639 962 HG21 THR 40 HG21 THR 40 -7.579 -7.941 -2.895 963 HG22 THR 40 HG22 THR 40 -6.834 -7.234 -1.463 964 HG23 THR 40 HG23 THR 40 -8.197 -8.337 -1.293 965 H ALA 41 HN ALA 41 -5.242 -6.531 -3.266 966 HA ALA 41 HA ALA 41 -2.874 -5.554 -1.977 967 HB1 ALA 41 HB1 ALA 41 -5.281 -4.012 -2.985 968 HB2 ALA 41 HB2 ALA 41 -3.880 -4.469 -3.952 969 HB3 ALA 41 HB3 ALA 41 -3.697 -3.326 -2.622 970 HA PRO 42 HA PRO 42 -4.571 -4.937 2.127 971 HB2 PRO 42 HB2 PRO 42 -2.729 -3.220 3.164 972 HB3 PRO 42 HB1 PRO 42 -2.371 -4.931 2.852 973 HG2 PRO 42 HG2 PRO 42 -1.702 -2.531 1.196 974 HG3 PRO 42 HG1 PRO 42 -0.692 -3.932 1.604 975 HD2 PRO 42 HD2 PRO 42 -1.975 -3.697 -0.801 976 HD3 PRO 42 HD1 PRO 42 -1.645 -5.268 -0.037 977 H VAL 43 HN VAL 43 -5.510 -3.257 3.522 978 HA VAL 43 HA VAL 43 -7.042 -1.312 2.115 979 HB VAL 43 HB VAL 43 -7.568 -0.430 4.408 980 HG11 VAL 43 HG11 VAL 43 -8.418 -2.681 5.286 981 HG12 VAL 43 HG12 VAL 43 -7.605 -3.414 3.903 982 HG13 VAL 43 HG13 VAL 43 -8.912 -2.258 3.646 983 HG21 VAL 43 HG21 VAL 43 -6.552 -1.488 6.346 984 HG22 VAL 43 HG22 VAL 43 -5.260 -0.858 5.326 985 HG23 VAL 43 HG23 VAL 43 -5.631 -2.581 5.315 986 H VAL 44 HN VAL 44 -3.806 -1.225 3.312 987 HA VAL 44 HA VAL 44 -3.469 1.579 3.730 988 HB VAL 44 HB VAL 44 -1.526 -0.536 2.750 989 HG11 VAL 44 HG11 VAL 44 -0.604 1.588 2.138 990 HG12 VAL 44 HG12 VAL 44 0.195 1.111 3.637 991 HG13 VAL 44 HG13 VAL 44 -1.095 2.314 3.670 992 HG21 VAL 44 HG21 VAL 44 -1.756 0.704 5.499 993 HG22 VAL 44 HG22 VAL 44 -0.888 -0.760 5.036 994 HG23 VAL 44 HG23 VAL 44 -2.651 -0.747 5.049 995 H VAL 45 HN VAL 45 -3.060 -0.423 0.804 996 HA VAL 45 HA VAL 45 -2.250 1.698 -0.935 997 HB VAL 45 HB VAL 45 -3.698 -0.911 -1.496 998 HG11 VAL 45 HG11 VAL 45 -2.529 1.173 -3.349 999 HG12 VAL 45 HG12 VAL 45 -4.153 0.486 -3.373 1000 HG13 VAL 45 HG13 VAL 45 -2.769 -0.500 -3.847 1001 HG21 VAL 45 HG21 VAL 45 -0.807 -0.150 -1.988 1002 HG22 VAL 45 HG22 VAL 45 -1.522 -1.760 -2.048 1003 HG23 VAL 45 HG23 VAL 45 -1.349 -0.931 -0.502 1004 H LYS 46 HN LYS 46 -5.446 0.363 -0.131 1005 HA LYS 46 HA LYS 46 -6.974 1.953 -1.929 1006 HB2 LYS 46 HB2 LYS 46 -7.680 0.821 0.797 1007 HB3 LYS 46 HB1 LYS 46 -8.852 1.533 -0.313 1008 HG2 LYS 46 HG2 LYS 46 -8.252 -0.135 -2.029 1009 HG3 LYS 46 HG1 LYS 46 -7.079 -0.852 -0.922 1010 HD2 LYS 46 HD2 LYS 46 -8.873 -1.390 0.664 1011 HD3 LYS 46 HD1 LYS 46 -10.057 -0.626 -0.394 1012 HE2 LYS 46 HE2 LYS 46 -10.228 -2.937 -0.892 1013 HE3 LYS 46 HE1 LYS 46 -9.241 -2.283 -2.199 1014 HZ1 LYS 46 HZ1 LYS 46 -7.274 -3.048 -1.138 1015 HZ2 LYS 46 HZ2 LYS 46 -8.363 -4.352 -1.172 1016 HZ3 LYS 46 HZ3 LYS 46 -8.115 -3.485 0.268 1017 H TYR 47 HN TYR 47 -5.756 2.619 1.342 1018 HA TYR 47 HA TYR 47 -7.177 5.036 1.813 1019 HB2 TYR 47 HB2 TYR 47 -5.852 3.924 3.562 1020 HB3 TYR 47 HB1 TYR 47 -4.366 4.273 2.675 1021 HD1 TYR 47 HD1 TYR 47 -7.270 5.833 4.396 1022 HD2 TYR 47 HD2 TYR 47 -3.320 6.413 2.813 1023 HE1 TYR 47 HE1 TYR 47 -7.178 8.076 5.450 1024 HE2 TYR 47 HE2 TYR 47 -3.229 8.655 3.868 1025 HH TYR 47 HH TYR 47 -4.603 9.695 6.101 1026 H ILE 48 HN ILE 48 -4.074 4.437 0.167 1027 HA ILE 48 HA ILE 48 -3.460 7.181 -0.376 1028 HB ILE 48 HB ILE 48 -2.762 4.648 -1.902 1029 HG12 ILE 48 HG12 ILE 48 -1.057 6.363 -0.072 1030 HG13 ILE 48 HG11 ILE 48 -1.939 4.940 0.485 1031 HG21 ILE 48 HG21 ILE 48 -1.861 7.516 -2.230 1032 HG22 ILE 48 HG22 ILE 48 -2.501 6.429 -3.463 1033 HG23 ILE 48 HG23 ILE 48 -0.889 6.160 -2.800 1034 HD11 ILE 48 HD11 ILE 48 0.094 4.931 -1.762 1035 HD12 ILE 48 HD12 ILE 48 -0.734 3.525 -1.095 1036 HD13 ILE 48 HD13 ILE 48 0.426 4.417 -0.109 1037 H ALA 49 HN ALA 49 -5.310 4.733 -2.165 1038 HA ALA 49 HA ALA 49 -5.861 6.212 -4.497 1039 HB1 ALA 49 HB1 ALA 49 -6.496 3.784 -3.942 1040 HB2 ALA 49 HB2 ALA 49 -7.678 4.720 -4.853 1041 HB3 ALA 49 HB3 ALA 49 -7.906 4.460 -3.123 1042 H PHE 50 HN PHE 50 -7.348 6.376 -1.281 1043 HA PHE 50 HA PHE 50 -9.542 8.066 -2.002 1044 HB2 PHE 50 HB2 PHE 50 -9.051 6.841 0.242 1045 HB3 PHE 50 HB1 PHE 50 -8.073 8.253 0.637 1046 HD1 PHE 50 HD1 PHE 50 -9.116 10.473 0.919 1047 HD2 PHE 50 HD2 PHE 50 -11.463 6.978 0.068 1048 HE1 PHE 50 HE1 PHE 50 -11.172 11.688 1.589 1049 HE2 PHE 50 HE2 PHE 50 -13.519 8.194 0.734 1050 HZ PHE 50 HZ PHE 50 -13.373 10.549 1.495 1051 H LEU 51 HN LEU 51 -6.256 8.821 -0.820 1052 HA LEU 51 HA LEU 51 -6.535 11.676 -1.009 1053 HB2 LEU 51 HB2 LEU 51 -4.205 9.769 -0.911 1054 HB3 LEU 51 HB1 LEU 51 -3.913 11.479 -1.212 1055 HG LEU 51 HG LEU 51 -3.770 10.772 1.218 1056 HD11 LEU 51 HD11 LEU 51 -4.609 12.788 1.999 1057 HD12 LEU 51 HD12 LEU 51 -6.042 12.730 0.975 1058 HD13 LEU 51 HD13 LEU 51 -4.472 13.142 0.281 1059 HD21 LEU 51 HD21 LEU 51 -5.723 10.171 2.421 1060 HD22 LEU 51 HD22 LEU 51 -5.772 9.191 0.954 1061 HD23 LEU 51 HD23 LEU 51 -6.783 10.630 1.090 1062 H ARG 52 HN ARG 52 -5.314 9.221 -3.265 1063 HA ARG 52 HA ARG 52 -4.524 11.052 -5.321 1064 HB2 ARG 52 HB2 ARG 52 -3.835 8.634 -5.149 1065 HB3 ARG 52 HB1 ARG 52 -5.465 8.190 -5.648 1066 HG2 ARG 52 HG2 ARG 52 -4.021 8.176 -7.601 1067 HG3 ARG 52 HG1 ARG 52 -5.153 9.519 -7.735 1068 HD2 ARG 52 HD2 ARG 52 -3.499 11.121 -7.418 1069 HD3 ARG 52 HD1 ARG 52 -2.499 10.051 -6.433 1070 HE ARG 52 HE ARG 52 -2.423 8.864 -8.921 1071 HH11 ARG 52 HH21 ARG 52 -1.915 12.033 -7.675 1072 HH12 ARG 52 HH22 ARG 52 -0.739 12.462 -8.872 1073 HH21 ARG 52 HH11 ARG 52 -0.887 9.399 -10.497 1074 HH22 ARG 52 HH12 ARG 52 -0.156 10.970 -10.471 1075 H SER 53 HN SER 53 -7.542 9.358 -4.625 1076 HA SER 53 HA SER 53 -8.976 9.925 -6.979 1077 HB2 SER 53 HB2 SER 53 -9.912 9.721 -4.105 1078 HB3 SER 53 HB1 SER 53 -11.011 9.815 -5.481 1079 HG SER 53 HG SER 53 -10.568 7.810 -5.938 1080 H LYS 54 HN LYS 54 -8.287 11.990 -4.198 1081 HA LYS 54 HA LYS 54 -10.057 14.118 -5.185 1082 HB2 LYS 54 HB2 LYS 54 -8.102 13.902 -2.894 1083 HB3 LYS 54 HB1 LYS 54 -8.918 15.414 -3.288 1084 HG2 LYS 54 HG2 LYS 54 -11.101 14.318 -3.017 1085 HG3 LYS 54 HG1 LYS 54 -10.300 12.786 -2.668 1086 HD2 LYS 54 HD2 LYS 54 -9.198 13.840 -0.702 1087 HD3 LYS 54 HD1 LYS 54 -10.086 15.328 -1.029 1088 HE2 LYS 54 HE2 LYS 54 -11.411 12.648 -0.540 1089 HE3 LYS 54 HE1 LYS 54 -11.166 13.866 0.711 1090 HZ1 LYS 54 HZ1 LYS 54 -12.422 15.437 -0.671 1091 HZ2 LYS 54 HZ2 LYS 54 -13.353 14.089 -0.220 1092 HZ3 LYS 54 HZ3 LYS 54 -12.724 14.202 -1.793 1093 H GLY 55 HN GLY 55 -7.187 12.970 -6.267 1094 HA2 GLY 55 HA2 GLY 55 -5.676 13.901 -7.812 1095 HA3 GLY 55 HA1 GLY 55 -6.612 15.393 -7.750 1096 H VAL 56 HN VAL 56 -5.361 13.967 -4.803 1097 HA VAL 56 HA VAL 56 -3.989 16.413 -4.126 1098 HB VAL 56 HB VAL 56 -3.945 13.640 -2.909 1099 HG11 VAL 56 HG11 VAL 56 -1.845 14.572 -2.264 1100 HG12 VAL 56 HG12 VAL 56 -2.927 14.915 -0.914 1101 HG13 VAL 56 HG13 VAL 56 -2.533 16.184 -2.074 1102 HG21 VAL 56 HG21 VAL 56 -5.167 16.282 -2.062 1103 HG22 VAL 56 HG22 VAL 56 -5.307 14.760 -1.182 1104 HG23 VAL 56 HG23 VAL 56 -6.044 14.933 -2.774 1105 H ASP 57 HN ASP 57 -1.894 16.990 -4.436 1106 HA ASP 57 HA ASP 57 -0.293 15.970 -6.465 1107 HB2 ASP 57 HB2 ASP 57 0.866 17.131 -3.923 1108 HB3 ASP 57 HB1 ASP 57 1.481 17.290 -5.569 1109 H LEU 58 HN LEU 58 -0.420 13.603 -6.248 1110 HA LEU 58 HA LEU 58 1.037 12.380 -3.984 1111 HB2 LEU 58 HB2 LEU 58 -1.073 11.358 -4.816 1112 HB3 LEU 58 HB1 LEU 58 -0.304 11.092 -6.378 1113 HG LEU 58 HG LEU 58 1.410 9.670 -5.277 1114 HD11 LEU 58 HD11 LEU 58 0.605 8.907 -2.858 1115 HD12 LEU 58 HD12 LEU 58 -0.108 10.521 -2.825 1116 HD13 LEU 58 HD13 LEU 58 1.629 10.327 -3.059 1117 HD21 LEU 58 HD21 LEU 58 -0.627 8.663 -6.229 1118 HD22 LEU 58 HD22 LEU 58 -1.459 8.879 -4.689 1119 HD23 LEU 58 HD23 LEU 58 -0.093 7.769 -4.806 1120 H ASN 59 HN ASN 59 1.289 12.672 -7.521 1121 HA ASN 59 HA ASN 59 3.546 11.073 -7.972 1122 HB2 ASN 59 HB2 ASN 59 4.034 13.001 -9.778 1123 HB3 ASN 59 HB1 ASN 59 2.667 11.903 -9.958 1124 HD21 ASN 59 HD21 ASN 59 0.597 12.824 -9.994 1125 HD22 ASN 59 HD22 ASN 59 0.265 14.447 -9.626 1126 H ALA 60 HN ALA 60 3.566 14.585 -7.253 1127 HA ALA 60 HA ALA 60 6.413 14.730 -7.018 1128 HB1 ALA 60 HB1 ALA 60 4.783 16.673 -7.262 1129 HB2 ALA 60 HB2 ALA 60 6.061 16.901 -6.069 1130 HB3 ALA 60 HB3 ALA 60 4.431 16.477 -5.545 1131 H LEU 61 HN LEU 61 3.846 14.140 -4.640 1132 HA LEU 61 HA LEU 61 5.125 14.285 -2.213 1133 HB2 LEU 61 HB2 LEU 61 2.771 13.391 -2.834 1134 HB3 LEU 61 HB1 LEU 61 3.547 11.817 -2.943 1135 HG LEU 61 HG LEU 61 4.514 12.541 -0.537 1136 HD11 LEU 61 HD11 LEU 61 1.856 13.990 -0.743 1137 HD12 LEU 61 HD12 LEU 61 3.434 14.768 -0.609 1138 HD13 LEU 61 HD13 LEU 61 2.813 13.793 0.721 1139 HD21 LEU 61 HD21 LEU 61 1.696 11.509 -1.014 1140 HD22 LEU 61 HD22 LEU 61 2.598 11.344 0.492 1141 HD23 LEU 61 HD23 LEU 61 3.162 10.530 -0.966 1142 H PHE 62 HN PHE 62 5.183 11.313 -4.217 1143 HA PHE 62 HA PHE 62 7.197 10.005 -2.647 1144 HB2 PHE 62 HB2 PHE 62 6.081 9.659 -5.420 1145 HB3 PHE 62 HB1 PHE 62 7.521 8.750 -4.967 1146 HD1 PHE 62 HD1 PHE 62 4.185 9.657 -3.471 1147 HD2 PHE 62 HD2 PHE 62 7.165 6.625 -4.081 1148 HE1 PHE 62 HE1 PHE 62 2.760 8.015 -2.280 1149 HE2 PHE 62 HE2 PHE 62 5.741 4.989 -2.900 1150 HZ PHE 62 HZ PHE 62 3.537 5.676 -1.997 1151 H ASP 63 HN ASP 63 7.395 11.954 -5.620 1152 HA ASP 63 HA ASP 63 10.063 11.708 -6.288 1153 HB2 ASP 63 HB2 ASP 63 8.281 13.203 -7.350 1154 HB3 ASP 63 HB1 ASP 63 8.713 14.408 -6.134 1155 H ARG 64 HN ARG 64 8.728 13.468 -3.537 1156 HA ARG 64 HA ARG 64 11.145 14.834 -2.792 1157 HB2 ARG 64 HB2 ARG 64 8.977 13.834 -0.919 1158 HB3 ARG 64 HB1 ARG 64 10.059 15.201 -0.662 1159 HG2 ARG 64 HG2 ARG 64 8.006 15.041 -2.881 1160 HG3 ARG 64 HG1 ARG 64 7.748 15.882 -1.364 1161 HD2 ARG 64 HD2 ARG 64 9.819 16.527 -3.480 1162 HD3 ARG 64 HD1 ARG 64 8.439 17.506 -3.015 1163 HE ARG 64 HE ARG 64 10.876 17.068 -1.354 1164 HH11 ARG 64 HH21 ARG 64 7.837 18.667 -1.929 1165 HH12 ARG 64 HH22 ARG 64 8.108 19.855 -0.703 1166 HH21 ARG 64 HH11 ARG 64 11.190 18.597 0.244 1167 HH22 ARG 64 HH12 ARG 64 9.989 19.814 0.522 1168 H ILE 65 HN ILE 65 9.791 11.671 -1.894 1169 HA ILE 65 HA ILE 65 11.847 10.994 -0.015 1170 HB ILE 65 HB ILE 65 10.005 9.261 -1.686 1171 HG12 ILE 65 HG12 ILE 65 9.899 9.940 1.265 1172 HG13 ILE 65 HG11 ILE 65 9.025 10.857 0.037 1173 HG21 ILE 65 HG21 ILE 65 10.579 7.549 0.145 1174 HG22 ILE 65 HG22 ILE 65 11.959 8.583 0.517 1175 HG23 ILE 65 HG23 ILE 65 11.818 7.843 -1.076 1176 HD11 ILE 65 HD11 ILE 65 8.727 7.894 0.602 1177 HD12 ILE 65 HD12 ILE 65 7.909 8.759 -0.698 1178 HD13 ILE 65 HD13 ILE 65 7.550 9.149 0.984 1179 H ILE 66 HN ILE 66 11.478 10.281 -3.496 1180 HA ILE 66 HA ILE 66 14.127 8.969 -3.531 1181 HB ILE 66 HB ILE 66 13.571 8.583 -5.946 1182 HG12 ILE 66 HG12 ILE 66 10.923 9.843 -5.152 1183 HG13 ILE 66 HG11 ILE 66 12.108 10.579 -6.230 1184 HG21 ILE 66 HG21 ILE 66 12.984 6.985 -4.117 1185 HG22 ILE 66 HG22 ILE 66 11.853 6.923 -5.468 1186 HG23 ILE 66 HG23 ILE 66 11.408 7.766 -3.985 1187 HD11 ILE 66 HD11 ILE 66 10.549 9.532 -7.677 1188 HD12 ILE 66 HD12 ILE 66 10.479 8.080 -6.680 1189 HD13 ILE 66 HD13 ILE 66 11.924 8.429 -7.628 1190 H VAL 67 HN VAL 67 15.966 9.874 -4.245 1191 HA VAL 67 HA VAL 67 16.031 12.734 -4.835 1192 HB VAL 67 HB VAL 67 18.199 10.612 -4.833 1193 HG11 VAL 67 HG11 VAL 67 18.293 13.611 -5.196 1194 HG12 VAL 67 HG12 VAL 67 19.004 12.365 -6.222 1195 HG13 VAL 67 HG13 VAL 67 19.689 12.694 -4.629 1196 HG21 VAL 67 HG21 VAL 67 18.751 11.428 -2.651 1197 HG22 VAL 67 HG22 VAL 67 17.004 11.188 -2.655 1198 HG23 VAL 67 HG23 VAL 67 17.671 12.812 -2.822 1199 H ASN 68 HN ASN 68 15.897 9.796 -6.637 1200 HA ASN 68 HA ASN 68 15.856 9.376 -8.941 1201 HB2 ASN 68 HB2 ASN 68 14.283 11.440 -8.744 1202 HB3 ASN 68 HB1 ASN 68 15.644 12.362 -9.379 1203 HD21 ASN 68 HD21 ASN 68 14.292 9.107 -10.184 1204 HD22 ASN 68 HD22 ASN 68 14.170 9.412 -11.849 1205 H LYS 69 HN LYS 69 18.397 9.876 -7.568 1206 HA LYS 69 HA LYS 69 20.640 10.498 -8.010 1207 HB2 LYS 69 HB2 LYS 69 19.694 9.274 -10.616 1208 HB3 LYS 69 HB1 LYS 69 21.389 9.601 -10.250 1209 HG2 LYS 69 HG2 LYS 69 21.122 8.203 -8.164 1210 HG3 LYS 69 HG1 LYS 69 19.519 7.751 -8.742 1211 HD2 LYS 69 HD2 LYS 69 22.066 7.315 -10.331 1212 HD3 LYS 69 HD1 LYS 69 21.329 6.085 -9.308 1213 HE2 LYS 69 HE2 LYS 69 19.181 6.475 -10.673 1214 HE3 LYS 69 HE1 LYS 69 20.207 7.339 -11.817 1215 HZ1 LYS 69 HZ1 LYS 69 21.653 5.287 -11.786 1216 HZ2 LYS 69 HZ2 LYS 69 20.149 5.133 -12.561 1217 HZ3 LYS 69 HZ3 LYS 69 20.373 4.499 -11.000 1218 H LEU 70 HN LEU 70 18.541 12.575 -8.640 1219 HA LEU 70 HA LEU 70 19.288 13.946 -11.039 1220 HB2 LEU 70 HB2 LEU 70 17.165 14.370 -9.841 1221 HB3 LEU 70 HB1 LEU 70 18.065 15.039 -8.482 1222 HG LEU 70 HG LEU 70 18.956 16.816 -9.938 1223 HD11 LEU 70 HD11 LEU 70 19.087 15.995 -12.114 1224 HD12 LEU 70 HD12 LEU 70 17.643 16.997 -12.231 1225 HD13 LEU 70 HD13 LEU 70 17.489 15.249 -12.047 1226 HD21 LEU 70 HD21 LEU 70 16.818 18.022 -10.293 1227 HD22 LEU 70 HD22 LEU 70 16.862 17.211 -8.726 1228 HD23 LEU 70 HD23 LEU 70 15.941 16.510 -10.057 1229 H GLU 71 HN GLU 71 21.407 14.483 -11.320 1230 HA GLU 71 HA GLU 71 22.901 15.711 -9.039 1231 HB2 GLU 71 HB2 GLU 71 23.767 14.411 -11.624 1232 HB3 GLU 71 HB1 GLU 71 24.876 15.388 -10.664 1233 HG2 GLU 71 HG2 GLU 71 24.391 13.932 -8.695 1234 HG3 GLU 71 HG1 GLU 71 23.388 12.915 -9.733 1235 H HIS 72 HN HIS 72 23.167 17.852 -9.017 1236 HA HIS 72 HA HIS 72 23.527 20.044 -9.749 1237 HB2 HIS 72 HB2 HIS 72 23.491 19.211 -12.636 1238 HB3 HIS 72 HB1 HIS 72 24.492 20.417 -11.831 1239 HD2 HIS 72 HD2 HIS 72 25.794 18.421 -9.494 1240 HE1 HIS 72 HE1 HIS 72 27.108 16.123 -12.788 1241 HE2 HIS 72 HE2 HIS 72 27.432 16.561 -10.310 1242 H HIS 73 HN HIS 73 22.490 21.748 -11.165 1243 HA HIS 73 HA HIS 73 20.457 22.915 -11.437 1244 HB2 HIS 73 HB2 HIS 73 21.048 21.984 -13.673 1245 HB3 HIS 73 HB1 HIS 73 20.037 20.581 -13.326 1246 HD2 HIS 73 HD2 HIS 73 19.397 24.528 -13.391 1247 HE1 HIS 73 HE1 HIS 73 15.933 22.517 -14.731 1248 HE2 HIS 73 HE2 HIS 73 16.969 24.793 -14.304 1249 H HIS 74 HN HIS 74 19.454 22.592 -9.379 1250 HA HIS 74 HA HIS 74 17.846 20.227 -8.866 1251 HB2 HIS 74 HB2 HIS 74 18.936 21.871 -7.159 1252 HB3 HIS 74 HB1 HIS 74 17.507 22.865 -7.431 1253 HD2 HIS 74 HD2 HIS 74 16.433 22.232 -4.858 1254 HE1 HIS 74 HE1 HIS 74 15.869 18.118 -5.638 1255 HE2 HIS 74 HE2 HIS 74 15.366 20.005 -4.019 1256 H HIS 75 HN HIS 75 15.778 19.879 -9.509 1257 HA HIS 75 HA HIS 75 14.454 21.832 -11.213 1258 HB2 HIS 75 HB2 HIS 75 14.342 19.306 -11.471 1259 HB3 HIS 75 HB1 HIS 75 13.273 19.289 -10.068 1260 HD2 HIS 75 HD2 HIS 75 11.146 21.605 -10.701 1261 HE1 HIS 75 HE1 HIS 75 10.834 19.988 -14.588 1262 HE2 HIS 75 HE2 HIS 75 9.743 21.528 -12.893 1263 H HIS 76 HN HIS 76 14.045 23.627 -9.806 1264 HA HIS 76 HA HIS 76 11.490 23.598 -8.528 1265 HB2 HIS 76 HB2 HIS 76 12.613 22.380 -6.727 1266 HB3 HIS 76 HB1 HIS 76 13.882 23.601 -6.655 1267 HD2 HIS 76 HD2 HIS 76 12.793 23.967 -3.893 1268 HE1 HIS 76 HE1 HIS 76 9.520 26.247 -5.286 1269 HE2 HIS 76 HE2 HIS 76 10.847 25.575 -3.232 1270 H HIS 77 HN HIS 77 11.450 25.428 -9.981 1271 HA HIS 77 HA HIS 77 12.086 27.933 -8.707 1272 HB2 HIS 77 HB2 HIS 77 13.782 28.767 -10.222 1273 HB3 HIS 77 HB1 HIS 77 14.362 27.252 -9.534 1274 HD2 HIS 77 HD2 HIS 77 14.649 25.132 -11.398 1275 HE1 HIS 77 HE1 HIS 77 13.493 27.350 -14.801 1276 HE2 HIS 77 HE2 HIS 77 14.494 25.162 -14.001 Start of MODEL 12 1 H1 MET 1 HT1 MET 1 12.621 12.702 5.998 2 H2 MET 1 HT2 MET 1 12.762 13.897 7.197 3 H3 MET 1 HT3 MET 1 12.794 14.330 5.554 4 HA MET 1 HA MET 1 10.586 14.207 7.230 5 HB2 MET 1 HB2 MET 1 10.864 14.486 4.219 6 HB3 MET 1 HB1 MET 1 9.411 14.892 5.132 7 HG2 MET 1 HG2 MET 1 12.139 16.140 5.583 8 HG3 MET 1 HG1 MET 1 10.836 16.890 4.667 9 HE1 MET 1 HE1 MET 1 8.101 16.134 6.659 10 HE2 MET 1 HE2 MET 1 8.645 17.212 5.377 11 HE3 MET 1 HE3 MET 1 8.193 17.877 6.943 12 H GLU 2 HN GLU 2 9.869 12.209 7.931 13 HA GLU 2 HA GLU 2 9.779 9.880 6.222 14 HB2 GLU 2 HB2 GLU 2 8.193 9.064 8.154 15 HB3 GLU 2 HB1 GLU 2 9.902 9.320 8.493 16 HG2 GLU 2 HG2 GLU 2 7.990 11.618 8.845 17 HG3 GLU 2 HG1 GLU 2 8.060 10.368 10.083 18 H LEU 3 HN LEU 3 7.930 8.892 5.310 19 HA LEU 3 HA LEU 3 6.058 10.670 4.094 20 HB2 LEU 3 HB2 LEU 3 6.806 8.407 3.226 21 HB3 LEU 3 HB1 LEU 3 5.744 7.681 4.426 22 HG LEU 3 HG LEU 3 3.884 9.179 3.403 23 HD11 LEU 3 HD11 LEU 3 5.126 10.657 1.998 24 HD12 LEU 3 HD12 LEU 3 4.326 9.536 0.904 25 HD13 LEU 3 HD13 LEU 3 6.034 9.331 1.275 26 HD21 LEU 3 HD21 LEU 3 5.078 6.909 1.781 27 HD22 LEU 3 HD22 LEU 3 3.412 7.479 1.677 28 HD23 LEU 3 HD23 LEU 3 3.993 6.721 3.159 29 H SER 4 HN SER 4 5.775 8.523 6.913 30 HA SER 4 HA SER 4 2.977 8.706 7.305 31 HB2 SER 4 HB2 SER 4 4.451 7.194 8.599 32 HB3 SER 4 HB1 SER 4 5.153 8.588 9.416 33 HG SER 4 HG SER 4 2.542 7.532 9.579 34 H ASN 5 HN ASN 5 5.560 10.846 8.531 35 HA ASN 5 HA ASN 5 3.790 12.616 9.937 36 HB2 ASN 5 HB2 ASN 5 6.309 12.477 10.197 37 HB3 ASN 5 HB1 ASN 5 6.440 13.355 8.672 38 HD21 ASN 5 HD21 ASN 5 5.851 15.613 8.654 39 HD22 ASN 5 HD22 ASN 5 5.544 16.475 10.083 40 H GLU 6 HN GLU 6 5.057 12.596 6.626 41 HA GLU 6 HA GLU 6 3.943 15.121 5.829 42 HB2 GLU 6 HB2 GLU 6 5.709 13.672 4.619 43 HB3 GLU 6 HB1 GLU 6 4.343 12.758 3.982 44 HG2 GLU 6 HG2 GLU 6 4.786 14.412 2.336 45 HG3 GLU 6 HG1 GLU 6 3.392 15.024 3.228 46 H LEU 7 HN LEU 7 2.716 11.799 5.747 47 HA LEU 7 HA LEU 7 0.293 12.331 4.327 48 HB2 LEU 7 HB2 LEU 7 1.162 10.205 6.283 49 HB3 LEU 7 HB1 LEU 7 -0.494 10.233 5.681 50 HG LEU 7 HG LEU 7 1.787 10.386 3.709 51 HD11 LEU 7 HD11 LEU 7 0.740 7.872 5.049 52 HD12 LEU 7 HD12 LEU 7 2.399 8.467 5.059 53 HD13 LEU 7 HD13 LEU 7 1.686 7.876 3.560 54 HD21 LEU 7 HD21 LEU 7 -0.746 10.635 3.176 55 HD22 LEU 7 HD22 LEU 7 -0.842 8.904 3.479 56 HD23 LEU 7 HD23 LEU 7 0.190 9.516 2.188 57 H LYS 8 HN LYS 8 1.118 12.442 7.762 58 HA LYS 8 HA LYS 8 -1.491 12.888 8.798 59 HB2 LYS 8 HB2 LYS 8 0.538 12.351 10.155 60 HB3 LYS 8 HB1 LYS 8 1.132 13.984 9.853 61 HG2 LYS 8 HG2 LYS 8 -0.842 14.934 10.947 62 HG3 LYS 8 HG1 LYS 8 -1.498 13.315 11.205 63 HD2 LYS 8 HD2 LYS 8 0.474 12.739 12.581 64 HD3 LYS 8 HD1 LYS 8 1.112 14.366 12.341 65 HE2 LYS 8 HE2 LYS 8 -0.881 15.318 13.430 66 HE3 LYS 8 HE1 LYS 8 -1.537 13.697 13.656 67 HZ1 LYS 8 HZ1 LYS 8 -0.159 14.871 15.527 68 HZ2 LYS 8 HZ2 LYS 8 1.160 14.258 14.649 69 HZ3 LYS 8 HZ3 LYS 8 -0.022 13.202 15.261 70 H VAL 9 HN VAL 9 0.969 15.200 7.651 71 HA VAL 9 HA VAL 9 -0.455 17.576 8.335 72 HB VAL 9 HB VAL 9 1.553 17.012 6.136 73 HG11 VAL 9 HG11 VAL 9 0.268 19.601 7.045 74 HG12 VAL 9 HG12 VAL 9 0.364 18.957 5.405 75 HG13 VAL 9 HG13 VAL 9 1.818 19.562 6.202 76 HG21 VAL 9 HG21 VAL 9 1.744 18.325 8.868 77 HG22 VAL 9 HG22 VAL 9 3.066 18.230 7.705 78 HG23 VAL 9 HG23 VAL 9 2.410 16.756 8.417 79 H GLU 10 HN GLU 10 -0.449 15.667 5.317 80 HA GLU 10 HA GLU 10 -2.206 17.378 3.860 81 HB2 GLU 10 HB2 GLU 10 -1.863 14.370 3.649 82 HB3 GLU 10 HB1 GLU 10 -2.591 15.411 2.425 83 HG2 GLU 10 HG2 GLU 10 -0.477 16.645 2.192 84 HG3 GLU 10 HG1 GLU 10 0.256 15.638 3.441 85 H ARG 11 HN ARG 11 -2.804 14.833 6.207 86 HA ARG 11 HA ARG 11 -5.648 14.674 5.687 87 HB2 ARG 11 HB2 ARG 11 -3.986 13.003 6.912 88 HB3 ARG 11 HB1 ARG 11 -4.460 13.911 8.346 89 HG2 ARG 11 HG2 ARG 11 -6.836 13.448 7.856 90 HG3 ARG 11 HG1 ARG 11 -6.364 12.548 6.413 91 HD2 ARG 11 HD2 ARG 11 -4.984 11.049 7.915 92 HD3 ARG 11 HD1 ARG 11 -5.734 11.856 9.293 93 HE ARG 11 HE ARG 11 -7.641 10.778 7.345 94 HH11 ARG 11 HH21 ARG 11 -5.756 10.293 10.191 95 HH12 ARG 11 HH22 ARG 11 -6.742 8.998 10.781 96 HH21 ARG 11 HH11 ARG 11 -8.929 9.086 8.094 97 HH22 ARG 11 HH12 ARG 11 -8.538 8.312 9.593 98 H ILE 12 HN ILE 12 -3.645 16.426 8.057 99 HA ILE 12 HA ILE 12 -5.776 17.516 9.624 100 HB ILE 12 HB ILE 12 -2.994 18.566 9.042 101 HG12 ILE 12 HG12 ILE 12 -4.076 17.214 11.526 102 HG13 ILE 12 HG11 ILE 12 -3.295 16.327 10.217 103 HG21 ILE 12 HG21 ILE 12 -4.213 20.461 9.802 104 HG22 ILE 12 HG22 ILE 12 -3.417 19.831 11.243 105 HG23 ILE 12 HG23 ILE 12 -5.128 19.506 10.968 106 HD11 ILE 12 HD11 ILE 12 -1.958 18.699 11.530 107 HD12 ILE 12 HD12 ILE 12 -1.220 17.424 10.558 108 HD13 ILE 12 HD13 ILE 12 -1.801 17.069 12.184 109 H ARG 13 HN ARG 13 -3.963 18.997 6.914 110 HA ARG 13 HA ARG 13 -5.480 21.413 6.872 111 HB2 ARG 13 HB2 ARG 13 -4.599 21.636 4.526 112 HB3 ARG 13 HB1 ARG 13 -3.371 21.361 5.752 113 HG2 ARG 13 HG2 ARG 13 -2.649 19.559 4.586 114 HG3 ARG 13 HG1 ARG 13 -4.168 18.761 4.931 115 HD2 ARG 13 HD2 ARG 13 -4.166 18.673 2.615 116 HD3 ARG 13 HD1 ARG 13 -5.023 20.187 2.861 117 HE ARG 13 HE ARG 13 -3.051 21.394 2.202 118 HH11 ARG 13 HH21 ARG 13 -2.657 17.950 2.212 119 HH12 ARG 13 HH22 ARG 13 -1.220 17.994 1.252 120 HH21 ARG 13 HH11 ARG 13 -1.186 21.439 0.959 121 HH22 ARG 13 HH12 ARG 13 -0.388 19.959 0.547 122 H LEU 14 HN LEU 14 -5.980 18.277 5.303 123 HA LEU 14 HA LEU 14 -8.333 19.252 3.836 124 HB2 LEU 14 HB2 LEU 14 -6.932 16.603 4.148 125 HB3 LEU 14 HB1 LEU 14 -8.565 16.636 3.490 126 HG LEU 14 HG LEU 14 -6.477 18.489 2.357 127 HD11 LEU 14 HD11 LEU 14 -6.761 15.536 1.816 128 HD12 LEU 14 HD12 LEU 14 -5.293 16.447 2.169 129 HD13 LEU 14 HD13 LEU 14 -6.096 16.640 0.612 130 HD21 LEU 14 HD21 LEU 14 -8.915 17.080 1.240 131 HD22 LEU 14 HD22 LEU 14 -7.850 18.127 0.305 132 HD23 LEU 14 HD23 LEU 14 -8.786 18.791 1.642 133 H SER 15 HN SER 15 -7.687 18.442 6.989 134 HA SER 15 HA SER 15 -9.006 17.689 8.800 135 HB2 SER 15 HB2 SER 15 -9.881 19.966 8.350 136 HB3 SER 15 HB1 SER 15 -11.061 19.281 7.235 137 HG SER 15 HG SER 15 -11.071 17.996 9.622 138 H LEU 16 HN LEU 16 -8.861 15.446 7.777 139 HA LEU 16 HA LEU 16 -11.531 14.509 6.769 140 HB2 LEU 16 HB2 LEU 16 -8.842 13.114 6.662 141 HB3 LEU 16 HB1 LEU 16 -10.333 12.587 5.880 142 HG LEU 16 HG LEU 16 -8.904 15.197 5.312 143 HD11 LEU 16 HD11 LEU 16 -9.090 12.656 3.664 144 HD12 LEU 16 HD12 LEU 16 -7.650 13.217 4.513 145 HD13 LEU 16 HD13 LEU 16 -8.298 14.151 3.166 146 HD21 LEU 16 HD21 LEU 16 -10.519 15.008 3.248 147 HD22 LEU 16 HD22 LEU 16 -11.159 15.595 4.776 148 HD23 LEU 16 HD23 LEU 16 -11.441 13.923 4.288 149 H THR 17 HN THR 17 -12.750 13.310 8.093 150 HA THR 17 HA THR 17 -11.691 12.537 10.734 151 HB THR 17 HB THR 17 -14.027 11.949 11.232 152 HG1 THR 17 HG1 THR 17 -15.456 11.753 9.685 153 HG21 THR 17 HG21 THR 17 -13.166 14.345 11.277 154 HG22 THR 17 HG22 THR 17 -14.915 14.162 11.153 155 HG23 THR 17 HG23 THR 17 -13.966 14.564 9.721 156 H ALA 18 HN ALA 18 -11.968 10.366 11.569 157 HA ALA 18 HA ALA 18 -11.064 8.344 9.728 158 HB1 ALA 18 HB1 ALA 18 -10.404 8.205 12.053 159 HB2 ALA 18 HB2 ALA 18 -11.416 6.805 11.696 160 HB3 ALA 18 HB3 ALA 18 -12.088 8.179 12.574 161 H LYS 19 HN LYS 19 -14.177 9.057 11.262 162 HA LYS 19 HA LYS 19 -15.553 6.734 10.314 163 HB2 LYS 19 HB2 LYS 19 -16.543 9.488 11.089 164 HB3 LYS 19 HB1 LYS 19 -17.595 8.113 10.771 165 HG2 LYS 19 HG2 LYS 19 -16.451 6.832 12.551 166 HG3 LYS 19 HG1 LYS 19 -15.436 8.233 12.891 167 HD2 LYS 19 HD2 LYS 19 -18.467 8.209 13.058 168 HD3 LYS 19 HD1 LYS 19 -17.382 8.076 14.441 169 HE2 LYS 19 HE2 LYS 19 -17.745 10.367 14.464 170 HE3 LYS 19 HE1 LYS 19 -16.355 10.321 13.380 171 HZ1 LYS 19 HZ1 LYS 19 -17.601 10.918 11.643 172 HZ2 LYS 19 HZ2 LYS 19 -18.739 11.430 12.797 173 HZ3 LYS 19 HZ3 LYS 19 -18.887 9.900 12.072 174 H SER 20 HN SER 20 -15.242 10.022 8.982 175 HA SER 20 HA SER 20 -16.994 9.667 6.766 176 HB2 SER 20 HB2 SER 20 -15.779 11.586 5.774 177 HB3 SER 20 HB1 SER 20 -16.175 11.873 7.467 178 HG SER 20 HG SER 20 -13.816 11.986 6.363 179 H VAL 21 HN VAL 21 -13.476 9.147 7.031 180 HA VAL 21 HA VAL 21 -13.113 8.373 4.292 181 HB VAL 21 HB VAL 21 -11.530 7.666 6.775 182 HG11 VAL 21 HG11 VAL 21 -9.698 7.278 5.005 183 HG12 VAL 21 HG12 VAL 21 -11.014 7.195 3.833 184 HG13 VAL 21 HG13 VAL 21 -10.935 6.031 5.157 185 HG21 VAL 21 HG21 VAL 21 -10.119 9.499 6.179 186 HG22 VAL 21 HG22 VAL 21 -11.767 10.110 6.046 187 HG23 VAL 21 HG23 VAL 21 -10.875 9.658 4.593 188 H ALA 22 HN ALA 22 -13.690 6.484 7.253 189 HA ALA 22 HA ALA 22 -13.579 3.908 6.031 190 HB1 ALA 22 HB1 ALA 22 -15.021 4.928 8.487 191 HB2 ALA 22 HB2 ALA 22 -13.506 4.027 8.418 192 HB3 ALA 22 HB3 ALA 22 -15.025 3.227 8.018 193 H GLU 23 HN GLU 23 -16.230 6.226 6.406 194 HA GLU 23 HA GLU 23 -18.366 4.544 5.532 195 HB2 GLU 23 HB2 GLU 23 -18.785 6.725 6.551 196 HB3 GLU 23 HB1 GLU 23 -17.931 7.540 5.249 197 HG2 GLU 23 HG2 GLU 23 -20.206 7.833 4.699 198 HG3 GLU 23 HG1 GLU 23 -19.734 6.485 3.681 199 H GLU 24 HN GLU 24 -16.407 6.882 3.657 200 HA GLU 24 HA GLU 24 -17.489 6.053 1.119 201 HB2 GLU 24 HB2 GLU 24 -16.248 8.249 1.752 202 HB3 GLU 24 HB1 GLU 24 -14.774 7.326 1.472 203 HG2 GLU 24 HG2 GLU 24 -15.161 8.242 -0.647 204 HG3 GLU 24 HG1 GLU 24 -15.936 6.667 -0.801 205 H MET 25 HN MET 25 -14.475 5.251 2.843 206 HA MET 25 HA MET 25 -13.393 3.559 0.798 207 HB2 MET 25 HB2 MET 25 -12.983 3.707 3.790 208 HB3 MET 25 HB1 MET 25 -12.111 2.557 2.780 209 HG2 MET 25 HG2 MET 25 -12.142 5.533 2.243 210 HG3 MET 25 HG1 MET 25 -10.892 4.743 3.201 211 HE1 MET 25 HE1 MET 25 -9.723 2.835 2.632 212 HE2 MET 25 HE2 MET 25 -8.823 2.726 1.125 213 HE3 MET 25 HE3 MET 25 -10.313 1.809 1.319 214 H GLY 26 HN GLY 26 -15.520 2.934 3.568 215 HA2 GLY 26 HA2 GLY 26 -17.130 1.192 3.749 216 HA3 GLY 26 HA1 GLY 26 -16.492 0.483 2.264 217 H ILE 27 HN ILE 27 -14.476 1.386 5.007 218 HA ILE 27 HA ILE 27 -13.990 -1.525 5.565 219 HB ILE 27 HB ILE 27 -11.645 -0.953 6.042 220 HG12 ILE 27 HG12 ILE 27 -12.326 1.802 4.971 221 HG13 ILE 27 HG11 ILE 27 -12.082 1.447 6.678 222 HG21 ILE 27 HG21 ILE 27 -10.934 -0.752 3.778 223 HG22 ILE 27 HG22 ILE 27 -12.383 0.148 3.327 224 HG23 ILE 27 HG23 ILE 27 -12.496 -1.570 3.713 225 HD11 ILE 27 HD11 ILE 27 -10.007 2.303 5.688 226 HD12 ILE 27 HD12 ILE 27 -10.043 1.019 4.480 227 HD13 ILE 27 HD13 ILE 27 -9.807 0.622 6.182 228 H SER 28 HN SER 28 -12.993 -1.838 7.776 229 HA SER 28 HA SER 28 -14.705 -0.624 9.757 230 HB2 SER 28 HB2 SER 28 -12.360 -2.511 9.879 231 HB3 SER 28 HB1 SER 28 -13.114 -1.900 11.346 232 HG SER 28 HG SER 28 -15.040 -2.670 9.708 233 H ARG 29 HN ARG 29 -14.068 0.691 11.517 234 HA ARG 29 HA ARG 29 -12.300 2.857 10.885 235 HB2 ARG 29 HB2 ARG 29 -13.499 1.956 13.524 236 HB3 ARG 29 HB1 ARG 29 -12.675 3.496 13.279 237 HG2 ARG 29 HG2 ARG 29 -14.316 4.174 11.622 238 HG3 ARG 29 HG1 ARG 29 -15.090 2.591 11.688 239 HD2 ARG 29 HD2 ARG 29 -15.552 3.000 14.132 240 HD3 ARG 29 HD1 ARG 29 -14.937 4.640 13.916 241 HE ARG 29 HE ARG 29 -16.994 5.193 12.929 242 HH11 ARG 29 HH21 ARG 29 -16.379 1.806 12.744 243 HH12 ARG 29 HH22 ARG 29 -17.953 1.418 12.134 244 HH21 ARG 29 HH11 ARG 29 -19.059 4.702 12.150 245 HH22 ARG 29 HH12 ARG 29 -19.470 3.056 11.800 246 H GLN 30 HN GLN 30 -11.929 -0.076 12.838 247 HA GLN 30 HA GLN 30 -9.419 0.563 14.037 248 HB2 GLN 30 HB2 GLN 30 -10.568 -2.130 13.233 249 HB3 GLN 30 HB1 GLN 30 -9.169 -1.913 14.282 250 HG2 GLN 30 HG2 GLN 30 -11.922 -0.773 14.843 251 HG3 GLN 30 HG1 GLN 30 -11.296 -2.260 15.555 252 HE21 GLN 30 HE21 GLN 30 -11.753 0.882 16.361 253 HE22 GLN 30 HE22 GLN 30 -10.429 1.131 17.393 254 H GLN 31 HN GLN 31 -10.210 -1.004 10.936 255 HA GLN 31 HA GLN 31 -7.535 -1.616 10.132 256 HB2 GLN 31 HB2 GLN 31 -9.984 -0.868 8.511 257 HB3 GLN 31 HB1 GLN 31 -8.469 -1.371 7.779 258 HG2 GLN 31 HG2 GLN 31 -8.616 -3.532 8.905 259 HG3 GLN 31 HG1 GLN 31 -10.080 -3.027 9.728 260 HE21 GLN 31 HE21 GLN 31 -8.776 -4.103 6.646 261 HE22 GLN 31 HE22 GLN 31 -10.259 -4.190 5.825 262 H LEU 32 HN LEU 32 -9.564 1.237 9.618 263 HA LEU 32 HA LEU 32 -7.703 2.713 8.073 264 HB2 LEU 32 HB2 LEU 32 -10.119 3.274 8.332 265 HB3 LEU 32 HB1 LEU 32 -9.801 3.768 9.993 266 HG LEU 32 HG LEU 32 -8.195 5.468 9.161 267 HD11 LEU 32 HD11 LEU 32 -8.925 4.194 6.537 268 HD12 LEU 32 HD12 LEU 32 -7.360 4.777 7.102 269 HD13 LEU 32 HD13 LEU 32 -8.581 5.922 6.563 270 HD21 LEU 32 HD21 LEU 32 -10.593 6.020 9.545 271 HD22 LEU 32 HD22 LEU 32 -10.930 5.639 7.856 272 HD23 LEU 32 HD23 LEU 32 -9.878 6.995 8.262 273 H CYS 33 HN CYS 33 -8.243 2.587 11.578 274 HA CYS 33 HA CYS 33 -6.311 4.579 12.273 275 HB2 CYS 33 HB2 CYS 33 -8.154 3.206 13.673 276 HB3 CYS 33 HB1 CYS 33 -6.742 2.250 14.106 277 HG CYS 33 HG CYS 33 -7.373 4.957 15.219 278 H ASN 34 HN ASN 34 -6.052 1.165 11.507 279 HA ASN 34 HA ASN 34 -3.429 0.677 12.505 280 HB2 ASN 34 HB2 ASN 34 -5.084 -1.031 11.620 281 HB3 ASN 34 HB1 ASN 34 -4.643 -0.509 9.995 282 HD21 ASN 34 HD21 ASN 34 -4.132 -3.155 10.658 283 HD22 ASN 34 HD22 ASN 34 -2.463 -3.399 10.853 284 H ILE 35 HN ILE 35 -4.518 1.808 9.298 285 HA ILE 35 HA ILE 35 -1.877 2.032 8.186 286 HB ILE 35 HB ILE 35 -4.477 3.419 7.471 287 HG12 ILE 35 HG12 ILE 35 -3.022 1.167 6.059 288 HG13 ILE 35 HG11 ILE 35 -4.270 0.881 7.271 289 HG21 ILE 35 HG21 ILE 35 -2.758 4.797 6.562 290 HG22 ILE 35 HG22 ILE 35 -3.238 3.738 5.238 291 HG23 ILE 35 HG23 ILE 35 -1.760 3.406 6.139 292 HD11 ILE 35 HD11 ILE 35 -5.957 1.862 5.942 293 HD12 ILE 35 HD12 ILE 35 -4.996 0.951 4.780 294 HD13 ILE 35 HD13 ILE 35 -4.789 2.695 4.915 295 H GLU 36 HN GLU 36 -4.023 4.376 9.779 296 HA GLU 36 HA GLU 36 -2.272 6.634 9.480 297 HB2 GLU 36 HB2 GLU 36 -4.787 6.574 10.114 298 HB3 GLU 36 HB1 GLU 36 -4.226 6.289 11.759 299 HG2 GLU 36 HG2 GLU 36 -4.467 8.646 11.597 300 HG3 GLU 36 HG1 GLU 36 -2.735 8.355 11.441 301 H GLN 37 HN GLN 37 -2.610 4.166 11.998 302 HA GLN 37 HA GLN 37 -0.707 5.468 13.784 303 HB2 GLN 37 HB2 GLN 37 -1.959 2.712 13.749 304 HB3 GLN 37 HB1 GLN 37 -0.831 3.240 14.998 305 HG2 GLN 37 HG2 GLN 37 -3.361 4.750 14.299 306 HG3 GLN 37 HG1 GLN 37 -3.273 3.549 15.588 307 HE21 GLN 37 HE21 GLN 37 -1.847 4.038 17.447 308 HE22 GLN 37 HE22 GLN 37 -1.385 5.637 17.777 309 H SER 38 HN SER 38 -0.097 4.355 10.879 310 HA SER 38 HA SER 38 2.255 2.659 11.568 311 HB2 SER 38 HB2 SER 38 0.774 1.927 9.718 312 HB3 SER 38 HB1 SER 38 1.109 3.432 8.867 313 HG SER 38 HG SER 38 2.618 2.122 8.070 314 H GLU 39 HN GLU 39 4.162 3.678 11.869 315 HA GLU 39 HA GLU 39 4.532 6.440 10.854 316 HB2 GLU 39 HB2 GLU 39 5.105 5.780 13.213 317 HB3 GLU 39 HB1 GLU 39 6.389 4.765 12.568 318 HG2 GLU 39 HG2 GLU 39 7.784 6.557 12.357 319 HG3 GLU 39 HG1 GLU 39 6.600 7.418 11.381 320 H THR 40 HN THR 40 5.239 3.269 9.892 321 HA THR 40 HA THR 40 7.375 4.246 8.018 322 HB THR 40 HB THR 40 7.115 1.501 9.279 323 HG1 THR 40 HG1 THR 40 8.532 3.798 9.860 324 HG21 THR 40 HG21 THR 40 8.975 2.666 7.203 325 HG22 THR 40 HG22 THR 40 8.007 1.195 7.098 326 HG23 THR 40 HG23 THR 40 9.412 1.252 8.162 327 H ALA 41 HN ALA 41 6.925 3.935 5.899 328 HA ALA 41 HA ALA 41 4.349 2.810 5.171 329 HB1 ALA 41 HB1 ALA 41 6.569 3.640 3.295 330 HB2 ALA 41 HB2 ALA 41 5.477 4.797 4.055 331 HB3 ALA 41 HB3 ALA 41 4.840 3.576 2.953 332 HA PRO 42 HA PRO 42 5.843 -1.322 4.332 333 HB2 PRO 42 HB2 PRO 42 3.926 -2.211 2.600 334 HB3 PRO 42 HB1 PRO 42 3.616 -1.964 4.330 335 HG2 PRO 42 HG2 PRO 42 2.958 -0.182 2.022 336 HG3 PRO 42 HG1 PRO 42 1.982 -0.595 3.440 337 HD2 PRO 42 HD2 PRO 42 3.368 1.755 3.236 338 HD3 PRO 42 HD1 PRO 42 3.034 0.958 4.790 339 H VAL 43 HN VAL 43 6.773 -2.665 2.647 340 HA VAL 43 HA VAL 43 8.206 -1.203 0.624 341 HB VAL 43 HB VAL 43 9.005 -3.328 1.688 342 HG11 VAL 43 HG11 VAL 43 8.060 -5.430 1.089 343 HG12 VAL 43 HG12 VAL 43 7.079 -4.707 -0.186 344 HG13 VAL 43 HG13 VAL 43 6.688 -4.403 1.508 345 HG21 VAL 43 HG21 VAL 43 9.902 -2.485 -0.500 346 HG22 VAL 43 HG22 VAL 43 8.727 -3.508 -1.328 347 HG23 VAL 43 HG23 VAL 43 9.992 -4.239 -0.340 348 H VAL 44 HN VAL 44 5.304 -3.236 0.545 349 HA VAL 44 HA VAL 44 4.948 -3.653 -2.174 350 HB VAL 44 HB VAL 44 2.619 -3.873 -1.739 351 HG11 VAL 44 HG11 VAL 44 4.220 -5.293 -0.328 352 HG12 VAL 44 HG12 VAL 44 2.564 -5.164 0.266 353 HG13 VAL 44 HG13 VAL 44 3.843 -4.203 1.007 354 HG21 VAL 44 HG21 VAL 44 2.009 -1.707 -0.948 355 HG22 VAL 44 HG22 VAL 44 3.116 -1.817 0.416 356 HG23 VAL 44 HG23 VAL 44 1.654 -2.790 0.395 357 H VAL 45 HN VAL 45 4.245 -0.671 -0.373 358 HA VAL 45 HA VAL 45 3.194 0.796 -2.607 359 HB VAL 45 HB VAL 45 4.510 1.685 -0.024 360 HG11 VAL 45 HG11 VAL 45 3.366 3.907 -0.618 361 HG12 VAL 45 HG12 VAL 45 3.250 3.283 -2.263 362 HG13 VAL 45 HG13 VAL 45 4.832 3.515 -1.518 363 HG21 VAL 45 HG21 VAL 45 2.222 0.463 -0.098 364 HG22 VAL 45 HG22 VAL 45 1.611 1.937 -0.845 365 HG23 VAL 45 HG23 VAL 45 2.301 1.992 0.777 366 H LYS 46 HN LYS 46 6.447 0.511 -1.206 367 HA LYS 46 HA LYS 46 7.751 2.344 -2.965 368 HB2 LYS 46 HB2 LYS 46 8.794 -0.125 -1.544 369 HB3 LYS 46 HB1 LYS 46 9.822 1.032 -2.387 370 HG2 LYS 46 HG2 LYS 46 9.005 2.836 -0.918 371 HG3 LYS 46 HG1 LYS 46 7.977 1.680 -0.072 372 HD2 LYS 46 HD2 LYS 46 9.965 0.389 0.603 373 HD3 LYS 46 HD1 LYS 46 11.001 1.532 -0.253 374 HE2 LYS 46 HE2 LYS 46 10.201 3.352 1.204 375 HE3 LYS 46 HE1 LYS 46 9.169 2.210 2.063 376 HZ1 LYS 46 HZ1 LYS 46 11.023 1.063 2.890 377 HZ2 LYS 46 HZ2 LYS 46 11.399 2.707 3.096 378 HZ3 LYS 46 HZ3 LYS 46 12.093 1.826 1.820 379 H TYR 47 HN TYR 47 7.011 -1.103 -3.243 380 HA TYR 47 HA TYR 47 8.512 -1.636 -5.596 381 HB2 TYR 47 HB2 TYR 47 7.237 -3.279 -4.035 382 HB3 TYR 47 HB1 TYR 47 5.831 -2.918 -5.036 383 HD1 TYR 47 HD2 TYR 47 9.199 -4.391 -4.968 384 HD2 TYR 47 HD1 TYR 47 5.717 -3.650 -7.364 385 HE1 TYR 47 HE2 TYR 47 10.048 -5.960 -6.679 386 HE2 TYR 47 HE1 TYR 47 6.565 -5.228 -9.084 387 HH TYR 47 HH TYR 47 8.821 -6.124 -9.796 388 H ILE 48 HN ILE 48 5.190 -0.408 -5.188 389 HA ILE 48 HA ILE 48 4.498 -0.393 -7.964 390 HB ILE 48 HB ILE 48 3.587 1.376 -5.672 391 HG12 ILE 48 HG12 ILE 48 2.168 -0.899 -7.086 392 HG13 ILE 48 HG11 ILE 48 3.106 -1.113 -5.608 393 HG21 ILE 48 HG21 ILE 48 2.667 1.191 -8.543 394 HG22 ILE 48 HG22 ILE 48 3.101 2.634 -7.632 395 HG23 ILE 48 HG23 ILE 48 1.604 1.779 -7.267 396 HD11 ILE 48 HD11 ILE 48 0.747 0.767 -5.919 397 HD12 ILE 48 HD12 ILE 48 1.668 0.498 -4.438 398 HD13 ILE 48 HD13 ILE 48 0.697 -0.806 -5.123 399 H ALA 49 HN ALA 49 6.028 2.053 -5.886 400 HA ALA 49 HA ALA 49 6.228 4.098 -7.864 401 HB1 ALA 49 HB1 ALA 49 8.057 3.517 -5.516 402 HB2 ALA 49 HB2 ALA 49 6.614 4.530 -5.471 403 HB3 ALA 49 HB3 ALA 49 8.013 5.028 -6.423 404 H PHE 50 HN PHE 50 8.272 1.314 -7.119 405 HA PHE 50 HA PHE 50 10.541 2.028 -8.681 406 HB2 PHE 50 HB2 PHE 50 10.341 0.075 -7.072 407 HB3 PHE 50 HB1 PHE 50 9.438 -0.772 -8.327 408 HD1 PHE 50 HD2 PHE 50 12.687 0.874 -7.578 409 HD2 PHE 50 HD1 PHE 50 10.560 -1.836 -10.141 410 HE1 PHE 50 HE2 PHE 50 14.823 0.198 -8.634 411 HE2 PHE 50 HE1 PHE 50 12.700 -2.516 -11.196 412 HZ PHE 50 HZ PHE 50 14.832 -1.498 -10.442 413 H LEU 51 HN LEU 51 7.642 0.136 -9.577 414 HA LEU 51 HA LEU 51 8.386 -0.224 -12.328 415 HB2 LEU 51 HB2 LEU 51 5.692 -0.222 -10.944 416 HB3 LEU 51 HB1 LEU 51 5.911 -0.667 -12.631 417 HG LEU 51 HG LEU 51 7.365 -1.996 -10.328 418 HD11 LEU 51 HD11 LEU 51 4.807 -2.719 -11.769 419 HD12 LEU 51 HD12 LEU 51 5.061 -2.521 -10.036 420 HD13 LEU 51 HD13 LEU 51 5.755 -3.907 -10.875 421 HD21 LEU 51 HD21 LEU 51 7.282 -2.404 -13.312 422 HD22 LEU 51 HD22 LEU 51 7.476 -3.816 -12.277 423 HD23 LEU 51 HD23 LEU 51 8.651 -2.508 -12.207 424 H ARG 52 HN ARG 52 6.431 2.227 -10.674 425 HA ARG 52 HA ARG 52 5.664 3.674 -13.028 426 HB2 ARG 52 HB2 ARG 52 5.970 4.523 -10.138 427 HB3 ARG 52 HB1 ARG 52 5.316 5.576 -11.391 428 HG2 ARG 52 HG2 ARG 52 3.527 3.970 -11.852 429 HG3 ARG 52 HG1 ARG 52 4.200 2.851 -10.664 430 HD2 ARG 52 HD2 ARG 52 3.837 4.515 -8.882 431 HD3 ARG 52 HD1 ARG 52 3.178 5.643 -10.064 432 HE ARG 52 HE ARG 52 1.768 3.381 -8.901 433 HH11 ARG 52 HH21 ARG 52 2.176 5.399 -11.659 434 HH12 ARG 52 HH22 ARG 52 0.552 5.193 -12.220 435 HH21 ARG 52 HH11 ARG 52 -0.366 3.110 -9.607 436 HH22 ARG 52 HH12 ARG 52 -0.890 3.901 -11.056 437 H SER 53 HN SER 53 8.496 3.776 -10.936 438 HA SER 53 HA SER 53 9.658 6.193 -11.874 439 HB2 SER 53 HB2 SER 53 10.423 4.677 -9.934 440 HB3 SER 53 HB1 SER 53 11.257 3.728 -11.161 441 HG SER 53 HG SER 53 12.756 5.181 -10.741 442 H LYS 54 HN LYS 54 9.277 3.111 -13.397 443 HA LYS 54 HA LYS 54 11.307 3.719 -15.479 444 HB2 LYS 54 HB2 LYS 54 9.489 1.334 -15.016 445 HB3 LYS 54 HB1 LYS 54 10.602 1.473 -16.378 446 HG2 LYS 54 HG2 LYS 54 12.498 1.680 -14.827 447 HG3 LYS 54 HG1 LYS 54 11.397 1.585 -13.453 448 HD2 LYS 54 HD2 LYS 54 10.699 -0.669 -14.152 449 HD3 LYS 54 HD1 LYS 54 11.784 -0.580 -15.542 450 HE2 LYS 54 HE2 LYS 54 13.716 -0.349 -14.031 451 HE3 LYS 54 HE1 LYS 54 12.640 -0.418 -12.636 452 HZ1 LYS 54 HZ1 LYS 54 13.108 -2.554 -14.639 453 HZ2 LYS 54 HZ2 LYS 54 11.905 -2.624 -13.443 454 HZ3 LYS 54 HZ3 LYS 54 13.544 -2.577 -13.001 455 H GLY 55 HN GLY 55 8.228 4.647 -14.838 456 HA2 GLY 55 HA2 GLY 55 6.764 5.873 -16.240 457 HA3 GLY 55 HA1 GLY 55 7.748 5.406 -17.626 458 H VAL 56 HN VAL 56 6.613 2.944 -15.426 459 HA VAL 56 HA VAL 56 5.331 1.485 -17.532 460 HB VAL 56 HB VAL 56 5.133 1.240 -14.518 461 HG11 VAL 56 HG11 VAL 56 3.999 -0.477 -16.742 462 HG12 VAL 56 HG12 VAL 56 3.137 0.225 -15.373 463 HG13 VAL 56 HG13 VAL 56 4.276 -1.096 -15.114 464 HG21 VAL 56 HG21 VAL 56 6.741 -0.516 -14.787 465 HG22 VAL 56 HG22 VAL 56 7.335 0.826 -15.762 466 HG23 VAL 56 HG23 VAL 56 6.524 -0.534 -16.534 467 H ASP 57 HN ASP 57 3.274 1.528 -18.273 468 HA ASP 57 HA ASP 57 1.546 3.733 -17.566 469 HB2 ASP 57 HB2 ASP 57 1.131 1.279 -19.291 470 HB3 ASP 57 HB1 ASP 57 -0.057 2.574 -19.136 471 H LEU 58 HN LEU 58 1.892 2.544 -15.183 472 HA LEU 58 HA LEU 58 -0.159 0.540 -14.639 473 HB2 LEU 58 HB2 LEU 58 2.086 0.933 -13.373 474 HB3 LEU 58 HB1 LEU 58 1.231 2.243 -12.565 475 HG LEU 58 HG LEU 58 -0.606 0.402 -12.110 476 HD11 LEU 58 HD11 LEU 58 1.860 -1.338 -12.312 477 HD12 LEU 58 HD12 LEU 58 0.641 -1.274 -13.576 478 HD13 LEU 58 HD13 LEU 58 0.209 -1.846 -11.970 479 HD21 LEU 58 HD21 LEU 58 0.583 1.431 -10.290 480 HD22 LEU 58 HD22 LEU 58 2.071 0.585 -10.708 481 HD23 LEU 58 HD23 LEU 58 0.703 -0.311 -10.049 482 H ASN 59 HN ASN 59 -0.127 3.864 -15.088 483 HA ASN 59 HA ASN 59 -2.113 4.704 -13.200 484 HB2 ASN 59 HB2 ASN 59 -1.283 5.810 -15.891 485 HB3 ASN 59 HB1 ASN 59 -2.481 6.594 -14.858 486 HD21 ASN 59 HD21 ASN 59 0.326 7.513 -15.593 487 HD22 ASN 59 HD22 ASN 59 1.104 7.752 -14.103 488 H ALA 60 HN ALA 60 -2.297 3.139 -16.343 489 HA ALA 60 HA ALA 60 -5.077 3.590 -16.848 490 HB1 ALA 60 HB1 ALA 60 -3.394 2.641 -18.483 491 HB2 ALA 60 HB2 ALA 60 -4.922 1.760 -18.413 492 HB3 ALA 60 HB3 ALA 60 -3.496 1.118 -17.598 493 H LEU 61 HN LEU 61 -3.398 0.917 -15.177 494 HA LEU 61 HA LEU 61 -5.786 -0.540 -14.522 495 HB2 LEU 61 HB2 LEU 61 -3.193 -0.480 -12.950 496 HB3 LEU 61 HB1 LEU 61 -4.397 -1.767 -12.959 497 HG LEU 61 HG LEU 61 -2.758 -0.882 -15.353 498 HD11 LEU 61 HD11 LEU 61 -1.528 -2.111 -13.523 499 HD12 LEU 61 HD12 LEU 61 -1.544 -2.950 -15.072 500 HD13 LEU 61 HD13 LEU 61 -2.625 -3.465 -13.776 501 HD21 LEU 61 HD21 LEU 61 -4.954 -2.920 -14.958 502 HD22 LEU 61 HD22 LEU 61 -3.734 -3.154 -16.210 503 HD23 LEU 61 HD23 LEU 61 -4.771 -1.730 -16.246 504 H PHE 62 HN PHE 62 -3.966 1.997 -12.853 505 HA PHE 62 HA PHE 62 -5.578 1.940 -10.456 506 HB2 PHE 62 HB2 PHE 62 -3.450 3.640 -11.627 507 HB3 PHE 62 HB1 PHE 62 -4.546 4.503 -10.551 508 HD1 PHE 62 HD2 PHE 62 -2.240 1.594 -10.798 509 HD2 PHE 62 HD1 PHE 62 -4.486 4.170 -8.208 510 HE1 PHE 62 HE2 PHE 62 -1.071 0.637 -8.831 511 HE2 PHE 62 HE1 PHE 62 -3.319 3.222 -6.238 512 HZ PHE 62 HZ PHE 62 -1.610 1.451 -6.551 513 H ASP 63 HN ASP 63 -5.601 4.115 -13.305 514 HA ASP 63 HA ASP 63 -7.745 5.758 -12.547 515 HB2 ASP 63 HB2 ASP 63 -6.961 4.686 -15.273 516 HB3 ASP 63 HB1 ASP 63 -8.234 5.888 -15.050 517 H ARG 64 HN ARG 64 -7.763 2.538 -13.991 518 HA ARG 64 HA ARG 64 -10.585 2.246 -14.300 519 HB2 ARG 64 HB2 ARG 64 -9.080 0.656 -15.325 520 HB3 ARG 64 HB1 ARG 64 -8.371 0.244 -13.772 521 HG2 ARG 64 HG2 ARG 64 -10.560 -0.710 -13.042 522 HG3 ARG 64 HG1 ARG 64 -11.227 -0.329 -14.630 523 HD2 ARG 64 HD2 ARG 64 -8.712 -1.962 -14.458 524 HD3 ARG 64 HD1 ARG 64 -10.255 -2.741 -14.120 525 HE ARG 64 HE ARG 64 -10.918 -1.685 -16.440 526 HH11 ARG 64 HH21 ARG 64 -7.794 -2.917 -15.543 527 HH12 ARG 64 HH22 ARG 64 -7.406 -3.416 -17.152 528 HH21 ARG 64 HH11 ARG 64 -10.407 -2.358 -18.509 529 HH22 ARG 64 HH12 ARG 64 -8.877 -3.106 -18.822 530 H ILE 65 HN ILE 65 -8.430 1.294 -11.601 531 HA ILE 65 HA ILE 65 -10.562 0.347 -9.927 532 HB ILE 65 HB ILE 65 -7.766 1.297 -9.241 533 HG12 ILE 65 HG12 ILE 65 -8.893 -1.514 -9.399 534 HG13 ILE 65 HG11 ILE 65 -8.080 -0.730 -10.754 535 HG21 ILE 65 HG21 ILE 65 -8.221 -0.132 -7.152 536 HG22 ILE 65 HG22 ILE 65 -9.927 -0.028 -7.586 537 HG23 ILE 65 HG23 ILE 65 -9.021 1.438 -7.215 538 HD11 ILE 65 HD11 ILE 65 -6.024 -0.559 -9.552 539 HD12 ILE 65 HD12 ILE 65 -6.606 -2.200 -9.271 540 HD13 ILE 65 HD13 ILE 65 -6.803 -0.969 -8.023 541 H ILE 66 HN ILE 66 -8.844 3.464 -10.031 542 HA ILE 66 HA ILE 66 -10.021 4.663 -7.774 543 HB ILE 66 HB ILE 66 -9.157 5.940 -10.380 544 HG12 ILE 66 HG12 ILE 66 -7.724 5.759 -7.712 545 HG13 ILE 66 HG11 ILE 66 -7.464 4.611 -9.025 546 HG21 ILE 66 HG21 ILE 66 -9.967 7.102 -7.706 547 HG22 ILE 66 HG22 ILE 66 -10.504 7.582 -9.315 548 HG23 ILE 66 HG23 ILE 66 -8.871 7.967 -8.783 549 HD11 ILE 66 HD11 ILE 66 -5.754 6.280 -9.234 550 HD12 ILE 66 HD12 ILE 66 -6.921 7.588 -9.045 551 HD13 ILE 66 HD13 ILE 66 -6.926 6.607 -10.511 552 H VAL 67 HN VAL 67 -10.940 6.062 -10.861 553 HA VAL 67 HA VAL 67 -13.610 6.567 -9.855 554 HB VAL 67 HB VAL 67 -12.422 8.168 -11.305 555 HG11 VAL 67 HG11 VAL 67 -12.922 6.261 -13.594 556 HG12 VAL 67 HG12 VAL 67 -11.394 6.272 -12.715 557 HG13 VAL 67 HG13 VAL 67 -11.923 7.713 -13.578 558 HG21 VAL 67 HG21 VAL 67 -14.313 8.773 -12.635 559 HG22 VAL 67 HG22 VAL 67 -14.966 7.962 -11.213 560 HG23 VAL 67 HG23 VAL 67 -14.858 7.101 -12.748 561 H ASN 68 HN ASN 68 -15.362 5.342 -10.092 562 HA ASN 68 HA ASN 68 -15.534 3.390 -12.342 563 HB2 ASN 68 HB2 ASN 68 -16.047 2.797 -9.405 564 HB3 ASN 68 HB1 ASN 68 -16.510 1.728 -10.729 565 HD21 ASN 68 HD21 ASN 68 -14.694 0.728 -8.855 566 HD22 ASN 68 HD22 ASN 68 -13.146 0.628 -9.544 567 H LYS 69 HN LYS 69 -17.309 4.611 -9.497 568 HA LYS 69 HA LYS 69 -19.519 5.494 -11.274 569 HB2 LYS 69 HB2 LYS 69 -19.830 3.609 -8.914 570 HB3 LYS 69 HB1 LYS 69 -21.176 4.454 -9.680 571 HG2 LYS 69 HG2 LYS 69 -20.604 3.392 -11.841 572 HG3 LYS 69 HG1 LYS 69 -19.278 2.532 -11.061 573 HD2 LYS 69 HD2 LYS 69 -20.909 1.452 -9.527 574 HD3 LYS 69 HD1 LYS 69 -22.221 2.258 -10.390 575 HE2 LYS 69 HE2 LYS 69 -20.211 0.401 -11.696 576 HE3 LYS 69 HE1 LYS 69 -21.824 -0.089 -11.176 577 HZ1 LYS 69 HZ1 LYS 69 -22.128 0.460 -13.384 578 HZ2 LYS 69 HZ2 LYS 69 -21.057 1.779 -13.324 579 HZ3 LYS 69 HZ3 LYS 69 -22.589 1.890 -12.598 580 H LEU 70 HN LEU 70 -18.204 7.468 -10.510 581 HA LEU 70 HA LEU 70 -18.364 8.280 -7.756 582 HB2 LEU 70 HB2 LEU 70 -16.838 9.154 -9.725 583 HB3 LEU 70 HB1 LEU 70 -18.178 10.257 -10.026 584 HG LEU 70 HG LEU 70 -17.995 10.678 -7.398 585 HD11 LEU 70 HD11 LEU 70 -15.832 10.400 -6.471 586 HD12 LEU 70 HD12 LEU 70 -15.109 10.067 -8.043 587 HD13 LEU 70 HD13 LEU 70 -16.161 8.872 -7.287 588 HD21 LEU 70 HD21 LEU 70 -17.688 12.450 -9.023 589 HD22 LEU 70 HD22 LEU 70 -16.109 11.817 -9.484 590 HD23 LEU 70 HD23 LEU 70 -16.344 12.519 -7.883 591 H GLU 71 HN GLU 71 -19.376 11.038 -8.461 592 HA GLU 71 HA GLU 71 -22.239 10.431 -8.008 593 HB2 GLU 71 HB2 GLU 71 -20.394 12.495 -7.189 594 HB3 GLU 71 HB1 GLU 71 -21.734 13.266 -8.026 595 HG2 GLU 71 HG2 GLU 71 -22.319 13.128 -5.693 596 HG3 GLU 71 HG1 GLU 71 -23.305 11.942 -6.549 597 H HIS 72 HN HIS 72 -23.007 9.848 -10.025 598 HA HIS 72 HA HIS 72 -23.686 12.019 -11.815 599 HB2 HIS 72 HB2 HIS 72 -22.555 11.180 -13.816 600 HB3 HIS 72 HB1 HIS 72 -21.357 11.534 -12.572 601 HD2 HIS 72 HD2 HIS 72 -19.861 9.320 -11.729 602 HE1 HIS 72 HE1 HIS 72 -21.948 6.403 -13.959 603 HE2 HIS 72 HE2 HIS 72 -19.924 6.825 -12.489 604 H HIS 73 HN HIS 73 -25.222 11.251 -13.476 605 HA HIS 73 HA HIS 73 -25.987 8.523 -13.738 606 HB2 HIS 73 HB2 HIS 73 -28.297 8.977 -12.442 607 HB3 HIS 73 HB1 HIS 73 -26.888 8.324 -11.610 608 HD2 HIS 73 HD2 HIS 73 -25.670 10.080 -9.757 609 HE1 HIS 73 HE1 HIS 73 -28.430 13.240 -10.235 610 HE2 HIS 73 HE2 HIS 73 -26.495 12.377 -8.840 611 H HIS 74 HN HIS 74 -27.183 8.399 -15.562 612 HA HIS 74 HA HIS 74 -28.131 10.901 -16.796 613 HB2 HIS 74 HB2 HIS 74 -28.106 8.036 -17.802 614 HB3 HIS 74 HB1 HIS 74 -28.587 9.436 -18.759 615 HD2 HIS 74 HD2 HIS 74 -25.332 9.305 -16.458 616 HE1 HIS 74 HE1 HIS 74 -24.166 9.945 -20.463 617 HE2 HIS 74 HE2 HIS 74 -23.343 9.781 -18.070 618 H HIS 75 HN HIS 75 -30.365 10.956 -17.741 619 HA HIS 75 HA HIS 75 -32.308 10.104 -15.731 620 HB2 HIS 75 HB2 HIS 75 -32.595 12.279 -16.785 621 HB3 HIS 75 HB1 HIS 75 -32.626 11.538 -18.384 622 HD2 HIS 75 HD2 HIS 75 -35.346 12.294 -18.830 623 HE1 HIS 75 HE1 HIS 75 -36.952 9.911 -15.734 624 HE2 HIS 75 HE2 HIS 75 -37.521 11.345 -17.748 625 H HIS 76 HN HIS 76 -33.537 8.275 -15.821 626 HA HIS 76 HA HIS 76 -33.776 6.821 -18.436 627 HB2 HIS 76 HB2 HIS 76 -33.365 5.529 -15.722 628 HB3 HIS 76 HB1 HIS 76 -33.443 4.712 -17.284 629 HD2 HIS 76 HD2 HIS 76 -31.164 5.318 -19.025 630 HE1 HIS 76 HE1 HIS 76 -28.755 6.748 -15.864 631 HE2 HIS 76 HE2 HIS 76 -28.762 6.024 -18.295 632 H HIS 77 HN HIS 77 -35.828 6.204 -18.908 633 HA HIS 77 HA HIS 77 -38.179 6.290 -18.733 634 HB2 HIS 77 HB2 HIS 77 -37.436 4.074 -17.717 635 HB3 HIS 77 HB1 HIS 77 -37.644 4.830 -16.137 636 HD2 HIS 77 HD2 HIS 77 -40.243 4.631 -15.203 637 HE1 HIS 77 HE1 HIS 77 -42.159 3.954 -18.905 638 HE2 HIS 77 HE2 HIS 77 -42.507 4.130 -16.398 639 H1 MET 1 HT1 MET 1 -9.851 -10.942 -13.597 640 H2 MET 1 HT2 MET 1 -9.483 -11.768 -15.037 641 H3 MET 1 HT3 MET 1 -10.157 -10.209 -15.096 642 HA MET 1 HA MET 1 -7.415 -11.024 -14.719 643 HB2 MET 1 HB2 MET 1 -8.869 -8.522 -15.624 644 HB3 MET 1 HB1 MET 1 -7.110 -8.666 -15.588 645 HG2 MET 1 HG2 MET 1 -7.193 -10.562 -17.124 646 HG3 MET 1 HG1 MET 1 -8.954 -10.539 -17.098 647 HE1 MET 1 HE1 MET 1 -6.023 -7.658 -19.035 648 HE2 MET 1 HE2 MET 1 -5.759 -8.830 -17.748 649 HE3 MET 1 HE3 MET 1 -6.458 -7.258 -17.367 650 H GLU 2 HN GLU 2 -6.842 -11.130 -12.565 651 HA GLU 2 HA GLU 2 -7.829 -9.236 -10.599 652 HB2 GLU 2 HB2 GLU 2 -5.667 -11.346 -10.514 653 HB3 GLU 2 HB1 GLU 2 -6.073 -10.335 -9.127 654 HG2 GLU 2 HG2 GLU 2 -8.431 -11.115 -9.284 655 HG3 GLU 2 HG1 GLU 2 -7.966 -12.177 -10.613 656 H LEU 3 HN LEU 3 -6.333 -7.911 -9.258 657 HA LEU 3 HA LEU 3 -4.879 -6.035 -10.844 658 HB2 LEU 3 HB2 LEU 3 -5.826 -5.439 -8.661 659 HB3 LEU 3 HB1 LEU 3 -4.769 -6.598 -7.861 660 HG LEU 3 HG LEU 3 -2.793 -5.313 -8.552 661 HD11 LEU 3 HD11 LEU 3 -3.309 -4.328 -10.619 662 HD12 LEU 3 HD12 LEU 3 -3.362 -2.946 -9.526 663 HD13 LEU 3 HD13 LEU 3 -4.862 -3.712 -10.052 664 HD21 LEU 3 HD21 LEU 3 -4.844 -3.415 -7.390 665 HD22 LEU 3 HD22 LEU 3 -3.107 -3.441 -7.087 666 HD23 LEU 3 HD23 LEU 3 -4.131 -4.736 -6.466 667 H SER 4 HN SER 4 -3.787 -8.707 -8.762 668 HA SER 4 HA SER 4 -0.982 -8.260 -9.173 669 HB2 SER 4 HB2 SER 4 -2.158 -9.725 -7.391 670 HB3 SER 4 HB1 SER 4 -2.204 -10.970 -8.636 671 HG SER 4 HG SER 4 0.224 -9.898 -8.619 672 H ASN 5 HN ASN 5 -3.443 -9.860 -11.065 673 HA ASN 5 HA ASN 5 -1.762 -11.502 -12.690 674 HB2 ASN 5 HB2 ASN 5 -4.298 -11.542 -12.579 675 HB3 ASN 5 HB1 ASN 5 -4.289 -10.098 -13.591 676 HD21 ASN 5 HD21 ASN 5 -4.415 -10.534 -15.787 677 HD22 ASN 5 HD22 ASN 5 -3.894 -11.968 -16.531 678 H GLU 6 HN GLU 6 -2.911 -8.152 -13.164 679 HA GLU 6 HA GLU 6 -1.473 -7.789 -15.648 680 HB2 GLU 6 HB2 GLU 6 -2.786 -5.921 -13.670 681 HB3 GLU 6 HB1 GLU 6 -1.846 -5.285 -15.021 682 HG2 GLU 6 HG2 GLU 6 -4.211 -5.440 -15.649 683 HG3 GLU 6 HG1 GLU 6 -3.258 -6.582 -16.597 684 H LEU 7 HN LEU 7 -0.733 -7.185 -12.247 685 HA LEU 7 HA LEU 7 1.672 -5.698 -12.648 686 HB2 LEU 7 HB2 LEU 7 0.462 -5.962 -10.454 687 HB3 LEU 7 HB1 LEU 7 1.049 -7.620 -10.383 688 HG LEU 7 HG LEU 7 3.397 -6.731 -10.537 689 HD11 LEU 7 HD11 LEU 7 1.879 -4.128 -10.521 690 HD12 LEU 7 HD12 LEU 7 3.304 -4.585 -11.454 691 HD13 LEU 7 HD13 LEU 7 3.460 -4.203 -9.744 692 HD21 LEU 7 HD21 LEU 7 3.416 -5.883 -8.175 693 HD22 LEU 7 HD22 LEU 7 2.466 -7.356 -8.375 694 HD23 LEU 7 HD23 LEU 7 1.655 -5.797 -8.234 695 H LYS 8 HN LYS 8 1.051 -9.183 -12.365 696 HA LYS 8 HA LYS 8 3.773 -10.045 -12.460 697 HB2 LYS 8 HB2 LYS 8 1.820 -11.496 -11.855 698 HB3 LYS 8 HB1 LYS 8 1.337 -11.488 -13.551 699 HG2 LYS 8 HG2 LYS 8 3.480 -12.505 -14.187 700 HG3 LYS 8 HG1 LYS 8 4.003 -12.482 -12.501 701 HD2 LYS 8 HD2 LYS 8 2.106 -13.950 -11.896 702 HD3 LYS 8 HD1 LYS 8 1.605 -13.989 -13.587 703 HE2 LYS 8 HE2 LYS 8 3.760 -15.002 -14.214 704 HE3 LYS 8 HE1 LYS 8 4.278 -14.951 -12.529 705 HZ1 LYS 8 HZ1 LYS 8 1.881 -16.402 -13.510 706 HZ2 LYS 8 HZ2 LYS 8 2.505 -16.423 -11.930 707 HZ3 LYS 8 HZ3 LYS 8 3.383 -17.127 -13.202 708 H VAL 9 HN VAL 9 1.403 -9.396 -15.024 709 HA VAL 9 HA VAL 9 2.978 -10.287 -17.227 710 HB VAL 9 HB VAL 9 0.878 -8.107 -17.055 711 HG11 VAL 9 HG11 VAL 9 0.718 -8.588 -19.571 712 HG12 VAL 9 HG12 VAL 9 2.293 -9.365 -19.416 713 HG13 VAL 9 HG13 VAL 9 2.114 -7.653 -19.041 714 HG21 VAL 9 HG21 VAL 9 0.644 -10.902 -18.188 715 HG22 VAL 9 HG22 VAL 9 -0.657 -9.786 -17.775 716 HG23 VAL 9 HG23 VAL 9 0.293 -10.542 -16.497 717 H GLU 10 HN GLU 10 2.729 -7.079 -15.682 718 HA GLU 10 HA GLU 10 4.419 -5.649 -17.425 719 HB2 GLU 10 HB2 GLU 10 4.040 -5.395 -14.434 720 HB3 GLU 10 HB1 GLU 10 4.927 -4.223 -15.410 721 HG2 GLU 10 HG2 GLU 10 2.937 -3.809 -16.772 722 HG3 GLU 10 HG1 GLU 10 2.042 -5.032 -15.867 723 H ARG 11 HN ARG 11 5.284 -7.590 -14.559 724 HA ARG 11 HA ARG 11 8.079 -7.071 -14.608 725 HB2 ARG 11 HB2 ARG 11 6.909 -8.241 -12.756 726 HB3 ARG 11 HB1 ARG 11 6.663 -9.635 -13.807 727 HG2 ARG 11 HG2 ARG 11 9.118 -9.877 -14.050 728 HG3 ARG 11 HG1 ARG 11 9.352 -8.498 -12.977 729 HD2 ARG 11 HD2 ARG 11 7.696 -10.840 -12.060 730 HD3 ARG 11 HD1 ARG 11 9.450 -10.926 -11.988 731 HE ARG 11 HE ARG 11 9.431 -8.954 -10.499 732 HH11 ARG 11 HH21 ARG 11 6.356 -10.471 -11.092 733 HH12 ARG 11 HH22 ARG 11 5.662 -9.879 -9.624 734 HH21 ARG 11 HH11 ARG 11 8.514 -8.211 -8.610 735 HH22 ARG 11 HH12 ARG 11 6.871 -8.608 -8.228 736 H ILE 12 HN ILE 12 6.179 -9.608 -16.241 737 HA ILE 12 HA ILE 12 8.431 -10.850 -17.529 738 HB ILE 12 HB ILE 12 5.484 -10.813 -18.243 739 HG12 ILE 12 HG12 ILE 12 7.178 -13.022 -17.046 740 HG13 ILE 12 HG11 ILE 12 6.281 -11.869 -16.058 741 HG21 ILE 12 HG21 ILE 12 6.621 -11.355 -20.269 742 HG22 ILE 12 HG22 ILE 12 6.178 -12.909 -19.564 743 HG23 ILE 12 HG23 ILE 12 7.833 -12.315 -19.422 744 HD11 ILE 12 HD11 ILE 12 4.974 -13.514 -18.235 745 HD12 ILE 12 HD12 ILE 12 4.184 -12.590 -16.956 746 HD13 ILE 12 HD13 ILE 12 5.076 -14.059 -16.561 747 H ARG 13 HN ARG 13 6.145 -8.326 -18.552 748 HA ARG 13 HA ARG 13 7.034 -8.008 -21.225 749 HB2 ARG 13 HB2 ARG 13 5.819 -6.138 -19.201 750 HB3 ARG 13 HB1 ARG 13 6.272 -5.539 -20.791 751 HG2 ARG 13 HG2 ARG 13 4.679 -8.078 -20.763 752 HG3 ARG 13 HG1 ARG 13 3.826 -6.631 -20.235 753 HD2 ARG 13 HD2 ARG 13 3.905 -7.303 -22.813 754 HD3 ARG 13 HD1 ARG 13 3.959 -5.613 -22.308 755 HE ARG 13 HE ARG 13 6.540 -7.032 -22.665 756 HH11 ARG 13 HH21 ARG 13 4.189 -4.750 -23.796 757 HH12 ARG 13 HH22 ARG 13 5.300 -3.940 -24.845 758 HH21 ARG 13 HH11 ARG 13 7.984 -5.967 -24.037 759 HH22 ARG 13 HH12 ARG 13 7.435 -4.624 -24.985 760 H LEU 14 HN LEU 14 8.208 -6.474 -18.231 761 HA LEU 14 HA LEU 14 10.466 -5.258 -19.738 762 HB2 LEU 14 HB2 LEU 14 9.698 -5.056 -16.805 763 HB3 LEU 14 HB1 LEU 14 10.975 -4.135 -17.601 764 HG LEU 14 HG LEU 14 8.034 -4.040 -18.344 765 HD11 LEU 14 HD11 LEU 14 8.356 -1.626 -17.469 766 HD12 LEU 14 HD12 LEU 14 9.799 -2.247 -16.672 767 HD13 LEU 14 HD13 LEU 14 8.214 -2.913 -16.272 768 HD21 LEU 14 HD21 LEU 14 10.527 -2.775 -19.475 769 HD22 LEU 14 HD22 LEU 14 9.005 -1.886 -19.546 770 HD23 LEU 14 HD23 LEU 14 9.139 -3.460 -20.324 771 H SER 15 HN SER 15 9.728 -8.151 -18.318 772 HA SER 15 HA SER 15 10.990 -9.881 -17.327 773 HB2 SER 15 HB2 SER 15 11.755 -10.315 -19.493 774 HB3 SER 15 HB1 SER 15 12.607 -8.778 -19.607 775 HG SER 15 HG SER 15 13.564 -10.207 -17.550 776 H LEU 16 HN LEU 16 11.185 -8.696 -15.264 777 HA LEU 16 HA LEU 16 13.912 -7.541 -14.778 778 HB2 LEU 16 HB2 LEU 16 11.412 -7.351 -13.072 779 HB3 LEU 16 HB1 LEU 16 12.932 -6.496 -12.807 780 HG LEU 16 HG LEU 16 11.172 -6.202 -15.257 781 HD11 LEU 16 HD11 LEU 16 10.852 -3.868 -14.284 782 HD12 LEU 16 HD12 LEU 16 11.558 -4.489 -12.792 783 HD13 LEU 16 HD13 LEU 16 10.053 -5.172 -13.406 784 HD21 LEU 16 HD21 LEU 16 13.340 -5.675 -15.998 785 HD22 LEU 16 HD22 LEU 16 13.828 -5.032 -14.429 786 HD23 LEU 16 HD23 LEU 16 12.746 -4.105 -15.467 787 H THR 17 HN THR 17 15.300 -8.597 -13.475 788 HA THR 17 HA THR 17 14.532 -11.247 -12.456 789 HB THR 17 HB THR 17 16.918 -11.455 -11.891 790 HG1 THR 17 HG1 THR 17 17.217 -9.261 -11.301 791 HG21 THR 17 HG21 THR 17 16.098 -11.831 -14.234 792 HG22 THR 17 HG22 THR 17 17.793 -11.348 -14.145 793 HG23 THR 17 HG23 THR 17 16.562 -10.172 -14.610 794 H ALA 18 HN ALA 18 14.969 -11.878 -10.228 795 HA ALA 18 HA ALA 18 13.877 -10.008 -8.324 796 HB1 ALA 18 HB1 ALA 18 13.484 -12.333 -7.922 797 HB2 ALA 18 HB2 ALA 18 14.591 -11.806 -6.654 798 HB3 ALA 18 HB3 ALA 18 15.203 -12.712 -8.037 799 H LYS 19 HN LYS 19 17.151 -11.141 -9.060 800 HA LYS 19 HA LYS 19 18.421 -9.859 -6.831 801 HB2 LYS 19 HB2 LYS 19 20.492 -10.271 -8.065 802 HB3 LYS 19 HB1 LYS 19 19.454 -11.688 -8.148 803 HG2 LYS 19 HG2 LYS 19 18.624 -10.858 -10.376 804 HG3 LYS 19 HG1 LYS 19 19.841 -9.587 -10.291 805 HD2 LYS 19 HD2 LYS 19 21.626 -11.248 -10.171 806 HD3 LYS 19 HD1 LYS 19 20.436 -12.551 -10.195 807 HE2 LYS 19 HE2 LYS 19 21.497 -12.020 -12.445 808 HE3 LYS 19 HE1 LYS 19 19.734 -11.986 -12.418 809 HZ1 LYS 19 HZ1 LYS 19 19.690 -9.796 -12.789 810 HZ2 LYS 19 HZ2 LYS 19 21.287 -9.995 -13.335 811 HZ3 LYS 19 HZ3 LYS 19 20.987 -9.475 -11.745 812 H SER 20 HN SER 20 17.871 -8.838 -10.197 813 HA SER 20 HA SER 20 19.279 -6.355 -9.984 814 HB2 SER 20 HB2 SER 20 16.968 -7.156 -11.774 815 HB3 SER 20 HB1 SER 20 17.951 -5.711 -11.994 816 HG SER 20 HG SER 20 19.360 -8.058 -11.666 817 H VAL 21 HN VAL 21 15.824 -7.142 -9.607 818 HA VAL 21 HA VAL 21 15.052 -4.443 -8.944 819 HB VAL 21 HB VAL 21 13.691 -7.087 -8.355 820 HG11 VAL 21 HG11 VAL 21 12.817 -4.209 -8.066 821 HG12 VAL 21 HG12 VAL 21 12.691 -5.518 -6.890 822 HG13 VAL 21 HG13 VAL 21 11.643 -5.502 -8.307 823 HG21 VAL 21 HG21 VAL 21 13.057 -5.067 -10.517 824 HG22 VAL 21 HG22 VAL 21 12.475 -6.726 -10.378 825 HG23 VAL 21 HG23 VAL 21 14.164 -6.414 -10.785 826 H ALA 22 HN ALA 22 15.784 -7.316 -6.981 827 HA ALA 22 HA ALA 22 15.210 -6.145 -4.444 828 HB1 ALA 22 HB1 ALA 22 16.641 -7.963 -3.533 829 HB2 ALA 22 HB2 ALA 22 17.184 -8.330 -5.170 830 HB3 ALA 22 HB3 ALA 22 15.492 -8.562 -4.730 831 H GLU 23 HN GLU 23 18.225 -6.249 -6.337 832 HA GLU 23 HA GLU 23 19.864 -5.038 -4.312 833 HB2 GLU 23 HB2 GLU 23 20.827 -6.233 -6.221 834 HB3 GLU 23 HB1 GLU 23 20.147 -5.046 -7.331 835 HG2 GLU 23 HG2 GLU 23 21.727 -3.706 -5.257 836 HG3 GLU 23 HG1 GLU 23 22.697 -4.930 -6.070 837 H GLU 24 HN GLU 24 18.118 -3.645 -7.099 838 HA GLU 24 HA GLU 24 18.896 -0.926 -6.496 839 HB2 GLU 24 HB2 GLU 24 16.607 -2.054 -8.132 840 HB3 GLU 24 HB1 GLU 24 17.017 -0.341 -8.059 841 HG2 GLU 24 HG2 GLU 24 18.957 -2.507 -8.911 842 HG3 GLU 24 HG1 GLU 24 18.017 -1.529 -10.038 843 H MET 25 HN MET 25 16.084 -2.926 -5.687 844 HA MET 25 HA MET 25 14.550 -0.864 -4.411 845 HB2 MET 25 HB2 MET 25 14.602 -3.876 -4.227 846 HB3 MET 25 HB1 MET 25 13.574 -2.940 -3.145 847 HG2 MET 25 HG2 MET 25 13.525 -2.627 -6.154 848 HG3 MET 25 HG1 MET 25 12.445 -3.711 -5.280 849 HE1 MET 25 HE1 MET 25 11.627 -1.812 -2.491 850 HE2 MET 25 HE2 MET 25 11.112 -3.195 -3.455 851 HE3 MET 25 HE3 MET 25 10.083 -1.769 -3.352 852 H GLY 26 HN GLY 26 17.052 -3.081 -3.230 853 HA2 GLY 26 HA2 GLY 26 18.548 -2.520 -1.414 854 HA3 GLY 26 HA1 GLY 26 17.364 -1.352 -0.824 855 H ILE 27 HN ILE 27 16.289 -4.513 -1.797 856 HA ILE 27 HA ILE 27 15.984 -5.312 1.081 857 HB ILE 27 HB ILE 27 13.834 -6.355 0.461 858 HG12 ILE 27 HG12 ILE 27 14.245 -4.981 -2.212 859 HG13 ILE 27 HG11 ILE 27 14.378 -6.718 -1.955 860 HG21 ILE 27 HG21 ILE 27 13.932 -4.019 1.315 861 HG22 ILE 27 HG22 ILE 27 12.561 -4.284 0.237 862 HG23 ILE 27 HG23 ILE 27 13.992 -3.439 -0.350 863 HD11 ILE 27 HD11 ILE 27 11.913 -5.005 -1.568 864 HD12 ILE 27 HD12 ILE 27 12.023 -6.693 -1.068 865 HD13 ILE 27 HD13 ILE 27 12.152 -6.269 -2.775 866 H SER 28 HN SER 28 15.705 -7.693 1.339 867 HA SER 28 HA SER 28 17.791 -9.089 -0.116 868 HB2 SER 28 HB2 SER 28 17.001 -11.042 1.299 869 HB3 SER 28 HB1 SER 28 17.500 -9.616 2.205 870 HG SER 28 HG SER 28 14.878 -10.495 1.581 871 H ARG 29 HN ARG 29 17.442 -11.164 -1.200 872 HA ARG 29 HA ARG 29 15.447 -11.023 -3.255 873 HB2 ARG 29 HB2 ARG 29 17.230 -13.287 -2.306 874 HB3 ARG 29 HB1 ARG 29 16.214 -13.384 -3.744 875 HG2 ARG 29 HG2 ARG 29 17.382 -11.523 -4.769 876 HG3 ARG 29 HG1 ARG 29 18.306 -11.238 -3.294 877 HD2 ARG 29 HD2 ARG 29 19.697 -12.468 -4.867 878 HD3 ARG 29 HD1 ARG 29 19.286 -13.525 -3.517 879 HE ARG 29 HE ARG 29 17.394 -13.799 -5.690 880 HH11 ARG 29 HH21 ARG 29 20.519 -14.637 -4.503 881 HH12 ARG 29 HH22 ARG 29 20.627 -16.097 -5.427 882 HH21 ARG 29 HH11 ARG 29 17.519 -15.697 -6.909 883 HH22 ARG 29 HH12 ARG 29 18.929 -16.698 -6.791 884 H GLN 30 HN GLN 30 15.666 -12.828 -0.214 885 HA GLN 30 HA GLN 30 13.324 -14.439 -0.598 886 HB2 GLN 30 HB2 GLN 30 15.071 -14.842 1.158 887 HB3 GLN 30 HB1 GLN 30 14.470 -13.426 2.022 888 HG2 GLN 30 HG2 GLN 30 12.231 -14.477 2.169 889 HG3 GLN 30 HG1 GLN 30 12.859 -15.905 1.345 890 HE21 GLN 30 HE21 GLN 30 12.904 -17.458 3.015 891 HE22 GLN 30 HE22 GLN 30 13.715 -17.245 4.490 892 H GLN 31 HN GLN 31 13.827 -11.210 0.772 893 HA GLN 31 HA GLN 31 11.185 -10.818 1.780 894 HB2 GLN 31 HB2 GLN 31 13.096 -9.317 2.295 895 HB3 GLN 31 HB1 GLN 31 13.091 -8.759 0.622 896 HG2 GLN 31 HG2 GLN 31 10.855 -7.850 0.874 897 HG3 GLN 31 HG1 GLN 31 10.720 -8.531 2.496 898 HE21 GLN 31 HE21 GLN 31 10.448 -5.726 2.114 899 HE22 GLN 31 HE22 GLN 31 11.790 -4.946 2.802 900 H LEU 32 HN LEU 32 12.611 -10.221 -1.419 901 HA LEU 32 HA LEU 32 10.305 -9.001 -2.583 902 HB2 LEU 32 HB2 LEU 32 12.480 -8.876 -3.676 903 HB3 LEU 32 HB1 LEU 32 12.532 -10.628 -3.843 904 HG LEU 32 HG LEU 32 10.620 -10.582 -5.366 905 HD11 LEU 32 HD11 LEU 32 9.245 -8.816 -4.623 906 HD12 LEU 32 HD12 LEU 32 9.894 -8.208 -6.141 907 HD13 LEU 32 HD13 LEU 32 10.577 -7.658 -4.609 908 HD21 LEU 32 HD21 LEU 32 13.013 -10.079 -6.149 909 HD22 LEU 32 HD22 LEU 32 12.511 -8.390 -6.238 910 HD23 LEU 32 HD23 LEU 32 11.712 -9.602 -7.241 911 H CYS 33 HN CYS 33 11.362 -12.390 -2.422 912 HA CYS 33 HA CYS 33 9.277 -13.497 -4.011 913 HB2 CYS 33 HB2 CYS 33 10.805 -14.690 -1.680 914 HB3 CYS 33 HB1 CYS 33 9.772 -15.615 -2.770 915 HG CYS 33 HG CYS 33 11.404 -14.776 -4.749 916 H ASN 34 HN ASN 34 9.392 -12.593 -0.606 917 HA ASN 34 HA ASN 34 6.950 -13.842 0.200 918 HB2 ASN 34 HB2 ASN 34 8.725 -12.786 1.697 919 HB3 ASN 34 HB1 ASN 34 8.027 -11.224 1.271 920 HD21 ASN 34 HD21 ASN 34 8.016 -13.005 3.858 921 HD22 ASN 34 HD22 ASN 34 6.385 -12.978 4.327 922 H ILE 35 HN ILE 35 7.646 -10.669 -1.232 923 HA ILE 35 HA ILE 35 4.991 -9.609 -1.049 924 HB ILE 35 HB ILE 35 7.223 -9.069 -3.033 925 HG12 ILE 35 HG12 ILE 35 6.243 -7.422 -0.683 926 HG13 ILE 35 HG11 ILE 35 7.588 -8.558 -0.576 927 HG21 ILE 35 HG21 ILE 35 5.913 -6.898 -3.383 928 HG22 ILE 35 HG22 ILE 35 4.555 -7.704 -2.593 929 HG23 ILE 35 HG23 ILE 35 5.207 -8.347 -4.100 930 HD11 ILE 35 HD11 ILE 35 8.683 -7.314 -2.484 931 HD12 ILE 35 HD12 ILE 35 8.522 -6.372 -1.001 932 HD13 ILE 35 HD13 ILE 35 7.408 -6.103 -2.342 933 H GLU 36 HN GLU 36 6.634 -11.460 -3.613 934 HA GLU 36 HA GLU 36 4.375 -11.434 -5.408 935 HB2 GLU 36 HB2 GLU 36 6.467 -13.605 -5.413 936 HB3 GLU 36 HB1 GLU 36 5.640 -12.857 -6.778 937 HG2 GLU 36 HG2 GLU 36 6.905 -10.665 -5.683 938 HG3 GLU 36 HG1 GLU 36 8.053 -11.943 -5.293 939 H GLN 37 HN GLN 37 5.115 -13.247 -2.584 940 HA GLN 37 HA GLN 37 3.371 -15.513 -3.285 941 HB2 GLN 37 HB2 GLN 37 5.485 -15.541 -1.757 942 HB3 GLN 37 HB1 GLN 37 4.421 -14.880 -0.519 943 HG2 GLN 37 HG2 GLN 37 4.404 -17.271 -0.256 944 HG3 GLN 37 HG1 GLN 37 2.856 -16.825 -0.974 945 HE21 GLN 37 HE21 GLN 37 2.428 -18.649 -2.292 946 HE22 GLN 37 HE22 GLN 37 3.472 -19.195 -3.514 947 H SER 38 HN SER 38 2.851 -12.377 -2.367 948 HA SER 38 HA SER 38 0.776 -12.703 -0.384 949 HB2 SER 38 HB2 SER 38 1.131 -10.377 -2.288 950 HB3 SER 38 HB1 SER 38 0.344 -10.359 -0.712 951 HG SER 38 HG SER 38 2.434 -9.579 -0.494 952 H GLU 39 HN GLU 39 -1.447 -12.731 -0.662 953 HA GLU 39 HA GLU 39 -2.438 -13.730 -3.237 954 HB2 GLU 39 HB2 GLU 39 -3.306 -14.682 -1.146 955 HB3 GLU 39 HB1 GLU 39 -3.836 -13.092 -0.611 956 HG2 GLU 39 HG2 GLU 39 -5.789 -14.183 -1.444 957 HG3 GLU 39 HG1 GLU 39 -5.335 -13.044 -2.699 958 H THR 40 HN THR 40 -4.032 -11.313 -1.189 959 HA THR 40 HA THR 40 -4.552 -9.670 -3.621 960 HB THR 40 HB THR 40 -6.471 -10.393 -2.189 961 HG1 THR 40 HG1 THR 40 -6.268 -8.308 -3.389 962 HG21 THR 40 HG21 THR 40 -6.742 -9.536 0.026 963 HG22 THR 40 HG22 THR 40 -5.347 -8.471 -0.143 964 HG23 THR 40 HG23 THR 40 -5.115 -10.216 -0.041 965 H ALA 41 HN ALA 41 -4.647 -7.221 -3.102 966 HA ALA 41 HA ALA 41 -2.028 -6.492 -1.968 967 HB1 ALA 41 HB1 ALA 41 -2.714 -4.189 -2.861 968 HB2 ALA 41 HB2 ALA 41 -4.124 -4.995 -3.547 969 HB3 ALA 41 HB3 ALA 41 -2.503 -5.462 -4.062 970 HA PRO 42 HA PRO 42 -3.753 -5.039 1.881 971 HB2 PRO 42 HB2 PRO 42 -1.930 -3.075 2.542 972 HB3 PRO 42 HB1 PRO 42 -1.607 -4.813 2.694 973 HG2 PRO 42 HG2 PRO 42 -0.764 -2.918 0.549 974 HG3 PRO 42 HG1 PRO 42 0.126 -4.257 1.293 975 HD2 PRO 42 HD2 PRO 42 -1.079 -4.450 -1.163 976 HD3 PRO 42 HD1 PRO 42 -0.841 -5.842 -0.083 977 H VAL 43 HN VAL 43 -4.918 -3.290 2.829 978 HA VAL 43 HA VAL 43 -6.267 -1.537 0.999 979 HB VAL 43 HB VAL 43 -7.082 -0.446 3.187 980 HG11 VAL 43 HG11 VAL 43 -7.395 -3.399 2.611 981 HG12 VAL 43 HG12 VAL 43 -8.462 -2.082 2.123 982 HG13 VAL 43 HG13 VAL 43 -8.358 -2.548 3.819 983 HG21 VAL 43 HG21 VAL 43 -5.807 -2.862 4.481 984 HG22 VAL 43 HG22 VAL 43 -6.473 -1.420 5.249 985 HG23 VAL 43 HG23 VAL 43 -4.938 -1.330 4.386 986 H VAL 44 HN VAL 44 -3.447 -1.125 3.053 987 HA VAL 44 HA VAL 44 -3.209 1.621 3.343 988 HB VAL 44 HB VAL 44 -1.535 -0.142 4.036 989 HG11 VAL 44 HG11 VAL 44 -0.225 0.203 1.347 990 HG12 VAL 44 HG12 VAL 44 -1.509 -0.990 1.525 991 HG13 VAL 44 HG13 VAL 44 -0.058 -1.110 2.510 992 HG21 VAL 44 HG21 VAL 44 -0.437 2.260 2.534 993 HG22 VAL 44 HG22 VAL 44 0.423 1.346 3.774 994 HG23 VAL 44 HG23 VAL 44 -1.020 2.266 4.200 995 H VAL 45 HN VAL 45 -2.733 -0.271 0.399 996 HA VAL 45 HA VAL 45 -1.719 1.875 -1.226 997 HB VAL 45 HB VAL 45 -3.201 -0.669 -1.954 998 HG11 VAL 45 HG11 VAL 45 -3.501 0.823 -3.801 999 HG12 VAL 45 HG12 VAL 45 -2.137 -0.207 -4.236 1000 HG13 VAL 45 HG13 VAL 45 -1.854 1.438 -3.661 1001 HG21 VAL 45 HG21 VAL 45 -0.273 0.125 -1.942 1002 HG22 VAL 45 HG22 VAL 45 -0.890 -1.376 -2.635 1003 HG23 VAL 45 HG23 VAL 45 -1.045 -1.074 -0.904 1004 H LYS 46 HN LYS 46 -4.987 0.603 -0.637 1005 HA LYS 46 HA LYS 46 -6.366 2.302 -2.464 1006 HB2 LYS 46 HB2 LYS 46 -7.279 1.069 0.150 1007 HB3 LYS 46 HB1 LYS 46 -8.356 1.867 -0.997 1008 HG2 LYS 46 HG2 LYS 46 -7.695 0.264 -2.746 1009 HG3 LYS 46 HG1 LYS 46 -6.610 -0.535 -1.606 1010 HD2 LYS 46 HD2 LYS 46 -8.558 -1.017 -0.131 1011 HD3 LYS 46 HD1 LYS 46 -9.621 -0.292 -1.338 1012 HE2 LYS 46 HE2 LYS 46 -7.766 -2.614 -1.916 1013 HE3 LYS 46 HE1 LYS 46 -9.465 -2.803 -1.484 1014 HZ1 LYS 46 HZ1 LYS 46 -8.318 -2.097 -3.984 1015 HZ2 LYS 46 HZ2 LYS 46 -9.416 -0.905 -3.472 1016 HZ3 LYS 46 HZ3 LYS 46 -9.920 -2.520 -3.621 1017 H TYR 47 HN TYR 47 -5.463 2.763 0.942 1018 HA TYR 47 HA TYR 47 -6.831 5.225 1.360 1019 HB2 TYR 47 HB2 TYR 47 -5.794 3.876 3.173 1020 HB3 TYR 47 HB1 TYR 47 -4.199 4.331 2.573 1021 HD1 TYR 47 HD1 TYR 47 -7.248 5.506 4.257 1022 HD2 TYR 47 HD2 TYR 47 -3.365 6.621 2.803 1023 HE1 TYR 47 HE1 TYR 47 -7.374 7.623 5.544 1024 HE2 TYR 47 HE2 TYR 47 -3.490 8.734 4.095 1025 HH TYR 47 HH TYR 47 -6.440 9.688 5.771 1026 H ILE 48 HN ILE 48 -3.527 4.581 0.188 1027 HA ILE 48 HA ILE 48 -2.740 7.319 -0.051 1028 HB ILE 48 HB ILE 48 -1.870 4.859 -1.604 1029 HG12 ILE 48 HG12 ILE 48 -0.456 6.387 0.603 1030 HG13 ILE 48 HG11 ILE 48 -1.455 4.962 0.899 1031 HG21 ILE 48 HG21 ILE 48 -1.303 6.736 -2.964 1032 HG22 ILE 48 HG22 ILE 48 0.169 6.326 -2.085 1033 HG23 ILE 48 HG23 ILE 48 -0.816 7.694 -1.565 1034 HD11 ILE 48 HD11 ILE 48 -0.006 3.715 -0.761 1035 HD12 ILE 48 HD12 ILE 48 0.824 4.204 0.717 1036 HD13 ILE 48 HD13 ILE 48 1.066 5.116 -0.773 1037 H ALA 49 HN ALA 49 -4.303 5.087 -2.331 1038 HA ALA 49 HA ALA 49 -4.385 6.846 -4.570 1039 HB1 ALA 49 HB1 ALA 49 -4.926 4.580 -5.003 1040 HB2 ALA 49 HB2 ALA 49 -6.467 5.422 -5.169 1041 HB3 ALA 49 HB3 ALA 49 -6.106 4.525 -3.694 1042 H PHE 50 HN PHE 50 -6.510 6.509 -1.763 1043 HA PHE 50 HA PHE 50 -8.649 8.134 -2.707 1044 HB2 PHE 50 HB2 PHE 50 -8.445 6.675 -0.539 1045 HB3 PHE 50 HB1 PHE 50 -7.786 8.139 0.188 1046 HD1 PHE 50 HD1 PHE 50 -10.720 6.777 -1.656 1047 HD2 PHE 50 HD2 PHE 50 -9.218 9.927 0.845 1048 HE1 PHE 50 HE1 PHE 50 -13.020 7.654 -1.383 1049 HE2 PHE 50 HE2 PHE 50 -11.521 10.806 1.121 1050 HZ PHE 50 HZ PHE 50 -13.422 9.670 0.006 1051 H LEU 51 HN LEU 51 -5.710 9.028 -0.861 1052 HA LEU 51 HA LEU 51 -6.288 11.836 -0.720 1053 HB2 LEU 51 HB2 LEU 51 -3.663 10.318 -0.738 1054 HB3 LEU 51 HB1 LEU 51 -3.771 12.050 -0.444 1055 HG LEU 51 HG LEU 51 -5.224 9.946 1.188 1056 HD11 LEU 51 HD11 LEU 51 -2.966 9.583 1.724 1057 HD12 LEU 51 HD12 LEU 51 -3.461 10.759 2.941 1058 HD13 LEU 51 HD13 LEU 51 -2.541 11.284 1.531 1059 HD21 LEU 51 HD21 LEU 51 -5.046 12.952 1.277 1060 HD22 LEU 51 HD22 LEU 51 -5.176 12.075 2.801 1061 HD23 LEU 51 HD23 LEU 51 -6.431 11.903 1.580 1062 H ARG 52 HN ARG 52 -4.551 9.878 -3.087 1063 HA ARG 52 HA ARG 52 -3.686 12.001 -4.786 1064 HB2 ARG 52 HB2 ARG 52 -2.730 9.800 -4.977 1065 HB3 ARG 52 HB1 ARG 52 -4.298 9.093 -5.326 1066 HG2 ARG 52 HG2 ARG 52 -3.398 11.291 -7.157 1067 HG3 ARG 52 HG1 ARG 52 -2.504 9.781 -7.269 1068 HD2 ARG 52 HD2 ARG 52 -5.434 10.272 -7.811 1069 HD3 ARG 52 HD1 ARG 52 -4.229 9.526 -8.856 1070 HE ARG 52 HE ARG 52 -5.847 8.141 -6.924 1071 HH11 ARG 52 HH21 ARG 52 -2.693 8.332 -8.302 1072 HH12 ARG 52 HH22 ARG 52 -2.293 6.686 -7.943 1073 HH21 ARG 52 HH11 ARG 52 -5.344 5.999 -6.450 1074 HH22 ARG 52 HH12 ARG 52 -3.795 5.364 -6.895 1075 H SER 53 HN SER 53 -6.676 10.080 -4.737 1076 HA SER 53 HA SER 53 -7.807 11.049 -7.154 1077 HB2 SER 53 HB2 SER 53 -9.066 10.110 -4.573 1078 HB3 SER 53 HB1 SER 53 -10.029 10.572 -5.974 1079 HG SER 53 HG SER 53 -8.674 8.294 -5.498 1080 H LYS 54 HN LYS 54 -7.340 12.609 -4.093 1081 HA LYS 54 HA LYS 54 -9.294 14.745 -4.662 1082 HB2 LYS 54 HB2 LYS 54 -7.244 14.366 -2.461 1083 HB3 LYS 54 HB1 LYS 54 -8.332 15.751 -2.559 1084 HG2 LYS 54 HG2 LYS 54 -10.272 14.236 -2.474 1085 HG3 LYS 54 HG1 LYS 54 -9.188 12.846 -2.395 1086 HD2 LYS 54 HD2 LYS 54 -8.234 13.711 -0.284 1087 HD3 LYS 54 HD1 LYS 54 -9.337 15.086 -0.357 1088 HE2 LYS 54 HE2 LYS 54 -11.265 13.560 -0.269 1089 HE3 LYS 54 HE1 LYS 54 -10.174 12.176 -0.219 1090 HZ1 LYS 54 HZ1 LYS 54 -9.806 14.293 1.764 1091 HZ2 LYS 54 HZ2 LYS 54 -9.548 12.620 1.904 1092 HZ3 LYS 54 HZ3 LYS 54 -11.126 13.247 1.964 1093 H GLY 55 HN GLY 55 -6.392 13.986 -5.930 1094 HA2 GLY 55 HA2 GLY 55 -5.022 15.293 -7.354 1095 HA3 GLY 55 HA1 GLY 55 -5.908 16.728 -6.833 1096 H VAL 56 HN VAL 56 -4.717 14.661 -4.343 1097 HA VAL 56 HA VAL 56 -3.171 16.716 -3.122 1098 HB VAL 56 HB VAL 56 -3.204 13.711 -2.771 1099 HG11 VAL 56 HG11 VAL 56 -2.024 14.304 -0.551 1100 HG12 VAL 56 HG12 VAL 56 -1.591 15.826 -1.330 1101 HG13 VAL 56 HG13 VAL 56 -1.030 14.298 -2.009 1102 HG21 VAL 56 HG21 VAL 56 -4.616 14.155 -0.931 1103 HG22 VAL 56 HG22 VAL 56 -5.166 15.309 -2.140 1104 HG23 VAL 56 HG23 VAL 56 -4.115 15.842 -0.831 1105 H ASP 57 HN ASP 57 -0.940 17.079 -3.046 1106 HA ASP 57 HA ASP 57 0.538 16.548 -5.459 1107 HB2 ASP 57 HB2 ASP 57 1.258 17.718 -2.771 1108 HB3 ASP 57 HB1 ASP 57 2.478 17.482 -4.021 1109 H LEU 58 HN LEU 58 -0.329 14.103 -4.238 1110 HA LEU 58 HA LEU 58 1.715 12.778 -2.762 1111 HB2 LEU 58 HB2 LEU 58 -0.630 11.961 -3.027 1112 HB3 LEU 58 HB1 LEU 58 -0.281 11.611 -4.716 1113 HG LEU 58 HG LEU 58 1.711 10.180 -3.725 1114 HD11 LEU 58 HD11 LEU 58 1.497 10.899 -1.409 1115 HD12 LEU 58 HD12 LEU 58 1.107 9.185 -1.524 1116 HD13 LEU 58 HD13 LEU 58 -0.185 10.374 -1.371 1117 HD21 LEU 58 HD21 LEU 58 0.313 8.228 -3.725 1118 HD22 LEU 58 HD22 LEU 58 -0.350 9.329 -4.924 1119 HD23 LEU 58 HD23 LEU 58 -1.121 9.178 -3.345 1120 H ASN 59 HN ASN 59 1.122 13.120 -6.237 1121 HA ASN 59 HA ASN 59 3.100 11.306 -7.168 1122 HB2 ASN 59 HB2 ASN 59 2.376 13.941 -8.483 1123 HB3 ASN 59 HB1 ASN 59 2.916 12.457 -9.268 1124 HD21 ASN 59 HD21 ASN 59 0.154 14.100 -7.876 1125 HD22 ASN 59 HD22 ASN 59 -0.999 12.916 -8.268 1126 H ALA 60 HN ALA 60 3.303 14.755 -6.335 1127 HA ALA 60 HA ALA 60 6.061 15.067 -7.083 1128 HB1 ALA 60 HB1 ALA 60 4.329 16.624 -5.150 1129 HB2 ALA 60 HB2 ALA 60 4.646 17.019 -6.839 1130 HB3 ALA 60 HB3 ALA 60 5.944 17.120 -5.649 1131 H LEU 61 HN LEU 61 4.476 14.192 -4.017 1132 HA LEU 61 HA LEU 61 6.780 14.348 -2.356 1133 HB2 LEU 61 HB2 LEU 61 4.349 12.551 -2.192 1134 HB3 LEU 61 HB1 LEU 61 5.577 12.631 -0.933 1135 HG LEU 61 HG LEU 61 3.976 15.008 -1.937 1136 HD11 LEU 61 HD11 LEU 61 2.438 13.627 -0.762 1137 HD12 LEU 61 HD12 LEU 61 2.975 14.805 0.429 1138 HD13 LEU 61 HD13 LEU 61 3.639 13.172 0.442 1139 HD21 LEU 61 HD21 LEU 61 6.194 14.655 0.062 1140 HD22 LEU 61 HD22 LEU 61 4.920 15.810 0.448 1141 HD23 LEU 61 HD23 LEU 61 5.866 16.005 -1.023 1142 H PHE 62 HN PHE 62 5.547 11.644 -4.320 1143 HA PHE 62 HA PHE 62 7.562 9.775 -3.484 1144 HB2 PHE 62 HB2 PHE 62 5.638 9.966 -5.777 1145 HB3 PHE 62 HB1 PHE 62 6.964 8.815 -5.922 1146 HD1 PHE 62 HD2 PHE 62 7.386 7.276 -3.859 1147 HD2 PHE 62 HD1 PHE 62 3.693 9.325 -4.615 1148 HE1 PHE 62 HE2 PHE 62 6.201 5.679 -2.382 1149 HE2 PHE 62 HE1 PHE 62 2.506 7.732 -3.132 1150 HZ PHE 62 HZ PHE 62 3.760 5.904 -2.018 1151 H ASP 63 HN ASP 63 7.421 12.044 -6.223 1152 HA ASP 63 HA ASP 63 9.765 11.316 -7.561 1153 HB2 ASP 63 HB2 ASP 63 8.219 13.123 -8.297 1154 HB3 ASP 63 HB1 ASP 63 8.839 14.151 -7.004 1155 H ARG 64 HN ARG 64 9.430 13.260 -4.616 1156 HA ARG 64 HA ARG 64 12.216 13.960 -4.397 1157 HB2 ARG 64 HB2 ARG 64 10.588 13.550 -1.900 1158 HB3 ARG 64 HB1 ARG 64 11.643 14.892 -2.341 1159 HG2 ARG 64 HG2 ARG 64 9.912 15.502 -4.110 1160 HG3 ARG 64 HG1 ARG 64 8.868 14.320 -3.338 1161 HD2 ARG 64 HD2 ARG 64 8.198 16.249 -2.239 1162 HD3 ARG 64 HD1 ARG 64 9.448 15.661 -1.141 1163 HE ARG 64 HE ARG 64 10.632 17.373 -3.108 1164 HH11 ARG 64 HH21 ARG 64 8.569 17.323 -0.353 1165 HH12 ARG 64 HH22 ARG 64 8.941 18.946 0.124 1166 HH21 ARG 64 HH11 ARG 64 11.123 19.496 -2.516 1167 HH22 ARG 64 HH12 ARG 64 10.389 20.179 -1.103 1168 H ILE 65 HN ILE 65 10.289 11.355 -2.917 1169 HA ILE 65 HA ILE 65 12.473 10.093 -1.548 1170 HB ILE 65 HB ILE 65 9.793 9.013 -2.462 1171 HG12 ILE 65 HG12 ILE 65 10.745 9.809 0.304 1172 HG13 ILE 65 HG11 ILE 65 9.883 10.912 -0.771 1173 HG21 ILE 65 HG21 ILE 65 11.187 7.099 -2.145 1174 HG22 ILE 65 HG22 ILE 65 10.297 7.282 -0.633 1175 HG23 ILE 65 HG23 ILE 65 11.975 7.815 -0.739 1176 HD11 ILE 65 HD11 ILE 65 8.373 9.732 0.844 1177 HD12 ILE 65 HD12 ILE 65 8.827 8.204 0.089 1178 HD13 ILE 65 HD13 ILE 65 7.962 9.425 -0.844 1179 H ILE 66 HN ILE 66 10.973 9.448 -4.712 1180 HA ILE 66 HA ILE 66 12.300 7.087 -5.378 1181 HB ILE 66 HB ILE 66 11.477 9.404 -7.140 1182 HG12 ILE 66 HG12 ILE 66 10.244 6.663 -6.752 1183 HG13 ILE 66 HG11 ILE 66 9.758 8.070 -5.814 1184 HG21 ILE 66 HG21 ILE 66 12.567 6.669 -7.841 1185 HG22 ILE 66 HG22 ILE 66 13.121 8.240 -8.420 1186 HG23 ILE 66 HG23 ILE 66 11.569 7.598 -8.958 1187 HD11 ILE 66 HD11 ILE 66 9.790 8.186 -8.826 1188 HD12 ILE 66 HD12 ILE 66 8.869 9.171 -7.689 1189 HD13 ILE 66 HD13 ILE 66 8.414 7.493 -7.968 1190 H VAL 67 HN VAL 67 14.282 6.532 -6.007 1191 HA VAL 67 HA VAL 67 16.563 8.001 -5.374 1192 HB VAL 67 HB VAL 67 16.717 5.635 -5.727 1193 HG11 VAL 67 HG11 VAL 67 14.908 5.734 -7.624 1194 HG12 VAL 67 HG12 VAL 67 16.151 4.493 -7.697 1195 HG13 VAL 67 HG13 VAL 67 16.289 5.934 -8.697 1196 HG21 VAL 67 HG21 VAL 67 18.233 6.801 -8.064 1197 HG22 VAL 67 HG22 VAL 67 18.729 5.509 -6.972 1198 HG23 VAL 67 HG23 VAL 67 18.679 7.176 -6.399 1199 H ASN 68 HN ASN 68 16.747 10.075 -6.140 1200 HA ASN 68 HA ASN 68 16.279 10.753 -8.941 1201 HB2 ASN 68 HB2 ASN 68 17.237 12.205 -6.493 1202 HB3 ASN 68 HB1 ASN 68 17.612 12.912 -8.063 1203 HD21 ASN 68 HD21 ASN 68 15.319 13.028 -5.659 1204 HD22 ASN 68 HD22 ASN 68 13.976 13.502 -6.580 1205 H LYS 69 HN LYS 69 19.144 10.322 -6.875 1206 HA LYS 69 HA LYS 69 20.973 10.758 -9.111 1207 HB2 LYS 69 HB2 LYS 69 21.419 9.797 -6.274 1208 HB3 LYS 69 HB1 LYS 69 22.716 10.098 -7.431 1209 HG2 LYS 69 HG2 LYS 69 21.978 12.441 -7.658 1210 HG3 LYS 69 HG1 LYS 69 20.673 12.142 -6.509 1211 HD2 LYS 69 HD2 LYS 69 22.366 11.525 -4.789 1212 HD3 LYS 69 HD1 LYS 69 23.643 11.927 -5.937 1213 HE2 LYS 69 HE2 LYS 69 21.519 13.843 -4.930 1214 HE3 LYS 69 HE1 LYS 69 23.205 13.819 -4.416 1215 HZ1 LYS 69 HZ1 LYS 69 23.546 15.227 -6.088 1216 HZ2 LYS 69 HZ2 LYS 69 22.037 14.905 -6.799 1217 HZ3 LYS 69 HZ3 LYS 69 23.365 13.895 -7.123 1218 H LEU 70 HN LEU 70 22.089 9.214 -10.257 1219 HA LEU 70 HA LEU 70 22.279 6.455 -9.530 1220 HB2 LEU 70 HB2 LEU 70 19.902 6.357 -10.077 1221 HB3 LEU 70 HB1 LEU 70 20.190 7.174 -11.612 1222 HG LEU 70 HG LEU 70 21.520 5.285 -12.414 1223 HD11 LEU 70 HD11 LEU 70 22.618 4.388 -10.539 1224 HD12 LEU 70 HD12 LEU 70 21.404 3.159 -10.882 1225 HD13 LEU 70 HD13 LEU 70 21.139 4.320 -9.582 1226 HD21 LEU 70 HD21 LEU 70 18.900 4.392 -11.173 1227 HD22 LEU 70 HD22 LEU 70 19.736 3.577 -12.496 1228 HD23 LEU 70 HD23 LEU 70 19.078 5.196 -12.732 1229 H GLU 71 HN GLU 71 21.661 7.970 -12.691 1230 HA GLU 71 HA GLU 71 24.300 6.992 -13.630 1231 HB2 GLU 71 HB2 GLU 71 22.060 6.740 -14.907 1232 HB3 GLU 71 HB1 GLU 71 22.235 8.452 -15.284 1233 HG2 GLU 71 HG2 GLU 71 23.269 7.409 -17.120 1234 HG3 GLU 71 HG1 GLU 71 24.636 7.799 -16.080 1235 H HIS 72 HN HIS 72 23.781 9.406 -15.654 1236 HA HIS 72 HA HIS 72 24.963 11.414 -15.985 1237 HB2 HIS 72 HB2 HIS 72 24.049 12.140 -13.200 1238 HB3 HIS 72 HB1 HIS 72 24.181 13.175 -14.624 1239 HD2 HIS 72 HD2 HIS 72 22.464 10.558 -16.349 1240 HE1 HIS 72 HE1 HIS 72 19.299 12.219 -14.101 1241 HE2 HIS 72 HE2 HIS 72 19.878 10.713 -16.058 1242 H HIS 73 HN HIS 73 27.068 10.380 -15.873 1243 HA HIS 73 HA HIS 73 28.530 9.985 -13.455 1244 HB2 HIS 73 HB2 HIS 73 30.527 9.940 -14.915 1245 HB3 HIS 73 HB1 HIS 73 29.214 8.977 -15.592 1246 HD2 HIS 73 HD2 HIS 73 30.643 12.660 -16.155 1247 HE1 HIS 73 HE1 HIS 73 28.829 11.309 -19.721 1248 HE2 HIS 73 HE2 HIS 73 30.131 13.206 -18.654 1249 H HIS 74 HN HIS 74 30.201 11.284 -12.517 1250 HA HIS 74 HA HIS 74 30.142 14.191 -13.255 1251 HB2 HIS 74 HB2 HIS 74 30.698 14.192 -10.527 1252 HB3 HIS 74 HB1 HIS 74 29.122 14.531 -11.233 1253 HD2 HIS 74 HD2 HIS 74 27.312 13.036 -9.804 1254 HE1 HIS 74 HE1 HIS 74 29.574 9.487 -9.460 1255 HE2 HIS 74 HE2 HIS 74 27.344 10.577 -8.935 1256 H HIS 75 HN HIS 75 32.095 13.986 -14.410 1257 HA HIS 75 HA HIS 75 34.490 13.007 -12.933 1258 HB2 HIS 75 HB2 HIS 75 35.614 13.028 -15.065 1259 HB3 HIS 75 HB1 HIS 75 34.030 12.301 -15.330 1260 HD2 HIS 75 HD2 HIS 75 32.775 15.646 -15.242 1261 HE1 HIS 75 HE1 HIS 75 34.637 15.612 -19.033 1262 HE2 HIS 75 HE2 HIS 75 32.987 16.843 -17.551 1263 H HIS 76 HN HIS 76 33.156 15.440 -12.122 1264 HA HIS 76 HA HIS 76 34.220 17.823 -13.127 1265 HB2 HIS 76 HB2 HIS 76 33.387 18.831 -11.205 1266 HB3 HIS 76 HB1 HIS 76 32.508 17.307 -11.158 1267 HD2 HIS 76 HD2 HIS 76 34.058 19.275 -8.557 1268 HE1 HIS 76 HE1 HIS 76 35.547 15.423 -7.674 1269 HE2 HIS 76 HE2 HIS 76 35.238 17.777 -6.779 1270 H HIS 77 HN HIS 77 35.842 19.238 -11.901 1271 HA HIS 77 HA HIS 77 38.443 18.092 -12.076 1272 HB2 HIS 77 HB2 HIS 77 38.166 20.477 -12.313 1273 HB3 HIS 77 HB1 HIS 77 37.422 20.605 -10.720 1274 HD2 HIS 77 HD2 HIS 77 39.359 21.906 -9.235 1275 HE1 HIS 77 HE1 HIS 77 42.671 19.559 -10.397 1276 HE2 HIS 77 HE2 HIS 77 41.901 21.444 -8.884 Start of MODEL 13 1 H1 MET 1 HT1 MET 1 9.178 7.744 10.877 2 H2 MET 1 HT2 MET 1 10.255 6.966 9.819 3 H3 MET 1 HT3 MET 1 9.183 6.052 10.770 4 HA MET 1 HA MET 1 8.039 6.000 8.826 5 HB2 MET 1 HB2 MET 1 7.292 8.665 10.062 6 HB3 MET 1 HB1 MET 1 6.328 7.829 8.847 7 HG2 MET 1 HG2 MET 1 6.247 5.849 10.422 8 HG3 MET 1 HG1 MET 1 6.991 6.881 11.645 9 HE1 MET 1 HE1 MET 1 6.325 9.080 12.154 10 HE2 MET 1 HE2 MET 1 4.668 9.523 12.552 11 HE3 MET 1 HE3 MET 1 5.310 9.897 10.955 12 H GLU 2 HN GLU 2 7.279 7.352 6.843 13 HA GLU 2 HA GLU 2 9.091 9.496 6.012 14 HB2 GLU 2 HB2 GLU 2 9.495 7.941 3.821 15 HB3 GLU 2 HB1 GLU 2 10.616 7.975 5.182 16 HG2 GLU 2 HG2 GLU 2 9.655 5.998 6.137 17 HG3 GLU 2 HG1 GLU 2 8.297 6.040 5.010 18 H LEU 3 HN LEU 3 7.476 7.218 3.888 19 HA LEU 3 HA LEU 3 6.020 9.253 2.515 20 HB2 LEU 3 HB2 LEU 3 6.498 7.060 1.507 21 HB3 LEU 3 HB1 LEU 3 5.485 6.270 2.711 22 HG LEU 3 HG LEU 3 3.508 7.459 1.863 23 HD11 LEU 3 HD11 LEU 3 4.229 9.535 1.055 24 HD12 LEU 3 HD12 LEU 3 3.928 8.659 -0.442 25 HD13 LEU 3 HD13 LEU 3 5.578 8.836 0.156 26 HD21 LEU 3 HD21 LEU 3 3.911 5.347 0.823 27 HD22 LEU 3 HD22 LEU 3 5.219 6.001 -0.163 28 HD23 LEU 3 HD23 LEU 3 3.550 6.462 -0.496 29 H SER 4 HN SER 4 5.043 6.951 5.050 30 HA SER 4 HA SER 4 2.320 7.916 5.176 31 HB2 SER 4 HB2 SER 4 2.193 6.600 7.272 32 HB3 SER 4 HB1 SER 4 2.905 5.666 5.960 33 HG SER 4 HG SER 4 4.204 5.416 7.740 34 H ASN 5 HN ASN 5 5.317 9.037 6.493 35 HA ASN 5 HA ASN 5 4.361 10.381 8.824 36 HB2 ASN 5 HB2 ASN 5 6.763 10.083 8.332 37 HB3 ASN 5 HB1 ASN 5 6.616 11.167 6.955 38 HD21 ASN 5 HD21 ASN 5 6.882 13.375 7.358 39 HD22 ASN 5 HD22 ASN 5 6.917 14.071 8.906 40 H GLU 6 HN GLU 6 4.862 11.607 5.507 41 HA GLU 6 HA GLU 6 3.655 14.168 6.113 42 HB2 GLU 6 HB2 GLU 6 3.816 13.098 3.305 43 HB3 GLU 6 HB1 GLU 6 4.090 14.736 3.888 44 HG2 GLU 6 HG2 GLU 6 5.921 12.354 4.307 45 HG3 GLU 6 HG1 GLU 6 6.218 13.730 3.249 46 H LEU 7 HN LEU 7 2.526 11.095 4.881 47 HA LEU 7 HA LEU 7 0.005 11.877 3.846 48 HB2 LEU 7 HB2 LEU 7 1.198 9.588 3.816 49 HB3 LEU 7 HB1 LEU 7 0.493 9.336 5.409 50 HG LEU 7 HG LEU 7 -1.113 10.043 2.941 51 HD11 LEU 7 HD11 LEU 7 -0.656 7.349 4.250 52 HD12 LEU 7 HD12 LEU 7 0.026 7.864 2.708 53 HD13 LEU 7 HD13 LEU 7 -1.719 7.660 2.877 54 HD21 LEU 7 HD21 LEU 7 -1.767 9.441 5.818 55 HD22 LEU 7 HD22 LEU 7 -2.878 8.859 4.584 56 HD23 LEU 7 HD23 LEU 7 -2.529 10.577 4.706 57 H LYS 8 HN LYS 8 0.904 10.890 7.171 58 HA LYS 8 HA LYS 8 -1.714 11.270 8.283 59 HB2 LYS 8 HB2 LYS 8 1.061 11.306 9.494 60 HB3 LYS 8 HB1 LYS 8 -0.395 11.540 10.463 61 HG2 LYS 8 HG2 LYS 8 -1.262 9.390 9.816 62 HG3 LYS 8 HG1 LYS 8 0.027 9.165 8.636 63 HD2 LYS 8 HD2 LYS 8 0.692 7.872 10.515 64 HD3 LYS 8 HD1 LYS 8 1.654 9.345 10.619 65 HE2 LYS 8 HE2 LYS 8 0.183 10.267 12.302 66 HE3 LYS 8 HE1 LYS 8 -0.973 8.953 12.083 67 HZ1 LYS 8 HZ1 LYS 8 0.248 8.358 13.952 68 HZ2 LYS 8 HZ2 LYS 8 1.726 8.851 13.276 69 HZ3 LYS 8 HZ3 LYS 8 0.955 7.448 12.709 70 H VAL 9 HN VAL 9 1.083 13.402 7.897 71 HA VAL 9 HA VAL 9 0.045 15.634 9.321 72 HB VAL 9 HB VAL 9 1.941 15.516 6.962 73 HG11 VAL 9 HG11 VAL 9 1.155 17.764 8.824 74 HG12 VAL 9 HG12 VAL 9 1.108 17.752 7.060 75 HG13 VAL 9 HG13 VAL 9 2.658 17.783 7.902 76 HG21 VAL 9 HG21 VAL 9 3.684 15.479 8.576 77 HG22 VAL 9 HG22 VAL 9 2.494 14.341 9.207 78 HG23 VAL 9 HG23 VAL 9 2.601 15.969 9.878 79 H GLU 10 HN GLU 10 -0.220 14.788 5.836 80 HA GLU 10 HA GLU 10 -1.632 17.124 5.055 81 HB2 GLU 10 HB2 GLU 10 -1.824 14.293 3.980 82 HB3 GLU 10 HB1 GLU 10 -2.579 15.689 3.211 83 HG2 GLU 10 HG2 GLU 10 -0.143 16.714 3.333 84 HG3 GLU 10 HG1 GLU 10 0.345 15.028 3.488 85 H ARG 11 HN ARG 11 -2.860 14.043 6.351 86 HA ARG 11 HA ARG 11 -5.634 14.633 6.080 87 HB2 ARG 11 HB2 ARG 11 -4.666 12.398 6.702 88 HB3 ARG 11 HB1 ARG 11 -4.308 13.047 8.302 89 HG2 ARG 11 HG2 ARG 11 -6.731 13.568 8.595 90 HG3 ARG 11 HG1 ARG 11 -7.052 12.804 7.037 91 HD2 ARG 11 HD2 ARG 11 -5.938 10.718 7.942 92 HD3 ARG 11 HD1 ARG 11 -5.929 11.500 9.523 93 HE ARG 11 HE ARG 11 -8.564 11.435 8.257 94 HH11 ARG 11 HH21 ARG 11 -6.236 9.897 10.282 95 HH12 ARG 11 HH22 ARG 11 -7.395 8.869 11.056 96 HH21 ARG 11 HH11 ARG 11 -10.086 10.097 9.246 97 HH22 ARG 11 HH12 ARG 11 -9.575 8.980 10.468 98 H ILE 12 HN ILE 12 -3.344 15.282 8.719 99 HA ILE 12 HA ILE 12 -5.222 16.469 10.522 100 HB ILE 12 HB ILE 12 -2.224 16.793 10.217 101 HG12 ILE 12 HG12 ILE 12 -3.813 15.270 12.297 102 HG13 ILE 12 HG11 ILE 12 -3.275 14.525 10.792 103 HG21 ILE 12 HG21 ILE 12 -4.142 17.788 12.337 104 HG22 ILE 12 HG22 ILE 12 -2.967 18.727 11.416 105 HG23 ILE 12 HG23 ILE 12 -2.416 17.582 12.640 106 HD11 ILE 12 HD11 ILE 12 -1.697 14.146 12.699 107 HD12 ILE 12 HD12 ILE 12 -1.426 15.888 12.769 108 HD13 ILE 12 HD13 ILE 12 -0.952 14.978 11.335 109 H ARG 13 HN ARG 13 -3.062 17.920 8.061 110 HA ARG 13 HA ARG 13 -3.763 20.644 8.616 111 HB2 ARG 13 HB2 ARG 13 -2.483 19.163 6.360 112 HB3 ARG 13 HB1 ARG 13 -3.189 20.721 5.940 113 HG2 ARG 13 HG2 ARG 13 -0.805 20.929 6.574 114 HG3 ARG 13 HG1 ARG 13 -1.854 21.829 7.663 115 HD2 ARG 13 HD2 ARG 13 -1.360 20.472 9.460 116 HD3 ARG 13 HD1 ARG 13 -1.270 19.020 8.466 117 HE ARG 13 HE ARG 13 1.023 19.500 8.003 118 HH11 ARG 13 HH21 ARG 13 -0.541 22.000 9.813 119 HH12 ARG 13 HH22 ARG 13 0.944 22.771 10.255 120 HH21 ARG 13 HH11 ARG 13 2.945 20.508 8.565 121 HH22 ARG 13 HH12 ARG 13 2.910 21.932 9.551 122 H LEU 14 HN LEU 14 -5.149 18.237 6.390 123 HA LEU 14 HA LEU 14 -7.269 20.121 5.571 124 HB2 LEU 14 HB2 LEU 14 -6.895 17.178 4.907 125 HB3 LEU 14 HB1 LEU 14 -8.002 18.297 4.110 126 HG LEU 14 HG LEU 14 -4.983 18.585 4.173 127 HD11 LEU 14 HD11 LEU 14 -5.530 16.738 2.747 128 HD12 LEU 14 HD12 LEU 14 -5.257 18.121 1.686 129 HD13 LEU 14 HD13 LEU 14 -6.903 17.600 2.049 130 HD21 LEU 14 HD21 LEU 14 -7.232 20.265 3.070 131 HD22 LEU 14 HD22 LEU 14 -5.671 20.256 2.247 132 HD23 LEU 14 HD23 LEU 14 -5.775 20.774 3.926 133 H SER 15 HN SER 15 -6.692 18.102 8.170 134 HA SER 15 HA SER 15 -8.085 16.960 9.703 135 HB2 SER 15 HB2 SER 15 -9.656 18.447 10.727 136 HB3 SER 15 HB1 SER 15 -8.327 19.449 10.153 137 HG SER 15 HG SER 15 -9.925 19.296 8.136 138 H LEU 16 HN LEU 16 -8.561 15.440 7.761 139 HA LEU 16 HA LEU 16 -11.215 15.695 6.569 140 HB2 LEU 16 HB2 LEU 16 -9.289 13.353 6.599 141 HB3 LEU 16 HB1 LEU 16 -10.724 13.487 5.584 142 HG LEU 16 HG LEU 16 -8.390 15.426 5.543 143 HD11 LEU 16 HD11 LEU 16 -9.172 13.202 3.634 144 HD12 LEU 16 HD12 LEU 16 -7.743 13.231 4.669 145 HD13 LEU 16 HD13 LEU 16 -7.894 14.382 3.342 146 HD21 LEU 16 HD21 LEU 16 -9.633 15.933 3.249 147 HD22 LEU 16 HD22 LEU 16 -10.195 16.680 4.740 148 HD23 LEU 16 HD23 LEU 16 -11.032 15.267 4.095 149 H THR 17 HN THR 17 -12.983 14.228 6.929 150 HA THR 17 HA THR 17 -13.340 13.565 9.746 151 HB THR 17 HB THR 17 -15.585 12.679 8.863 152 HG1 THR 17 HG1 THR 17 -14.264 13.460 6.544 153 HG21 THR 17 HG21 THR 17 -16.389 15.013 8.347 154 HG22 THR 17 HG22 THR 17 -14.704 15.535 8.374 155 HG23 THR 17 HG23 THR 17 -15.450 14.883 9.835 156 H ALA 18 HN ALA 18 -13.058 11.614 10.676 157 HA ALA 18 HA ALA 18 -11.833 9.442 9.241 158 HB1 ALA 18 HB1 ALA 18 -11.299 9.594 11.545 159 HB2 ALA 18 HB2 ALA 18 -12.361 8.192 11.441 160 HB3 ALA 18 HB3 ALA 18 -12.993 9.733 12.014 161 H LYS 19 HN LYS 19 -15.145 10.067 10.355 162 HA LYS 19 HA LYS 19 -16.224 7.494 9.770 163 HB2 LYS 19 HB2 LYS 19 -17.397 9.269 11.078 164 HB3 LYS 19 HB1 LYS 19 -17.629 10.175 9.583 165 HG2 LYS 19 HG2 LYS 19 -18.910 8.310 8.627 166 HG3 LYS 19 HG1 LYS 19 -18.648 7.363 10.092 167 HD2 LYS 19 HD2 LYS 19 -19.840 9.076 11.413 168 HD3 LYS 19 HD1 LYS 19 -20.112 10.015 9.945 169 HE2 LYS 19 HE2 LYS 19 -22.102 8.679 10.469 170 HE3 LYS 19 HE1 LYS 19 -21.363 8.107 8.973 171 HZ1 LYS 19 HZ1 LYS 19 -21.108 6.122 9.879 172 HZ2 LYS 19 HZ2 LYS 19 -21.869 6.659 11.300 173 HZ3 LYS 19 HZ3 LYS 19 -20.181 6.775 11.140 174 H SER 20 HN SER 20 -15.984 10.431 7.747 175 HA SER 20 HA SER 20 -17.325 9.378 5.471 176 HB2 SER 20 HB2 SER 20 -15.028 11.362 5.545 177 HB3 SER 20 HB1 SER 20 -16.135 11.117 4.196 178 HG SER 20 HG SER 20 -17.720 11.479 6.158 179 H VAL 21 HN VAL 21 -13.857 9.341 6.321 180 HA VAL 21 HA VAL 21 -13.020 7.943 3.959 181 HB VAL 21 HB VAL 21 -11.770 8.087 6.718 182 HG11 VAL 21 HG11 VAL 21 -10.770 7.007 4.078 183 HG12 VAL 21 HG12 VAL 21 -10.788 6.201 5.646 184 HG13 VAL 21 HG13 VAL 21 -9.667 7.530 5.349 185 HG21 VAL 21 HG21 VAL 21 -10.968 9.559 4.204 186 HG22 VAL 21 HG22 VAL 21 -10.497 9.906 5.866 187 HG23 VAL 21 HG23 VAL 21 -12.147 10.225 5.333 188 H ALA 22 HN ALA 22 -13.758 6.767 7.255 189 HA ALA 22 HA ALA 22 -13.251 4.010 6.657 190 HB1 ALA 22 HB1 ALA 22 -13.382 5.038 8.960 191 HB2 ALA 22 HB2 ALA 22 -14.284 3.534 8.776 192 HB3 ALA 22 HB3 ALA 22 -15.137 5.079 8.771 193 H GLU 23 HN GLU 23 -16.256 5.929 6.575 194 HA GLU 23 HA GLU 23 -17.976 3.689 6.069 195 HB2 GLU 23 HB2 GLU 23 -18.752 5.931 6.839 196 HB3 GLU 23 HB1 GLU 23 -18.375 6.576 5.242 197 HG2 GLU 23 HG2 GLU 23 -19.965 5.014 4.213 198 HG3 GLU 23 HG1 GLU 23 -20.323 4.319 5.794 199 H GLU 24 HN GLU 24 -16.484 6.050 3.827 200 HA GLU 24 HA GLU 24 -17.552 4.776 1.469 201 HB2 GLU 24 HB2 GLU 24 -16.682 7.165 1.657 202 HB3 GLU 24 HB1 GLU 24 -15.055 6.481 1.595 203 HG2 GLU 24 HG2 GLU 24 -15.599 7.029 -0.662 204 HG3 GLU 24 HG1 GLU 24 -15.806 5.283 -0.542 205 H MET 25 HN MET 25 -14.507 4.473 3.254 206 HA MET 25 HA MET 25 -13.125 2.832 1.366 207 HB2 MET 25 HB2 MET 25 -12.927 3.201 4.356 208 HB3 MET 25 HB1 MET 25 -11.913 2.026 3.520 209 HG2 MET 25 HG2 MET 25 -12.079 4.891 2.585 210 HG3 MET 25 HG1 MET 25 -10.954 4.405 3.852 211 HE1 MET 25 HE1 MET 25 -8.799 1.765 2.427 212 HE2 MET 25 HE2 MET 25 -9.637 2.467 3.807 213 HE3 MET 25 HE3 MET 25 -8.345 3.367 3.020 214 H GLY 26 HN GLY 26 -15.390 2.048 3.985 215 HA2 GLY 26 HA2 GLY 26 -16.842 0.131 3.963 216 HA3 GLY 26 HA1 GLY 26 -15.800 -0.627 2.757 217 H ILE 27 HN ILE 27 -14.431 0.882 5.589 218 HA ILE 27 HA ILE 27 -13.892 -1.819 6.784 219 HB ILE 27 HB ILE 27 -11.656 -0.995 7.419 220 HG12 ILE 27 HG12 ILE 27 -12.367 1.424 5.732 221 HG13 ILE 27 HG11 ILE 27 -12.237 1.432 7.488 222 HG21 ILE 27 HG21 ILE 27 -12.126 -2.159 5.208 223 HG22 ILE 27 HG22 ILE 27 -10.658 -1.183 5.246 224 HG23 ILE 27 HG23 ILE 27 -12.108 -0.564 4.456 225 HD11 ILE 27 HD11 ILE 27 -10.022 0.828 5.511 226 HD12 ILE 27 HD12 ILE 27 -9.870 0.629 7.257 227 HD13 ILE 27 HD13 ILE 27 -10.141 2.231 6.573 228 H SER 28 HN SER 28 -13.424 -1.713 9.120 229 HA SER 28 HA SER 28 -15.344 -0.006 10.476 230 HB2 SER 28 HB2 SER 28 -15.019 -2.271 11.275 231 HB3 SER 28 HB1 SER 28 -13.293 -1.993 11.493 232 HG SER 28 HG SER 28 -15.409 -1.336 13.099 233 H ARG 29 HN ARG 29 -14.775 1.396 12.301 234 HA ARG 29 HA ARG 29 -12.718 3.270 11.660 235 HB2 ARG 29 HB2 ARG 29 -14.345 2.818 14.175 236 HB3 ARG 29 HB1 ARG 29 -13.154 4.115 14.041 237 HG2 ARG 29 HG2 ARG 29 -14.318 4.985 12.048 238 HG3 ARG 29 HG1 ARG 29 -15.509 3.693 12.176 239 HD2 ARG 29 HD2 ARG 29 -14.998 5.604 14.455 240 HD3 ARG 29 HD1 ARG 29 -16.147 5.981 13.174 241 HE ARG 29 HE ARG 29 -16.652 3.364 14.307 242 HH11 ARG 29 HH21 ARG 29 -16.962 6.766 14.729 243 HH12 ARG 29 HH22 ARG 29 -18.388 6.656 15.708 244 HH21 ARG 29 HH11 ARG 29 -18.523 3.193 15.587 245 HH22 ARG 29 HH12 ARG 29 -19.270 4.634 16.192 246 H GLN 30 HN GLN 30 -12.792 0.452 13.782 247 HA GLN 30 HA GLN 30 -10.415 0.892 15.244 248 HB2 GLN 30 HB2 GLN 30 -11.494 -1.719 14.129 249 HB3 GLN 30 HB1 GLN 30 -10.270 -1.585 15.392 250 HG2 GLN 30 HG2 GLN 30 -13.061 -0.421 15.585 251 HG3 GLN 30 HG1 GLN 30 -12.568 -1.955 16.302 252 HE21 GLN 30 HE21 GLN 30 -13.141 1.114 17.236 253 HE22 GLN 30 HE22 GLN 30 -11.975 1.295 18.455 254 H GLN 31 HN GLN 31 -10.853 -0.574 12.020 255 HA GLN 31 HA GLN 31 -8.054 -1.085 11.589 256 HB2 GLN 31 HB2 GLN 31 -9.936 -2.133 10.291 257 HB3 GLN 31 HB1 GLN 31 -10.192 -0.579 9.498 258 HG2 GLN 31 HG2 GLN 31 -7.971 -0.626 8.543 259 HG3 GLN 31 HG1 GLN 31 -7.549 -2.062 9.477 260 HE21 GLN 31 HE21 GLN 31 -7.370 -2.155 6.648 261 HE22 GLN 31 HE22 GLN 31 -8.592 -3.169 6.049 262 H LEU 32 HN LEU 32 -10.168 1.669 10.920 263 HA LEU 32 HA LEU 32 -8.337 3.202 9.361 264 HB2 LEU 32 HB2 LEU 32 -10.703 3.782 9.503 265 HB3 LEU 32 HB1 LEU 32 -10.560 4.067 11.234 266 HG LEU 32 HG LEU 32 -9.068 5.962 10.841 267 HD11 LEU 32 HD11 LEU 32 -7.808 5.415 8.926 268 HD12 LEU 32 HD12 LEU 32 -8.870 6.697 8.354 269 HD13 LEU 32 HD13 LEU 32 -9.243 5.012 7.981 270 HD21 LEU 32 HD21 LEU 32 -11.369 6.249 8.902 271 HD22 LEU 32 HD22 LEU 32 -10.686 7.469 9.977 272 HD23 LEU 32 HD23 LEU 32 -11.636 6.139 10.641 273 H CYS 33 HN CYS 33 -8.883 3.034 12.879 274 HA CYS 33 HA CYS 33 -7.023 5.081 13.603 275 HB2 CYS 33 HB2 CYS 33 -7.920 2.606 15.115 276 HB3 CYS 33 HB1 CYS 33 -6.998 3.930 15.829 277 HG CYS 33 HG CYS 33 -9.926 4.205 14.772 278 H ASN 34 HN ASN 34 -6.645 1.635 12.925 279 HA ASN 34 HA ASN 34 -3.940 1.367 13.818 280 HB2 ASN 34 HB2 ASN 34 -5.465 -0.093 11.637 281 HB3 ASN 34 HB1 ASN 34 -3.876 -0.579 12.232 282 HD21 ASN 34 HD21 ASN 34 -5.134 -2.623 12.900 283 HD22 ASN 34 HD22 ASN 34 -5.931 -2.599 14.398 284 H ILE 35 HN ILE 35 -5.346 2.470 10.746 285 HA ILE 35 HA ILE 35 -2.908 2.555 9.259 286 HB ILE 35 HB ILE 35 -5.411 4.260 9.057 287 HG12 ILE 35 HG12 ILE 35 -4.411 1.975 7.328 288 HG13 ILE 35 HG11 ILE 35 -5.573 1.770 8.637 289 HG21 ILE 35 HG21 ILE 35 -4.489 4.690 6.702 290 HG22 ILE 35 HG22 ILE 35 -2.945 4.095 7.311 291 HG23 ILE 35 HG23 ILE 35 -3.676 5.535 8.020 292 HD11 ILE 35 HD11 ILE 35 -5.912 3.287 6.048 293 HD12 ILE 35 HD12 ILE 35 -6.950 3.611 7.438 294 HD13 ILE 35 HD13 ILE 35 -6.924 2.005 6.711 295 H GLU 36 HN GLU 36 -4.482 4.982 11.360 296 HA GLU 36 HA GLU 36 -2.624 7.099 10.965 297 HB2 GLU 36 HB2 GLU 36 -4.078 6.299 13.518 298 HB3 GLU 36 HB1 GLU 36 -3.324 7.866 13.220 299 HG2 GLU 36 HG2 GLU 36 -5.487 6.704 11.449 300 HG3 GLU 36 HG1 GLU 36 -5.817 7.802 12.789 301 H GLN 37 HN GLN 37 -2.537 4.182 12.900 302 HA GLN 37 HA GLN 37 -0.012 4.840 14.225 303 HB2 GLN 37 HB2 GLN 37 -1.904 3.301 15.102 304 HB3 GLN 37 HB1 GLN 37 -1.255 2.090 13.998 305 HG2 GLN 37 HG2 GLN 37 -0.216 1.725 16.134 306 HG3 GLN 37 HG1 GLN 37 1.004 2.452 15.089 307 HE21 GLN 37 HE21 GLN 37 2.156 4.044 16.180 308 HE22 GLN 37 HE22 GLN 37 1.510 5.091 17.349 309 H SER 38 HN SER 38 0.089 5.054 11.392 310 HA SER 38 HA SER 38 0.886 3.042 9.756 311 HB2 SER 38 HB2 SER 38 2.147 4.591 8.541 312 HB3 SER 38 HB1 SER 38 1.085 5.642 9.473 313 HG SER 38 HG SER 38 2.732 6.069 10.862 314 H GLU 39 HN GLU 39 2.657 1.718 9.417 315 HA GLU 39 HA GLU 39 4.928 1.844 11.345 316 HB2 GLU 39 HB2 GLU 39 3.311 0.241 12.292 317 HB3 GLU 39 HB1 GLU 39 3.286 -0.647 10.770 318 HG2 GLU 39 HG2 GLU 39 5.616 -1.244 11.001 319 HG3 GLU 39 HG1 GLU 39 5.798 -0.188 12.403 320 H THR 40 HN THR 40 6.113 2.605 9.510 321 HA THR 40 HA THR 40 7.528 2.344 7.671 322 HB THR 40 HB THR 40 7.195 -0.637 8.026 323 HG1 THR 40 HG1 THR 40 8.523 -0.549 9.727 324 HG21 THR 40 HG21 THR 40 9.629 1.017 7.321 325 HG22 THR 40 HG22 THR 40 8.536 0.345 6.110 326 HG23 THR 40 HG23 THR 40 9.439 -0.731 7.177 327 H ALA 41 HN ALA 41 7.078 2.509 5.523 328 HA ALA 41 HA ALA 41 4.458 1.798 4.546 329 HB1 ALA 41 HB1 ALA 41 5.522 2.499 2.295 330 HB2 ALA 41 HB2 ALA 41 6.958 2.884 3.244 331 HB3 ALA 41 HB3 ALA 41 5.440 3.722 3.562 332 HA PRO 42 HA PRO 42 5.335 -2.319 3.111 333 HB2 PRO 42 HB2 PRO 42 3.548 -2.578 1.059 334 HB3 PRO 42 HB1 PRO 42 3.051 -2.531 2.764 335 HG2 PRO 42 HG2 PRO 42 3.044 -0.329 0.739 336 HG3 PRO 42 HG1 PRO 42 1.798 -0.772 1.920 337 HD2 PRO 42 HD2 PRO 42 3.533 1.285 2.347 338 HD3 PRO 42 HD1 PRO 42 2.894 0.294 3.676 339 H VAL 43 HN VAL 43 6.482 -3.450 1.506 340 HA VAL 43 HA VAL 43 8.194 -1.888 -0.211 341 HB VAL 43 HB VAL 43 8.831 -4.231 -1.089 342 HG11 VAL 43 HG11 VAL 43 10.034 -4.764 0.990 343 HG12 VAL 43 HG12 VAL 43 8.970 -3.687 1.894 344 HG13 VAL 43 HG13 VAL 43 10.072 -3.027 0.685 345 HG21 VAL 43 HG21 VAL 43 7.155 -5.112 1.276 346 HG22 VAL 43 HG22 VAL 43 7.979 -6.131 0.101 347 HG23 VAL 43 HG23 VAL 43 6.568 -5.189 -0.385 348 H VAL 44 HN VAL 44 5.048 -3.218 -0.649 349 HA VAL 44 HA VAL 44 5.086 -3.764 -3.442 350 HB VAL 44 HB VAL 44 2.705 -3.682 -3.353 351 HG11 VAL 44 HG11 VAL 44 3.629 -4.314 -0.534 352 HG12 VAL 44 HG12 VAL 44 3.780 -5.413 -1.905 353 HG13 VAL 44 HG13 VAL 44 2.183 -4.934 -1.330 354 HG21 VAL 44 HG21 VAL 44 3.158 -1.734 -1.093 355 HG22 VAL 44 HG22 VAL 44 1.618 -2.577 -1.251 356 HG23 VAL 44 HG23 VAL 44 2.186 -1.523 -2.547 357 H VAL 45 HN VAL 45 4.569 -0.740 -1.662 358 HA VAL 45 HA VAL 45 3.913 0.899 -3.909 359 HB VAL 45 HB VAL 45 5.254 1.556 -1.271 360 HG11 VAL 45 HG11 VAL 45 5.851 3.337 -2.749 361 HG12 VAL 45 HG12 VAL 45 4.450 3.915 -1.847 362 HG13 VAL 45 HG13 VAL 45 4.255 3.340 -3.501 363 HG21 VAL 45 HG21 VAL 45 2.845 0.643 -1.385 364 HG22 VAL 45 HG22 VAL 45 2.434 2.165 -2.173 365 HG23 VAL 45 HG23 VAL 45 3.079 2.169 -0.532 366 H LYS 46 HN LYS 46 7.016 0.108 -2.374 367 HA LYS 46 HA LYS 46 8.673 1.754 -4.012 368 HB2 LYS 46 HB2 LYS 46 9.363 -0.951 -2.816 369 HB3 LYS 46 HB1 LYS 46 10.499 0.319 -3.268 370 HG2 LYS 46 HG2 LYS 46 8.357 0.590 -1.136 371 HG3 LYS 46 HG1 LYS 46 10.059 0.268 -0.817 372 HD2 LYS 46 HD2 LYS 46 10.541 2.421 -2.142 373 HD3 LYS 46 HD1 LYS 46 8.818 2.761 -1.986 374 HE2 LYS 46 HE2 LYS 46 8.975 2.635 0.449 375 HE3 LYS 46 HE1 LYS 46 10.688 2.233 0.336 376 HZ1 LYS 46 HZ1 LYS 46 9.492 4.768 0.334 377 HZ2 LYS 46 HZ2 LYS 46 10.239 4.538 -1.174 378 HZ3 LYS 46 HZ3 LYS 46 11.142 4.383 0.256 379 H TYR 47 HN TYR 47 7.501 -1.569 -4.433 380 HA TYR 47 HA TYR 47 8.997 -2.202 -6.770 381 HB2 TYR 47 HB2 TYR 47 7.544 -3.751 -5.313 382 HB3 TYR 47 HB1 TYR 47 6.173 -3.152 -6.245 383 HD1 TYR 47 HD1 TYR 47 9.506 -4.788 -6.562 384 HD2 TYR 47 HD2 TYR 47 5.710 -4.017 -8.417 385 HE1 TYR 47 HE1 TYR 47 10.062 -6.391 -8.368 386 HE2 TYR 47 HE2 TYR 47 6.270 -5.627 -10.222 387 HH TYR 47 HH TYR 47 7.982 -6.787 -11.183 388 H ILE 48 HN ILE 48 5.843 -0.597 -6.371 389 HA ILE 48 HA ILE 48 5.192 -0.415 -9.148 390 HB ILE 48 HB ILE 48 4.474 1.367 -6.802 391 HG12 ILE 48 HG12 ILE 48 2.805 -0.675 -8.290 392 HG13 ILE 48 HG11 ILE 48 3.724 -1.062 -6.837 393 HG21 ILE 48 HG21 ILE 48 2.568 2.061 -8.353 394 HG22 ILE 48 HG22 ILE 48 3.507 1.353 -9.668 395 HG23 ILE 48 HG23 ILE 48 4.157 2.714 -8.752 396 HD11 ILE 48 HD11 ILE 48 1.172 -0.289 -6.704 397 HD12 ILE 48 HD12 ILE 48 1.902 1.316 -6.731 398 HD13 ILE 48 HD13 ILE 48 2.333 0.168 -5.462 399 H ALA 49 HN ALA 49 6.962 1.805 -6.985 400 HA ALA 49 HA ALA 49 7.410 3.849 -8.937 401 HB1 ALA 49 HB1 ALA 49 9.366 4.456 -7.433 402 HB2 ALA 49 HB2 ALA 49 8.961 3.039 -6.462 403 HB3 ALA 49 HB3 ALA 49 7.807 4.364 -6.618 404 H PHE 50 HN PHE 50 9.152 0.889 -8.118 405 HA PHE 50 HA PHE 50 11.511 1.342 -9.637 406 HB2 PHE 50 HB2 PHE 50 11.109 -0.544 -8.004 407 HB3 PHE 50 HB1 PHE 50 10.111 -1.317 -9.235 408 HD1 PHE 50 HD2 PHE 50 11.133 -1.977 -11.440 409 HD2 PHE 50 HD1 PHE 50 13.491 -0.585 -8.130 410 HE1 PHE 50 HE2 PHE 50 13.172 -2.909 -12.497 411 HE2 PHE 50 HE1 PHE 50 15.529 -1.518 -9.188 412 HZ PHE 50 HZ PHE 50 15.371 -2.681 -11.372 413 H LEU 51 HN LEU 51 8.424 -0.194 -10.574 414 HA LEU 51 HA LEU 51 9.196 -0.843 -13.243 415 HB2 LEU 51 HB2 LEU 51 6.453 -0.156 -12.141 416 HB3 LEU 51 HB1 LEU 51 6.760 -0.964 -13.678 417 HG LEU 51 HG LEU 51 7.575 -2.015 -10.950 418 HD11 LEU 51 HD11 LEU 51 5.849 -3.810 -11.615 419 HD12 LEU 51 HD12 LEU 51 5.277 -2.646 -12.806 420 HD13 LEU 51 HD13 LEU 51 5.226 -2.248 -11.089 421 HD21 LEU 51 HD21 LEU 51 8.045 -2.963 -13.768 422 HD22 LEU 51 HD22 LEU 51 7.829 -4.161 -12.496 423 HD23 LEU 51 HD23 LEU 51 9.137 -2.988 -12.385 424 H ARG 52 HN ARG 52 7.661 2.073 -11.887 425 HA ARG 52 HA ARG 52 7.366 3.438 -14.402 426 HB2 ARG 52 HB2 ARG 52 6.146 4.206 -12.436 427 HB3 ARG 52 HB1 ARG 52 7.646 4.468 -11.555 428 HG2 ARG 52 HG2 ARG 52 6.754 6.601 -12.372 429 HG3 ARG 52 HG1 ARG 52 8.277 6.246 -13.173 430 HD2 ARG 52 HD2 ARG 52 5.872 5.219 -14.591 431 HD3 ARG 52 HD1 ARG 52 5.989 6.975 -14.497 432 HE ARG 52 HE ARG 52 8.416 5.542 -15.390 433 HH11 ARG 52 HH21 ARG 52 5.566 7.346 -16.175 434 HH12 ARG 52 HH22 ARG 52 6.165 7.842 -17.722 435 HH21 ARG 52 HH11 ARG 52 9.191 6.193 -17.391 436 HH22 ARG 52 HH12 ARG 52 8.208 7.193 -18.409 437 H SER 53 HN SER 53 10.053 2.712 -12.377 438 HA SER 53 HA SER 53 11.814 4.851 -13.097 439 HB2 SER 53 HB2 SER 53 13.492 3.589 -12.074 440 HB3 SER 53 HB1 SER 53 12.061 2.879 -11.334 441 HG SER 53 HG SER 53 12.914 1.110 -12.122 442 H LYS 54 HN LYS 54 10.973 1.783 -14.659 443 HA LYS 54 HA LYS 54 12.873 2.332 -16.881 444 HB2 LYS 54 HB2 LYS 54 11.076 -0.028 -16.257 445 HB3 LYS 54 HB1 LYS 54 12.083 0.089 -17.701 446 HG2 LYS 54 HG2 LYS 54 14.093 0.290 -16.311 447 HG3 LYS 54 HG1 LYS 54 13.105 0.227 -14.851 448 HD2 LYS 54 HD2 LYS 54 12.328 -2.024 -15.455 449 HD3 LYS 54 HD1 LYS 54 13.283 -1.966 -16.936 450 HE2 LYS 54 HE2 LYS 54 15.346 -1.751 -15.613 451 HE3 LYS 54 HE1 LYS 54 14.403 -1.780 -14.124 452 HZ1 LYS 54 HZ1 LYS 54 14.437 -3.956 -16.144 453 HZ2 LYS 54 HZ2 LYS 54 13.651 -3.984 -14.637 454 HZ3 LYS 54 HZ3 LYS 54 15.349 -3.957 -14.713 455 H GLY 55 HN GLY 55 9.702 3.088 -16.063 456 HA2 GLY 55 HA2 GLY 55 8.171 4.312 -17.394 457 HA3 GLY 55 HA1 GLY 55 9.145 3.949 -18.816 458 H VAL 56 HN VAL 56 7.555 1.782 -16.444 459 HA VAL 56 HA VAL 56 6.608 0.043 -18.575 460 HB VAL 56 HB VAL 56 6.006 0.169 -15.605 461 HG11 VAL 56 HG11 VAL 56 5.073 -2.186 -16.054 462 HG12 VAL 56 HG12 VAL 56 5.014 -1.712 -17.753 463 HG13 VAL 56 HG13 VAL 56 4.068 -0.825 -16.558 464 HG21 VAL 56 HG21 VAL 56 8.240 -0.565 -15.971 465 HG22 VAL 56 HG22 VAL 56 7.778 -1.534 -17.368 466 HG23 VAL 56 HG23 VAL 56 7.307 -2.044 -15.752 467 H ASP 57 HN ASP 57 5.441 2.848 -17.001 468 HA ASP 57 HA ASP 57 3.597 4.198 -17.485 469 HB2 ASP 57 HB2 ASP 57 2.482 2.067 -19.310 470 HB3 ASP 57 HB1 ASP 57 2.247 3.808 -19.363 471 H LEU 58 HN LEU 58 3.298 3.388 -15.190 472 HA LEU 58 HA LEU 58 1.224 1.380 -14.760 473 HB2 LEU 58 HB2 LEU 58 1.559 1.751 -12.436 474 HB3 LEU 58 HB1 LEU 58 3.153 1.935 -13.152 475 HG LEU 58 HG LEU 58 1.279 4.198 -12.361 476 HD11 LEU 58 HD11 LEU 58 3.838 3.096 -11.201 477 HD12 LEU 58 HD12 LEU 58 2.268 3.259 -10.412 478 HD13 LEU 58 HD13 LEU 58 3.214 4.696 -10.798 479 HD21 LEU 58 HD21 LEU 58 3.989 4.160 -13.711 480 HD22 LEU 58 HD22 LEU 58 3.362 5.584 -12.884 481 HD23 LEU 58 HD23 LEU 58 2.511 4.938 -14.284 482 H ASN 59 HN ASN 59 1.188 4.560 -15.772 483 HA ASN 59 HA ASN 59 -0.971 5.707 -14.320 484 HB2 ASN 59 HB2 ASN 59 -0.114 6.072 -17.208 485 HB3 ASN 59 HB1 ASN 59 -1.279 7.107 -16.380 486 HD21 ASN 59 HD21 ASN 59 2.138 6.095 -16.378 487 HD22 ASN 59 HD22 ASN 59 2.701 7.413 -15.468 488 H ALA 60 HN ALA 60 -0.966 3.764 -17.309 489 HA ALA 60 HA ALA 60 -3.826 3.819 -17.638 490 HB1 ALA 60 HB1 ALA 60 -3.487 2.104 -19.305 491 HB2 ALA 60 HB2 ALA 60 -1.900 1.706 -18.643 492 HB3 ALA 60 HB3 ALA 60 -2.161 3.257 -19.442 493 H LEU 61 HN LEU 61 -1.605 1.596 -15.985 494 HA LEU 61 HA LEU 61 -3.480 -0.484 -15.457 495 HB2 LEU 61 HB2 LEU 61 -1.041 -0.701 -15.138 496 HB3 LEU 61 HB1 LEU 61 -1.110 0.435 -13.796 497 HG LEU 61 HG LEU 61 -2.986 -1.881 -13.568 498 HD11 LEU 61 HD11 LEU 61 0.012 -2.271 -13.290 499 HD12 LEU 61 HD12 LEU 61 -1.000 -2.993 -14.541 500 HD13 LEU 61 HD13 LEU 61 -1.229 -3.446 -12.852 501 HD21 LEU 61 HD21 LEU 61 -0.952 -0.636 -11.681 502 HD22 LEU 61 HD22 LEU 61 -2.166 -1.835 -11.234 503 HD23 LEU 61 HD23 LEU 61 -2.665 -0.226 -11.749 504 H PHE 62 HN PHE 62 -2.572 2.351 -13.482 505 HA PHE 62 HA PHE 62 -4.513 1.778 -11.413 506 HB2 PHE 62 HB2 PHE 62 -2.797 4.145 -12.139 507 HB3 PHE 62 HB1 PHE 62 -4.056 4.323 -10.920 508 HD1 PHE 62 HD2 PHE 62 -1.334 1.900 -11.848 509 HD2 PHE 62 HD1 PHE 62 -3.461 3.908 -8.701 510 HE1 PHE 62 HE2 PHE 62 0.136 0.826 -10.164 511 HE2 PHE 62 HE1 PHE 62 -1.993 2.834 -7.021 512 HZ PHE 62 HZ PHE 62 -0.197 1.294 -7.752 513 H ASP 63 HN ASP 63 -4.542 3.722 -14.361 514 HA ASP 63 HA ASP 63 -6.876 5.233 -13.932 515 HB2 ASP 63 HB2 ASP 63 -5.296 5.365 -15.912 516 HB3 ASP 63 HB1 ASP 63 -6.114 3.948 -16.569 517 H ARG 64 HN ARG 64 -6.629 1.903 -15.264 518 HA ARG 64 HA ARG 64 -9.420 1.575 -15.735 519 HB2 ARG 64 HB2 ARG 64 -7.810 -0.018 -16.633 520 HB3 ARG 64 HB1 ARG 64 -7.302 -0.473 -15.007 521 HG2 ARG 64 HG2 ARG 64 -9.482 -1.420 -14.522 522 HG3 ARG 64 HG1 ARG 64 -10.131 -0.816 -16.046 523 HD2 ARG 64 HD2 ARG 64 -7.740 -2.645 -16.071 524 HD3 ARG 64 HD1 ARG 64 -9.355 -3.323 -15.868 525 HE ARG 64 HE ARG 64 -9.550 -1.621 -18.078 526 HH11 ARG 64 HH21 ARG 64 -7.641 -4.311 -17.079 527 HH12 ARG 64 HH22 ARG 64 -7.476 -4.960 -18.676 528 HH21 ARG 64 HH11 ARG 64 -9.354 -2.459 -20.171 529 HH22 ARG 64 HH12 ARG 64 -8.447 -3.912 -20.426 530 H ILE 65 HN ILE 65 -7.440 0.894 -12.858 531 HA ILE 65 HA ILE 65 -9.623 -0.139 -11.286 532 HB ILE 65 HB ILE 65 -7.065 1.168 -10.319 533 HG12 ILE 65 HG12 ILE 65 -7.602 -1.767 -10.856 534 HG13 ILE 65 HG11 ILE 65 -6.751 -0.716 -11.987 535 HG21 ILE 65 HG21 ILE 65 -8.975 -0.824 -9.060 536 HG22 ILE 65 HG22 ILE 65 -8.741 0.852 -8.562 537 HG23 ILE 65 HG23 ILE 65 -7.438 -0.320 -8.357 538 HD11 ILE 65 HD11 ILE 65 -5.086 -1.844 -10.656 539 HD12 ILE 65 HD12 ILE 65 -5.918 -1.412 -9.161 540 HD13 ILE 65 HD13 ILE 65 -5.137 -0.161 -10.130 541 H ILE 66 HN ILE 66 -7.827 2.885 -10.651 542 HA ILE 66 HA ILE 66 -10.225 4.036 -9.393 543 HB ILE 66 HB ILE 66 -8.647 6.026 -9.072 544 HG12 ILE 66 HG12 ILE 66 -6.503 4.040 -9.853 545 HG13 ILE 66 HG11 ILE 66 -7.157 5.182 -11.023 546 HG21 ILE 66 HG21 ILE 66 -7.753 3.331 -7.998 547 HG22 ILE 66 HG22 ILE 66 -9.084 4.286 -7.345 548 HG23 ILE 66 HG23 ILE 66 -7.434 4.902 -7.262 549 HD11 ILE 66 HD11 ILE 66 -5.167 6.141 -10.002 550 HD12 ILE 66 HD12 ILE 66 -5.833 5.881 -8.390 551 HD13 ILE 66 HD13 ILE 66 -6.582 7.049 -9.478 552 H VAL 67 HN VAL 67 -11.557 5.529 -10.314 553 HA VAL 67 HA VAL 67 -10.837 6.594 -13.032 554 HB VAL 67 HB VAL 67 -12.677 4.937 -13.100 555 HG11 VAL 67 HG11 VAL 67 -14.683 5.205 -11.868 556 HG12 VAL 67 HG12 VAL 67 -14.297 6.871 -11.438 557 HG13 VAL 67 HG13 VAL 67 -13.408 5.540 -10.698 558 HG21 VAL 67 HG21 VAL 67 -12.605 7.022 -14.574 559 HG22 VAL 67 HG22 VAL 67 -13.793 7.726 -13.477 560 HG23 VAL 67 HG23 VAL 67 -14.191 6.271 -14.391 561 H ASN 68 HN ASN 68 -10.743 8.781 -13.128 562 HA ASN 68 HA ASN 68 -12.503 10.449 -11.479 563 HB2 ASN 68 HB2 ASN 68 -10.646 11.702 -10.420 564 HB3 ASN 68 HB1 ASN 68 -10.659 10.016 -9.902 565 HD21 ASN 68 HD21 ASN 68 -9.164 8.523 -11.268 566 HD22 ASN 68 HD22 ASN 68 -7.688 9.184 -11.782 567 H LYS 69 HN LYS 69 -13.226 11.760 -13.080 568 HA LYS 69 HA LYS 69 -11.614 12.404 -15.402 569 HB2 LYS 69 HB2 LYS 69 -14.278 13.461 -14.423 570 HB3 LYS 69 HB1 LYS 69 -13.541 13.930 -15.956 571 HG2 LYS 69 HG2 LYS 69 -13.499 11.572 -16.667 572 HG3 LYS 69 HG1 LYS 69 -14.230 11.095 -15.133 573 HD2 LYS 69 HD2 LYS 69 -16.216 12.456 -15.644 574 HD3 LYS 69 HD1 LYS 69 -15.487 12.956 -17.171 575 HE2 LYS 69 HE2 LYS 69 -15.424 10.608 -17.918 576 HE3 LYS 69 HE1 LYS 69 -16.148 10.101 -16.392 577 HZ1 LYS 69 HZ1 LYS 69 -17.939 11.851 -17.059 578 HZ2 LYS 69 HZ2 LYS 69 -17.985 10.283 -17.713 579 HZ3 LYS 69 HZ3 LYS 69 -17.355 11.569 -18.626 580 H LEU 70 HN LEU 70 -10.661 14.367 -15.943 581 HA LEU 70 HA LEU 70 -9.951 16.103 -13.655 582 HB2 LEU 70 HB2 LEU 70 -8.925 15.797 -16.481 583 HB3 LEU 70 HB1 LEU 70 -8.463 17.181 -15.496 584 HG LEU 70 HG LEU 70 -6.859 15.212 -15.417 585 HD11 LEU 70 HD11 LEU 70 -6.275 15.633 -13.209 586 HD12 LEU 70 HD12 LEU 70 -7.941 15.628 -12.640 587 HD13 LEU 70 HD13 LEU 70 -7.312 17.018 -13.525 588 HD21 LEU 70 HD21 LEU 70 -8.998 13.937 -13.695 589 HD22 LEU 70 HD22 LEU 70 -7.473 13.226 -14.223 590 HD23 LEU 70 HD23 LEU 70 -8.762 13.516 -15.391 591 H GLU 71 HN GLU 71 -12.439 15.984 -15.808 592 HA GLU 71 HA GLU 71 -12.537 18.896 -16.367 593 HB2 GLU 71 HB2 GLU 71 -14.510 16.691 -17.068 594 HB3 GLU 71 HB1 GLU 71 -14.549 18.346 -17.670 595 HG2 GLU 71 HG2 GLU 71 -12.125 16.590 -18.069 596 HG3 GLU 71 HG1 GLU 71 -13.482 16.550 -19.193 597 H HIS 72 HN HIS 72 -13.836 16.520 -14.195 598 HA HIS 72 HA HIS 72 -15.761 16.645 -12.754 599 HB2 HIS 72 HB2 HIS 72 -15.096 18.096 -10.839 600 HB3 HIS 72 HB1 HIS 72 -13.798 17.046 -11.395 601 HD2 HIS 72 HD2 HIS 72 -13.936 20.525 -10.269 602 HE1 HIS 72 HE1 HIS 72 -11.251 20.710 -13.523 603 HE2 HIS 72 HE2 HIS 72 -12.110 21.941 -11.478 604 H HIS 73 HN HIS 73 -16.570 17.999 -15.024 605 HA HIS 73 HA HIS 73 -17.623 20.632 -14.141 606 HB2 HIS 73 HB2 HIS 73 -16.588 20.142 -16.466 607 HB3 HIS 73 HB1 HIS 73 -18.097 19.302 -16.820 608 HD2 HIS 73 HD2 HIS 73 -20.120 21.000 -17.659 609 HE1 HIS 73 HE1 HIS 73 -18.429 24.630 -16.316 610 HE2 HIS 73 HE2 HIS 73 -20.371 23.595 -17.579 611 H HIS 74 HN HIS 74 -19.642 20.761 -13.290 612 HA HIS 74 HA HIS 74 -21.741 20.013 -12.517 613 HB2 HIS 74 HB2 HIS 74 -22.311 20.865 -14.748 614 HB3 HIS 74 HB1 HIS 74 -21.905 19.306 -15.464 615 HD2 HIS 74 HD2 HIS 74 -24.225 19.923 -12.275 616 HE1 HIS 74 HE1 HIS 74 -26.380 17.718 -15.162 617 HE2 HIS 74 HE2 HIS 74 -26.457 18.686 -12.819 618 H HIS 75 HN HIS 75 -19.728 18.117 -12.026 619 HA HIS 75 HA HIS 75 -19.381 15.830 -11.620 620 HB2 HIS 75 HB2 HIS 75 -22.406 15.958 -11.428 621 HB3 HIS 75 HB1 HIS 75 -21.392 14.669 -10.777 622 HD2 HIS 75 HD2 HIS 75 -20.219 15.249 -8.300 623 HE1 HIS 75 HE1 HIS 75 -21.467 19.278 -8.059 624 HE2 HIS 75 HE2 HIS 75 -20.355 17.379 -6.798 625 H HIS 76 HN HIS 76 -22.364 14.636 -12.695 626 HA HIS 76 HA HIS 76 -21.494 14.164 -15.477 627 HB2 HIS 76 HB2 HIS 76 -21.740 11.680 -15.193 628 HB3 HIS 76 HB1 HIS 76 -20.360 12.349 -14.325 629 HD2 HIS 76 HD2 HIS 76 -21.470 9.653 -12.972 630 HE1 HIS 76 HE1 HIS 76 -23.565 12.132 -10.270 631 HE2 HIS 76 HE2 HIS 76 -22.712 9.780 -10.681 632 H HIS 77 HN HIS 77 -23.232 13.066 -16.725 633 HA HIS 77 HA HIS 77 -25.947 13.534 -15.521 634 HB2 HIS 77 HB2 HIS 77 -26.598 13.836 -18.013 635 HB3 HIS 77 HB1 HIS 77 -25.722 15.150 -17.229 636 HD2 HIS 77 HD2 HIS 77 -24.330 11.895 -19.092 637 HE1 HIS 77 HE1 HIS 77 -22.275 15.310 -20.492 638 HE2 HIS 77 HE2 HIS 77 -22.463 12.787 -20.681 639 H1 MET 1 HT1 MET 1 -8.005 -12.455 -7.485 640 H2 MET 1 HT2 MET 1 -8.097 -10.804 -7.876 641 H3 MET 1 HT3 MET 1 -6.842 -11.378 -6.884 642 HA MET 1 HA MET 1 -5.568 -11.880 -8.615 643 HB2 MET 1 HB2 MET 1 -7.103 -13.925 -8.798 644 HB3 MET 1 HB1 MET 1 -7.959 -13.041 -10.061 645 HG2 MET 1 HG2 MET 1 -5.755 -12.757 -11.252 646 HG3 MET 1 HG1 MET 1 -5.035 -13.831 -10.052 647 HE1 MET 1 HE1 MET 1 -4.971 -16.101 -12.988 648 HE2 MET 1 HE2 MET 1 -4.256 -14.678 -12.237 649 HE3 MET 1 HE3 MET 1 -5.397 -14.483 -13.563 650 H GLU 2 HN GLU 2 -5.699 -9.449 -8.836 651 HA GLU 2 HA GLU 2 -6.551 -8.760 -11.582 652 HB2 GLU 2 HB2 GLU 2 -8.511 -8.188 -10.206 653 HB3 GLU 2 HB1 GLU 2 -7.487 -7.221 -9.145 654 HG2 GLU 2 HG2 GLU 2 -6.939 -5.713 -11.000 655 HG3 GLU 2 HG1 GLU 2 -7.876 -6.710 -12.112 656 H LEU 3 HN LEU 3 -5.825 -6.526 -8.978 657 HA LEU 3 HA LEU 3 -3.788 -5.176 -10.444 658 HB2 LEU 3 HB2 LEU 3 -4.981 -4.103 -8.616 659 HB3 LEU 3 HB1 LEU 3 -4.343 -5.271 -7.463 660 HG LEU 3 HG LEU 3 -2.264 -3.832 -9.054 661 HD11 LEU 3 HD11 LEU 3 -3.662 -1.922 -8.758 662 HD12 LEU 3 HD12 LEU 3 -2.454 -1.830 -7.478 663 HD13 LEU 3 HD13 LEU 3 -4.085 -2.392 -7.112 664 HD21 LEU 3 HD21 LEU 3 -1.033 -3.962 -7.038 665 HD22 LEU 3 HD22 LEU 3 -1.997 -5.436 -7.009 666 HD23 LEU 3 HD23 LEU 3 -2.487 -4.048 -6.043 667 H SER 4 HN SER 4 -3.499 -7.532 -7.760 668 HA SER 4 HA SER 4 -0.624 -7.597 -7.840 669 HB2 SER 4 HB2 SER 4 -2.188 -8.422 -5.965 670 HB3 SER 4 HB1 SER 4 -2.374 -9.886 -6.926 671 HG SER 4 HG SER 4 0.150 -8.793 -6.253 672 H ASN 5 HN ASN 5 -3.134 -9.619 -9.326 673 HA ASN 5 HA ASN 5 -1.387 -11.538 -10.514 674 HB2 ASN 5 HB2 ASN 5 -3.777 -11.925 -10.303 675 HB3 ASN 5 HB1 ASN 5 -4.128 -10.558 -11.358 676 HD21 ASN 5 HD21 ASN 5 -1.376 -12.639 -12.063 677 HD22 ASN 5 HD22 ASN 5 -2.056 -13.392 -13.422 678 H GLU 6 HN GLU 6 -2.789 -8.532 -11.860 679 HA GLU 6 HA GLU 6 -1.567 -8.844 -14.443 680 HB2 GLU 6 HB2 GLU 6 -3.492 -7.246 -13.708 681 HB3 GLU 6 HB1 GLU 6 -2.197 -6.156 -13.216 682 HG2 GLU 6 HG2 GLU 6 -1.243 -6.588 -15.616 683 HG3 GLU 6 HG1 GLU 6 -2.866 -7.173 -15.976 684 H LEU 7 HN LEU 7 -0.503 -7.412 -11.410 685 HA LEU 7 HA LEU 7 1.756 -5.979 -12.375 686 HB2 LEU 7 HB2 LEU 7 0.862 -5.760 -10.076 687 HB3 LEU 7 HB1 LEU 7 1.378 -7.406 -9.721 688 HG LEU 7 HG LEU 7 3.730 -6.758 -10.133 689 HD11 LEU 7 HD11 LEU 7 4.042 -4.133 -10.168 690 HD12 LEU 7 HD12 LEU 7 2.421 -4.146 -10.861 691 HD13 LEU 7 HD13 LEU 7 3.735 -5.001 -11.670 692 HD21 LEU 7 HD21 LEU 7 2.504 -4.755 -8.229 693 HD22 LEU 7 HD22 LEU 7 4.037 -5.614 -8.074 694 HD23 LEU 7 HD23 LEU 7 2.518 -6.483 -7.869 695 H LYS 8 HN LYS 8 1.426 -9.349 -11.262 696 HA LYS 8 HA LYS 8 4.176 -10.066 -11.584 697 HB2 LYS 8 HB2 LYS 8 2.461 -11.420 -10.351 698 HB3 LYS 8 HB1 LYS 8 1.746 -11.846 -11.906 699 HG2 LYS 8 HG2 LYS 8 3.781 -12.952 -12.612 700 HG3 LYS 8 HG1 LYS 8 4.640 -12.379 -11.183 701 HD2 LYS 8 HD2 LYS 8 4.027 -14.655 -10.730 702 HD3 LYS 8 HD1 LYS 8 2.937 -13.644 -9.784 703 HE2 LYS 8 HE2 LYS 8 1.132 -13.990 -11.299 704 HE3 LYS 8 HE1 LYS 8 2.198 -14.648 -12.540 705 HZ1 LYS 8 HZ1 LYS 8 2.710 -16.329 -10.582 706 HZ2 LYS 8 HZ2 LYS 8 1.435 -16.573 -11.678 707 HZ3 LYS 8 HZ3 LYS 8 1.127 -15.911 -10.144 708 H VAL 9 HN VAL 9 1.432 -10.007 -13.822 709 HA VAL 9 HA VAL 9 2.659 -11.392 -15.990 710 HB VAL 9 HB VAL 9 0.602 -9.162 -16.005 711 HG11 VAL 9 HG11 VAL 9 0.052 -10.184 -18.279 712 HG12 VAL 9 HG12 VAL 9 1.603 -11.017 -18.178 713 HG13 VAL 9 HG13 VAL 9 1.549 -9.254 -18.203 714 HG21 VAL 9 HG21 VAL 9 0.197 -12.137 -16.389 715 HG22 VAL 9 HG22 VAL 9 -1.027 -10.911 -16.057 716 HG23 VAL 9 HG23 VAL 9 0.117 -11.380 -14.799 717 H GLU 10 HN GLU 10 2.640 -7.893 -15.187 718 HA GLU 10 HA GLU 10 4.115 -7.007 -17.444 719 HB2 GLU 10 HB2 GLU 10 3.789 -5.982 -14.624 720 HB3 GLU 10 HB1 GLU 10 4.918 -5.186 -15.719 721 HG2 GLU 10 HG2 GLU 10 2.827 -4.030 -15.914 722 HG3 GLU 10 HG1 GLU 10 3.009 -4.990 -17.380 723 H ARG 11 HN ARG 11 5.210 -8.283 -14.316 724 HA ARG 11 HA ARG 11 7.998 -7.825 -14.647 725 HB2 ARG 11 HB2 ARG 11 6.791 -8.719 -12.574 726 HB3 ARG 11 HB1 ARG 11 6.797 -10.294 -13.365 727 HG2 ARG 11 HG2 ARG 11 9.384 -9.811 -13.660 728 HG3 ARG 11 HG1 ARG 11 9.120 -8.682 -12.331 729 HD2 ARG 11 HD2 ARG 11 9.662 -10.633 -11.167 730 HD3 ARG 11 HD1 ARG 11 7.902 -10.754 -11.214 731 HE ARG 11 HE ARG 11 9.088 -12.004 -13.533 732 HH11 ARG 11 HH21 ARG 11 8.415 -12.340 -10.170 733 HH12 ARG 11 HH22 ARG 11 8.441 -14.072 -10.205 734 HH21 ARG 11 HH11 ARG 11 9.132 -14.253 -13.598 735 HH22 ARG 11 HH12 ARG 11 8.849 -15.156 -12.147 736 H ILE 12 HN ILE 12 5.982 -10.596 -15.605 737 HA ILE 12 HA ILE 12 8.088 -12.148 -16.771 738 HB ILE 12 HB ILE 12 5.100 -12.113 -17.294 739 HG12 ILE 12 HG12 ILE 12 6.788 -14.110 -15.766 740 HG13 ILE 12 HG11 ILE 12 5.985 -12.745 -14.990 741 HG21 ILE 12 HG21 ILE 12 7.299 -13.945 -18.275 742 HG22 ILE 12 HG22 ILE 12 6.070 -13.114 -19.229 743 HG23 ILE 12 HG23 ILE 12 5.617 -14.466 -18.192 744 HD11 ILE 12 HD11 ILE 12 4.647 -14.877 -14.926 745 HD12 ILE 12 HD12 ILE 12 4.543 -14.801 -16.686 746 HD13 ILE 12 HD13 ILE 12 3.811 -13.532 -15.703 747 H ARG 13 HN ARG 13 5.800 -9.788 -18.181 748 HA ARG 13 HA ARG 13 6.538 -10.155 -20.892 749 HB2 ARG 13 HB2 ARG 13 5.575 -7.679 -19.435 750 HB3 ARG 13 HB1 ARG 13 5.763 -7.765 -21.188 751 HG2 ARG 13 HG2 ARG 13 4.230 -9.715 -21.237 752 HG3 ARG 13 HG1 ARG 13 4.003 -9.559 -19.495 753 HD2 ARG 13 HD2 ARG 13 2.150 -8.420 -20.450 754 HD3 ARG 13 HD1 ARG 13 3.271 -7.141 -19.978 755 HE ARG 13 HE ARG 13 4.011 -7.629 -22.570 756 HH11 ARG 13 HH21 ARG 13 0.992 -7.130 -20.984 757 HH12 ARG 13 HH22 ARG 13 0.249 -6.368 -22.350 758 HH21 ARG 13 HH11 ARG 13 3.061 -6.638 -24.361 759 HH22 ARG 13 HH12 ARG 13 1.421 -6.089 -24.263 760 H LEU 14 HN LEU 14 7.919 -7.976 -18.432 761 HA LEU 14 HA LEU 14 10.100 -7.254 -20.326 762 HB2 LEU 14 HB2 LEU 14 9.416 -6.237 -17.549 763 HB3 LEU 14 HB1 LEU 14 10.749 -5.642 -18.538 764 HG LEU 14 HG LEU 14 7.839 -5.614 -19.396 765 HD11 LEU 14 HD11 LEU 14 7.977 -4.059 -17.612 766 HD12 LEU 14 HD12 LEU 14 8.171 -3.085 -19.070 767 HD13 LEU 14 HD13 LEU 14 9.582 -3.513 -18.101 768 HD21 LEU 14 HD21 LEU 14 9.032 -5.511 -21.397 769 HD22 LEU 14 HD22 LEU 14 10.430 -4.733 -20.656 770 HD23 LEU 14 HD23 LEU 14 8.971 -3.800 -20.987 771 H SER 15 HN SER 15 9.409 -9.639 -18.129 772 HA SER 15 HA SER 15 10.716 -11.061 -16.776 773 HB2 SER 15 HB2 SER 15 11.313 -11.977 -18.894 774 HB3 SER 15 HB1 SER 15 12.361 -10.611 -19.272 775 HG SER 15 HG SER 15 12.884 -12.077 -16.951 776 H LEU 16 HN LEU 16 11.024 -9.299 -15.138 777 HA LEU 16 HA LEU 16 13.594 -7.866 -15.229 778 HB2 LEU 16 HB2 LEU 16 11.224 -7.891 -13.390 779 HB3 LEU 16 HB1 LEU 16 12.759 -7.329 -12.735 780 HG LEU 16 HG LEU 16 12.918 -5.745 -14.702 781 HD11 LEU 16 HD11 LEU 16 11.382 -6.871 -16.225 782 HD12 LEU 16 HD12 LEU 16 10.775 -5.253 -15.871 783 HD13 LEU 16 HD13 LEU 16 10.053 -6.657 -15.085 784 HD21 LEU 16 HD21 LEU 16 10.522 -5.486 -12.865 785 HD22 LEU 16 HD22 LEU 16 11.291 -4.157 -13.734 786 HD23 LEU 16 HD23 LEU 16 12.180 -5.024 -12.479 787 H THR 17 HN THR 17 15.186 -8.048 -13.505 788 HA THR 17 HA THR 17 15.580 -10.894 -12.696 789 HB THR 17 HB THR 17 17.935 -9.965 -12.136 790 HG1 THR 17 HG1 THR 17 16.606 -7.774 -13.131 791 HG21 THR 17 HG21 THR 17 16.841 -10.012 -14.958 792 HG22 THR 17 HG22 THR 17 17.585 -11.349 -14.082 793 HG23 THR 17 HG23 THR 17 18.561 -9.965 -14.576 794 H ALA 18 HN ALA 18 15.500 -11.485 -10.585 795 HA ALA 18 HA ALA 18 14.484 -9.692 -8.593 796 HB1 ALA 18 HB1 ALA 18 15.112 -11.602 -7.014 797 HB2 ALA 18 HB2 ALA 18 15.711 -12.451 -8.439 798 HB3 ALA 18 HB3 ALA 18 14.006 -12.016 -8.322 799 H LYS 19 HN LYS 19 17.752 -10.857 -9.341 800 HA LYS 19 HA LYS 19 19.043 -9.821 -7.024 801 HB2 LYS 19 HB2 LYS 19 20.032 -10.307 -9.845 802 HB3 LYS 19 HB1 LYS 19 21.081 -9.858 -8.504 803 HG2 LYS 19 HG2 LYS 19 20.444 -11.854 -7.266 804 HG3 LYS 19 HG1 LYS 19 19.259 -12.276 -8.500 805 HD2 LYS 19 HD2 LYS 19 21.140 -13.628 -9.004 806 HD3 LYS 19 HD1 LYS 19 21.230 -12.297 -10.155 807 HE2 LYS 19 HE2 LYS 19 22.933 -11.191 -8.869 808 HE3 LYS 19 HE1 LYS 19 22.705 -12.288 -7.507 809 HZ1 LYS 19 HZ1 LYS 19 24.593 -12.631 -9.308 810 HZ2 LYS 19 HZ2 LYS 19 23.346 -13.486 -10.085 811 HZ3 LYS 19 HZ3 LYS 19 23.842 -13.933 -8.523 812 H SER 20 HN SER 20 18.519 -8.371 -10.254 813 HA SER 20 HA SER 20 19.866 -5.915 -9.676 814 HB2 SER 20 HB2 SER 20 19.057 -6.838 -11.958 815 HB3 SER 20 HB1 SER 20 17.499 -6.120 -11.550 816 HG SER 20 HG SER 20 20.026 -4.851 -11.816 817 H VAL 21 HN VAL 21 16.394 -6.747 -9.549 818 HA VAL 21 HA VAL 21 15.570 -4.184 -8.553 819 HB VAL 21 HB VAL 21 14.255 -6.907 -8.356 820 HG11 VAL 21 HG11 VAL 21 12.169 -5.418 -8.089 821 HG12 VAL 21 HG12 VAL 21 13.294 -4.124 -7.681 822 HG13 VAL 21 HG13 VAL 21 13.222 -5.577 -6.685 823 HG21 VAL 21 HG21 VAL 21 14.754 -5.828 -10.650 824 HG22 VAL 21 HG22 VAL 21 13.559 -4.613 -10.196 825 HG23 VAL 21 HG23 VAL 21 13.086 -6.307 -10.333 826 H ALA 22 HN ALA 22 16.246 -7.275 -6.896 827 HA ALA 22 HA ALA 22 15.608 -6.364 -4.271 828 HB1 ALA 22 HB1 ALA 22 17.585 -8.487 -5.159 829 HB2 ALA 22 HB2 ALA 22 15.881 -8.742 -4.781 830 HB3 ALA 22 HB3 ALA 22 17.006 -8.274 -3.506 831 H GLU 23 HN GLU 23 18.765 -6.487 -5.957 832 HA GLU 23 HA GLU 23 20.229 -5.332 -3.773 833 HB2 GLU 23 HB2 GLU 23 20.802 -5.454 -6.743 834 HB3 GLU 23 HB1 GLU 23 21.946 -4.825 -5.558 835 HG2 GLU 23 HG2 GLU 23 21.965 -6.966 -4.385 836 HG3 GLU 23 HG1 GLU 23 20.739 -7.606 -5.481 837 H GLU 24 HN GLU 24 18.727 -3.892 -6.667 838 HA GLU 24 HA GLU 24 19.645 -1.226 -6.056 839 HB2 GLU 24 HB2 GLU 24 18.994 -1.971 -8.330 840 HB3 GLU 24 HB1 GLU 24 17.319 -2.094 -7.791 841 HG2 GLU 24 HG2 GLU 24 17.113 0.234 -7.487 842 HG3 GLU 24 HG1 GLU 24 18.860 0.483 -7.472 843 H MET 25 HN MET 25 16.556 -2.926 -5.451 844 HA MET 25 HA MET 25 15.259 -0.648 -4.267 845 HB2 MET 25 HB2 MET 25 14.789 -3.622 -4.042 846 HB3 MET 25 HB1 MET 25 13.807 -2.457 -3.155 847 HG2 MET 25 HG2 MET 25 13.209 -1.348 -5.279 848 HG3 MET 25 HG1 MET 25 14.189 -2.517 -6.162 849 HE1 MET 25 HE1 MET 25 11.651 -3.379 -2.976 850 HE2 MET 25 HE2 MET 25 10.249 -3.034 -3.985 851 HE3 MET 25 HE3 MET 25 11.494 -1.809 -3.775 852 H GLY 26 HN GLY 26 17.252 -3.264 -2.924 853 HA2 GLY 26 HA2 GLY 26 18.700 -2.896 -1.009 854 HA3 GLY 26 HA1 GLY 26 17.618 -1.618 -0.459 855 H ILE 27 HN ILE 27 16.384 -4.701 -1.586 856 HA ILE 27 HA ILE 27 15.758 -5.485 1.247 857 HB ILE 27 HB ILE 27 13.621 -6.454 0.314 858 HG12 ILE 27 HG12 ILE 27 14.232 -4.670 -2.053 859 HG13 ILE 27 HG11 ILE 27 14.476 -6.416 -2.077 860 HG21 ILE 27 HG21 ILE 27 12.451 -4.287 0.246 861 HG22 ILE 27 HG22 ILE 27 13.990 -3.457 0.012 862 HG23 ILE 27 HG23 ILE 27 13.664 -4.300 1.526 863 HD11 ILE 27 HD11 ILE 27 12.128 -6.817 -1.673 864 HD12 ILE 27 HD12 ILE 27 12.252 -5.671 -3.008 865 HD13 ILE 27 HD13 ILE 27 11.833 -5.101 -1.392 866 H SER 28 HN SER 28 15.381 -7.829 1.481 867 HA SER 28 HA SER 28 17.417 -9.353 0.097 868 HB2 SER 28 HB2 SER 28 16.877 -9.810 2.443 869 HB3 SER 28 HB1 SER 28 15.222 -10.221 2.003 870 HG SER 28 HG SER 28 16.680 -12.040 2.236 871 H ARG 29 HN ARG 29 17.015 -11.292 -1.159 872 HA ARG 29 HA ARG 29 15.054 -10.952 -3.213 873 HB2 ARG 29 HB2 ARG 29 16.742 -13.331 -2.394 874 HB3 ARG 29 HB1 ARG 29 15.691 -13.340 -3.811 875 HG2 ARG 29 HG2 ARG 29 16.883 -11.433 -4.759 876 HG3 ARG 29 HG1 ARG 29 17.889 -11.313 -3.317 877 HD2 ARG 29 HD2 ARG 29 17.772 -13.801 -5.035 878 HD3 ARG 29 HD1 ARG 29 18.960 -12.520 -5.281 879 HE ARG 29 HE ARG 29 19.041 -13.288 -2.541 880 HH11 ARG 29 HH21 ARG 29 19.674 -14.484 -5.710 881 HH12 ARG 29 HH22 ARG 29 20.953 -15.537 -5.203 882 HH21 ARG 29 HH11 ARG 29 20.708 -14.653 -1.859 883 HH22 ARG 29 HH12 ARG 29 21.539 -15.631 -3.021 884 H GLN 30 HN GLN 30 15.114 -12.923 -0.274 885 HA GLN 30 HA GLN 30 12.808 -14.489 -0.731 886 HB2 GLN 30 HB2 GLN 30 14.507 -14.514 1.254 887 HB3 GLN 30 HB1 GLN 30 13.436 -13.320 1.986 888 HG2 GLN 30 HG2 GLN 30 12.550 -16.048 0.994 889 HG3 GLN 30 HG1 GLN 30 12.890 -15.655 2.679 890 HE21 GLN 30 HE21 GLN 30 10.340 -15.975 0.593 891 HE22 GLN 30 HE22 GLN 30 9.250 -14.881 1.300 892 H GLN 31 HN GLN 31 13.116 -11.197 0.589 893 HA GLN 31 HA GLN 31 10.310 -10.847 1.114 894 HB2 GLN 31 HB2 GLN 31 12.123 -9.420 2.088 895 HB3 GLN 31 HB1 GLN 31 12.387 -8.721 0.492 896 HG2 GLN 31 HG2 GLN 31 10.933 -7.242 1.766 897 HG3 GLN 31 HG1 GLN 31 9.990 -7.984 0.474 898 HE21 GLN 31 HE21 GLN 31 7.937 -8.017 1.527 899 HE22 GLN 31 HE22 GLN 31 7.639 -8.898 2.947 900 H LEU 32 HN LEU 32 12.363 -10.159 -1.712 901 HA LEU 32 HA LEU 32 10.394 -8.769 -3.240 902 HB2 LEU 32 HB2 LEU 32 12.821 -8.867 -3.819 903 HB3 LEU 32 HB1 LEU 32 12.623 -10.563 -4.256 904 HG LEU 32 HG LEU 32 10.944 -9.905 -5.971 905 HD11 LEU 32 HD11 LEU 32 11.151 -7.299 -6.516 906 HD12 LEU 32 HD12 LEU 32 11.482 -7.197 -4.788 907 HD13 LEU 32 HD13 LEU 32 9.966 -7.893 -5.359 908 HD21 LEU 32 HD21 LEU 32 13.585 -8.430 -6.200 909 HD22 LEU 32 HD22 LEU 32 12.555 -8.929 -7.542 910 HD23 LEU 32 HD23 LEU 32 13.349 -10.144 -6.540 911 H CYS 33 HN CYS 33 11.207 -12.238 -3.050 912 HA CYS 33 HA CYS 33 9.257 -13.070 -4.992 913 HB2 CYS 33 HB2 CYS 33 9.774 -15.275 -4.339 914 HB3 CYS 33 HB1 CYS 33 11.263 -14.396 -3.997 915 HG CYS 33 HG CYS 33 10.373 -14.259 -1.443 916 H ASN 34 HN ASN 34 9.147 -12.440 -1.540 917 HA ASN 34 HA ASN 34 6.595 -13.604 -0.966 918 HB2 ASN 34 HB2 ASN 34 8.293 -12.746 0.718 919 HB3 ASN 34 HB1 ASN 34 7.778 -11.112 0.303 920 HD21 ASN 34 HD21 ASN 34 7.006 -13.903 2.198 921 HD22 ASN 34 HD22 ASN 34 5.519 -13.348 2.798 922 H ILE 35 HN ILE 35 7.561 -10.434 -2.238 923 HA ILE 35 HA ILE 35 4.982 -9.200 -2.136 924 HB ILE 35 HB ILE 35 7.300 -8.800 -4.053 925 HG12 ILE 35 HG12 ILE 35 6.375 -7.122 -1.700 926 HG13 ILE 35 HG11 ILE 35 7.656 -8.326 -1.589 927 HG21 ILE 35 HG21 ILE 35 6.144 -6.542 -4.411 928 HG22 ILE 35 HG22 ILE 35 4.720 -7.266 -3.664 929 HG23 ILE 35 HG23 ILE 35 5.366 -7.935 -5.162 930 HD11 ILE 35 HD11 ILE 35 7.652 -5.688 -3.025 931 HD12 ILE 35 HD12 ILE 35 8.667 -6.989 -3.649 932 HD13 ILE 35 HD13 ILE 35 8.902 -6.402 -2.008 933 H GLU 36 HN GLU 36 6.604 -11.140 -4.644 934 HA GLU 36 HA GLU 36 4.474 -10.976 -6.558 935 HB2 GLU 36 HB2 GLU 36 6.951 -11.821 -6.823 936 HB3 GLU 36 HB1 GLU 36 6.289 -13.381 -6.341 937 HG2 GLU 36 HG2 GLU 36 6.149 -13.380 -8.711 938 HG3 GLU 36 HG1 GLU 36 4.514 -12.995 -8.171 939 H GLN 37 HN GLN 37 4.942 -12.837 -3.665 940 HA GLN 37 HA GLN 37 2.796 -14.764 -4.333 941 HB2 GLN 37 HB2 GLN 37 4.722 -15.620 -3.107 942 HB3 GLN 37 HB1 GLN 37 4.521 -14.391 -1.860 943 HG2 GLN 37 HG2 GLN 37 2.532 -15.372 -1.050 944 HG3 GLN 37 HG1 GLN 37 2.309 -16.344 -2.504 945 HE21 GLN 37 HE21 GLN 37 2.288 -17.625 -0.002 946 HE22 GLN 37 HE22 GLN 37 3.702 -18.545 0.179 947 H SER 38 HN SER 38 2.898 -11.629 -3.352 948 HA SER 38 HA SER 38 1.165 -11.436 -1.133 949 HB2 SER 38 HB2 SER 38 2.316 -9.484 -2.042 950 HB3 SER 38 HB1 SER 38 1.418 -9.623 -3.550 951 HG SER 38 HG SER 38 0.403 -8.114 -2.256 952 H GLU 39 HN GLU 39 -1.060 -11.478 -0.917 953 HA GLU 39 HA GLU 39 -2.626 -12.432 -3.292 954 HB2 GLU 39 HB2 GLU 39 -2.531 -14.030 -1.425 955 HB3 GLU 39 HB1 GLU 39 -3.153 -12.799 -0.326 956 HG2 GLU 39 HG2 GLU 39 -5.248 -12.685 -1.551 957 HG3 GLU 39 HG1 GLU 39 -4.627 -13.778 -2.789 958 H THR 40 HN THR 40 -3.006 -10.460 -0.322 959 HA THR 40 HA THR 40 -5.028 -8.791 -1.797 960 HB THR 40 HB THR 40 -4.807 -9.356 1.179 961 HG1 THR 40 HG1 THR 40 -5.680 -10.983 -0.380 962 HG21 THR 40 HG21 THR 40 -5.674 -7.161 0.967 963 HG22 THR 40 HG22 THR 40 -7.100 -8.188 1.120 964 HG23 THR 40 HG23 THR 40 -6.615 -7.582 -0.464 965 H ALA 41 HN ALA 41 -4.536 -6.659 -2.004 966 HA ALA 41 HA ALA 41 -1.960 -5.699 -1.054 967 HB1 ALA 41 HB1 ALA 41 -2.530 -4.826 -3.155 968 HB2 ALA 41 HB2 ALA 41 -2.942 -3.483 -2.090 969 HB3 ALA 41 HB3 ALA 41 -4.209 -4.551 -2.691 970 HA PRO 42 HA PRO 42 -3.335 -3.849 2.743 971 HB2 PRO 42 HB2 PRO 42 -1.636 -1.705 2.962 972 HB3 PRO 42 HB1 PRO 42 -1.113 -3.384 3.206 973 HG2 PRO 42 HG2 PRO 42 -0.832 -1.651 0.785 974 HG3 PRO 42 HG1 PRO 42 0.346 -2.752 1.524 975 HD2 PRO 42 HD2 PRO 42 -1.102 -3.453 -0.672 976 HD3 PRO 42 HD1 PRO 42 -0.603 -4.643 0.548 977 H VAL 43 HN VAL 43 -4.599 -2.134 3.582 978 HA VAL 43 HA VAL 43 -6.234 -0.713 1.706 979 HB VAL 43 HB VAL 43 -7.073 0.494 3.760 980 HG11 VAL 43 HG11 VAL 43 -7.914 -1.757 2.937 981 HG12 VAL 43 HG12 VAL 43 -8.174 -1.443 4.652 982 HG13 VAL 43 HG13 VAL 43 -6.861 -2.503 4.140 983 HG21 VAL 43 HG21 VAL 43 -4.969 -1.243 5.096 984 HG22 VAL 43 HG22 VAL 43 -6.237 -0.367 5.951 985 HG23 VAL 43 HG23 VAL 43 -5.000 0.520 5.060 986 H VAL 44 HN VAL 44 -3.129 -0.058 2.894 987 HA VAL 44 HA VAL 44 -3.120 2.772 3.096 988 HB VAL 44 HB VAL 44 -0.958 0.866 2.156 989 HG11 VAL 44 HG11 VAL 44 0.545 2.816 2.884 990 HG12 VAL 44 HG12 VAL 44 -0.904 3.818 2.804 991 HG13 VAL 44 HG13 VAL 44 -0.309 3.013 1.353 992 HG21 VAL 44 HG21 VAL 44 -1.934 0.671 4.514 993 HG22 VAL 44 HG22 VAL 44 -1.263 2.273 4.818 994 HG23 VAL 44 HG23 VAL 44 -0.192 0.929 4.420 995 H VAL 45 HN VAL 45 -2.678 0.665 0.249 996 HA VAL 45 HA VAL 45 -2.101 2.716 -1.635 997 HB VAL 45 HB VAL 45 -3.563 0.078 -1.975 998 HG11 VAL 45 HG11 VAL 45 -2.831 0.394 -4.406 999 HG12 VAL 45 HG12 VAL 45 -2.548 2.086 -3.998 1000 HG13 VAL 45 HG13 VAL 45 -4.171 1.406 -3.866 1001 HG21 VAL 45 HG21 VAL 45 -1.202 -0.014 -1.167 1002 HG22 VAL 45 HG22 VAL 45 -0.709 0.891 -2.598 1003 HG23 VAL 45 HG23 VAL 45 -1.399 -0.722 -2.770 1004 H LYS 46 HN LYS 46 -5.234 1.312 -0.640 1005 HA LYS 46 HA LYS 46 -6.847 2.963 -2.336 1006 HB2 LYS 46 HB2 LYS 46 -7.467 1.623 0.315 1007 HB3 LYS 46 HB1 LYS 46 -8.679 2.391 -0.714 1008 HG2 LYS 46 HG2 LYS 46 -8.092 0.877 -2.560 1009 HG3 LYS 46 HG1 LYS 46 -6.862 0.114 -1.553 1010 HD2 LYS 46 HD2 LYS 46 -8.601 -0.582 0.051 1011 HD3 LYS 46 HD1 LYS 46 -9.834 0.176 -0.957 1012 HE2 LYS 46 HE2 LYS 46 -9.245 -1.323 -2.821 1013 HE3 LYS 46 HE1 LYS 46 -8.003 -2.079 -1.824 1014 HZ1 LYS 46 HZ1 LYS 46 -10.634 -1.960 -0.630 1015 HZ2 LYS 46 HZ2 LYS 46 -9.511 -3.234 -0.663 1016 HZ3 LYS 46 HZ3 LYS 46 -10.522 -2.952 -2.000 1017 H TYR 47 HN TYR 47 -5.608 3.385 0.957 1018 HA TYR 47 HA TYR 47 -7.038 5.736 1.636 1019 HB2 TYR 47 HB2 TYR 47 -5.325 4.190 2.984 1020 HB3 TYR 47 HB1 TYR 47 -4.166 5.422 2.491 1021 HD1 TYR 47 HD2 TYR 47 -4.436 7.772 3.240 1022 HD2 TYR 47 HD1 TYR 47 -7.100 4.665 4.527 1023 HE1 TYR 47 HE2 TYR 47 -5.274 9.243 5.058 1024 HE2 TYR 47 HE1 TYR 47 -7.938 6.126 6.329 1025 HH TYR 47 HH TYR 47 -7.511 9.376 6.433 1026 H ILE 48 HN ILE 48 -3.937 5.326 -0.063 1027 HA ILE 48 HA ILE 48 -3.317 8.099 -0.335 1028 HB ILE 48 HB ILE 48 -2.647 5.724 -2.099 1029 HG12 ILE 48 HG12 ILE 48 -0.930 7.227 -0.108 1030 HG13 ILE 48 HG11 ILE 48 -1.836 5.770 0.306 1031 HG21 ILE 48 HG21 ILE 48 -0.778 7.239 -2.897 1032 HG22 ILE 48 HG22 ILE 48 -1.623 8.569 -2.115 1033 HG23 ILE 48 HG23 ILE 48 -2.387 7.707 -3.448 1034 HD11 ILE 48 HD11 ILE 48 0.423 5.117 -0.285 1035 HD12 ILE 48 HD12 ILE 48 0.331 6.022 -1.796 1036 HD13 ILE 48 HD13 ILE 48 -0.663 4.583 -1.568 1037 H ALA 49 HN ALA 49 -5.157 5.857 -2.393 1038 HA ALA 49 HA ALA 49 -5.700 7.660 -4.523 1039 HB1 ALA 49 HB1 ALA 49 -7.325 5.349 -3.422 1040 HB2 ALA 49 HB2 ALA 49 -6.195 5.302 -4.774 1041 HB3 ALA 49 HB3 ALA 49 -7.709 6.192 -4.922 1042 H PHE 50 HN PHE 50 -7.259 7.198 -1.384 1043 HA PHE 50 HA PHE 50 -9.518 8.888 -1.977 1044 HB2 PHE 50 HB2 PHE 50 -9.139 7.131 -0.038 1045 HB3 PHE 50 HB1 PHE 50 -8.490 8.520 0.833 1046 HD1 PHE 50 HD2 PHE 50 -11.416 7.647 -1.353 1047 HD2 PHE 50 HD1 PHE 50 -10.006 9.796 2.088 1048 HE1 PHE 50 HE2 PHE 50 -13.728 8.398 -0.874 1049 HE2 PHE 50 HE1 PHE 50 -12.324 10.545 2.568 1050 HZ PHE 50 HZ PHE 50 -14.184 9.844 1.087 1051 H LEU 51 HN LEU 51 -6.238 9.523 -0.868 1052 HA LEU 51 HA LEU 51 -6.795 12.209 0.081 1053 HB2 LEU 51 HB2 LEU 51 -4.215 10.888 -0.799 1054 HB3 LEU 51 HB1 LEU 51 -4.310 12.478 -0.043 1055 HG LEU 51 HG LEU 51 -5.370 9.928 1.206 1056 HD11 LEU 51 HD11 LEU 51 -3.406 9.911 2.576 1057 HD12 LEU 51 HD12 LEU 51 -2.867 11.462 1.938 1058 HD13 LEU 51 HD13 LEU 51 -2.858 10.030 0.907 1059 HD21 LEU 51 HD21 LEU 51 -6.544 11.617 2.296 1060 HD22 LEU 51 HD22 LEU 51 -5.279 12.820 2.041 1061 HD23 LEU 51 HD23 LEU 51 -5.087 11.584 3.284 1062 H ARG 52 HN ARG 52 -5.295 10.971 -2.933 1063 HA ARG 52 HA ARG 52 -5.114 13.574 -4.154 1064 HB2 ARG 52 HB2 ARG 52 -4.952 12.216 -6.305 1065 HB3 ARG 52 HB1 ARG 52 -3.746 11.833 -5.076 1066 HG2 ARG 52 HG2 ARG 52 -4.764 9.802 -4.511 1067 HG3 ARG 52 HG1 ARG 52 -6.339 10.303 -5.122 1068 HD2 ARG 52 HD2 ARG 52 -4.047 10.040 -7.049 1069 HD3 ARG 52 HD1 ARG 52 -4.893 8.592 -6.510 1070 HE ARG 52 HE ARG 52 -6.007 10.702 -8.227 1071 HH11 ARG 52 HH21 ARG 52 -6.547 8.028 -6.111 1072 HH12 ARG 52 HH22 ARG 52 -8.117 7.673 -6.746 1073 HH21 ARG 52 HH11 ARG 52 -8.068 10.253 -9.057 1074 HH22 ARG 52 HH12 ARG 52 -8.977 8.929 -8.407 1075 H SER 53 HN SER 53 -7.686 11.318 -3.705 1076 HA SER 53 HA SER 53 -9.385 11.992 -5.878 1077 HB2 SER 53 HB2 SER 53 -9.989 11.094 -3.053 1078 HB3 SER 53 HB1 SER 53 -11.246 11.322 -4.262 1079 HG SER 53 HG SER 53 -9.727 9.911 -5.578 1080 H LYS 54 HN LYS 54 -8.753 13.620 -2.814 1081 HA LYS 54 HA LYS 54 -10.858 15.637 -3.348 1082 HB2 LYS 54 HB2 LYS 54 -9.027 15.013 -1.036 1083 HB3 LYS 54 HB1 LYS 54 -9.776 16.605 -1.141 1084 HG2 LYS 54 HG2 LYS 54 -11.187 15.132 0.202 1085 HG3 LYS 54 HG1 LYS 54 -12.010 15.513 -1.310 1086 HD2 LYS 54 HD2 LYS 54 -11.347 13.369 -2.260 1087 HD3 LYS 54 HD1 LYS 54 -10.392 12.992 -0.826 1088 HE2 LYS 54 HE2 LYS 54 -12.440 13.027 0.545 1089 HE3 LYS 54 HE1 LYS 54 -13.394 13.424 -0.884 1090 HZ1 LYS 54 HZ1 LYS 54 -11.912 10.928 -0.311 1091 HZ2 LYS 54 HZ2 LYS 54 -12.432 11.328 -1.879 1092 HZ3 LYS 54 HZ3 LYS 54 -13.567 11.116 -0.632 1093 H GLY 55 HN GLY 55 -7.935 15.165 -4.632 1094 HA2 GLY 55 HA2 GLY 55 -6.708 16.711 -5.959 1095 HA3 GLY 55 HA1 GLY 55 -7.551 18.038 -5.164 1096 H VAL 56 HN VAL 56 -6.189 15.604 -3.120 1097 HA VAL 56 HA VAL 56 -4.545 17.442 -1.694 1098 HB VAL 56 HB VAL 56 -4.426 14.417 -1.889 1099 HG11 VAL 56 HG11 VAL 56 -2.252 15.051 -1.166 1100 HG12 VAL 56 HG12 VAL 56 -3.132 14.692 0.319 1101 HG13 VAL 56 HG13 VAL 56 -2.881 16.366 -0.174 1102 HG21 VAL 56 HG21 VAL 56 -5.669 14.427 0.146 1103 HG22 VAL 56 HG22 VAL 56 -6.462 15.628 -0.876 1104 HG23 VAL 56 HG23 VAL 56 -5.370 16.145 0.407 1105 H ASP 57 HN ASP 57 -2.296 17.810 -1.779 1106 HA ASP 57 HA ASP 57 -1.088 17.642 -4.408 1107 HB2 ASP 57 HB2 ASP 57 -0.197 18.585 -1.685 1108 HB3 ASP 57 HB1 ASP 57 0.999 18.386 -2.962 1109 H LEU 58 HN LEU 58 -1.789 15.097 -3.731 1110 HA LEU 58 HA LEU 58 0.154 13.520 -2.395 1111 HB2 LEU 58 HB2 LEU 58 -2.288 13.021 -3.359 1112 HB3 LEU 58 HB1 LEU 58 -1.381 12.441 -4.747 1113 HG LEU 58 HG LEU 58 -1.760 10.568 -3.285 1114 HD11 LEU 58 HD11 LEU 58 0.562 10.966 -4.332 1115 HD12 LEU 58 HD12 LEU 58 0.448 9.780 -3.035 1116 HD13 LEU 58 HD13 LEU 58 1.080 11.388 -2.697 1117 HD21 LEU 58 HD21 LEU 58 -1.575 10.592 -0.983 1118 HD22 LEU 58 HD22 LEU 58 -1.888 12.307 -1.210 1119 HD23 LEU 58 HD23 LEU 58 -0.236 11.735 -0.980 1120 H ASN 59 HN ASN 59 -0.166 14.509 -5.788 1121 HA ASN 59 HA ASN 59 1.966 12.966 -6.877 1122 HB2 ASN 59 HB2 ASN 59 1.116 15.766 -7.696 1123 HB3 ASN 59 HB1 ASN 59 1.928 14.570 -8.708 1124 HD21 ASN 59 HD21 ASN 59 -1.152 15.361 -7.133 1125 HD22 ASN 59 HD22 ASN 59 -2.089 14.248 -8.008 1126 H ALA 60 HN ALA 60 1.894 16.149 -5.321 1127 HA ALA 60 HA ALA 60 4.641 16.805 -5.739 1128 HB1 ALA 60 HB1 ALA 60 4.264 18.607 -4.303 1129 HB2 ALA 60 HB2 ALA 60 3.185 17.685 -3.257 1130 HB3 ALA 60 HB3 ALA 60 2.622 18.246 -4.831 1131 H LEU 61 HN LEU 61 2.985 14.936 -3.232 1132 HA LEU 61 HA LEU 61 5.116 14.740 -1.363 1133 HB2 LEU 61 HB2 LEU 61 2.601 13.936 -1.292 1134 HB3 LEU 61 HB1 LEU 61 3.261 12.424 -1.904 1135 HG LEU 61 HG LEU 61 4.075 13.841 0.653 1136 HD11 LEU 61 HD11 LEU 61 1.988 12.745 0.990 1137 HD12 LEU 61 HD12 LEU 61 3.201 11.624 1.611 1138 HD13 LEU 61 HD13 LEU 61 2.477 11.350 0.029 1139 HD21 LEU 61 HD21 LEU 61 5.345 11.593 0.959 1140 HD22 LEU 61 HD22 LEU 61 6.057 12.801 -0.107 1141 HD23 LEU 61 HD23 LEU 61 5.184 11.426 -0.790 1142 H PHE 62 HN PHE 62 4.249 12.555 -4.073 1143 HA PHE 62 HA PHE 62 6.590 10.884 -3.708 1144 HB2 PHE 62 HB2 PHE 62 4.441 11.156 -5.787 1145 HB3 PHE 62 HB1 PHE 62 5.915 10.303 -6.242 1146 HD1 PHE 62 HD2 PHE 62 6.681 8.338 -4.871 1147 HD2 PHE 62 HD1 PHE 62 2.814 10.134 -4.352 1148 HE1 PHE 62 HE2 PHE 62 5.899 6.305 -3.690 1149 HE2 PHE 62 HE1 PHE 62 2.033 8.093 -3.171 1150 HZ PHE 62 HZ PHE 62 3.574 6.185 -2.840 1151 H ASP 63 HN ASP 63 5.865 13.727 -5.682 1152 HA ASP 63 HA ASP 63 8.011 13.701 -7.472 1153 HB2 ASP 63 HB2 ASP 63 6.339 15.458 -7.566 1154 HB3 ASP 63 HB1 ASP 63 6.809 16.044 -5.971 1155 H ARG 64 HN ARG 64 8.032 14.822 -4.067 1156 HA ARG 64 HA ARG 64 10.739 15.725 -4.079 1157 HB2 ARG 64 HB2 ARG 64 9.124 14.550 -1.788 1158 HB3 ARG 64 HB1 ARG 64 10.654 15.411 -1.607 1159 HG2 ARG 64 HG2 ARG 64 9.643 17.405 -2.685 1160 HG3 ARG 64 HG1 ARG 64 8.107 16.547 -2.805 1161 HD2 ARG 64 HD2 ARG 64 7.755 17.696 -0.817 1162 HD3 ARG 64 HD1 ARG 64 8.500 16.234 -0.172 1163 HE ARG 64 HE ARG 64 10.308 18.480 -0.853 1164 HH11 ARG 64 HH21 ARG 64 8.663 16.573 1.529 1165 HH12 ARG 64 HH22 ARG 64 9.598 17.200 2.842 1166 HH21 ARG 64 HH11 ARG 64 11.498 19.303 0.854 1167 HH22 ARG 64 HH12 ARG 64 11.194 18.742 2.465 1168 H ILE 65 HN ILE 65 9.314 12.520 -3.645 1169 HA ILE 65 HA ILE 65 11.893 11.287 -2.998 1170 HB ILE 65 HB ILE 65 9.217 10.067 -3.742 1171 HG12 ILE 65 HG12 ILE 65 10.582 10.250 -1.044 1172 HG13 ILE 65 HG11 ILE 65 9.384 11.421 -1.597 1173 HG21 ILE 65 HG21 ILE 65 11.839 8.875 -2.823 1174 HG22 ILE 65 HG22 ILE 65 10.877 8.432 -4.234 1175 HG23 ILE 65 HG23 ILE 65 10.306 8.031 -2.615 1176 HD11 ILE 65 HD11 ILE 65 8.887 8.436 -1.460 1177 HD12 ILE 65 HD12 ILE 65 7.699 9.695 -1.798 1178 HD13 ILE 65 HD13 ILE 65 8.418 9.570 -0.193 1179 H ILE 66 HN ILE 66 9.615 10.536 -5.659 1180 HA ILE 66 HA ILE 66 11.856 9.648 -7.332 1181 HB ILE 66 HB ILE 66 10.055 9.161 -9.003 1182 HG12 ILE 66 HG12 ILE 66 8.182 10.064 -6.798 1183 HG13 ILE 66 HG11 ILE 66 8.548 11.036 -8.220 1184 HG21 ILE 66 HG21 ILE 66 9.376 8.135 -6.234 1185 HG22 ILE 66 HG22 ILE 66 10.763 7.568 -7.165 1186 HG23 ILE 66 HG23 ILE 66 9.129 7.309 -7.773 1187 HD11 ILE 66 HD11 ILE 66 6.480 9.783 -8.570 1188 HD12 ILE 66 HD12 ILE 66 7.320 8.270 -8.231 1189 HD13 ILE 66 HD13 ILE 66 7.733 9.206 -9.669 1190 H VAL 67 HN VAL 67 12.699 10.718 -9.090 1191 HA VAL 67 HA VAL 67 12.039 13.591 -9.346 1192 HB VAL 67 HB VAL 67 14.119 11.999 -10.869 1193 HG11 VAL 67 HG11 VAL 67 13.864 14.936 -10.151 1194 HG12 VAL 67 HG12 VAL 67 13.629 14.235 -11.752 1195 HG13 VAL 67 HG13 VAL 67 15.227 14.214 -11.008 1196 HG21 VAL 67 HG21 VAL 67 14.618 11.607 -8.560 1197 HG22 VAL 67 HG22 VAL 67 14.241 13.274 -8.125 1198 HG23 VAL 67 HG23 VAL 67 15.685 12.914 -9.072 1199 H ASN 68 HN ASN 68 10.398 14.100 -10.740 1200 HA ASN 68 HA ASN 68 9.896 12.334 -13.096 1201 HB2 ASN 68 HB2 ASN 68 7.819 13.993 -13.217 1202 HB3 ASN 68 HB1 ASN 68 7.838 12.668 -12.054 1203 HD21 ASN 68 HD21 ASN 68 9.496 15.868 -12.007 1204 HD22 ASN 68 HD22 ASN 68 8.858 16.338 -10.507 1205 H LYS 69 HN LYS 69 11.235 12.962 -14.735 1206 HA LYS 69 HA LYS 69 10.774 15.426 -16.120 1207 HB2 LYS 69 HB2 LYS 69 12.111 16.359 -14.229 1208 HB3 LYS 69 HB1 LYS 69 13.431 15.274 -14.662 1209 HG2 LYS 69 HG2 LYS 69 13.608 16.311 -16.868 1210 HG3 LYS 69 HG1 LYS 69 12.222 17.343 -16.519 1211 HD2 LYS 69 HD2 LYS 69 13.467 18.380 -14.652 1212 HD3 LYS 69 HD1 LYS 69 14.859 17.358 -15.020 1213 HE2 LYS 69 HE2 LYS 69 15.016 18.350 -17.264 1214 HE3 LYS 69 HE1 LYS 69 13.603 19.352 -16.929 1215 HZ1 LYS 69 HZ1 LYS 69 16.327 19.729 -16.143 1216 HZ2 LYS 69 HZ2 LYS 69 15.263 19.819 -14.822 1217 HZ3 LYS 69 HZ3 LYS 69 15.045 20.839 -16.163 1218 H LEU 70 HN LEU 70 11.876 15.435 -18.159 1219 HA LEU 70 HA LEU 70 12.382 12.984 -19.370 1220 HB2 LEU 70 HB2 LEU 70 12.086 15.036 -20.660 1221 HB3 LEU 70 HB1 LEU 70 13.596 15.682 -20.025 1222 HG LEU 70 HG LEU 70 14.861 13.904 -21.138 1223 HD11 LEU 70 HD11 LEU 70 13.485 12.000 -21.159 1224 HD12 LEU 70 HD12 LEU 70 13.450 12.503 -22.846 1225 HD13 LEU 70 HD13 LEU 70 12.096 12.888 -21.784 1226 HD21 LEU 70 HD21 LEU 70 12.861 15.300 -22.936 1227 HD22 LEU 70 HD22 LEU 70 14.355 14.546 -23.493 1228 HD23 LEU 70 HD23 LEU 70 14.420 15.936 -22.410 1229 H GLU 71 HN GLU 71 15.054 15.255 -18.771 1230 HA GLU 71 HA GLU 71 17.288 14.865 -18.244 1231 HB2 GLU 71 HB2 GLU 71 15.889 12.760 -16.596 1232 HB3 GLU 71 HB1 GLU 71 17.626 13.041 -16.496 1233 HG2 GLU 71 HG2 GLU 71 17.292 15.318 -15.791 1234 HG3 GLU 71 HG1 GLU 71 15.562 15.223 -16.118 1235 H HIS 72 HN HIS 72 17.371 11.580 -17.629 1236 HA HIS 72 HA HIS 72 18.231 9.744 -18.786 1237 HB2 HIS 72 HB2 HIS 72 17.218 11.138 -21.290 1238 HB3 HIS 72 HB1 HIS 72 17.697 9.454 -21.148 1239 HD2 HIS 72 HD2 HIS 72 15.857 9.873 -17.995 1240 HE1 HIS 72 HE1 HIS 72 12.789 9.144 -20.806 1241 HE2 HIS 72 HE2 HIS 72 13.350 9.235 -18.333 1242 H HIS 73 HN HIS 73 19.038 12.954 -19.976 1243 HA HIS 73 HA HIS 73 21.366 12.252 -21.469 1244 HB2 HIS 73 HB2 HIS 73 20.157 14.447 -21.575 1245 HB3 HIS 73 HB1 HIS 73 20.788 14.830 -19.975 1246 HD2 HIS 73 HD2 HIS 73 22.336 16.945 -21.212 1247 HE1 HIS 73 HE1 HIS 73 25.036 14.309 -23.109 1248 HE2 HIS 73 HE2 HIS 73 24.609 16.727 -22.470 1249 H HIS 74 HN HIS 74 23.491 13.655 -20.401 1250 HA HIS 74 HA HIS 74 24.931 11.982 -18.854 1251 HB2 HIS 74 HB2 HIS 74 26.233 13.866 -18.037 1252 HB3 HIS 74 HB1 HIS 74 25.744 14.175 -19.701 1253 HD2 HIS 74 HD2 HIS 74 24.722 15.402 -16.068 1254 HE1 HIS 74 HE1 HIS 74 23.256 18.165 -18.908 1255 HE2 HIS 74 HE2 HIS 74 23.550 17.705 -16.431 1256 H HIS 75 HN HIS 75 24.822 11.078 -16.899 1257 HA HIS 75 HA HIS 75 22.655 11.731 -15.080 1258 HB2 HIS 75 HB2 HIS 75 24.082 10.005 -13.616 1259 HB3 HIS 75 HB1 HIS 75 23.129 9.454 -14.991 1260 HD2 HIS 75 HD2 HIS 75 26.899 10.785 -14.710 1261 HE1 HIS 75 HE1 HIS 75 26.749 7.475 -17.330 1262 HE2 HIS 75 HE2 HIS 75 28.273 9.197 -16.259 1263 H HIS 76 HN HIS 76 23.440 11.774 -12.594 1264 HA HIS 76 HA HIS 76 24.772 14.322 -12.273 1265 HB2 HIS 76 HB2 HIS 76 24.603 13.716 -9.798 1266 HB3 HIS 76 HB1 HIS 76 23.076 13.777 -10.677 1267 HD2 HIS 76 HD2 HIS 76 25.277 11.177 -8.790 1268 HE1 HIS 76 HE1 HIS 76 21.999 9.088 -10.444 1269 HE2 HIS 76 HE2 HIS 76 23.982 8.914 -8.871 1270 H HIS 77 HN HIS 77 26.576 12.783 -13.626 1271 HA HIS 77 HA HIS 77 28.791 12.019 -13.567 1272 HB2 HIS 77 HB2 HIS 77 28.892 13.410 -10.877 1273 HB3 HIS 77 HB1 HIS 77 30.234 13.101 -11.978 1274 HD2 HIS 77 HD2 HIS 77 30.530 16.018 -12.089 1275 HE1 HIS 77 HE1 HIS 77 27.123 16.552 -14.526 1276 HE2 HIS 77 HE2 HIS 77 29.203 17.674 -13.604 Start of MODEL 14 1 H1 MET 1 HT1 MET 1 9.098 14.109 4.484 2 H2 MET 1 HT2 MET 1 9.796 15.589 4.947 3 H3 MET 1 HT3 MET 1 8.139 15.308 5.203 4 HA MET 1 HA MET 1 10.428 14.029 6.581 5 HB2 MET 1 HB2 MET 1 9.660 16.259 7.391 6 HB3 MET 1 HB1 MET 1 8.041 15.594 7.607 7 HG2 MET 1 HG2 MET 1 8.873 13.981 9.235 8 HG3 MET 1 HG1 MET 1 10.530 14.515 8.959 9 HE1 MET 1 HE1 MET 1 7.213 16.936 9.346 10 HE2 MET 1 HE2 MET 1 7.102 16.621 11.075 11 HE3 MET 1 HE3 MET 1 7.064 15.277 9.939 12 H GLU 2 HN GLU 2 9.769 11.933 5.738 13 HA GLU 2 HA GLU 2 8.663 9.879 5.886 14 HB2 GLU 2 HB2 GLU 2 7.592 11.070 8.464 15 HB3 GLU 2 HB1 GLU 2 7.568 9.366 8.026 16 HG2 GLU 2 HG2 GLU 2 10.084 11.032 8.282 17 HG3 GLU 2 HG1 GLU 2 9.478 9.936 9.524 18 H LEU 3 HN LEU 3 6.760 8.959 5.207 19 HA LEU 3 HA LEU 3 4.770 10.636 4.017 20 HB2 LEU 3 HB2 LEU 3 4.820 7.678 4.657 21 HB3 LEU 3 HB1 LEU 3 3.508 8.438 3.764 22 HG LEU 3 HG LEU 3 6.402 8.712 2.915 23 HD11 LEU 3 HD11 LEU 3 4.376 6.631 2.038 24 HD12 LEU 3 HD12 LEU 3 5.832 6.317 2.984 25 HD13 LEU 3 HD13 LEU 3 5.966 6.876 1.316 26 HD21 LEU 3 HD21 LEU 3 5.120 8.966 0.646 27 HD22 LEU 3 HD22 LEU 3 5.092 10.319 1.768 28 HD23 LEU 3 HD23 LEU 3 3.702 9.244 1.651 29 H SER 4 HN SER 4 4.797 8.780 7.038 30 HA SER 4 HA SER 4 2.159 8.923 7.862 31 HB2 SER 4 HB2 SER 4 4.516 9.592 9.647 32 HB3 SER 4 HB1 SER 4 2.968 8.918 10.152 33 HG SER 4 HG SER 4 4.919 7.722 8.468 34 H ASN 5 HN ASN 5 4.564 11.490 8.511 35 HA ASN 5 HA ASN 5 2.632 13.353 9.523 36 HB2 ASN 5 HB2 ASN 5 4.997 13.631 10.022 37 HB3 ASN 5 HB1 ASN 5 5.373 13.804 8.307 38 HD21 ASN 5 HD21 ASN 5 4.821 15.824 7.257 39 HD22 ASN 5 HD22 ASN 5 4.346 17.193 8.141 40 H GLU 6 HN GLU 6 4.000 12.856 6.286 41 HA GLU 6 HA GLU 6 2.902 15.139 5.033 42 HB2 GLU 6 HB2 GLU 6 4.468 13.067 4.209 43 HB3 GLU 6 HB1 GLU 6 2.954 12.609 3.438 44 HG2 GLU 6 HG2 GLU 6 3.993 13.973 1.823 45 HG3 GLU 6 HG1 GLU 6 2.872 15.077 2.618 46 H LEU 7 HN LEU 7 1.470 11.869 5.343 47 HA LEU 7 HA LEU 7 -0.990 12.540 4.025 48 HB2 LEU 7 HB2 LEU 7 -0.110 10.371 5.914 49 HB3 LEU 7 HB1 LEU 7 -1.833 10.564 5.606 50 HG LEU 7 HG LEU 7 -1.417 10.370 3.175 51 HD11 LEU 7 HD11 LEU 7 1.449 9.838 4.025 52 HD12 LEU 7 HD12 LEU 7 0.884 11.239 3.113 53 HD13 LEU 7 HD13 LEU 7 0.814 9.631 2.391 54 HD21 LEU 7 HD21 LEU 7 -0.076 8.066 4.602 55 HD22 LEU 7 HD22 LEU 7 -1.087 8.011 3.159 56 HD23 LEU 7 HD23 LEU 7 -1.810 8.367 4.727 57 H LYS 8 HN LYS 8 0.037 12.705 7.419 58 HA LYS 8 HA LYS 8 -2.482 13.503 8.513 59 HB2 LYS 8 HB2 LYS 8 0.368 14.026 9.398 60 HB3 LYS 8 HB1 LYS 8 -1.036 14.530 10.339 61 HG2 LYS 8 HG2 LYS 8 -1.810 12.230 10.503 62 HG3 LYS 8 HG1 LYS 8 -0.515 11.684 9.444 63 HD2 LYS 8 HD2 LYS 8 0.261 11.200 11.636 64 HD3 LYS 8 HD1 LYS 8 1.106 12.676 11.174 65 HE2 LYS 8 HE2 LYS 8 -0.361 14.036 12.494 66 HE3 LYS 8 HE1 LYS 8 -1.486 12.701 12.745 67 HZ1 LYS 8 HZ1 LYS 8 0.468 13.400 14.445 68 HZ2 LYS 8 HZ2 LYS 8 1.222 12.155 13.568 69 HZ3 LYS 8 HZ3 LYS 8 -0.243 11.862 14.378 70 H VAL 9 HN VAL 9 0.177 15.360 7.074 71 HA VAL 9 HA VAL 9 -0.804 17.964 7.690 72 HB VAL 9 HB VAL 9 0.867 16.919 5.384 73 HG11 VAL 9 HG11 VAL 9 0.007 19.738 6.061 74 HG12 VAL 9 HG12 VAL 9 -0.103 18.911 4.508 75 HG13 VAL 9 HG13 VAL 9 1.470 19.407 5.132 76 HG21 VAL 9 HG21 VAL 9 2.722 17.685 6.640 77 HG22 VAL 9 HG22 VAL 9 1.669 16.970 7.860 78 HG23 VAL 9 HG23 VAL 9 1.719 18.719 7.657 79 H GLU 10 HN GLU 10 -1.369 15.904 4.813 80 HA GLU 10 HA GLU 10 -3.141 17.766 3.526 81 HB2 GLU 10 HB2 GLU 10 -3.012 14.740 3.286 82 HB3 GLU 10 HB1 GLU 10 -3.788 15.835 2.138 83 HG2 GLU 10 HG2 GLU 10 -0.852 15.941 2.886 84 HG3 GLU 10 HG1 GLU 10 -1.478 15.163 1.432 85 H ARG 11 HN ARG 11 -3.616 15.136 5.834 86 HA ARG 11 HA ARG 11 -6.470 15.043 5.791 87 HB2 ARG 11 HB2 ARG 11 -5.064 13.340 6.904 88 HB3 ARG 11 HB1 ARG 11 -4.548 14.536 8.089 89 HG2 ARG 11 HG2 ARG 11 -6.929 14.805 8.800 90 HG3 ARG 11 HG1 ARG 11 -7.371 13.532 7.667 91 HD2 ARG 11 HD2 ARG 11 -5.988 11.928 8.841 92 HD3 ARG 11 HD1 ARG 11 -5.362 13.196 9.896 93 HE ARG 11 HE ARG 11 -8.295 12.776 9.932 94 HH11 ARG 11 HH21 ARG 11 -5.184 12.230 11.354 95 HH12 ARG 11 HH22 ARG 11 -5.824 11.903 12.928 96 HH21 ARG 11 HH11 ARG 11 -9.126 12.353 11.983 97 HH22 ARG 11 HH12 ARG 11 -8.047 11.971 13.283 98 H ILE 12 HN ILE 12 -4.222 16.926 7.813 99 HA ILE 12 HA ILE 12 -6.256 18.255 9.337 100 HB ILE 12 HB ILE 12 -3.399 19.030 8.684 101 HG12 ILE 12 HG12 ILE 12 -4.567 17.965 11.265 102 HG13 ILE 12 HG11 ILE 12 -3.923 16.901 10.015 103 HG21 ILE 12 HG21 ILE 12 -4.474 21.063 9.311 104 HG22 ILE 12 HG22 ILE 12 -3.715 20.473 10.789 105 HG23 ILE 12 HG23 ILE 12 -5.448 20.257 10.540 106 HD11 ILE 12 HD11 ILE 12 -1.764 18.174 10.126 107 HD12 ILE 12 HD12 ILE 12 -2.165 17.339 11.627 108 HD13 ILE 12 HD13 ILE 12 -2.420 19.079 11.491 109 H ARG 13 HN ARG 13 -4.468 19.211 6.406 110 HA ARG 13 HA ARG 13 -5.715 21.786 6.140 111 HB2 ARG 13 HB2 ARG 13 -3.627 21.122 4.953 112 HB3 ARG 13 HB1 ARG 13 -4.571 20.008 3.964 113 HG2 ARG 13 HG2 ARG 13 -5.921 21.897 3.117 114 HG3 ARG 13 HG1 ARG 13 -4.978 23.011 4.110 115 HD2 ARG 13 HD2 ARG 13 -3.768 21.192 2.023 116 HD3 ARG 13 HD1 ARG 13 -4.218 22.866 1.708 117 HE ARG 13 HE ARG 13 -2.617 23.348 3.740 118 HH11 ARG 13 HH21 ARG 13 -2.228 20.829 1.372 119 HH12 ARG 13 HH22 ARG 13 -0.507 20.803 1.523 120 HH21 ARG 13 HH11 ARG 13 -0.386 23.302 3.911 121 HH22 ARG 13 HH12 ARG 13 0.530 22.194 2.947 122 H LEU 14 HN LEU 14 -6.479 18.598 4.778 123 HA LEU 14 HA LEU 14 -8.934 19.671 3.516 124 HB2 LEU 14 HB2 LEU 14 -7.853 16.835 3.620 125 HB3 LEU 14 HB1 LEU 14 -9.168 17.408 2.596 126 HG LEU 14 HG LEU 14 -6.310 18.424 2.492 127 HD11 LEU 14 HD11 LEU 14 -6.658 16.070 1.674 128 HD12 LEU 14 HD12 LEU 14 -6.112 17.186 0.423 129 HD13 LEU 14 HD13 LEU 14 -7.807 16.706 0.496 130 HD21 LEU 14 HD21 LEU 14 -7.610 20.213 1.704 131 HD22 LEU 14 HD22 LEU 14 -8.852 19.152 1.039 132 HD23 LEU 14 HD23 LEU 14 -7.301 19.320 0.217 133 H SER 15 HN SER 15 -8.072 18.797 6.548 134 HA SER 15 HA SER 15 -9.172 17.776 8.386 135 HB2 SER 15 HB2 SER 15 -11.038 19.079 9.018 136 HB3 SER 15 HB1 SER 15 -10.107 20.146 7.972 137 HG SER 15 HG SER 15 -11.663 18.778 6.388 138 H LEU 16 HN LEU 16 -9.215 15.597 7.503 139 HA LEU 16 HA LEU 16 -11.906 14.731 6.470 140 HB2 LEU 16 HB2 LEU 16 -9.260 13.258 6.369 141 HB3 LEU 16 HB1 LEU 16 -10.762 12.765 5.596 142 HG LEU 16 HG LEU 16 -9.342 15.378 5.006 143 HD11 LEU 16 HD11 LEU 16 -9.171 12.660 3.701 144 HD12 LEU 16 HD12 LEU 16 -7.857 13.729 4.191 145 HD13 LEU 16 HD13 LEU 16 -8.845 14.133 2.787 146 HD21 LEU 16 HD21 LEU 16 -11.614 15.615 4.384 147 HD22 LEU 16 HD22 LEU 16 -11.740 13.938 3.857 148 HD23 LEU 16 HD23 LEU 16 -10.834 15.102 2.894 149 H THR 17 HN THR 17 -13.099 13.326 7.669 150 HA THR 17 HA THR 17 -12.176 12.763 10.415 151 HB THR 17 HB THR 17 -14.557 11.797 10.585 152 HG1 THR 17 HG1 THR 17 -14.360 12.190 7.975 153 HG21 THR 17 HG21 THR 17 -14.041 13.992 11.459 154 HG22 THR 17 HG22 THR 17 -15.557 14.104 10.565 155 HG23 THR 17 HG23 THR 17 -14.061 14.690 9.839 156 H ALA 18 HN ALA 18 -11.698 10.780 11.221 157 HA ALA 18 HA ALA 18 -10.881 8.684 9.451 158 HB1 ALA 18 HB1 ALA 18 -9.975 9.078 11.768 159 HB2 ALA 18 HB2 ALA 18 -10.438 7.403 11.470 160 HB3 ALA 18 HB3 ALA 18 -11.490 8.455 12.414 161 H LYS 19 HN LYS 19 -13.827 9.157 11.386 162 HA LYS 19 HA LYS 19 -14.940 6.568 10.940 163 HB2 LYS 19 HB2 LYS 19 -16.243 9.255 11.433 164 HB3 LYS 19 HB1 LYS 19 -17.125 7.734 11.416 165 HG2 LYS 19 HG2 LYS 19 -15.613 6.880 13.209 166 HG3 LYS 19 HG1 LYS 19 -14.858 8.470 13.283 167 HD2 LYS 19 HD2 LYS 19 -17.831 8.031 13.669 168 HD3 LYS 19 HD1 LYS 19 -16.684 8.058 15.007 169 HE2 LYS 19 HE2 LYS 19 -15.943 10.354 14.109 170 HE3 LYS 19 HE1 LYS 19 -17.402 10.309 13.120 171 HZ1 LYS 19 HZ1 LYS 19 -17.284 11.201 15.655 172 HZ2 LYS 19 HZ2 LYS 19 -17.840 9.610 15.873 173 HZ3 LYS 19 HZ3 LYS 19 -18.696 10.683 14.870 174 H SER 20 HN SER 20 -15.331 9.635 9.158 175 HA SER 20 HA SER 20 -17.123 8.579 7.187 176 HB2 SER 20 HB2 SER 20 -16.771 11.015 7.568 177 HB3 SER 20 HB1 SER 20 -15.142 10.866 6.914 178 HG SER 20 HG SER 20 -16.447 9.817 5.073 179 H VAL 21 HN VAL 21 -13.587 9.018 7.167 180 HA VAL 21 HA VAL 21 -13.184 7.928 4.543 181 HB VAL 21 HB VAL 21 -11.325 8.125 6.931 182 HG11 VAL 21 HG11 VAL 21 -9.550 7.910 5.087 183 HG12 VAL 21 HG12 VAL 21 -10.847 7.286 4.067 184 HG13 VAL 21 HG13 VAL 21 -10.395 6.430 5.541 185 HG21 VAL 21 HG21 VAL 21 -12.205 10.260 5.943 186 HG22 VAL 21 HG22 VAL 21 -11.500 9.783 4.398 187 HG23 VAL 21 HG23 VAL 21 -10.457 10.089 5.788 188 H ALA 22 HN ALA 22 -13.058 6.468 7.780 189 HA ALA 22 HA ALA 22 -12.196 3.882 7.041 190 HB1 ALA 22 HB1 ALA 22 -14.082 4.757 9.247 191 HB2 ALA 22 HB2 ALA 22 -12.342 4.505 9.378 192 HB3 ALA 22 HB3 ALA 22 -13.416 3.130 9.117 193 H GLU 23 HN GLU 23 -15.549 5.099 7.318 194 HA GLU 23 HA GLU 23 -16.707 2.627 6.402 195 HB2 GLU 23 HB2 GLU 23 -17.806 5.443 6.545 196 HB3 GLU 23 HB1 GLU 23 -18.771 4.052 6.043 197 HG2 GLU 23 HG2 GLU 23 -18.267 2.929 8.186 198 HG3 GLU 23 HG1 GLU 23 -17.317 4.326 8.691 199 H GLU 24 HN GLU 24 -15.659 5.569 4.729 200 HA GLU 24 HA GLU 24 -16.804 4.849 2.175 201 HB2 GLU 24 HB2 GLU 24 -15.096 6.960 3.257 202 HB3 GLU 24 HB1 GLU 24 -14.499 6.445 1.687 203 HG2 GLU 24 HG2 GLU 24 -16.108 8.253 1.402 204 HG3 GLU 24 HG1 GLU 24 -16.766 6.757 0.743 205 H MET 25 HN MET 25 -13.561 4.474 3.563 206 HA MET 25 HA MET 25 -12.401 3.151 1.303 207 HB2 MET 25 HB2 MET 25 -11.729 3.145 4.251 208 HB3 MET 25 HB1 MET 25 -10.778 2.239 3.072 209 HG2 MET 25 HG2 MET 25 -10.330 4.293 1.816 210 HG3 MET 25 HG1 MET 25 -11.342 5.213 2.928 211 HE1 MET 25 HE1 MET 25 -7.259 3.345 3.519 212 HE2 MET 25 HE2 MET 25 -8.533 2.927 2.380 213 HE3 MET 25 HE3 MET 25 -8.588 2.294 4.021 214 H GLY 26 HN GLY 26 -14.138 1.926 4.145 215 HA2 GLY 26 HA2 GLY 26 -15.546 -0.063 3.972 216 HA3 GLY 26 HA1 GLY 26 -14.477 -0.685 2.719 217 H ILE 27 HN ILE 27 -13.154 0.784 5.598 218 HA ILE 27 HA ILE 27 -12.423 -1.931 6.653 219 HB ILE 27 HB ILE 27 -10.242 -0.975 7.343 220 HG12 ILE 27 HG12 ILE 27 -11.008 1.404 5.625 221 HG13 ILE 27 HG11 ILE 27 -11.049 1.426 7.387 222 HG21 ILE 27 HG21 ILE 27 -10.705 -0.559 4.383 223 HG22 ILE 27 HG22 ILE 27 -10.626 -2.155 5.130 224 HG23 ILE 27 HG23 ILE 27 -9.223 -1.087 5.180 225 HD11 ILE 27 HD11 ILE 27 -8.918 2.340 6.413 226 HD12 ILE 27 HD12 ILE 27 -8.582 0.735 5.767 227 HD13 ILE 27 HD13 ILE 27 -8.673 0.983 7.511 228 H SER 28 HN SER 28 -11.887 -1.895 8.978 229 HA SER 28 HA SER 28 -13.919 -0.483 10.471 230 HB2 SER 28 HB2 SER 28 -11.598 -2.253 11.237 231 HB3 SER 28 HB1 SER 28 -12.592 -1.470 12.462 232 HG SER 28 HG SER 28 -14.402 -2.489 11.533 233 H ARG 29 HN ARG 29 -13.603 1.103 12.081 234 HA ARG 29 HA ARG 29 -11.802 3.205 11.418 235 HB2 ARG 29 HB2 ARG 29 -13.819 3.725 12.616 236 HB3 ARG 29 HB1 ARG 29 -13.385 2.648 13.942 237 HG2 ARG 29 HG2 ARG 29 -11.866 4.143 14.854 238 HG3 ARG 29 HG1 ARG 29 -11.424 4.820 13.289 239 HD2 ARG 29 HD2 ARG 29 -12.745 6.341 14.849 240 HD3 ARG 29 HD1 ARG 29 -13.359 6.188 13.210 241 HE ARG 29 HE ARG 29 -14.955 4.417 14.214 242 HH11 ARG 29 HH21 ARG 29 -13.665 7.078 16.054 243 HH12 ARG 29 HH22 ARG 29 -15.020 7.134 17.123 244 HH21 ARG 29 HH11 ARG 29 -16.703 4.524 15.606 245 HH22 ARG 29 HH12 ARG 29 -16.727 5.704 16.873 246 H GLN 30 HN GLN 30 -11.585 0.638 13.870 247 HA GLN 30 HA GLN 30 -9.265 1.549 15.199 248 HB2 GLN 30 HB2 GLN 30 -8.956 -0.697 15.958 249 HB3 GLN 30 HB1 GLN 30 -10.692 -0.431 15.840 250 HG2 GLN 30 HG2 GLN 30 -10.484 -2.476 14.766 251 HG3 GLN 30 HG1 GLN 30 -10.391 -1.384 13.395 252 HE21 GLN 30 HE21 GLN 30 -7.842 -2.128 15.825 253 HE22 GLN 30 HE22 GLN 30 -6.729 -2.735 14.696 254 H GLN 31 HN GLN 31 -9.601 -0.305 12.206 255 HA GLN 31 HA GLN 31 -6.799 -0.755 11.776 256 HB2 GLN 31 HB2 GLN 31 -8.651 -1.964 10.590 257 HB3 GLN 31 HB1 GLN 31 -9.006 -0.480 9.708 258 HG2 GLN 31 HG2 GLN 31 -7.595 -1.902 8.327 259 HG3 GLN 31 HG1 GLN 31 -6.663 -0.493 8.833 260 HE21 GLN 31 HE21 GLN 31 -4.577 -1.479 8.865 261 HE22 GLN 31 HE22 GLN 31 -4.172 -2.752 9.912 262 H LEU 32 HN LEU 32 -9.023 1.767 10.599 263 HA LEU 32 HA LEU 32 -7.048 3.207 9.106 264 HB2 LEU 32 HB2 LEU 32 -9.495 3.516 8.797 265 HB3 LEU 32 HB1 LEU 32 -9.590 4.254 10.394 266 HG LEU 32 HG LEU 32 -8.035 6.034 9.658 267 HD11 LEU 32 HD11 LEU 32 -7.841 6.097 7.008 268 HD12 LEU 32 HD12 LEU 32 -7.994 4.350 7.168 269 HD13 LEU 32 HD13 LEU 32 -6.672 5.199 7.968 270 HD21 LEU 32 HD21 LEU 32 -10.386 5.652 7.781 271 HD22 LEU 32 HD22 LEU 32 -9.604 7.183 8.179 272 HD23 LEU 32 HD23 LEU 32 -10.495 6.300 9.417 273 H CYS 33 HN CYS 33 -8.165 3.444 12.457 274 HA CYS 33 HA CYS 33 -6.833 5.834 13.182 275 HB2 CYS 33 HB2 CYS 33 -7.367 3.349 14.841 276 HB3 CYS 33 HB1 CYS 33 -6.869 4.907 15.505 277 HG CYS 33 HG CYS 33 -9.197 5.710 15.286 278 H ASN 34 HN ASN 34 -5.622 2.483 13.120 279 HA ASN 34 HA ASN 34 -3.067 3.070 14.269 280 HB2 ASN 34 HB2 ASN 34 -3.779 0.923 12.246 281 HB3 ASN 34 HB1 ASN 34 -2.346 0.939 13.274 282 HD21 ASN 34 HD21 ASN 34 -4.133 -1.227 13.478 283 HD22 ASN 34 HD22 ASN 34 -4.951 -1.143 14.964 284 H ILE 35 HN ILE 35 -4.181 3.008 10.888 285 HA ILE 35 HA ILE 35 -1.617 3.622 9.735 286 HB ILE 35 HB ILE 35 -4.366 4.272 8.624 287 HG12 ILE 35 HG12 ILE 35 -2.679 1.782 8.222 288 HG13 ILE 35 HG11 ILE 35 -4.071 1.869 9.302 289 HG21 ILE 35 HG21 ILE 35 -2.452 5.351 7.464 290 HG22 ILE 35 HG22 ILE 35 -3.221 4.128 6.452 291 HG23 ILE 35 HG23 ILE 35 -1.700 3.767 7.267 292 HD11 ILE 35 HD11 ILE 35 -4.875 0.981 7.220 293 HD12 ILE 35 HD12 ILE 35 -4.049 2.238 6.299 294 HD13 ILE 35 HD13 ILE 35 -5.434 2.652 7.310 295 H GLU 36 HN GLU 36 -4.374 5.632 10.694 296 HA GLU 36 HA GLU 36 -3.267 8.132 9.848 297 HB2 GLU 36 HB2 GLU 36 -5.356 7.386 11.901 298 HB3 GLU 36 HB1 GLU 36 -4.921 9.065 11.581 299 HG2 GLU 36 HG2 GLU 36 -5.661 7.204 9.318 300 HG3 GLU 36 HG1 GLU 36 -6.910 8.031 10.246 301 H GLN 37 HN GLN 37 -2.874 6.241 12.799 302 HA GLN 37 HA GLN 37 -1.448 8.437 14.151 303 HB2 GLN 37 HB2 GLN 37 -1.990 5.553 14.901 304 HB3 GLN 37 HB1 GLN 37 -1.050 6.653 15.912 305 HG2 GLN 37 HG2 GLN 37 -2.944 8.189 16.067 306 HG3 GLN 37 HG1 GLN 37 -3.888 7.176 14.973 307 HE21 GLN 37 HE21 GLN 37 -3.420 7.816 18.233 308 HE22 GLN 37 HE22 GLN 37 -3.968 6.344 18.875 309 H SER 38 HN SER 38 -0.656 6.237 11.781 310 HA SER 38 HA SER 38 2.003 6.882 11.454 311 HB2 SER 38 HB2 SER 38 1.646 4.932 13.686 312 HB3 SER 38 HB1 SER 38 2.974 4.621 12.572 313 HG SER 38 HG SER 38 3.459 6.024 14.398 314 H GLU 39 HN GLU 39 2.108 6.237 9.362 315 HA GLU 39 HA GLU 39 1.005 3.565 8.594 316 HB2 GLU 39 HB2 GLU 39 0.778 4.476 6.330 317 HB3 GLU 39 HB1 GLU 39 -0.107 5.456 7.494 318 HG2 GLU 39 HG2 GLU 39 1.008 7.258 6.674 319 HG3 GLU 39 HG1 GLU 39 2.446 6.639 7.465 320 H THR 40 HN THR 40 2.535 2.097 8.203 321 HA THR 40 HA THR 40 5.339 2.883 7.818 322 HB THR 40 HB THR 40 5.854 0.582 8.098 323 HG1 THR 40 HG1 THR 40 4.675 -0.651 6.875 324 HG21 THR 40 HG21 THR 40 3.271 0.784 9.642 325 HG22 THR 40 HG22 THR 40 4.667 1.777 10.060 326 HG23 THR 40 HG23 THR 40 4.782 0.018 10.127 327 H ALA 41 HN ALA 41 6.591 1.834 5.998 328 HA ALA 41 HA ALA 41 5.036 2.024 3.447 329 HB1 ALA 41 HB1 ALA 41 6.735 3.675 3.465 330 HB2 ALA 41 HB2 ALA 41 7.370 2.372 2.460 331 HB3 ALA 41 HB3 ALA 41 7.926 2.556 4.124 332 HA PRO 42 HA PRO 42 6.162 -2.412 3.504 333 HB2 PRO 42 HB2 PRO 42 4.315 -3.306 1.722 334 HB3 PRO 42 HB1 PRO 42 3.903 -2.900 3.400 335 HG2 PRO 42 HG2 PRO 42 3.457 -1.323 0.909 336 HG3 PRO 42 HG1 PRO 42 2.429 -1.491 2.344 337 HD2 PRO 42 HD2 PRO 42 4.093 0.685 1.842 338 HD3 PRO 42 HD1 PRO 42 3.479 0.235 3.449 339 H VAL 43 HN VAL 43 6.975 -3.962 1.877 340 HA VAL 43 HA VAL 43 8.795 -2.770 0.030 341 HB VAL 43 HB VAL 43 9.020 -5.155 -0.840 342 HG11 VAL 43 HG11 VAL 43 9.160 -4.723 2.159 343 HG12 VAL 43 HG12 VAL 43 10.404 -4.252 1.002 344 HG13 VAL 43 HG13 VAL 43 10.038 -5.958 1.258 345 HG21 VAL 43 HG21 VAL 43 6.623 -5.738 -0.267 346 HG22 VAL 43 HG22 VAL 43 7.099 -5.741 1.430 347 HG23 VAL 43 HG23 VAL 43 7.813 -6.903 0.312 348 H VAL 44 HN VAL 44 5.456 -3.555 -0.269 349 HA VAL 44 HA VAL 44 5.261 -4.013 -3.078 350 HB VAL 44 HB VAL 44 3.308 -2.697 -1.161 351 HG11 VAL 44 HG11 VAL 44 1.632 -3.420 -2.954 352 HG12 VAL 44 HG12 VAL 44 3.017 -3.622 -4.027 353 HG13 VAL 44 HG13 VAL 44 2.644 -2.033 -3.361 354 HG21 VAL 44 HG21 VAL 44 2.221 -4.979 -1.342 355 HG22 VAL 44 HG22 VAL 44 3.789 -4.980 -0.533 356 HG23 VAL 44 HG23 VAL 44 3.660 -5.520 -2.208 357 H VAL 45 HN VAL 45 5.206 -1.006 -1.184 358 HA VAL 45 HA VAL 45 4.758 0.785 -3.357 359 HB VAL 45 HB VAL 45 6.287 1.200 -0.768 360 HG11 VAL 45 HG11 VAL 45 6.980 2.943 -2.245 361 HG12 VAL 45 HG12 VAL 45 5.690 3.644 -1.268 362 HG13 VAL 45 HG13 VAL 45 5.359 3.115 -2.918 363 HG21 VAL 45 HG21 VAL 45 3.864 0.551 -0.604 364 HG22 VAL 45 HG22 VAL 45 3.464 1.973 -1.566 365 HG23 VAL 45 HG23 VAL 45 4.196 2.164 0.027 366 H LYS 46 HN LYS 46 7.768 -0.518 -1.978 367 HA LYS 46 HA LYS 46 9.586 0.979 -3.566 368 HB2 LYS 46 HB2 LYS 46 9.796 -1.839 -2.466 369 HB3 LYS 46 HB1 LYS 46 11.146 -0.959 -3.185 370 HG2 LYS 46 HG2 LYS 46 10.904 0.819 -1.517 371 HG3 LYS 46 HG1 LYS 46 9.518 -0.013 -0.811 372 HD2 LYS 46 HD2 LYS 46 10.973 -1.965 -0.314 373 HD3 LYS 46 HD1 LYS 46 12.354 -1.070 -0.952 374 HE2 LYS 46 HE2 LYS 46 10.610 -0.097 1.325 375 HE3 LYS 46 HE1 LYS 46 12.147 -0.934 1.546 376 HZ1 LYS 46 HZ1 LYS 46 11.683 1.675 0.219 377 HZ2 LYS 46 HZ2 LYS 46 13.150 0.827 0.109 378 HZ3 LYS 46 HZ3 LYS 46 12.592 1.373 1.619 379 H TYR 47 HN TYR 47 7.938 -2.108 -4.223 380 HA TYR 47 HA TYR 47 9.183 -2.625 -6.744 381 HB2 TYR 47 HB2 TYR 47 7.461 -4.025 -5.215 382 HB3 TYR 47 HB1 TYR 47 6.286 -3.339 -6.329 383 HD1 TYR 47 HD1 TYR 47 7.644 -3.305 -8.912 384 HD2 TYR 47 HD2 TYR 47 7.827 -6.260 -5.803 385 HE1 TYR 47 HE1 TYR 47 8.263 -5.014 -10.583 386 HE2 TYR 47 HE2 TYR 47 8.432 -7.974 -7.487 387 HH TYR 47 HH TYR 47 7.954 -8.097 -10.244 388 H ILE 48 HN ILE 48 6.171 -0.929 -5.900 389 HA ILE 48 HA ILE 48 5.452 -0.157 -8.554 390 HB ILE 48 HB ILE 48 4.879 1.107 -5.860 391 HG12 ILE 48 HG12 ILE 48 3.075 -0.504 -7.679 392 HG13 ILE 48 HG11 ILE 48 4.036 -1.234 -6.393 393 HG21 ILE 48 HG21 ILE 48 4.521 2.871 -7.389 394 HG22 ILE 48 HG22 ILE 48 2.926 2.146 -7.201 395 HG23 ILE 48 HG23 ILE 48 3.895 1.790 -8.630 396 HD11 ILE 48 HD11 ILE 48 1.744 -0.727 -5.619 397 HD12 ILE 48 HD12 ILE 48 1.992 0.973 -6.016 398 HD13 ILE 48 HD13 ILE 48 2.942 0.218 -4.736 399 H ALA 49 HN ALA 49 7.367 1.520 -6.057 400 HA ALA 49 HA ALA 49 7.817 3.909 -7.563 401 HB1 ALA 49 HB1 ALA 49 8.331 3.927 -5.213 402 HB2 ALA 49 HB2 ALA 49 9.866 4.124 -6.061 403 HB3 ALA 49 HB3 ALA 49 9.427 2.557 -5.382 404 H PHE 50 HN PHE 50 9.620 0.858 -7.366 405 HA PHE 50 HA PHE 50 11.812 1.660 -9.001 406 HB2 PHE 50 HB2 PHE 50 11.757 -0.404 -7.589 407 HB3 PHE 50 HB1 PHE 50 10.615 -1.115 -8.726 408 HD1 PHE 50 HD2 PHE 50 13.900 0.738 -8.894 409 HD2 PHE 50 HD1 PHE 50 11.548 -2.589 -10.277 410 HE1 PHE 50 HE2 PHE 50 15.784 -0.006 -10.315 411 HE2 PHE 50 HE1 PHE 50 13.441 -3.333 -11.687 412 HZ PHE 50 HZ PHE 50 15.558 -2.044 -11.708 413 H LEU 51 HN LEU 51 8.750 0.049 -9.853 414 HA LEU 51 HA LEU 51 9.291 -0.131 -12.663 415 HB2 LEU 51 HB2 LEU 51 6.673 0.029 -11.140 416 HB3 LEU 51 HB1 LEU 51 6.782 -0.332 -12.861 417 HG LEU 51 HG LEU 51 8.200 -1.930 -10.710 418 HD11 LEU 51 HD11 LEU 51 5.570 -2.456 -12.124 419 HD12 LEU 51 HD12 LEU 51 5.791 -2.144 -10.401 420 HD13 LEU 51 HD13 LEU 51 6.419 -3.629 -11.118 421 HD21 LEU 51 HD21 LEU 51 8.053 -3.638 -12.738 422 HD22 LEU 51 HD22 LEU 51 9.329 -2.430 -12.697 423 HD23 LEU 51 HD23 LEU 51 7.904 -2.169 -13.699 424 H ARG 52 HN ARG 52 7.730 2.371 -10.695 425 HA ARG 52 HA ARG 52 6.963 4.078 -12.868 426 HB2 ARG 52 HB2 ARG 52 7.542 4.626 -9.944 427 HB3 ARG 52 HB1 ARG 52 6.946 5.864 -11.053 428 HG2 ARG 52 HG2 ARG 52 4.957 4.596 -11.518 429 HG3 ARG 52 HG1 ARG 52 5.569 3.202 -10.630 430 HD2 ARG 52 HD2 ARG 52 4.021 4.288 -9.174 431 HD3 ARG 52 HD1 ARG 52 5.624 4.711 -8.574 432 HE ARG 52 HE ARG 52 5.037 6.794 -10.277 433 HH11 ARG 52 HH21 ARG 52 3.377 5.177 -7.724 434 HH12 ARG 52 HH22 ARG 52 2.539 6.595 -7.189 435 HH21 ARG 52 HH11 ARG 52 3.952 8.662 -9.586 436 HH22 ARG 52 HH12 ARG 52 2.863 8.565 -8.242 437 H SER 53 HN SER 53 9.945 3.798 -10.985 438 HA SER 53 HA SER 53 11.234 6.161 -11.902 439 HB2 SER 53 HB2 SER 53 13.310 5.097 -11.236 440 HB3 SER 53 HB1 SER 53 12.067 4.661 -10.068 441 HG SER 53 HG SER 53 13.003 2.767 -10.597 442 H LYS 54 HN LYS 54 10.527 3.185 -13.524 443 HA LYS 54 HA LYS 54 12.463 3.752 -15.707 444 HB2 LYS 54 HB2 LYS 54 10.538 1.469 -15.207 445 HB3 LYS 54 HB1 LYS 54 11.534 1.605 -16.657 446 HG2 LYS 54 HG2 LYS 54 13.565 1.616 -15.280 447 HG3 LYS 54 HG1 LYS 54 12.585 1.528 -13.814 448 HD2 LYS 54 HD2 LYS 54 11.675 -0.639 -14.535 449 HD3 LYS 54 HD1 LYS 54 12.623 -0.554 -16.020 450 HE2 LYS 54 HE2 LYS 54 14.702 -0.529 -14.709 451 HE3 LYS 54 HE1 LYS 54 13.768 -0.582 -13.215 452 HZ1 LYS 54 HZ1 LYS 54 14.647 -2.770 -14.076 453 HZ2 LYS 54 HZ2 LYS 54 13.499 -2.641 -15.321 454 HZ3 LYS 54 HZ3 LYS 54 12.993 -2.723 -13.702 455 H GLY 55 HN GLY 55 9.436 4.771 -14.852 456 HA2 GLY 55 HA2 GLY 55 7.951 6.115 -16.114 457 HA3 GLY 55 HA1 GLY 55 8.904 5.758 -17.553 458 H VAL 56 HN VAL 56 7.757 3.125 -15.567 459 HA VAL 56 HA VAL 56 6.416 1.871 -17.770 460 HB VAL 56 HB VAL 56 6.171 1.404 -14.782 461 HG11 VAL 56 HG11 VAL 56 5.267 -0.848 -15.544 462 HG12 VAL 56 HG12 VAL 56 5.111 -0.151 -17.157 463 HG13 VAL 56 HG13 VAL 56 4.184 0.518 -15.817 464 HG21 VAL 56 HG21 VAL 56 8.400 1.049 -16.002 465 HG22 VAL 56 HG22 VAL 56 7.596 -0.250 -16.877 466 HG23 VAL 56 HG23 VAL 56 7.765 -0.338 -15.126 467 H ASP 57 HN ASP 57 5.483 4.304 -15.569 468 HA ASP 57 HA ASP 57 3.548 5.575 -15.339 469 HB2 ASP 57 HB2 ASP 57 2.653 4.194 -17.885 470 HB3 ASP 57 HB1 ASP 57 2.007 5.681 -17.209 471 H LEU 58 HN LEU 58 3.040 4.360 -13.450 472 HA LEU 58 HA LEU 58 1.182 2.088 -13.671 473 HB2 LEU 58 HB2 LEU 58 2.476 3.576 -11.382 474 HB3 LEU 58 HB1 LEU 58 1.167 2.436 -11.085 475 HG LEU 58 HG LEU 58 3.490 1.445 -10.906 476 HD11 LEU 58 HD11 LEU 58 1.236 0.242 -11.733 477 HD12 LEU 58 HD12 LEU 58 2.774 -0.604 -11.693 478 HD13 LEU 58 HD13 LEU 58 2.173 0.050 -13.212 479 HD21 LEU 58 HD21 LEU 58 4.336 2.833 -12.883 480 HD22 LEU 58 HD22 LEU 58 3.510 1.676 -13.919 481 HD23 LEU 58 HD23 LEU 58 4.819 1.137 -12.870 482 H ASN 59 HN ASN 59 0.953 5.387 -13.901 483 HA ASN 59 HA ASN 59 -1.361 6.021 -12.353 484 HB2 ASN 59 HB2 ASN 59 -1.667 7.790 -14.260 485 HB3 ASN 59 HB1 ASN 59 -0.217 7.881 -13.259 486 HD21 ASN 59 HD21 ASN 59 1.012 8.874 -15.037 487 HD22 ASN 59 HD22 ASN 59 1.520 7.948 -16.367 488 H ALA 60 HN ALA 60 -1.026 4.847 -15.704 489 HA ALA 60 HA ALA 60 -3.848 4.802 -16.254 490 HB1 ALA 60 HB1 ALA 60 -1.526 3.276 -17.464 491 HB2 ALA 60 HB2 ALA 60 -2.294 4.729 -18.103 492 HB3 ALA 60 HB3 ALA 60 -3.172 3.198 -18.093 493 H LEU 61 HN LEU 61 -1.582 2.286 -15.120 494 HA LEU 61 HA LEU 61 -3.497 0.171 -15.034 495 HB2 LEU 61 HB2 LEU 61 -1.080 -0.245 -14.900 496 HB3 LEU 61 HB1 LEU 61 -1.001 0.610 -13.362 497 HG LEU 61 HG LEU 61 -2.444 -1.074 -12.317 498 HD11 LEU 61 HD11 LEU 61 -3.920 -1.843 -13.969 499 HD12 LEU 61 HD12 LEU 61 -2.816 -3.204 -13.807 500 HD13 LEU 61 HD13 LEU 61 -2.634 -2.080 -15.152 501 HD21 LEU 61 HD21 LEU 61 -0.062 -2.094 -13.874 502 HD22 LEU 61 HD22 LEU 61 -0.907 -3.089 -12.688 503 HD23 LEU 61 HD23 LEU 61 -0.123 -1.592 -12.185 504 H PHE 62 HN PHE 62 -2.418 2.445 -12.518 505 HA PHE 62 HA PHE 62 -4.218 1.393 -10.506 506 HB2 PHE 62 HB2 PHE 62 -2.471 3.825 -10.776 507 HB3 PHE 62 HB1 PHE 62 -3.690 3.804 -9.502 508 HD1 PHE 62 HD1 PHE 62 -1.159 1.445 -10.994 509 HD2 PHE 62 HD2 PHE 62 -2.994 2.987 -7.426 510 HE1 PHE 62 HE1 PHE 62 0.314 0.007 -9.607 511 HE2 PHE 62 HE2 PHE 62 -1.517 1.554 -6.050 512 HZ PHE 62 HZ PHE 62 0.136 0.064 -7.138 513 H ASP 63 HN ASP 63 -4.459 3.860 -12.989 514 HA ASP 63 HA ASP 63 -6.783 5.217 -12.060 515 HB2 ASP 63 HB2 ASP 63 -5.490 6.082 -13.932 516 HB3 ASP 63 HB1 ASP 63 -5.835 4.636 -14.884 517 H ARG 64 HN ARG 64 -6.393 2.212 -13.884 518 HA ARG 64 HA ARG 64 -9.165 1.804 -14.482 519 HB2 ARG 64 HB2 ARG 64 -6.685 0.166 -14.469 520 HB3 ARG 64 HB1 ARG 64 -8.164 -0.763 -14.243 521 HG2 ARG 64 HG2 ARG 64 -7.683 -0.640 -16.616 522 HG3 ARG 64 HG1 ARG 64 -9.111 0.335 -16.281 523 HD2 ARG 64 HD2 ARG 64 -7.653 2.367 -16.196 524 HD3 ARG 64 HD1 ARG 64 -6.281 1.361 -16.666 525 HE ARG 64 HE ARG 64 -8.392 0.966 -18.549 526 HH11 ARG 64 HH21 ARG 64 -6.114 3.303 -17.441 527 HH12 ARG 64 HH22 ARG 64 -6.023 4.128 -18.961 528 HH21 ARG 64 HH11 ARG 64 -8.290 2.025 -20.536 529 HH22 ARG 64 HH12 ARG 64 -7.257 3.404 -20.717 530 H ILE 65 HN ILE 65 -7.221 1.048 -11.618 531 HA ILE 65 HA ILE 65 -9.217 -0.547 -10.298 532 HB ILE 65 HB ILE 65 -7.140 1.233 -8.990 533 HG12 ILE 65 HG12 ILE 65 -6.019 -0.184 -10.614 534 HG13 ILE 65 HG11 ILE 65 -5.727 -0.840 -9.006 535 HG21 ILE 65 HG21 ILE 65 -8.685 -1.210 -8.091 536 HG22 ILE 65 HG22 ILE 65 -8.731 0.407 -7.389 537 HG23 ILE 65 HG23 ILE 65 -7.280 -0.583 -7.227 538 HD11 ILE 65 HD11 ILE 65 -7.524 -1.896 -11.176 539 HD12 ILE 65 HD12 ILE 65 -7.840 -2.312 -9.494 540 HD13 ILE 65 HD13 ILE 65 -6.305 -2.752 -10.238 541 H ILE 66 HN ILE 66 -8.480 2.934 -10.173 542 HA ILE 66 HA ILE 66 -10.884 3.405 -8.499 543 HB ILE 66 HB ILE 66 -8.757 5.285 -9.570 544 HG12 ILE 66 HG12 ILE 66 -9.241 4.298 -6.744 545 HG13 ILE 66 HG11 ILE 66 -8.091 3.544 -7.847 546 HG21 ILE 66 HG21 ILE 66 -9.765 6.791 -7.741 547 HG22 ILE 66 HG22 ILE 66 -11.158 5.710 -7.782 548 HG23 ILE 66 HG23 ILE 66 -10.698 6.613 -9.226 549 HD11 ILE 66 HD11 ILE 66 -8.036 6.384 -6.802 550 HD12 ILE 66 HD12 ILE 66 -7.001 5.813 -8.111 551 HD13 ILE 66 HD13 ILE 66 -6.855 5.109 -6.500 552 H VAL 67 HN VAL 67 -12.644 3.087 -9.862 553 HA VAL 67 HA VAL 67 -13.079 5.168 -11.921 554 HB VAL 67 HB VAL 67 -13.368 2.211 -12.564 555 HG11 VAL 67 HG11 VAL 67 -14.033 2.902 -14.755 556 HG12 VAL 67 HG12 VAL 67 -13.601 4.581 -14.434 557 HG13 VAL 67 HG13 VAL 67 -15.004 3.868 -13.646 558 HG21 VAL 67 HG21 VAL 67 -11.555 2.756 -14.248 559 HG22 VAL 67 HG22 VAL 67 -11.028 2.779 -12.569 560 HG23 VAL 67 HG23 VAL 67 -11.339 4.293 -13.412 561 H ASN 68 HN ASN 68 -14.905 2.176 -11.662 562 HA ASN 68 HA ASN 68 -17.114 3.678 -10.286 563 HB2 ASN 68 HB2 ASN 68 -18.609 2.024 -11.610 564 HB3 ASN 68 HB1 ASN 68 -17.904 3.383 -12.487 565 HD21 ASN 68 HD21 ASN 68 -17.731 -0.112 -12.028 566 HD22 ASN 68 HD22 ASN 68 -16.704 -0.413 -13.340 567 H LYS 69 HN LYS 69 -16.299 0.276 -11.099 568 HA LYS 69 HA LYS 69 -17.456 -0.606 -8.547 569 HB2 LYS 69 HB2 LYS 69 -16.170 -2.036 -10.874 570 HB3 LYS 69 HB1 LYS 69 -16.554 -2.888 -9.378 571 HG2 LYS 69 HG2 LYS 69 -18.908 -2.224 -9.581 572 HG3 LYS 69 HG1 LYS 69 -18.543 -1.321 -11.048 573 HD2 LYS 69 HD2 LYS 69 -17.812 -3.396 -12.156 574 HD3 LYS 69 HD1 LYS 69 -18.153 -4.306 -10.685 575 HE2 LYS 69 HE2 LYS 69 -20.526 -3.649 -10.822 576 HE3 LYS 69 HE1 LYS 69 -20.190 -2.735 -12.292 577 HZ1 LYS 69 HZ1 LYS 69 -19.156 -5.094 -12.935 578 HZ2 LYS 69 HZ2 LYS 69 -20.765 -4.661 -13.265 579 HZ3 LYS 69 HZ3 LYS 69 -20.398 -5.603 -11.899 580 H LEU 70 HN LEU 70 -16.317 -1.534 -6.835 581 HA LEU 70 HA LEU 70 -13.353 -1.540 -6.905 582 HB2 LEU 70 HB2 LEU 70 -13.318 -0.319 -4.694 583 HB3 LEU 70 HB1 LEU 70 -13.738 0.681 -6.082 584 HG LEU 70 HG LEU 70 -16.018 -0.639 -4.639 585 HD11 LEU 70 HD11 LEU 70 -14.782 0.118 -2.731 586 HD12 LEU 70 HD12 LEU 70 -16.053 1.305 -3.020 587 HD13 LEU 70 HD13 LEU 70 -14.395 1.649 -3.512 588 HD21 LEU 70 HD21 LEU 70 -15.701 2.227 -5.568 589 HD22 LEU 70 HD22 LEU 70 -17.196 1.337 -5.288 590 HD23 LEU 70 HD23 LEU 70 -16.177 0.936 -6.666 591 H GLU 71 HN GLU 71 -14.328 -3.858 -6.916 592 HA GLU 71 HA GLU 71 -15.517 -4.870 -4.488 593 HB2 GLU 71 HB2 GLU 71 -14.016 -6.357 -6.663 594 HB3 GLU 71 HB1 GLU 71 -15.079 -7.087 -5.458 595 HG2 GLU 71 HG2 GLU 71 -16.972 -5.755 -6.320 596 HG3 GLU 71 HG1 GLU 71 -15.913 -5.037 -7.534 597 H HIS 72 HN HIS 72 -14.554 -5.477 -2.639 598 HA HIS 72 HA HIS 72 -11.880 -6.557 -2.486 599 HB2 HIS 72 HB2 HIS 72 -11.556 -3.994 -2.776 600 HB3 HIS 72 HB1 HIS 72 -12.189 -3.866 -1.135 601 HD2 HIS 72 HD2 HIS 72 -8.999 -5.297 -2.971 602 HE1 HIS 72 HE1 HIS 72 -8.278 -5.371 1.189 603 HE2 HIS 72 HE2 HIS 72 -7.242 -5.741 -1.096 604 H HIS 73 HN HIS 73 -13.921 -4.504 -0.401 605 HA HIS 73 HA HIS 73 -14.614 -4.884 1.831 606 HB2 HIS 73 HB2 HIS 73 -16.337 -5.866 0.277 607 HB3 HIS 73 HB1 HIS 73 -15.595 -7.441 0.539 608 HD2 HIS 73 HD2 HIS 73 -18.306 -7.826 1.850 609 HE1 HIS 73 HE1 HIS 73 -16.959 -5.997 5.410 610 HE2 HIS 73 HE2 HIS 73 -18.792 -7.416 4.379 611 H HIS 74 HN HIS 74 -14.793 -8.229 1.882 612 HA HIS 74 HA HIS 74 -12.064 -8.599 2.999 613 HB2 HIS 74 HB2 HIS 74 -12.869 -9.477 5.088 614 HB3 HIS 74 HB1 HIS 74 -13.649 -7.914 4.854 615 HD2 HIS 74 HD2 HIS 74 -15.213 -10.257 6.641 616 HE1 HIS 74 HE1 HIS 74 -17.744 -10.537 3.271 617 HE2 HIS 74 HE2 HIS 74 -17.519 -11.077 5.740 618 H HIS 75 HN HIS 75 -11.405 -10.783 3.020 619 HA HIS 75 HA HIS 75 -13.210 -12.911 2.130 620 HB2 HIS 75 HB2 HIS 75 -11.762 -13.415 0.108 621 HB3 HIS 75 HB1 HIS 75 -12.753 -11.966 -0.042 622 HD2 HIS 75 HD2 HIS 75 -8.956 -12.783 0.846 623 HE1 HIS 75 HE1 HIS 75 -9.199 -8.861 -0.692 624 HE2 HIS 75 HE2 HIS 75 -7.619 -10.662 0.134 625 H HIS 76 HN HIS 76 -9.950 -11.757 2.748 626 HA HIS 76 HA HIS 76 -8.084 -12.790 3.711 627 HB2 HIS 76 HB2 HIS 76 -10.191 -14.450 5.121 628 HB3 HIS 76 HB1 HIS 76 -8.558 -14.104 5.688 629 HD2 HIS 76 HD2 HIS 76 -9.822 -10.809 4.349 630 HE1 HIS 76 HE1 HIS 76 -11.078 -10.868 8.376 631 HE2 HIS 76 HE2 HIS 76 -10.797 -9.416 6.317 632 H HIS 77 HN HIS 77 -7.544 -13.751 1.628 633 HA HIS 77 HA HIS 77 -8.404 -16.254 0.667 634 HB2 HIS 77 HB2 HIS 77 -5.804 -16.287 -0.131 635 HB3 HIS 77 HB1 HIS 77 -7.014 -15.252 -0.889 636 HD2 HIS 77 HD2 HIS 77 -6.273 -12.597 -0.864 637 HE1 HIS 77 HE1 HIS 77 -3.586 -12.737 2.392 638 HE2 HIS 77 HE2 HIS 77 -4.591 -11.246 0.602 639 H1 MET 1 HT1 MET 1 -7.136 -6.264 -15.062 640 H2 MET 1 HT2 MET 1 -7.779 -7.316 -16.230 641 H3 MET 1 HT3 MET 1 -6.146 -7.436 -15.782 642 HA MET 1 HA MET 1 -8.543 -8.341 -14.366 643 HB2 MET 1 HB2 MET 1 -5.714 -9.418 -14.522 644 HB3 MET 1 HB1 MET 1 -7.132 -10.266 -13.908 645 HG2 MET 1 HG2 MET 1 -6.910 -11.088 -16.108 646 HG3 MET 1 HG1 MET 1 -8.151 -9.844 -16.255 647 HE1 MET 1 HE1 MET 1 -4.872 -11.168 -17.687 648 HE2 MET 1 HE2 MET 1 -4.409 -10.467 -16.139 649 HE3 MET 1 HE3 MET 1 -3.798 -9.765 -17.632 650 H GLU 2 HN GLU 2 -6.542 -9.460 -12.371 651 HA GLU 2 HA GLU 2 -6.843 -7.339 -10.398 652 HB2 GLU 2 HB2 GLU 2 -5.422 -10.016 -10.278 653 HB3 GLU 2 HB1 GLU 2 -5.655 -8.948 -8.896 654 HG2 GLU 2 HG2 GLU 2 -7.473 -10.428 -8.719 655 HG3 GLU 2 HG1 GLU 2 -8.185 -9.039 -9.536 656 H LEU 3 HN LEU 3 -5.012 -6.510 -9.132 657 HA LEU 3 HA LEU 3 -2.983 -5.349 -10.772 658 HB2 LEU 3 HB2 LEU 3 -3.211 -5.660 -7.767 659 HB3 LEU 3 HB1 LEU 3 -1.933 -4.731 -8.540 660 HG LEU 3 HG LEU 3 -4.882 -4.227 -9.030 661 HD11 LEU 3 HD11 LEU 3 -3.004 -2.803 -7.120 662 HD12 LEU 3 HD12 LEU 3 -4.314 -3.883 -6.643 663 HD13 LEU 3 HD13 LEU 3 -4.678 -2.358 -7.449 664 HD21 LEU 3 HD21 LEU 3 -2.303 -2.878 -9.830 665 HD22 LEU 3 HD22 LEU 3 -3.735 -1.888 -9.587 666 HD23 LEU 3 HD23 LEU 3 -3.753 -3.172 -10.787 667 H SER 4 HN SER 4 -2.943 -8.153 -8.601 668 HA SER 4 HA SER 4 -0.153 -8.671 -8.700 669 HB2 SER 4 HB2 SER 4 -1.440 -9.907 -7.128 670 HB3 SER 4 HB1 SER 4 -2.554 -10.474 -8.367 671 HG SER 4 HG SER 4 0.211 -11.108 -8.196 672 H ASN 5 HN ASN 5 -2.763 -9.898 -10.814 673 HA ASN 5 HA ASN 5 -0.971 -11.393 -12.509 674 HB2 ASN 5 HB2 ASN 5 -3.582 -11.545 -12.231 675 HB3 ASN 5 HB1 ASN 5 -3.612 -10.302 -13.481 676 HD21 ASN 5 HD21 ASN 5 -2.553 -10.872 -15.595 677 HD22 ASN 5 HD22 ASN 5 -2.431 -12.503 -16.050 678 H GLU 6 HN GLU 6 -2.395 -8.150 -12.736 679 HA GLU 6 HA GLU 6 -1.310 -7.501 -15.316 680 HB2 GLU 6 HB2 GLU 6 -2.186 -5.791 -12.972 681 HB3 GLU 6 HB1 GLU 6 -1.693 -5.119 -14.527 682 HG2 GLU 6 HG2 GLU 6 -3.479 -6.232 -15.674 683 HG3 GLU 6 HG1 GLU 6 -3.867 -7.208 -14.257 684 H LEU 7 HN LEU 7 -0.123 -6.972 -12.011 685 HA LEU 7 HA LEU 7 2.213 -5.494 -12.706 686 HB2 LEU 7 HB2 LEU 7 1.285 -5.727 -10.386 687 HB3 LEU 7 HB1 LEU 7 1.845 -7.396 -10.368 688 HG LEU 7 HG LEU 7 4.172 -6.581 -10.765 689 HD11 LEU 7 HD11 LEU 7 4.346 -3.997 -10.101 690 HD12 LEU 7 HD12 LEU 7 2.726 -3.943 -10.790 691 HD13 LEU 7 HD13 LEU 7 4.085 -4.487 -11.772 692 HD21 LEU 7 HD21 LEU 7 2.840 -5.302 -8.359 693 HD22 LEU 7 HD22 LEU 7 4.520 -5.824 -8.483 694 HD23 LEU 7 HD23 LEU 7 3.224 -7.020 -8.477 695 H LYS 8 HN LYS 8 1.633 -8.976 -12.356 696 HA LYS 8 HA LYS 8 4.335 -9.817 -12.744 697 HB2 LYS 8 HB2 LYS 8 2.427 -11.258 -11.920 698 HB3 LYS 8 HB1 LYS 8 1.846 -11.324 -13.584 699 HG2 LYS 8 HG2 LYS 8 3.906 -12.371 -14.323 700 HG3 LYS 8 HG1 LYS 8 4.625 -12.164 -12.729 701 HD2 LYS 8 HD2 LYS 8 3.884 -14.440 -12.829 702 HD3 LYS 8 HD1 LYS 8 2.732 -13.584 -11.804 703 HE2 LYS 8 HE2 LYS 8 1.089 -13.520 -13.518 704 HE3 LYS 8 HE1 LYS 8 2.258 -13.936 -14.771 705 HZ1 LYS 8 HZ1 LYS 8 1.752 -16.046 -14.445 706 HZ2 LYS 8 HZ2 LYS 8 0.708 -15.648 -13.166 707 HZ3 LYS 8 HZ3 LYS 8 2.353 -15.945 -12.862 708 H VAL 9 HN VAL 9 1.744 -9.060 -15.042 709 HA VAL 9 HA VAL 9 3.008 -10.041 -17.401 710 HB VAL 9 HB VAL 9 1.078 -7.742 -16.973 711 HG11 VAL 9 HG11 VAL 9 2.144 -7.232 -19.043 712 HG12 VAL 9 HG12 VAL 9 0.668 -8.092 -19.491 713 HG13 VAL 9 HG13 VAL 9 2.219 -8.932 -19.509 714 HG21 VAL 9 HG21 VAL 9 0.568 -10.435 -18.250 715 HG22 VAL 9 HG22 VAL 9 -0.606 -9.302 -17.581 716 HG23 VAL 9 HG23 VAL 9 0.453 -10.211 -16.504 717 H GLU 10 HN GLU 10 3.136 -6.784 -15.905 718 HA GLU 10 HA GLU 10 4.917 -5.687 -17.868 719 HB2 GLU 10 HB2 GLU 10 4.228 -4.973 -15.011 720 HB3 GLU 10 HB1 GLU 10 5.489 -4.093 -15.876 721 HG2 GLU 10 HG2 GLU 10 3.390 -2.911 -16.165 722 HG3 GLU 10 HG1 GLU 10 3.838 -3.637 -17.705 723 H ARG 11 HN ARG 11 5.443 -7.415 -14.836 724 HA ARG 11 HA ARG 11 8.279 -7.082 -14.703 725 HB2 ARG 11 HB2 ARG 11 6.452 -8.160 -13.047 726 HB3 ARG 11 HB1 ARG 11 7.031 -9.655 -13.773 727 HG2 ARG 11 HG2 ARG 11 8.739 -7.556 -12.407 728 HG3 ARG 11 HG1 ARG 11 8.312 -9.135 -11.745 729 HD2 ARG 11 HD2 ARG 11 10.039 -8.549 -14.156 730 HD3 ARG 11 HD1 ARG 11 10.514 -9.353 -12.663 731 HE ARG 11 HE ARG 11 9.145 -10.600 -14.909 732 HH11 ARG 11 HH21 ARG 11 9.660 -10.581 -11.494 733 HH12 ARG 11 HH22 ARG 11 9.321 -12.270 -11.306 734 HH21 ARG 11 HH11 ARG 11 8.706 -12.794 -14.677 735 HH22 ARG 11 HH12 ARG 11 8.782 -13.521 -13.107 736 H ILE 12 HN ILE 12 6.304 -9.716 -16.081 737 HA ILE 12 HA ILE 12 8.541 -11.192 -17.144 738 HB ILE 12 HB ILE 12 5.598 -11.188 -17.878 739 HG12 ILE 12 HG12 ILE 12 7.225 -13.232 -16.344 740 HG13 ILE 12 HG11 ILE 12 6.334 -11.931 -15.556 741 HG21 ILE 12 HG21 ILE 12 6.709 -12.062 -19.794 742 HG22 ILE 12 HG22 ILE 12 6.237 -13.481 -18.863 743 HG23 ILE 12 HG23 ILE 12 7.904 -12.908 -18.813 744 HD11 ILE 12 HD11 ILE 12 4.982 -13.987 -15.626 745 HD12 ILE 12 HD12 ILE 12 5.139 -14.037 -17.382 746 HD13 ILE 12 HD13 ILE 12 4.245 -12.724 -16.613 747 H ARG 13 HN ARG 13 6.286 -8.833 -18.567 748 HA ARG 13 HA ARG 13 7.288 -8.942 -21.235 749 HB2 ARG 13 HB2 ARG 13 5.183 -7.728 -20.360 750 HB3 ARG 13 HB1 ARG 13 6.271 -6.410 -19.920 751 HG2 ARG 13 HG2 ARG 13 7.090 -6.367 -22.289 752 HG3 ARG 13 HG1 ARG 13 5.871 -7.577 -22.688 753 HD2 ARG 13 HD2 ARG 13 4.930 -5.436 -23.244 754 HD3 ARG 13 HD1 ARG 13 4.132 -5.979 -21.768 755 HE ARG 13 HE ARG 13 6.305 -4.476 -20.888 756 HH11 ARG 13 HH21 ARG 13 3.551 -4.046 -22.924 757 HH12 ARG 13 HH22 ARG 13 3.420 -2.348 -22.606 758 HH21 ARG 13 HH11 ARG 13 6.154 -2.262 -20.478 759 HH22 ARG 13 HH12 ARG 13 4.892 -1.340 -21.224 760 H LEU 14 HN LEU 14 8.209 -6.945 -18.456 761 HA LEU 14 HA LEU 14 10.411 -5.686 -19.949 762 HB2 LEU 14 HB2 LEU 14 9.633 -5.561 -17.014 763 HB3 LEU 14 HB1 LEU 14 10.869 -4.561 -17.775 764 HG LEU 14 HG LEU 14 7.966 -4.631 -18.656 765 HD11 LEU 14 HD11 LEU 14 7.707 -2.506 -17.492 766 HD12 LEU 14 HD12 LEU 14 9.395 -2.543 -16.987 767 HD13 LEU 14 HD13 LEU 14 8.258 -3.728 -16.345 768 HD21 LEU 14 HD21 LEU 14 8.815 -2.327 -19.629 769 HD22 LEU 14 HD22 LEU 14 9.182 -3.815 -20.491 770 HD23 LEU 14 HD23 LEU 14 10.411 -3.061 -19.477 771 H SER 15 HN SER 15 9.919 -8.631 -18.498 772 HA SER 15 HA SER 15 11.339 -10.239 -17.485 773 HB2 SER 15 HB2 SER 15 11.862 -10.346 -19.904 774 HB3 SER 15 HB1 SER 15 13.129 -9.144 -19.676 775 HG SER 15 HG SER 15 14.227 -10.970 -19.422 776 H LEU 16 HN LEU 16 11.567 -8.829 -15.506 777 HA LEU 16 HA LEU 16 14.275 -7.560 -15.275 778 HB2 LEU 16 HB2 LEU 16 11.931 -7.454 -13.357 779 HB3 LEU 16 HB1 LEU 16 13.413 -6.508 -13.252 780 HG LEU 16 HG LEU 16 11.454 -6.400 -15.563 781 HD11 LEU 16 HD11 LEU 16 11.895 -4.588 -13.178 782 HD12 LEU 16 HD12 LEU 16 10.403 -5.402 -13.650 783 HD13 LEU 16 HD13 LEU 16 11.029 -4.074 -14.627 784 HD21 LEU 16 HD21 LEU 16 12.866 -4.206 -15.923 785 HD22 LEU 16 HD22 LEU 16 13.521 -5.745 -16.467 786 HD23 LEU 16 HD23 LEU 16 14.079 -5.040 -14.949 787 H THR 17 HN THR 17 15.823 -8.456 -14.048 788 HA THR 17 HA THR 17 15.526 -11.170 -13.109 789 HB THR 17 HB THR 17 17.843 -10.769 -12.172 790 HG1 THR 17 HG1 THR 17 17.029 -8.239 -12.634 791 HG21 THR 17 HG21 THR 17 17.438 -11.603 -14.472 792 HG22 THR 17 HG22 THR 17 18.878 -10.588 -14.385 793 HG23 THR 17 HG23 THR 17 17.379 -9.938 -15.049 794 H ALA 18 HN ALA 18 15.126 -11.931 -11.095 795 HA ALA 18 HA ALA 18 13.936 -10.220 -9.120 796 HB1 ALA 18 HB1 ALA 18 14.028 -12.269 -7.669 797 HB2 ALA 18 HB2 ALA 18 14.963 -13.069 -8.931 798 HB3 ALA 18 HB3 ALA 18 13.303 -12.567 -9.250 799 H LYS 19 HN LYS 19 17.180 -11.604 -9.474 800 HA LYS 19 HA LYS 19 18.175 -10.921 -6.897 801 HB2 LYS 19 HB2 LYS 19 19.549 -11.188 -9.586 802 HB3 LYS 19 HB1 LYS 19 20.415 -10.961 -8.073 803 HG2 LYS 19 HG2 LYS 19 19.436 -13.001 -7.164 804 HG3 LYS 19 HG1 LYS 19 18.492 -13.229 -8.637 805 HD2 LYS 19 HD2 LYS 19 20.587 -13.405 -9.938 806 HD3 LYS 19 HD1 LYS 19 21.520 -13.191 -8.457 807 HE2 LYS 19 HE2 LYS 19 20.516 -15.237 -7.517 808 HE3 LYS 19 HE1 LYS 19 19.565 -15.451 -8.988 809 HZ1 LYS 19 HZ1 LYS 19 21.694 -15.515 -10.226 810 HZ2 LYS 19 HZ2 LYS 19 21.498 -16.808 -9.140 811 HZ3 LYS 19 HZ3 LYS 19 22.522 -15.510 -8.746 812 H SER 20 HN SER 20 18.230 -9.099 -9.967 813 HA SER 20 HA SER 20 19.630 -6.834 -8.940 814 HB2 SER 20 HB2 SER 20 19.296 -7.252 -11.359 815 HB3 SER 20 HB1 SER 20 17.572 -6.945 -11.169 816 HG SER 20 HG SER 20 18.295 -4.855 -10.264 817 H VAL 21 HN VAL 21 16.146 -7.506 -9.203 818 HA VAL 21 HA VAL 21 15.267 -4.994 -8.148 819 HB VAL 21 HB VAL 21 13.940 -7.722 -8.135 820 HG11 VAL 21 HG11 VAL 21 12.828 -6.464 -6.451 821 HG12 VAL 21 HG12 VAL 21 11.842 -6.250 -7.897 822 HG13 VAL 21 HG13 VAL 21 12.940 -4.970 -7.380 823 HG21 VAL 21 HG21 VAL 21 12.820 -6.953 -10.117 824 HG22 VAL 21 HG22 VAL 21 14.533 -6.599 -10.346 825 HG23 VAL 21 HG23 VAL 21 13.421 -5.309 -9.891 826 H ALA 22 HN ALA 22 16.583 -7.820 -6.620 827 HA ALA 22 HA ALA 22 15.537 -7.120 -3.961 828 HB1 ALA 22 HB1 ALA 22 15.853 -9.459 -4.315 829 HB2 ALA 22 HB2 ALA 22 17.167 -8.968 -3.244 830 HB3 ALA 22 HB3 ALA 22 17.476 -9.214 -4.962 831 H GLU 23 HN GLU 23 18.467 -6.634 -5.836 832 HA GLU 23 HA GLU 23 20.133 -5.753 -3.649 833 HB2 GLU 23 HB2 GLU 23 20.237 -5.202 -6.631 834 HB3 GLU 23 HB1 GLU 23 21.499 -4.711 -5.499 835 HG2 GLU 23 HG2 GLU 23 21.939 -6.999 -4.888 836 HG3 GLU 23 HG1 GLU 23 20.548 -7.569 -5.804 837 H GLU 24 HN GLU 24 18.111 -4.012 -6.018 838 HA GLU 24 HA GLU 24 18.717 -1.391 -4.952 839 HB2 GLU 24 HB2 GLU 24 16.506 -0.815 -6.224 840 HB3 GLU 24 HB1 GLU 24 17.908 -1.331 -7.155 841 HG2 GLU 24 HG2 GLU 24 16.889 -3.263 -7.850 842 HG3 GLU 24 HG1 GLU 24 16.239 -3.603 -6.256 843 H MET 25 HN MET 25 15.987 -3.648 -4.493 844 HA MET 25 HA MET 25 14.549 -1.916 -2.691 845 HB2 MET 25 HB2 MET 25 14.459 -4.915 -3.092 846 HB3 MET 25 HB1 MET 25 13.353 -4.032 -2.038 847 HG2 MET 25 HG2 MET 25 12.568 -2.696 -3.924 848 HG3 MET 25 HG1 MET 25 13.732 -3.479 -4.992 849 HE1 MET 25 HE1 MET 25 11.070 -3.832 -2.486 850 HE2 MET 25 HE2 MET 25 10.096 -5.238 -2.911 851 HE3 MET 25 HE3 MET 25 9.936 -3.751 -3.840 852 H GLY 26 HN GLY 26 17.002 -4.417 -2.246 853 HA2 GLY 26 HA2 GLY 26 18.525 -4.542 -0.401 854 HA3 GLY 26 HA1 GLY 26 17.529 -3.379 0.472 855 H ILE 27 HN ILE 27 15.917 -6.042 -1.018 856 HA ILE 27 HA ILE 27 15.547 -7.330 1.679 857 HB ILE 27 HB ILE 27 13.336 -7.996 0.901 858 HG12 ILE 27 HG12 ILE 27 14.288 -6.732 -1.673 859 HG13 ILE 27 HG11 ILE 27 13.649 -8.339 -1.409 860 HG21 ILE 27 HG21 ILE 27 13.397 -5.927 2.046 861 HG22 ILE 27 HG22 ILE 27 12.347 -5.666 0.668 862 HG23 ILE 27 HG23 ILE 27 14.003 -5.062 0.633 863 HD11 ILE 27 HD11 ILE 27 11.412 -7.430 -0.946 864 HD12 ILE 27 HD12 ILE 27 11.978 -6.942 -2.542 865 HD13 ILE 27 HD13 ILE 27 12.030 -5.791 -1.218 866 H SER 28 HN SER 28 14.510 -9.692 1.065 867 HA SER 28 HA SER 28 16.663 -11.040 -0.486 868 HB2 SER 28 HB2 SER 28 16.354 -12.004 1.663 869 HB3 SER 28 HB1 SER 28 14.599 -11.959 1.516 870 HG SER 28 HG SER 28 15.781 -13.325 -0.513 871 H ARG 29 HN ARG 29 15.999 -12.894 -1.855 872 HA ARG 29 HA ARG 29 14.080 -12.136 -3.844 873 HB2 ARG 29 HB2 ARG 29 15.528 -14.721 -3.242 874 HB3 ARG 29 HB1 ARG 29 14.404 -14.573 -4.592 875 HG2 ARG 29 HG2 ARG 29 15.723 -12.799 -5.575 876 HG3 ARG 29 HG1 ARG 29 16.776 -12.741 -4.162 877 HD2 ARG 29 HD2 ARG 29 16.458 -15.295 -5.736 878 HD3 ARG 29 HD1 ARG 29 17.600 -14.057 -6.248 879 HE ARG 29 HE ARG 29 18.162 -14.442 -3.550 880 HH11 ARG 29 HH21 ARG 29 17.919 -16.400 -6.384 881 HH12 ARG 29 HH22 ARG 29 19.130 -17.525 -5.865 882 HH21 ARG 29 HH11 ARG 29 19.746 -15.892 -2.869 883 HH22 ARG 29 HH12 ARG 29 20.163 -17.237 -3.878 884 H GLN 30 HN GLN 30 13.935 -14.309 -1.062 885 HA GLN 30 HA GLN 30 11.453 -15.568 -1.604 886 HB2 GLN 30 HB2 GLN 30 12.627 -14.724 1.068 887 HB3 GLN 30 HB1 GLN 30 11.294 -15.862 0.868 888 HG2 GLN 30 HG2 GLN 30 14.046 -16.225 -0.351 889 HG3 GLN 30 HG1 GLN 30 13.516 -16.992 1.147 890 HE21 GLN 30 HE21 GLN 30 13.965 -17.785 -1.982 891 HE22 GLN 30 HE22 GLN 30 12.693 -18.885 -2.215 892 H GLN 31 HN GLN 31 12.141 -12.488 0.042 893 HA GLN 31 HA GLN 31 9.400 -11.876 0.646 894 HB2 GLN 31 HB2 GLN 31 11.389 -10.748 1.687 895 HB3 GLN 31 HB1 GLN 31 11.683 -9.936 0.150 896 HG2 GLN 31 HG2 GLN 31 10.429 -8.432 1.589 897 HG3 GLN 31 HG1 GLN 31 9.373 -8.966 0.282 898 HE21 GLN 31 HE21 GLN 31 7.356 -8.903 1.394 899 HE22 GLN 31 HE22 GLN 31 7.016 -9.855 2.758 900 H LEU 32 HN LEU 32 11.509 -11.029 -2.090 901 HA LEU 32 HA LEU 32 9.576 -9.432 -3.470 902 HB2 LEU 32 HB2 LEU 32 12.036 -9.469 -3.977 903 HB3 LEU 32 HB1 LEU 32 11.830 -11.075 -4.667 904 HG LEU 32 HG LEU 32 10.171 -10.124 -6.279 905 HD11 LEU 32 HD11 LEU 32 9.302 -8.163 -5.347 906 HD12 LEU 32 HD12 LEU 32 10.477 -7.494 -6.470 907 HD13 LEU 32 HD13 LEU 32 10.868 -7.617 -4.759 908 HD21 LEU 32 HD21 LEU 32 11.900 -8.853 -7.614 909 HD22 LEU 32 HD22 LEU 32 12.457 -10.414 -7.013 910 HD23 LEU 32 HD23 LEU 32 12.957 -8.929 -6.204 911 H CYS 33 HN CYS 33 10.386 -12.877 -3.623 912 HA CYS 33 HA CYS 33 8.605 -13.555 -5.752 913 HB2 CYS 33 HB2 CYS 33 10.518 -14.911 -4.416 914 HB3 CYS 33 HB1 CYS 33 9.104 -15.571 -3.599 915 HG CYS 33 HG CYS 33 8.196 -16.181 -6.077 916 H ASN 34 HN ASN 34 8.110 -13.196 -2.280 917 HA ASN 34 HA ASN 34 5.555 -14.453 -2.090 918 HB2 ASN 34 HB2 ASN 34 6.918 -12.252 -0.535 919 HB3 ASN 34 HB1 ASN 34 5.263 -12.725 -0.150 920 HD21 ASN 34 HD21 ASN 34 7.984 -13.166 1.295 921 HD22 ASN 34 HD22 ASN 34 7.978 -14.828 1.638 922 H ILE 35 HN ILE 35 6.461 -11.125 -2.938 923 HA ILE 35 HA ILE 35 3.795 -10.093 -3.104 924 HB ILE 35 HB ILE 35 6.229 -9.236 -4.699 925 HG12 ILE 35 HG12 ILE 35 5.249 -8.206 -2.021 926 HG13 ILE 35 HG11 ILE 35 6.564 -9.367 -2.193 927 HG21 ILE 35 HG21 ILE 35 3.690 -7.794 -3.875 928 HG22 ILE 35 HG22 ILE 35 4.135 -8.266 -5.515 929 HG23 ILE 35 HG23 ILE 35 5.067 -7.030 -4.670 930 HD11 ILE 35 HD11 ILE 35 7.462 -7.092 -2.008 931 HD12 ILE 35 HD12 ILE 35 6.486 -6.582 -3.386 932 HD13 ILE 35 HD13 ILE 35 7.790 -7.749 -3.610 933 H GLU 36 HN GLU 36 5.923 -11.566 -5.533 934 HA GLU 36 HA GLU 36 4.129 -11.284 -7.751 935 HB2 GLU 36 HB2 GLU 36 6.522 -12.993 -7.134 936 HB3 GLU 36 HB1 GLU 36 5.542 -13.404 -8.539 937 HG2 GLU 36 HG2 GLU 36 7.525 -11.797 -8.918 938 HG3 GLU 36 HG1 GLU 36 5.967 -11.332 -9.593 939 H GLN 37 HN GLN 37 4.338 -13.662 -5.172 940 HA GLN 37 HA GLN 37 2.582 -15.583 -6.461 941 HB2 GLN 37 HB2 GLN 37 3.477 -15.211 -3.593 942 HB3 GLN 37 HB1 GLN 37 2.410 -16.523 -4.101 943 HG2 GLN 37 HG2 GLN 37 4.085 -17.328 -5.680 944 HG3 GLN 37 HG1 GLN 37 5.140 -15.972 -5.300 945 HE21 GLN 37 HE21 GLN 37 6.513 -18.134 -4.822 946 HE22 GLN 37 HE22 GLN 37 6.484 -18.640 -3.202 947 H SER 38 HN SER 38 1.624 -12.824 -6.402 948 HA SER 38 HA SER 38 -0.360 -11.656 -6.063 949 HB2 SER 38 HB2 SER 38 -1.653 -14.282 -5.354 950 HB3 SER 38 HB1 SER 38 -2.356 -12.903 -6.195 951 HG SER 38 HG SER 38 -1.353 -13.480 -8.005 952 H GLU 39 HN GLU 39 0.561 -10.677 -4.128 953 HA GLU 39 HA GLU 39 -0.461 -11.782 -1.549 954 HB2 GLU 39 HB2 GLU 39 1.993 -11.073 -1.864 955 HB3 GLU 39 HB1 GLU 39 1.401 -9.416 -1.925 956 HG2 GLU 39 HG2 GLU 39 0.639 -11.227 0.370 957 HG3 GLU 39 HG1 GLU 39 2.181 -10.379 0.372 958 H THR 40 HN THR 40 -1.087 -9.459 -3.942 959 HA THR 40 HA THR 40 -2.906 -8.002 -4.164 960 HB THR 40 HB THR 40 -3.556 -8.154 -1.237 961 HG1 THR 40 HG1 THR 40 -4.138 -10.178 -1.355 962 HG21 THR 40 HG21 THR 40 -5.208 -8.166 -3.779 963 HG22 THR 40 HG22 THR 40 -4.940 -6.779 -2.724 964 HG23 THR 40 HG23 THR 40 -5.861 -8.163 -2.142 965 H ALA 41 HN ALA 41 -3.554 -5.765 -3.254 966 HA ALA 41 HA ALA 41 -1.060 -4.361 -2.568 967 HB1 ALA 41 HB1 ALA 41 -3.813 -3.443 -3.416 968 HB2 ALA 41 HB2 ALA 41 -2.306 -3.331 -4.323 969 HB3 ALA 41 HB3 ALA 41 -2.562 -2.309 -2.909 970 HA PRO 42 HA PRO 42 -2.210 -3.872 1.732 971 HB2 PRO 42 HB2 PRO 42 -0.707 -1.712 2.420 972 HB3 PRO 42 HB1 PRO 42 0.016 -3.290 2.052 973 HG2 PRO 42 HG2 PRO 42 -0.244 -0.882 0.298 974 HG3 PRO 42 HG1 PRO 42 1.142 -1.958 0.523 975 HD2 PRO 42 HD2 PRO 42 -0.544 -2.176 -1.614 976 HD3 PRO 42 HD1 PRO 42 0.315 -3.568 -0.912 977 H VAL 43 HN VAL 43 -3.320 -2.397 3.229 978 HA VAL 43 HA VAL 43 -5.437 -0.898 1.997 979 HB VAL 43 HB VAL 43 -5.937 -0.159 4.346 980 HG11 VAL 43 HG11 VAL 43 -6.850 -2.264 3.545 981 HG12 VAL 43 HG12 VAL 43 -6.316 -2.485 5.211 982 HG13 VAL 43 HG13 VAL 43 -5.331 -3.093 3.880 983 HG21 VAL 43 HG21 VAL 43 -3.603 -0.016 5.136 984 HG22 VAL 43 HG22 VAL 43 -3.428 -1.760 4.946 985 HG23 VAL 43 HG23 VAL 43 -4.539 -1.113 6.154 986 H VAL 44 HN VAL 44 -2.213 -0.058 2.873 987 HA VAL 44 HA VAL 44 -2.497 2.740 3.358 988 HB VAL 44 HB VAL 44 -0.221 1.193 2.072 989 HG11 VAL 44 HG11 VAL 44 0.078 3.472 1.421 990 HG12 VAL 44 HG12 VAL 44 1.107 3.248 2.836 991 HG13 VAL 44 HG13 VAL 44 -0.448 4.065 2.996 992 HG21 VAL 44 HG21 VAL 44 -0.806 2.146 4.889 993 HG22 VAL 44 HG22 VAL 44 0.781 1.567 4.377 994 HG23 VAL 44 HG23 VAL 44 -0.610 0.481 4.343 995 H VAL 45 HN VAL 45 -2.108 0.900 0.345 996 HA VAL 45 HA VAL 45 -1.960 3.102 -1.445 997 HB VAL 45 HB VAL 45 -3.073 0.304 -1.783 998 HG11 VAL 45 HG11 VAL 45 -2.682 2.511 -3.820 999 HG12 VAL 45 HG12 VAL 45 -4.163 1.616 -3.476 1000 HG13 VAL 45 HG13 VAL 45 -2.807 0.808 -4.261 1001 HG21 VAL 45 HG21 VAL 45 -0.586 0.748 -1.334 1002 HG22 VAL 45 HG22 VAL 45 -0.549 1.534 -2.911 1003 HG23 VAL 45 HG23 VAL 45 -0.959 -0.178 -2.787 1004 H LYS 46 HN LYS 46 -4.758 1.342 -0.150 1005 HA LYS 46 HA LYS 46 -6.759 2.766 -1.603 1006 HB2 LYS 46 HB2 LYS 46 -6.863 1.405 1.104 1007 HB3 LYS 46 HB1 LYS 46 -8.284 2.003 0.245 1008 HG2 LYS 46 HG2 LYS 46 -7.741 0.548 -1.671 1009 HG3 LYS 46 HG1 LYS 46 -6.325 -0.058 -0.810 1010 HD2 LYS 46 HD2 LYS 46 -7.754 -0.958 0.963 1011 HD3 LYS 46 HD1 LYS 46 -9.184 -0.298 0.170 1012 HE2 LYS 46 HE2 LYS 46 -9.145 -2.560 -0.516 1013 HE3 LYS 46 HE1 LYS 46 -8.452 -1.690 -1.884 1014 HZ1 LYS 46 HZ1 LYS 46 -6.275 -2.144 -0.427 1015 HZ2 LYS 46 HZ2 LYS 46 -6.825 -3.200 -1.640 1016 HZ3 LYS 46 HZ3 LYS 46 -7.189 -3.509 -0.010 1017 H TYR 47 HN TYR 47 -5.128 3.483 1.471 1018 HA TYR 47 HA TYR 47 -6.800 5.622 2.322 1019 HB2 TYR 47 HB2 TYR 47 -5.017 4.600 3.725 1020 HB3 TYR 47 HB1 TYR 47 -3.801 5.356 2.696 1021 HD1 TYR 47 HD1 TYR 47 -3.518 7.813 2.667 1022 HD2 TYR 47 HD2 TYR 47 -6.333 5.890 5.268 1023 HE1 TYR 47 HE1 TYR 47 -3.718 9.898 3.993 1024 HE2 TYR 47 HE2 TYR 47 -6.537 7.978 6.595 1025 HH TYR 47 HH TYR 47 -6.116 10.232 6.540 1026 H ILE 48 HN ILE 48 -3.751 5.793 0.450 1027 HA ILE 48 HA ILE 48 -3.917 8.619 -0.001 1028 HB ILE 48 HB ILE 48 -2.293 8.164 -1.857 1029 HG12 ILE 48 HG12 ILE 48 -2.630 5.277 -1.019 1030 HG13 ILE 48 HG11 ILE 48 -3.343 5.947 -2.484 1031 HG21 ILE 48 HG21 ILE 48 -1.738 6.662 0.719 1032 HG22 ILE 48 HG22 ILE 48 -1.543 8.401 0.497 1033 HG23 ILE 48 HG23 ILE 48 -0.523 7.275 -0.401 1034 HD11 ILE 48 HD11 ILE 48 -1.175 6.446 -3.398 1035 HD12 ILE 48 HD12 ILE 48 -1.125 4.783 -2.829 1036 HD13 ILE 48 HD13 ILE 48 -0.377 6.064 -1.873 1037 H ALA 49 HN ALA 49 -5.386 5.857 -1.519 1038 HA ALA 49 HA ALA 49 -6.195 7.108 -3.975 1039 HB1 ALA 49 HB1 ALA 49 -7.809 4.992 -2.542 1040 HB2 ALA 49 HB2 ALA 49 -6.273 4.599 -3.315 1041 HB3 ALA 49 HB3 ALA 49 -7.609 5.231 -4.278 1042 H PHE 50 HN PHE 50 -7.650 6.905 -0.747 1043 HA PHE 50 HA PHE 50 -10.149 8.145 -1.355 1044 HB2 PHE 50 HB2 PHE 50 -9.653 7.076 0.834 1045 HB3 PHE 50 HB1 PHE 50 -8.495 8.358 1.187 1046 HD1 PHE 50 HD2 PHE 50 -9.243 10.654 1.616 1047 HD2 PHE 50 HD1 PHE 50 -12.049 7.488 0.883 1048 HE1 PHE 50 HE2 PHE 50 -11.078 12.080 2.480 1049 HE2 PHE 50 HE1 PHE 50 -13.884 8.914 1.749 1050 HZ PHE 50 HZ PHE 50 -13.397 11.210 2.550 1051 H LEU 51 HN LEU 51 -7.006 9.472 -0.396 1052 HA LEU 51 HA LEU 51 -7.775 12.231 -0.452 1053 HB2 LEU 51 HB2 LEU 51 -5.153 10.764 -0.723 1054 HB3 LEU 51 HB1 LEU 51 -5.212 12.513 -0.922 1055 HG LEU 51 HG LEU 51 -6.503 11.260 1.502 1056 HD11 LEU 51 HD11 LEU 51 -3.553 11.687 1.022 1057 HD12 LEU 51 HD12 LEU 51 -4.365 10.269 1.685 1058 HD13 LEU 51 HD13 LEU 51 -4.235 11.740 2.649 1059 HD21 LEU 51 HD21 LEU 51 -5.859 13.435 2.507 1060 HD22 LEU 51 HD22 LEU 51 -6.826 13.677 1.056 1061 HD23 LEU 51 HD23 LEU 51 -5.079 13.898 0.997 1062 H ARG 52 HN ARG 52 -6.584 10.017 -2.939 1063 HA ARG 52 HA ARG 52 -6.230 11.945 -5.021 1064 HB2 ARG 52 HB2 ARG 52 -5.403 9.588 -5.124 1065 HB3 ARG 52 HB1 ARG 52 -7.071 9.039 -5.289 1066 HG2 ARG 52 HG2 ARG 52 -7.301 10.370 -7.359 1067 HG3 ARG 52 HG1 ARG 52 -5.628 10.903 -7.193 1068 HD2 ARG 52 HD2 ARG 52 -4.911 8.510 -7.264 1069 HD3 ARG 52 HD1 ARG 52 -6.582 8.055 -7.564 1070 HE ARG 52 HE ARG 52 -6.455 9.076 -9.749 1071 HH11 ARG 52 HH21 ARG 52 -3.514 9.299 -7.917 1072 HH12 ARG 52 HH22 ARG 52 -2.544 9.653 -9.304 1073 HH21 ARG 52 HH11 ARG 52 -5.188 9.545 -11.535 1074 HH22 ARG 52 HH12 ARG 52 -3.485 9.795 -11.341 1075 H SER 53 HN SER 53 -9.062 10.583 -3.572 1076 HA SER 53 HA SER 53 -10.931 10.844 -5.703 1077 HB2 SER 53 HB2 SER 53 -12.639 10.871 -4.009 1078 HB3 SER 53 HB1 SER 53 -11.357 9.825 -3.406 1079 HG SER 53 HG SER 53 -11.273 11.130 -1.769 1080 H LYS 54 HN LYS 54 -9.509 13.193 -3.516 1081 HA LYS 54 HA LYS 54 -11.185 15.382 -4.605 1082 HB2 LYS 54 HB2 LYS 54 -8.987 15.341 -2.511 1083 HB3 LYS 54 HB1 LYS 54 -9.889 16.782 -2.982 1084 HG2 LYS 54 HG2 LYS 54 -11.994 15.690 -2.315 1085 HG3 LYS 54 HG1 LYS 54 -11.099 14.245 -1.845 1086 HD2 LYS 54 HD2 LYS 54 -9.875 15.516 -0.149 1087 HD3 LYS 54 HD1 LYS 54 -10.686 17.000 -0.647 1088 HE2 LYS 54 HE2 LYS 54 -11.946 16.302 1.216 1089 HE3 LYS 54 HE1 LYS 54 -12.888 15.704 -0.149 1090 HZ1 LYS 54 HZ1 LYS 54 -12.524 14.049 1.640 1091 HZ2 LYS 54 HZ2 LYS 54 -10.860 14.092 1.299 1092 HZ3 LYS 54 HZ3 LYS 54 -11.957 13.545 0.122 1093 H GLY 55 HN GLY 55 -8.526 13.715 -5.577 1094 HA2 GLY 55 HA2 GLY 55 -7.127 14.195 -7.430 1095 HA3 GLY 55 HA1 GLY 55 -7.724 15.853 -7.417 1096 H VAL 56 HN VAL 56 -6.428 14.324 -4.516 1097 HA VAL 56 HA VAL 56 -4.589 16.481 -4.071 1098 HB VAL 56 HB VAL 56 -4.671 13.680 -2.906 1099 HG11 VAL 56 HG11 VAL 56 -3.341 14.840 -1.032 1100 HG12 VAL 56 HG12 VAL 56 -3.014 16.114 -2.208 1101 HG13 VAL 56 HG13 VAL 56 -2.455 14.471 -2.513 1102 HG21 VAL 56 HG21 VAL 56 -5.562 16.345 -1.765 1103 HG22 VAL 56 HG22 VAL 56 -5.809 14.756 -1.048 1104 HG23 VAL 56 HG23 VAL 56 -6.649 15.192 -2.534 1105 H ASP 57 HN ASP 57 -2.698 16.859 -5.035 1106 HA ASP 57 HA ASP 57 -1.591 15.157 -7.060 1107 HB2 ASP 57 HB2 ASP 57 -0.503 17.544 -5.550 1108 HB3 ASP 57 HB1 ASP 57 0.406 16.742 -6.831 1109 H LEU 58 HN LEU 58 -1.620 13.204 -5.481 1110 HA LEU 58 HA LEU 58 0.430 12.979 -3.474 1111 HB2 LEU 58 HB2 LEU 58 -1.569 11.436 -3.750 1112 HB3 LEU 58 HB1 LEU 58 -0.747 10.740 -5.145 1113 HG LEU 58 HG LEU 58 1.276 10.491 -3.408 1114 HD11 LEU 58 HD11 LEU 58 -1.144 10.284 -1.593 1115 HD12 LEU 58 HD12 LEU 58 -0.057 11.671 -1.608 1116 HD13 LEU 58 HD13 LEU 58 0.548 10.083 -1.141 1117 HD21 LEU 58 HD21 LEU 58 -1.144 8.736 -3.789 1118 HD22 LEU 58 HD22 LEU 58 0.166 8.226 -2.719 1119 HD23 LEU 58 HD23 LEU 58 0.486 8.529 -4.426 1120 H ASN 59 HN ASN 59 0.303 12.300 -6.932 1121 HA ASN 59 HA ASN 59 2.658 10.912 -7.397 1122 HB2 ASN 59 HB2 ASN 59 2.121 13.290 -9.165 1123 HB3 ASN 59 HB1 ASN 59 2.502 11.625 -9.609 1124 HD21 ASN 59 HD21 ASN 59 0.723 10.701 -10.624 1125 HD22 ASN 59 HD22 ASN 59 -0.894 10.942 -10.163 1126 H ALA 60 HN ALA 60 2.306 14.381 -6.778 1127 HA ALA 60 HA ALA 60 5.009 15.137 -7.215 1128 HB1 ALA 60 HB1 ALA 60 3.006 16.666 -6.841 1129 HB2 ALA 60 HB2 ALA 60 4.482 17.135 -5.997 1130 HB3 ALA 60 HB3 ALA 60 3.180 16.330 -5.120 1131 H LEU 61 HN LEU 61 3.382 14.137 -4.195 1132 HA LEU 61 HA LEU 61 5.707 14.338 -2.542 1133 HB2 LEU 61 HB2 LEU 61 3.255 12.567 -2.305 1134 HB3 LEU 61 HB1 LEU 61 4.454 12.770 -1.029 1135 HG LEU 61 HG LEU 61 2.889 15.050 -2.277 1136 HD11 LEU 61 HD11 LEU 61 1.287 13.748 -1.108 1137 HD12 LEU 61 HD12 LEU 61 1.754 15.012 0.030 1138 HD13 LEU 61 HD13 LEU 61 2.414 13.387 0.200 1139 HD21 LEU 61 HD21 LEU 61 4.761 16.078 -1.340 1140 HD22 LEU 61 HD22 LEU 61 4.970 14.835 -0.110 1141 HD23 LEU 61 HD23 LEU 61 3.700 16.045 0.064 1142 H PHE 62 HN PHE 62 4.344 11.617 -4.372 1143 HA PHE 62 HA PHE 62 6.339 9.706 -3.547 1144 HB2 PHE 62 HB2 PHE 62 4.278 9.856 -5.729 1145 HB3 PHE 62 HB1 PHE 62 5.520 8.611 -5.838 1146 HD1 PHE 62 HD1 PHE 62 3.676 10.082 -2.901 1147 HD2 PHE 62 HD2 PHE 62 4.585 6.561 -5.194 1148 HE1 PHE 62 HE1 PHE 62 2.432 8.695 -1.268 1149 HE2 PHE 62 HE2 PHE 62 3.337 5.180 -3.559 1150 HZ PHE 62 HZ PHE 62 2.260 6.245 -1.599 1151 H ASP 63 HN ASP 63 6.077 11.886 -6.337 1152 HA ASP 63 HA ASP 63 8.422 10.927 -7.688 1153 HB2 ASP 63 HB2 ASP 63 6.980 13.588 -7.774 1154 HB3 ASP 63 HB1 ASP 63 8.327 13.181 -8.838 1155 H ARG 64 HN ARG 64 7.987 12.904 -4.904 1156 HA ARG 64 HA ARG 64 10.684 14.103 -5.094 1157 HB2 ARG 64 HB2 ARG 64 8.492 14.280 -3.007 1158 HB3 ARG 64 HB1 ARG 64 10.042 15.107 -2.862 1159 HG2 ARG 64 HG2 ARG 64 8.421 15.470 -5.379 1160 HG3 ARG 64 HG1 ARG 64 7.961 16.360 -3.930 1161 HD2 ARG 64 HD2 ARG 64 10.750 16.392 -5.129 1162 HD3 ARG 64 HD1 ARG 64 9.534 17.632 -5.410 1163 HE ARG 64 HE ARG 64 11.044 17.220 -2.918 1164 HH11 ARG 64 HH21 ARG 64 8.303 18.581 -4.521 1165 HH12 ARG 64 HH22 ARG 64 8.048 19.806 -3.323 1166 HH21 ARG 64 HH11 ARG 64 10.713 18.811 -1.344 1167 HH22 ARG 64 HH12 ARG 64 9.408 19.934 -1.529 1168 H ILE 65 HN ILE 65 9.114 11.375 -3.620 1169 HA ILE 65 HA ILE 65 11.226 10.945 -1.630 1170 HB ILE 65 HB ILE 65 8.882 9.250 -2.524 1171 HG12 ILE 65 HG12 ILE 65 9.383 10.678 0.096 1172 HG13 ILE 65 HG11 ILE 65 8.516 11.423 -1.246 1173 HG21 ILE 65 HG21 ILE 65 10.499 7.690 -1.724 1174 HG22 ILE 65 HG22 ILE 65 9.435 7.997 -0.351 1175 HG23 ILE 65 HG23 ILE 65 11.017 8.775 -0.435 1176 HD11 ILE 65 HD11 ILE 65 7.737 8.763 -0.031 1177 HD12 ILE 65 HD12 ILE 65 6.812 9.723 -1.187 1178 HD13 ILE 65 HD13 ILE 65 7.034 10.303 0.463 1179 H ILE 66 HN ILE 66 10.669 10.050 -4.929 1180 HA ILE 66 HA ILE 66 12.409 7.711 -4.879 1181 HB ILE 66 HB ILE 66 12.255 7.866 -7.368 1182 HG12 ILE 66 HG12 ILE 66 10.481 10.255 -6.797 1183 HG13 ILE 66 HG11 ILE 66 12.129 10.388 -7.410 1184 HG21 ILE 66 HG21 ILE 66 9.773 7.529 -7.457 1185 HG22 ILE 66 HG22 ILE 66 9.672 8.127 -5.802 1186 HG23 ILE 66 HG23 ILE 66 10.545 6.635 -6.148 1187 HD11 ILE 66 HD11 ILE 66 10.568 10.488 -9.281 1188 HD12 ILE 66 HD12 ILE 66 9.813 8.980 -8.767 1189 HD13 ILE 66 HD13 ILE 66 11.474 8.976 -9.361 1190 H VAL 67 HN VAL 67 12.981 11.028 -4.749 1191 HA VAL 67 HA VAL 67 15.132 11.622 -6.377 1192 HB VAL 67 HB VAL 67 16.006 13.035 -4.503 1193 HG11 VAL 67 HG11 VAL 67 13.788 14.272 -4.162 1194 HG12 VAL 67 HG12 VAL 67 13.042 12.982 -5.106 1195 HG13 VAL 67 HG13 VAL 67 14.280 14.005 -5.833 1196 HG21 VAL 67 HG21 VAL 67 14.676 13.014 -2.382 1197 HG22 VAL 67 HG22 VAL 67 15.565 11.514 -2.642 1198 HG23 VAL 67 HG23 VAL 67 13.831 11.578 -2.962 1199 H ASN 68 HN ASN 68 17.495 11.662 -5.839 1200 HA ASN 68 HA ASN 68 18.551 9.067 -5.606 1201 HB2 ASN 68 HB2 ASN 68 20.709 10.078 -5.577 1202 HB3 ASN 68 HB1 ASN 68 19.690 11.165 -6.518 1203 HD21 ASN 68 HD21 ASN 68 19.049 13.214 -5.518 1204 HD22 ASN 68 HD22 ASN 68 19.846 13.800 -4.143 1205 H LYS 69 HN LYS 69 19.582 7.943 -3.939 1206 HA LYS 69 HA LYS 69 19.841 7.156 -1.756 1207 HB2 LYS 69 HB2 LYS 69 21.303 9.165 -1.614 1208 HB3 LYS 69 HB1 LYS 69 19.917 10.104 -1.057 1209 HG2 LYS 69 HG2 LYS 69 19.667 8.649 0.893 1210 HG3 LYS 69 HG1 LYS 69 20.983 7.622 0.323 1211 HD2 LYS 69 HD2 LYS 69 22.543 9.534 0.492 1212 HD3 LYS 69 HD1 LYS 69 21.227 10.548 1.084 1213 HE2 LYS 69 HE2 LYS 69 20.936 9.063 3.024 1214 HE3 LYS 69 HE1 LYS 69 22.226 8.018 2.430 1215 HZ1 LYS 69 HZ1 LYS 69 22.465 10.298 4.009 1216 HZ2 LYS 69 HZ2 LYS 69 23.144 10.674 2.498 1217 HZ3 LYS 69 HZ3 LYS 69 23.710 9.335 3.377 1218 H LEU 70 HN LEU 70 17.946 6.172 -1.242 1219 HA LEU 70 HA LEU 70 15.560 7.744 -0.511 1220 HB2 LEU 70 HB2 LEU 70 16.047 4.746 -0.405 1221 HB3 LEU 70 HB1 LEU 70 14.484 5.550 -0.264 1222 HG LEU 70 HG LEU 70 16.299 5.687 -2.691 1223 HD11 LEU 70 HD11 LEU 70 15.263 3.447 -2.279 1224 HD12 LEU 70 HD12 LEU 70 14.680 4.215 -3.756 1225 HD13 LEU 70 HD13 LEU 70 13.675 4.216 -2.308 1226 HD21 LEU 70 HD21 LEU 70 13.637 6.918 -1.976 1227 HD22 LEU 70 HD22 LEU 70 14.006 6.544 -3.659 1228 HD23 LEU 70 HD23 LEU 70 15.028 7.663 -2.764 1229 H GLU 71 HN GLU 71 18.345 6.690 1.013 1230 HA GLU 71 HA GLU 71 18.996 6.577 3.263 1231 HB2 GLU 71 HB2 GLU 71 17.671 8.791 3.212 1232 HB3 GLU 71 HB1 GLU 71 16.344 7.876 3.922 1233 HG2 GLU 71 HG2 GLU 71 17.764 7.238 5.821 1234 HG3 GLU 71 HG1 GLU 71 19.128 8.092 5.103 1235 H HIS 72 HN HIS 72 16.450 4.925 1.982 1236 HA HIS 72 HA HIS 72 15.427 3.688 4.434 1237 HB2 HIS 72 HB2 HIS 72 15.007 3.167 1.485 1238 HB3 HIS 72 HB1 HIS 72 14.310 2.127 2.728 1239 HD2 HIS 72 HD2 HIS 72 11.656 3.034 2.430 1240 HE1 HIS 72 HE1 HIS 72 12.427 7.085 3.337 1241 HE2 HIS 72 HE2 HIS 72 10.605 5.367 2.928 1242 H HIS 73 HN HIS 73 15.982 1.673 5.230 1243 HA HIS 73 HA HIS 73 17.748 -0.103 3.707 1244 HB2 HIS 73 HB2 HIS 73 19.188 1.695 4.955 1245 HB3 HIS 73 HB1 HIS 73 18.777 0.783 6.406 1246 HD2 HIS 73 HD2 HIS 73 21.835 0.368 5.904 1247 HE1 HIS 73 HE1 HIS 73 20.942 -3.022 3.548 1248 HE2 HIS 73 HE2 HIS 73 22.778 -1.798 4.797 1249 H HIS 74 HN HIS 74 18.338 -2.040 5.327 1250 HA HIS 74 HA HIS 74 15.931 -3.311 6.023 1251 HB2 HIS 74 HB2 HIS 74 17.254 -5.024 6.971 1252 HB3 HIS 74 HB1 HIS 74 18.329 -4.285 5.787 1253 HD2 HIS 74 HD2 HIS 74 18.477 -5.254 9.422 1254 HE1 HIS 74 HE1 HIS 74 21.217 -2.061 9.064 1255 HE2 HIS 74 HE2 HIS 74 20.415 -3.940 10.568 1256 H HIS 75 HN HIS 75 14.529 -3.021 7.668 1257 HA HIS 75 HA HIS 75 15.429 -2.300 10.346 1258 HB2 HIS 75 HB2 HIS 75 15.421 -0.051 9.668 1259 HB3 HIS 75 HB1 HIS 75 14.063 -0.285 8.571 1260 HD2 HIS 75 HD2 HIS 75 11.725 0.675 9.661 1261 HE1 HIS 75 HE1 HIS 75 12.696 0.209 13.744 1262 HE2 HIS 75 HE2 HIS 75 10.910 0.980 12.116 1263 H HIS 76 HN HIS 76 13.481 -2.142 11.836 1264 HA HIS 76 HA HIS 76 10.910 -3.099 10.902 1265 HB2 HIS 76 HB2 HIS 76 11.085 -5.254 12.327 1266 HB3 HIS 76 HB1 HIS 76 11.847 -5.260 10.738 1267 HD2 HIS 76 HD2 HIS 76 14.031 -6.913 11.392 1268 HE1 HIS 76 HE1 HIS 76 15.544 -4.538 14.538 1269 HE2 HIS 76 HE2 HIS 76 15.989 -6.564 13.079 1270 H HIS 77 HN HIS 77 9.942 -1.536 12.133 1271 HA HIS 77 HA HIS 77 10.581 -0.438 14.564 1272 HB2 HIS 77 HB2 HIS 77 7.811 -1.288 13.672 1273 HB3 HIS 77 HB1 HIS 77 8.134 -0.168 14.996 1274 HD2 HIS 77 HD2 HIS 77 7.131 0.281 11.509 1275 HE1 HIS 77 HE1 HIS 77 10.024 3.314 12.027 1276 HE2 HIS 77 HE2 HIS 77 8.146 2.478 10.540 Start of MODEL 15 1 H1 MET 1 HT1 MET 1 11.869 15.422 6.222 2 H2 MET 1 HT2 MET 1 10.469 15.580 5.271 3 H3 MET 1 HT3 MET 1 11.383 14.149 5.213 4 HA MET 1 HA MET 1 10.838 14.282 7.829 5 HB2 MET 1 HB2 MET 1 8.538 15.492 6.286 6 HB3 MET 1 HB1 MET 1 8.354 14.762 7.880 7 HG2 MET 1 HG2 MET 1 10.020 16.320 8.801 8 HG3 MET 1 HG1 MET 1 10.221 17.053 7.211 9 HE1 MET 1 HE1 MET 1 7.922 17.677 5.806 10 HE2 MET 1 HE2 MET 1 8.960 18.973 6.389 11 HE3 MET 1 HE3 MET 1 7.212 19.119 6.539 12 H GLU 2 HN GLU 2 8.890 12.707 8.344 13 HA GLU 2 HA GLU 2 9.263 10.400 6.570 14 HB2 GLU 2 HB2 GLU 2 8.143 9.143 8.296 15 HB3 GLU 2 HB1 GLU 2 9.265 10.252 9.082 16 HG2 GLU 2 HG2 GLU 2 7.280 11.876 9.264 17 HG3 GLU 2 HG1 GLU 2 6.262 10.499 8.838 18 H LEU 3 HN LEU 3 7.224 9.045 6.108 19 HA LEU 3 HA LEU 3 5.486 10.511 4.385 20 HB2 LEU 3 HB2 LEU 3 5.996 8.095 4.121 21 HB3 LEU 3 HB1 LEU 3 5.096 7.754 5.596 22 HG LEU 3 HG LEU 3 3.045 8.675 4.548 23 HD11 LEU 3 HD11 LEU 3 3.674 10.249 2.946 24 HD12 LEU 3 HD12 LEU 3 3.294 8.871 1.916 25 HD13 LEU 3 HD13 LEU 3 4.974 9.242 2.306 26 HD21 LEU 3 HD21 LEU 3 3.451 6.286 4.389 27 HD22 LEU 3 HD22 LEU 3 4.498 6.517 2.990 28 HD23 LEU 3 HD23 LEU 3 2.768 6.839 2.860 29 H SER 4 HN SER 4 5.043 9.292 7.702 30 HA SER 4 HA SER 4 2.279 9.828 7.951 31 HB2 SER 4 HB2 SER 4 2.601 9.624 10.281 32 HB3 SER 4 HB1 SER 4 3.909 8.666 9.594 33 HG SER 4 HG SER 4 4.049 11.364 10.468 34 H ASN 5 HN ASN 5 5.061 12.004 8.455 35 HA ASN 5 HA ASN 5 3.538 14.223 9.433 36 HB2 ASN 5 HB2 ASN 5 6.077 13.890 9.469 37 HB3 ASN 5 HB1 ASN 5 6.062 14.418 7.787 38 HD21 ASN 5 HD21 ASN 5 4.150 16.469 7.839 39 HD22 ASN 5 HD22 ASN 5 4.675 17.712 8.867 40 H GLU 6 HN GLU 6 4.653 13.393 6.145 41 HA GLU 6 HA GLU 6 3.396 15.669 4.891 42 HB2 GLU 6 HB2 GLU 6 4.592 13.071 3.947 43 HB3 GLU 6 HB1 GLU 6 3.659 14.042 2.810 44 HG2 GLU 6 HG2 GLU 6 6.090 14.571 2.734 45 HG3 GLU 6 HG1 GLU 6 5.121 15.965 3.207 46 H LEU 7 HN LEU 7 2.388 12.340 5.545 47 HA LEU 7 HA LEU 7 -0.003 12.382 3.993 48 HB2 LEU 7 HB2 LEU 7 1.074 10.338 5.009 49 HB3 LEU 7 HB1 LEU 7 0.478 10.870 6.580 50 HG LEU 7 HG LEU 7 -1.847 10.845 5.659 51 HD11 LEU 7 HD11 LEU 7 -1.776 11.042 3.353 52 HD12 LEU 7 HD12 LEU 7 -1.923 9.293 3.475 53 HD13 LEU 7 HD13 LEU 7 -0.346 10.025 3.189 54 HD21 LEU 7 HD21 LEU 7 -1.959 8.306 5.498 55 HD22 LEU 7 HD22 LEU 7 -1.136 8.933 6.926 56 HD23 LEU 7 HD23 LEU 7 -0.196 8.306 5.573 57 H LYS 8 HN LYS 8 0.647 13.280 7.373 58 HA LYS 8 HA LYS 8 -2.050 13.833 8.122 59 HB2 LYS 8 HB2 LYS 8 -0.125 13.628 9.704 60 HB3 LYS 8 HB1 LYS 8 0.475 15.182 9.126 61 HG2 LYS 8 HG2 LYS 8 -1.583 16.283 9.861 62 HG3 LYS 8 HG1 LYS 8 -2.251 14.733 10.372 63 HD2 LYS 8 HD2 LYS 8 -0.397 14.474 11.990 64 HD3 LYS 8 HD1 LYS 8 0.240 16.043 11.496 65 HE2 LYS 8 HE2 LYS 8 -2.510 15.571 12.681 66 HE3 LYS 8 HE1 LYS 8 -1.126 16.229 13.553 67 HZ1 LYS 8 HZ1 LYS 8 -2.634 17.953 12.700 68 HZ2 LYS 8 HZ2 LYS 8 -2.312 17.435 11.114 69 HZ3 LYS 8 HZ3 LYS 8 -1.067 18.091 12.067 70 H VAL 9 HN VAL 9 0.459 15.906 6.683 71 HA VAL 9 HA VAL 9 -0.993 18.348 6.786 72 HB VAL 9 HB VAL 9 1.088 17.357 4.818 73 HG11 VAL 9 HG11 VAL 9 -0.151 20.085 5.227 74 HG12 VAL 9 HG12 VAL 9 -0.052 19.154 3.732 75 HG13 VAL 9 HG13 VAL 9 1.406 19.858 4.431 76 HG21 VAL 9 HG21 VAL 9 1.355 19.293 7.135 77 HG22 VAL 9 HG22 VAL 9 2.655 18.564 6.191 78 HG23 VAL 9 HG23 VAL 9 1.688 17.566 7.278 79 H GLU 10 HN GLU 10 -0.869 15.832 4.245 80 HA GLU 10 HA GLU 10 -2.515 17.139 2.346 81 HB2 GLU 10 HB2 GLU 10 -2.206 14.194 3.001 82 HB3 GLU 10 HB1 GLU 10 -3.008 14.811 1.556 83 HG2 GLU 10 HG2 GLU 10 -0.964 15.880 0.805 84 HG3 GLU 10 HG1 GLU 10 -0.148 15.466 2.314 85 H ARG 11 HN ARG 11 -3.377 15.044 5.105 86 HA ARG 11 HA ARG 11 -6.165 14.857 4.638 87 HB2 ARG 11 HB2 ARG 11 -4.835 13.667 6.440 88 HB3 ARG 11 HB1 ARG 11 -4.826 15.182 7.341 89 HG2 ARG 11 HG2 ARG 11 -7.357 15.168 7.196 90 HG3 ARG 11 HG1 ARG 11 -7.236 13.530 6.552 91 HD2 ARG 11 HD2 ARG 11 -6.083 14.428 9.208 92 HD3 ARG 11 HD1 ARG 11 -7.597 13.544 9.016 93 HE ARG 11 HE ARG 11 -5.806 11.918 7.723 94 HH11 ARG 11 HH21 ARG 11 -5.839 13.539 10.770 95 HH12 ARG 11 HH22 ARG 11 -4.893 12.331 11.572 96 HH21 ARG 11 HH11 ARG 11 -4.573 10.331 8.755 97 HH22 ARG 11 HH12 ARG 11 -4.174 10.516 10.428 98 H ILE 12 HN ILE 12 -4.299 17.302 6.433 99 HA ILE 12 HA ILE 12 -6.547 18.955 7.107 100 HB ILE 12 HB ILE 12 -3.591 19.586 6.819 101 HG12 ILE 12 HG12 ILE 12 -5.266 19.252 9.322 102 HG13 ILE 12 HG11 ILE 12 -4.391 17.913 8.577 103 HG21 ILE 12 HG21 ILE 12 -4.274 21.557 8.335 104 HG22 ILE 12 HG22 ILE 12 -5.924 21.239 7.799 105 HG23 ILE 12 HG23 ILE 12 -4.687 21.685 6.625 106 HD11 ILE 12 HD11 ILE 12 -2.278 19.008 8.886 107 HD12 ILE 12 HD12 ILE 12 -3.132 19.118 10.426 108 HD13 ILE 12 HD13 ILE 12 -3.061 20.517 9.354 109 H ARG 13 HN ARG 13 -4.229 19.006 4.402 110 HA ARG 13 HA ARG 13 -5.041 21.402 3.171 111 HB2 ARG 13 HB2 ARG 13 -3.087 20.015 2.478 112 HB3 ARG 13 HB1 ARG 13 -4.199 18.834 1.788 113 HG2 ARG 13 HG2 ARG 13 -5.093 20.561 0.267 114 HG3 ARG 13 HG1 ARG 13 -3.975 21.742 0.952 115 HD2 ARG 13 HD2 ARG 13 -3.138 19.157 -0.395 116 HD3 ARG 13 HD1 ARG 13 -3.132 20.736 -1.178 117 HE ARG 13 HE ARG 13 -1.216 19.802 0.846 118 HH11 ARG 13 HH21 ARG 13 -2.670 22.438 -0.841 119 HH12 ARG 13 HH22 ARG 13 -1.340 23.512 -0.572 120 HH21 ARG 13 HH11 ARG 13 0.527 21.191 1.203 121 HH22 ARG 13 HH12 ARG 13 0.470 22.808 0.585 122 H LEU 14 HN LEU 14 -6.367 18.117 2.741 123 HA LEU 14 HA LEU 14 -8.637 19.286 1.185 124 HB2 LEU 14 HB2 LEU 14 -7.780 16.402 1.578 125 HB3 LEU 14 HB1 LEU 14 -9.093 16.957 0.536 126 HG LEU 14 HG LEU 14 -6.179 17.745 0.238 127 HD11 LEU 14 HD11 LEU 14 -6.311 15.478 -0.421 128 HD12 LEU 14 HD12 LEU 14 -6.493 16.373 -1.930 129 HD13 LEU 14 HD13 LEU 14 -7.909 15.686 -1.136 130 HD21 LEU 14 HD21 LEU 14 -7.344 19.525 -0.729 131 HD22 LEU 14 HD22 LEU 14 -8.721 18.523 -1.184 132 HD23 LEU 14 HD23 LEU 14 -7.219 18.435 -2.107 133 H SER 15 HN SER 15 -7.872 18.693 4.303 134 HA SER 15 HA SER 15 -9.074 18.096 6.237 135 HB2 SER 15 HB2 SER 15 -11.282 19.497 4.712 136 HB3 SER 15 HB1 SER 15 -11.136 19.347 6.461 137 HG SER 15 HG SER 15 -8.860 20.331 5.567 138 H LEU 16 HN LEU 16 -9.069 15.790 5.798 139 HA LEU 16 HA LEU 16 -11.665 14.686 4.769 140 HB2 LEU 16 HB2 LEU 16 -8.844 13.677 4.855 141 HB3 LEU 16 HB1 LEU 16 -10.134 12.480 4.969 142 HG LEU 16 HG LEU 16 -11.098 13.245 2.883 143 HD11 LEU 16 HD11 LEU 16 -9.648 15.008 1.601 144 HD12 LEU 16 HD12 LEU 16 -9.091 15.462 3.213 145 HD13 LEU 16 HD13 LEU 16 -10.804 15.562 2.806 146 HD21 LEU 16 HD21 LEU 16 -9.264 12.653 1.357 147 HD22 LEU 16 HD22 LEU 16 -9.216 11.629 2.793 148 HD23 LEU 16 HD23 LEU 16 -8.086 12.972 2.630 149 H THR 17 HN THR 17 -12.711 13.050 5.961 150 HA THR 17 HA THR 17 -12.133 13.111 8.911 151 HB THR 17 HB THR 17 -14.549 12.555 9.159 152 HG1 THR 17 HG1 THR 17 -14.536 12.966 6.351 153 HG21 THR 17 HG21 THR 17 -13.837 14.883 9.276 154 HG22 THR 17 HG22 THR 17 -15.386 14.785 8.440 155 HG23 THR 17 HG23 THR 17 -13.901 15.017 7.517 156 H ALA 18 HN ALA 18 -12.064 11.164 10.017 157 HA ALA 18 HA ALA 18 -11.271 8.820 8.583 158 HB1 ALA 18 HB1 ALA 18 -10.545 9.212 10.873 159 HB2 ALA 18 HB2 ALA 18 -11.471 7.712 10.821 160 HB3 ALA 18 HB3 ALA 18 -12.212 9.187 11.444 161 H LYS 19 HN LYS 19 -14.374 9.835 9.990 162 HA LYS 19 HA LYS 19 -15.735 7.354 9.641 163 HB2 LYS 19 HB2 LYS 19 -16.721 10.218 9.673 164 HB3 LYS 19 HB1 LYS 19 -17.792 8.820 9.665 165 HG2 LYS 19 HG2 LYS 19 -16.655 7.999 11.739 166 HG3 LYS 19 HG1 LYS 19 -15.732 9.502 11.780 167 HD2 LYS 19 HD2 LYS 19 -18.759 9.289 11.852 168 HD3 LYS 19 HD1 LYS 19 -17.729 9.634 13.240 169 HE2 LYS 19 HE2 LYS 19 -18.348 11.377 10.866 170 HE3 LYS 19 HE1 LYS 19 -18.398 11.779 12.580 171 HZ1 LYS 19 HZ1 LYS 19 -16.493 12.804 11.642 172 HZ2 LYS 19 HZ2 LYS 19 -15.987 11.359 10.905 173 HZ3 LYS 19 HZ3 LYS 19 -15.945 11.513 12.596 174 H SER 20 HN SER 20 -15.416 10.198 7.501 175 HA SER 20 HA SER 20 -17.091 9.216 5.411 176 HB2 SER 20 HB2 SER 20 -14.690 11.067 5.309 177 HB3 SER 20 HB1 SER 20 -15.815 10.821 3.974 178 HG SER 20 HG SER 20 -16.312 12.644 5.335 179 H VAL 21 HN VAL 21 -13.560 8.983 5.865 180 HA VAL 21 HA VAL 21 -13.112 7.421 3.487 181 HB VAL 21 HB VAL 21 -11.472 7.760 6.016 182 HG11 VAL 21 HG11 VAL 21 -10.872 6.392 3.389 183 HG12 VAL 21 HG12 VAL 21 -10.720 5.733 5.018 184 HG13 VAL 21 HG13 VAL 21 -9.598 6.976 4.460 185 HG21 VAL 21 HG21 VAL 21 -11.356 9.038 3.264 186 HG22 VAL 21 HG22 VAL 21 -10.125 9.250 4.510 187 HG23 VAL 21 HG23 VAL 21 -11.765 9.839 4.781 188 H ALA 22 HN ALA 22 -13.519 6.566 6.917 189 HA ALA 22 HA ALA 22 -13.082 3.767 6.620 190 HB1 ALA 22 HB1 ALA 22 -13.101 4.936 8.798 191 HB2 ALA 22 HB2 ALA 22 -14.215 3.570 8.792 192 HB3 ALA 22 HB3 ALA 22 -14.834 5.215 8.626 193 H GLU 23 HN GLU 23 -16.062 5.705 6.358 194 HA GLU 23 HA GLU 23 -17.794 3.422 6.094 195 HB2 GLU 23 HB2 GLU 23 -18.526 5.760 6.685 196 HB3 GLU 23 HB1 GLU 23 -18.244 6.216 5.006 197 HG2 GLU 23 HG2 GLU 23 -19.938 4.729 4.215 198 HG3 GLU 23 HG1 GLU 23 -20.062 3.924 5.782 199 H GLU 24 HN GLU 24 -16.080 5.462 3.740 200 HA GLU 24 HA GLU 24 -17.216 4.130 1.432 201 HB2 GLU 24 HB2 GLU 24 -16.049 6.474 1.635 202 HB3 GLU 24 HB1 GLU 24 -14.559 5.565 1.400 203 HG2 GLU 24 HG2 GLU 24 -15.224 6.205 -0.790 204 HG3 GLU 24 HG1 GLU 24 -15.720 4.519 -0.648 205 H MET 25 HN MET 25 -14.144 3.833 3.203 206 HA MET 25 HA MET 25 -12.973 1.858 1.496 207 HB2 MET 25 HB2 MET 25 -12.545 2.652 4.373 208 HB3 MET 25 HB1 MET 25 -11.621 1.343 3.637 209 HG2 MET 25 HG2 MET 25 -11.805 4.129 2.459 210 HG3 MET 25 HG1 MET 25 -10.501 3.614 3.527 211 HE1 MET 25 HE1 MET 25 -8.965 0.660 1.903 212 HE2 MET 25 HE2 MET 25 -9.332 1.600 3.346 213 HE3 MET 25 HE3 MET 25 -8.138 2.195 2.200 214 H GLY 26 HN GLY 26 -15.051 1.590 4.371 215 HA2 GLY 26 HA2 GLY 26 -16.600 -0.250 4.675 216 HA3 GLY 26 HA1 GLY 26 -15.596 -1.245 3.616 217 H ILE 27 HN ILE 27 -14.041 0.703 6.055 218 HA ILE 27 HA ILE 27 -13.605 -1.749 7.743 219 HB ILE 27 HB ILE 27 -11.318 -0.919 8.176 220 HG12 ILE 27 HG12 ILE 27 -11.933 1.118 6.013 221 HG13 ILE 27 HG11 ILE 27 -11.815 1.498 7.730 222 HG21 ILE 27 HG21 ILE 27 -11.920 -2.486 6.250 223 HG22 ILE 27 HG22 ILE 27 -10.378 -1.642 6.111 224 HG23 ILE 27 HG23 ILE 27 -11.777 -1.081 5.192 225 HD11 ILE 27 HD11 ILE 27 -9.488 0.475 7.674 226 HD12 ILE 27 HD12 ILE 27 -9.672 1.993 6.794 227 HD13 ILE 27 HD13 ILE 27 -9.629 0.464 5.917 228 H SER 28 HN SER 28 -13.005 -1.225 9.996 229 HA SER 28 HA SER 28 -14.765 0.846 11.050 230 HB2 SER 28 HB2 SER 28 -14.110 -0.032 13.226 231 HB3 SER 28 HB1 SER 28 -14.438 -1.380 12.140 232 HG SER 28 HG SER 28 -12.117 -1.339 11.706 233 H ARG 29 HN ARG 29 -13.914 2.394 12.730 234 HA ARG 29 HA ARG 29 -11.853 4.061 11.648 235 HB2 ARG 29 HB2 ARG 29 -13.198 3.956 14.361 236 HB3 ARG 29 HB1 ARG 29 -11.981 5.164 13.956 237 HG2 ARG 29 HG2 ARG 29 -14.130 6.157 13.519 238 HG3 ARG 29 HG1 ARG 29 -13.392 5.805 11.959 239 HD2 ARG 29 HD2 ARG 29 -15.855 5.177 12.211 240 HD3 ARG 29 HD1 ARG 29 -14.796 3.908 11.609 241 HE ARG 29 HE ARG 29 -14.749 3.063 14.031 242 HH11 ARG 29 HH21 ARG 29 -17.425 4.938 12.793 243 HH12 ARG 29 HH22 ARG 29 -18.538 4.304 13.957 244 HH21 ARG 29 HH11 ARG 29 -16.225 2.261 15.513 245 HH22 ARG 29 HH12 ARG 29 -17.869 2.807 15.475 246 H GLN 30 HN GLN 30 -11.865 1.549 14.137 247 HA GLN 30 HA GLN 30 -9.321 1.995 15.276 248 HB2 GLN 30 HB2 GLN 30 -10.692 -0.645 14.665 249 HB3 GLN 30 HB1 GLN 30 -9.338 -0.440 15.777 250 HG2 GLN 30 HG2 GLN 30 -12.017 0.956 16.053 251 HG3 GLN 30 HG1 GLN 30 -11.540 -0.486 16.949 252 HE21 GLN 30 HE21 GLN 30 -11.827 2.729 17.430 253 HE22 GLN 30 HE22 GLN 30 -10.537 3.001 18.498 254 H GLN 31 HN GLN 31 -10.199 0.100 12.382 255 HA GLN 31 HA GLN 31 -7.535 -0.747 11.757 256 HB2 GLN 31 HB2 GLN 31 -9.611 -1.730 10.777 257 HB3 GLN 31 HB1 GLN 31 -9.869 -0.234 9.882 258 HG2 GLN 31 HG2 GLN 31 -8.795 -1.867 8.428 259 HG3 GLN 31 HG1 GLN 31 -7.659 -0.562 8.767 260 HE21 GLN 31 HE21 GLN 31 -5.884 -2.147 8.317 261 HE22 GLN 31 HE22 GLN 31 -5.446 -3.273 9.508 262 H LEU 32 HN LEU 32 -9.452 2.066 10.739 263 HA LEU 32 HA LEU 32 -7.487 3.142 8.970 264 HB2 LEU 32 HB2 LEU 32 -9.995 3.801 9.316 265 HB3 LEU 32 HB1 LEU 32 -9.376 4.859 10.583 266 HG LEU 32 HG LEU 32 -7.692 5.668 8.728 267 HD11 LEU 32 HD11 LEU 32 -8.833 5.621 6.458 268 HD12 LEU 32 HD12 LEU 32 -9.908 4.385 7.101 269 HD13 LEU 32 HD13 LEU 32 -8.177 4.075 6.987 270 HD21 LEU 32 HD21 LEU 32 -9.483 7.282 7.882 271 HD22 LEU 32 HD22 LEU 32 -9.296 7.191 9.634 272 HD23 LEU 32 HD23 LEU 32 -10.636 6.357 8.846 273 H CYS 33 HN CYS 33 -8.068 3.551 12.432 274 HA CYS 33 HA CYS 33 -6.173 5.603 12.929 275 HB2 CYS 33 HB2 CYS 33 -7.972 4.298 14.457 276 HB3 CYS 33 HB1 CYS 33 -6.520 3.454 14.990 277 HG CYS 33 HG CYS 33 -5.944 5.458 16.315 278 H ASN 34 HN ASN 34 -5.785 2.106 12.630 279 HA ASN 34 HA ASN 34 -3.114 1.930 13.604 280 HB2 ASN 34 HB2 ASN 34 -4.856 0.075 12.933 281 HB3 ASN 34 HB1 ASN 34 -4.124 0.209 11.338 282 HD21 ASN 34 HD21 ASN 34 -3.140 -1.926 11.494 283 HD22 ASN 34 HD22 ASN 34 -1.832 -2.229 12.533 284 H ILE 35 HN ILE 35 -4.409 2.610 10.354 285 HA ILE 35 HA ILE 35 -1.882 2.661 9.005 286 HB ILE 35 HB ILE 35 -4.487 4.104 8.433 287 HG12 ILE 35 HG12 ILE 35 -3.242 1.703 7.067 288 HG13 ILE 35 HG11 ILE 35 -4.393 1.559 8.396 289 HG21 ILE 35 HG21 ILE 35 -1.913 3.907 6.861 290 HG22 ILE 35 HG22 ILE 35 -2.828 5.356 7.276 291 HG23 ILE 35 HG23 ILE 35 -3.460 4.226 6.077 292 HD11 ILE 35 HD11 ILE 35 -4.877 2.893 5.719 293 HD12 ILE 35 HD12 ILE 35 -6.008 2.947 7.072 294 HD13 ILE 35 HD13 ILE 35 -5.621 1.404 6.306 295 H GLU 36 HN GLU 36 -3.768 5.241 10.597 296 HA GLU 36 HA GLU 36 -1.850 7.327 10.013 297 HB2 GLU 36 HB2 GLU 36 -4.254 7.723 10.654 298 HB3 GLU 36 HB1 GLU 36 -3.864 7.187 12.287 299 HG2 GLU 36 HG2 GLU 36 -2.165 9.016 12.442 300 HG3 GLU 36 HG1 GLU 36 -2.657 9.568 10.843 301 H GLN 37 HN GLN 37 -1.841 4.680 12.151 302 HA GLN 37 HA GLN 37 -0.325 5.869 14.298 303 HB2 GLN 37 HB2 GLN 37 -1.698 3.657 14.278 304 HB3 GLN 37 HB1 GLN 37 -0.250 2.934 13.581 305 HG2 GLN 37 HG2 GLN 37 1.072 3.706 15.508 306 HG3 GLN 37 HG1 GLN 37 -0.363 4.466 16.195 307 HE21 GLN 37 HE21 GLN 37 0.560 2.725 17.941 308 HE22 GLN 37 HE22 GLN 37 -0.233 1.226 17.893 309 H SER 38 HN SER 38 0.752 6.548 11.748 310 HA SER 38 HA SER 38 2.778 6.586 10.557 311 HB2 SER 38 HB2 SER 38 3.487 7.518 12.718 312 HB3 SER 38 HB1 SER 38 3.796 5.893 13.325 313 HG SER 38 HG SER 38 5.075 5.992 11.088 314 H GLU 39 HN GLU 39 4.512 4.426 12.538 315 HA GLU 39 HA GLU 39 5.443 2.346 12.134 316 HB2 GLU 39 HB2 GLU 39 2.655 1.951 11.047 317 HB3 GLU 39 HB1 GLU 39 3.850 0.659 10.990 318 HG2 GLU 39 HG2 GLU 39 3.095 2.142 13.525 319 HG3 GLU 39 HG1 GLU 39 2.384 0.599 13.041 320 H THR 40 HN THR 40 6.723 1.365 10.635 321 HA THR 40 HA THR 40 7.387 2.834 8.291 322 HB THR 40 HB THR 40 8.756 0.761 7.745 323 HG1 THR 40 HG1 THR 40 7.818 -0.920 8.651 324 HG21 THR 40 HG21 THR 40 10.139 1.006 9.868 325 HG22 THR 40 HG22 THR 40 8.870 2.078 10.463 326 HG23 THR 40 HG23 THR 40 9.781 2.507 9.015 327 H ALA 41 HN ALA 41 6.812 2.584 6.165 328 HA ALA 41 HA ALA 41 4.325 1.257 5.586 329 HB1 ALA 41 HB1 ALA 41 5.073 1.899 3.151 330 HB2 ALA 41 HB2 ALA 41 6.388 2.739 3.974 331 HB3 ALA 41 HB3 ALA 41 4.716 3.185 4.304 332 HA PRO 42 HA PRO 42 5.756 -2.787 4.414 333 HB2 PRO 42 HB2 PRO 42 3.984 -3.381 2.361 334 HB3 PRO 42 HB1 PRO 42 3.581 -3.460 4.087 335 HG2 PRO 42 HG2 PRO 42 2.984 -1.310 2.106 336 HG3 PRO 42 HG1 PRO 42 1.985 -1.938 3.425 337 HD2 PRO 42 HD2 PRO 42 3.335 0.417 3.612 338 HD3 PRO 42 HD1 PRO 42 3.022 -0.619 5.020 339 H VAL 43 HN VAL 43 6.909 -3.963 2.785 340 HA VAL 43 HA VAL 43 8.554 -2.390 1.045 341 HB VAL 43 HB VAL 43 9.301 -4.628 0.172 342 HG11 VAL 43 HG11 VAL 43 10.176 -5.440 2.336 343 HG12 VAL 43 HG12 VAL 43 9.004 -4.437 3.188 344 HG13 VAL 43 HG13 VAL 43 10.284 -3.684 2.237 345 HG21 VAL 43 HG21 VAL 43 8.313 -6.645 1.158 346 HG22 VAL 43 HG22 VAL 43 7.066 -5.718 0.325 347 HG23 VAL 43 HG23 VAL 43 7.183 -5.660 2.084 348 H VAL 44 HN VAL 44 5.440 -3.908 0.566 349 HA VAL 44 HA VAL 44 5.493 -4.232 -2.256 350 HB VAL 44 HB VAL 44 3.110 -4.319 -2.150 351 HG11 VAL 44 HG11 VAL 44 3.978 -5.020 0.665 352 HG12 VAL 44 HG12 VAL 44 4.401 -6.001 -0.736 353 HG13 VAL 44 HG13 VAL 44 2.710 -5.785 -0.294 354 HG21 VAL 44 HG21 VAL 44 3.459 -2.510 0.237 355 HG22 VAL 44 HG22 VAL 44 1.963 -3.407 -0.005 356 HG23 VAL 44 HG23 VAL 44 2.494 -2.234 -1.209 357 H VAL 45 HN VAL 45 4.784 -1.377 -0.256 358 HA VAL 45 HA VAL 45 4.025 0.360 -2.395 359 HB VAL 45 HB VAL 45 5.242 0.888 0.329 360 HG11 VAL 45 HG11 VAL 45 5.859 2.791 -0.951 361 HG12 VAL 45 HG12 VAL 45 4.378 3.263 -0.117 362 HG13 VAL 45 HG13 VAL 45 4.324 2.803 -1.821 363 HG21 VAL 45 HG21 VAL 45 2.452 1.450 -0.707 364 HG22 VAL 45 HG22 VAL 45 3.000 1.446 0.970 365 HG23 VAL 45 HG23 VAL 45 2.886 -0.070 0.074 366 H LYS 46 HN LYS 46 7.173 -0.298 -0.877 367 HA LYS 46 HA LYS 46 8.697 1.564 -2.412 368 HB2 LYS 46 HB2 LYS 46 9.584 -1.133 -1.339 369 HB3 LYS 46 HB1 LYS 46 10.628 0.235 -1.720 370 HG2 LYS 46 HG2 LYS 46 8.434 0.348 0.373 371 HG3 LYS 46 HG1 LYS 46 10.106 -0.060 0.750 372 HD2 LYS 46 HD2 LYS 46 10.813 2.131 -0.222 373 HD3 LYS 46 HD1 LYS 46 9.117 2.540 -0.455 374 HE2 LYS 46 HE2 LYS 46 8.702 2.336 1.947 375 HE3 LYS 46 HE1 LYS 46 10.385 1.876 2.210 376 HZ1 LYS 46 HZ1 LYS 46 9.246 4.474 1.780 377 HZ2 LYS 46 HZ2 LYS 46 10.575 4.160 0.769 378 HZ3 LYS 46 HZ3 LYS 46 10.742 4.046 2.456 379 H TYR 47 HN TYR 47 7.804 -1.817 -2.993 380 HA TYR 47 HA TYR 47 9.305 -2.201 -5.380 381 HB2 TYR 47 HB2 TYR 47 8.285 -4.077 -4.245 382 HB3 TYR 47 HB1 TYR 47 6.677 -3.377 -4.426 383 HD1 TYR 47 HD2 TYR 47 9.627 -4.168 -6.616 384 HD2 TYR 47 HD1 TYR 47 5.364 -4.310 -6.111 385 HE1 TYR 47 HE2 TYR 47 9.401 -5.287 -8.820 386 HE2 TYR 47 HE1 TYR 47 5.139 -5.424 -8.311 387 HH TYR 47 HH TYR 47 7.566 -5.505 -10.590 388 H ILE 48 HN ILE 48 6.012 -0.974 -4.838 389 HA ILE 48 HA ILE 48 5.344 -0.571 -7.588 390 HB ILE 48 HB ILE 48 4.396 0.816 -5.062 391 HG12 ILE 48 HG12 ILE 48 3.024 -1.249 -6.812 392 HG13 ILE 48 HG11 ILE 48 3.953 -1.661 -5.370 393 HG21 ILE 48 HG21 ILE 48 3.909 2.345 -6.812 394 HG22 ILE 48 HG22 ILE 48 2.420 1.426 -6.593 395 HG23 ILE 48 HG23 ILE 48 3.500 1.050 -7.935 396 HD11 ILE 48 HD11 ILE 48 2.474 -0.266 -3.993 397 HD12 ILE 48 HD12 ILE 48 1.530 -1.466 -4.871 398 HD13 ILE 48 HD13 ILE 48 1.565 0.207 -5.425 399 H ALA 49 HN ALA 49 6.867 1.549 -5.165 400 HA ALA 49 HA ALA 49 7.007 3.914 -6.697 401 HB1 ALA 49 HB1 ALA 49 7.655 3.800 -4.321 402 HB2 ALA 49 HB2 ALA 49 8.962 4.487 -5.287 403 HB3 ALA 49 HB3 ALA 49 9.052 2.811 -4.743 404 H PHE 50 HN PHE 50 9.101 1.048 -6.723 405 HA PHE 50 HA PHE 50 11.130 2.132 -8.410 406 HB2 PHE 50 HB2 PHE 50 10.977 -0.151 -7.061 407 HB3 PHE 50 HB1 PHE 50 10.350 -0.779 -8.585 408 HD1 PHE 50 HD1 PHE 50 13.154 1.225 -7.157 409 HD2 PHE 50 HD2 PHE 50 11.874 -1.409 -10.300 410 HE1 PHE 50 HE1 PHE 50 15.477 1.123 -8.012 411 HE2 PHE 50 HE2 PHE 50 14.202 -1.510 -11.157 412 HZ PHE 50 HZ PHE 50 16.001 -0.244 -10.013 413 H LEU 51 HN LEU 51 8.146 0.319 -9.168 414 HA LEU 51 HA LEU 51 8.500 0.296 -12.008 415 HB2 LEU 51 HB2 LEU 51 5.871 0.429 -10.503 416 HB3 LEU 51 HB1 LEU 51 6.125 -0.195 -12.130 417 HG LEU 51 HG LEU 51 7.310 -1.354 -9.591 418 HD11 LEU 51 HD11 LEU 51 4.897 -1.761 -9.801 419 HD12 LEU 51 HD12 LEU 51 5.792 -3.254 -10.083 420 HD13 LEU 51 HD13 LEU 51 5.125 -2.356 -11.446 421 HD21 LEU 51 HD21 LEU 51 7.638 -1.998 -12.525 422 HD22 LEU 51 HD22 LEU 51 7.801 -3.271 -11.316 423 HD23 LEU 51 HD23 LEU 51 8.874 -1.876 -11.272 424 H ARG 52 HN ARG 52 7.116 2.702 -9.813 425 HA ARG 52 HA ARG 52 5.993 4.427 -11.778 426 HB2 ARG 52 HB2 ARG 52 5.681 4.623 -9.279 427 HB3 ARG 52 HB1 ARG 52 7.330 5.235 -9.175 428 HG2 ARG 52 HG2 ARG 52 6.142 7.236 -9.297 429 HG3 ARG 52 HG1 ARG 52 6.485 6.966 -11.004 430 HD2 ARG 52 HD2 ARG 52 4.224 5.761 -11.122 431 HD3 ARG 52 HD1 ARG 52 3.904 6.418 -9.517 432 HE ARG 52 HE ARG 52 4.019 7.955 -12.026 433 HH11 ARG 52 HH21 ARG 52 4.085 7.920 -8.575 434 HH12 ARG 52 HH22 ARG 52 3.569 9.564 -8.422 435 HH21 ARG 52 HH11 ARG 52 3.352 10.098 -11.843 436 HH22 ARG 52 HH12 ARG 52 3.150 10.798 -10.272 437 H SER 53 HN SER 53 9.269 4.164 -10.450 438 HA SER 53 HA SER 53 10.435 6.423 -11.668 439 HB2 SER 53 HB2 SER 53 11.738 3.709 -11.323 440 HB3 SER 53 HB1 SER 53 12.555 5.267 -11.431 441 HG SER 53 HG SER 53 10.965 4.201 -9.365 442 H LYS 54 HN LYS 54 9.535 3.311 -13.038 443 HA LYS 54 HA LYS 54 10.953 3.823 -15.557 444 HB2 LYS 54 HB2 LYS 54 9.182 1.647 -14.467 445 HB3 LYS 54 HB1 LYS 54 9.452 1.736 -16.206 446 HG2 LYS 54 HG2 LYS 54 11.103 0.240 -15.198 447 HG3 LYS 54 HG1 LYS 54 11.912 1.689 -15.793 448 HD2 LYS 54 HD2 LYS 54 11.974 2.632 -13.551 449 HD3 LYS 54 HD1 LYS 54 11.034 1.279 -12.921 450 HE2 LYS 54 HE2 LYS 54 12.847 -0.273 -13.529 451 HE3 LYS 54 HE1 LYS 54 13.783 1.072 -14.183 452 HZ1 LYS 54 HZ1 LYS 54 14.565 0.721 -12.009 453 HZ2 LYS 54 HZ2 LYS 54 12.996 0.601 -11.367 454 HZ3 LYS 54 HZ3 LYS 54 13.581 2.100 -11.915 455 H GLY 55 HN GLY 55 8.290 5.182 -14.220 456 HA2 GLY 55 HA2 GLY 55 6.719 6.627 -15.232 457 HA3 GLY 55 HA1 GLY 55 7.317 6.112 -16.807 458 H VAL 56 HN VAL 56 6.306 3.675 -14.495 459 HA VAL 56 HA VAL 56 4.413 2.600 -16.378 460 HB VAL 56 HB VAL 56 4.852 2.060 -13.430 461 HG11 VAL 56 HG11 VAL 56 3.548 -0.091 -14.027 462 HG12 VAL 56 HG12 VAL 56 2.961 0.805 -15.428 463 HG13 VAL 56 HG13 VAL 56 2.605 1.382 -13.801 464 HG21 VAL 56 HG21 VAL 56 5.656 0.681 -16.008 465 HG22 VAL 56 HG22 VAL 56 5.799 -0.078 -14.425 466 HG23 VAL 56 HG23 VAL 56 6.720 1.380 -14.788 467 H ASP 57 HN ASP 57 2.240 2.948 -16.604 468 HA ASP 57 HA ASP 57 1.092 5.272 -15.277 469 HB2 ASP 57 HB2 ASP 57 -1.002 4.480 -16.586 470 HB3 ASP 57 HB1 ASP 57 0.404 4.993 -17.520 471 H LEU 58 HN LEU 58 0.901 4.780 -13.079 472 HA LEU 58 HA LEU 58 -0.538 2.362 -12.210 473 HB2 LEU 58 HB2 LEU 58 1.439 3.587 -10.999 474 HB3 LEU 58 HB1 LEU 58 0.197 4.711 -10.451 475 HG LEU 58 HG LEU 58 -1.071 2.476 -9.755 476 HD11 LEU 58 HD11 LEU 58 1.791 1.580 -9.416 477 HD12 LEU 58 HD12 LEU 58 0.850 1.127 -10.834 478 HD13 LEU 58 HD13 LEU 58 0.319 0.631 -9.228 479 HD21 LEU 58 HD21 LEU 58 1.256 3.719 -8.259 480 HD22 LEU 58 HD22 LEU 58 0.118 2.591 -7.521 481 HD23 LEU 58 HD23 LEU 58 -0.450 4.148 -8.125 482 H ASN 59 HN ASN 59 -1.292 5.513 -13.214 483 HA ASN 59 HA ASN 59 -3.530 6.124 -11.548 484 HB2 ASN 59 HB2 ASN 59 -4.211 7.624 -13.423 485 HB3 ASN 59 HB1 ASN 59 -2.506 7.805 -13.002 486 HD21 ASN 59 HD21 ASN 59 -3.375 8.527 -15.610 487 HD22 ASN 59 HD22 ASN 59 -2.753 7.409 -16.725 488 H ALA 60 HN ALA 60 -3.349 4.429 -14.682 489 HA ALA 60 HA ALA 60 -6.187 3.954 -14.832 490 HB1 ALA 60 HB1 ALA 60 -5.670 2.605 -16.727 491 HB2 ALA 60 HB2 ALA 60 -4.029 2.300 -16.153 492 HB3 ALA 60 HB3 ALA 60 -4.477 3.902 -16.735 493 H LEU 61 HN LEU 61 -3.431 2.021 -13.669 494 HA LEU 61 HA LEU 61 -4.878 -0.388 -13.210 495 HB2 LEU 61 HB2 LEU 61 -2.315 0.128 -13.147 496 HB3 LEU 61 HB1 LEU 61 -2.594 0.514 -11.450 497 HG LEU 61 HG LEU 61 -3.352 -2.103 -12.770 498 HD11 LEU 61 HD11 LEU 61 -1.424 -2.958 -11.312 499 HD12 LEU 61 HD12 LEU 61 -0.945 -1.269 -11.149 500 HD13 LEU 61 HD13 LEU 61 -0.975 -2.027 -12.741 501 HD21 LEU 61 HD21 LEU 61 -4.752 -1.989 -10.917 502 HD22 LEU 61 HD22 LEU 61 -3.636 -0.986 -9.992 503 HD23 LEU 61 HD23 LEU 61 -3.327 -2.714 -10.179 504 H PHE 62 HN PHE 62 -4.121 2.301 -10.991 505 HA PHE 62 HA PHE 62 -5.615 1.192 -8.784 506 HB2 PHE 62 HB2 PHE 62 -4.287 3.801 -9.425 507 HB3 PHE 62 HB1 PHE 62 -5.480 3.809 -8.128 508 HD1 PHE 62 HD1 PHE 62 -3.004 1.184 -9.190 509 HD2 PHE 62 HD2 PHE 62 -4.300 3.873 -6.101 510 HE1 PHE 62 HE1 PHE 62 -1.331 0.213 -7.636 511 HE2 PHE 62 HE2 PHE 62 -2.629 2.904 -4.553 512 HZ PHE 62 HZ PHE 62 -1.141 1.074 -5.320 513 H ASP 63 HN ASP 63 -6.458 3.434 -11.406 514 HA ASP 63 HA ASP 63 -8.898 4.395 -10.346 515 HB2 ASP 63 HB2 ASP 63 -7.768 4.044 -13.096 516 HB3 ASP 63 HB1 ASP 63 -9.476 4.460 -12.964 517 H ARG 64 HN ARG 64 -8.431 1.493 -12.433 518 HA ARG 64 HA ARG 64 -11.207 0.808 -12.467 519 HB2 ARG 64 HB2 ARG 64 -9.693 -0.206 -14.056 520 HB3 ARG 64 HB1 ARG 64 -8.737 -0.923 -12.763 521 HG2 ARG 64 HG2 ARG 64 -10.590 -2.368 -12.119 522 HG3 ARG 64 HG1 ARG 64 -11.660 -1.566 -13.268 523 HD2 ARG 64 HD2 ARG 64 -10.672 -2.590 -15.111 524 HD3 ARG 64 HD1 ARG 64 -9.117 -2.787 -14.301 525 HE ARG 64 HE ARG 64 -9.941 -4.768 -13.244 526 HH11 ARG 64 HH21 ARG 64 -12.359 -3.160 -15.141 527 HH12 ARG 64 HH22 ARG 64 -13.423 -4.527 -15.142 528 HH21 ARG 64 HH11 ARG 64 -11.319 -6.516 -13.237 529 HH22 ARG 64 HH12 ARG 64 -12.838 -6.422 -14.064 530 H ILE 65 HN ILE 65 -8.598 -0.141 -10.241 531 HA ILE 65 HA ILE 65 -10.129 -2.000 -8.723 532 HB ILE 65 HB ILE 65 -7.788 -0.235 -7.951 533 HG12 ILE 65 HG12 ILE 65 -7.890 -3.200 -8.581 534 HG13 ILE 65 HG11 ILE 65 -7.516 -1.969 -9.789 535 HG21 ILE 65 HG21 ILE 65 -8.799 -0.846 -5.888 536 HG22 ILE 65 HG22 ILE 65 -7.527 -2.043 -6.134 537 HG23 ILE 65 HG23 ILE 65 -9.207 -2.458 -6.474 538 HD11 ILE 65 HD11 ILE 65 -6.001 -2.298 -7.186 539 HD12 ILE 65 HD12 ILE 65 -5.585 -1.231 -8.526 540 HD13 ILE 65 HD13 ILE 65 -5.474 -2.980 -8.725 541 H ILE 66 HN ILE 66 -9.645 1.518 -8.287 542 HA ILE 66 HA ILE 66 -11.093 1.745 -5.846 543 HB ILE 66 HB ILE 66 -10.692 3.728 -8.100 544 HG12 ILE 66 HG12 ILE 66 -9.366 3.610 -5.383 545 HG13 ILE 66 HG11 ILE 66 -8.682 2.823 -6.809 546 HG21 ILE 66 HG21 ILE 66 -12.583 4.530 -6.892 547 HG22 ILE 66 HG22 ILE 66 -11.203 5.408 -6.232 548 HG23 ILE 66 HG23 ILE 66 -11.890 4.048 -5.343 549 HD11 ILE 66 HD11 ILE 66 -8.458 4.902 -7.966 550 HD12 ILE 66 HD12 ILE 66 -7.838 5.189 -6.339 551 HD13 ILE 66 HD13 ILE 66 -9.453 5.747 -6.779 552 H VAL 67 HN VAL 67 -12.333 2.976 -8.961 553 HA VAL 67 HA VAL 67 -15.057 2.751 -7.991 554 HB VAL 67 HB VAL 67 -15.568 3.393 -10.447 555 HG11 VAL 67 HG11 VAL 67 -13.747 5.200 -8.825 556 HG12 VAL 67 HG12 VAL 67 -15.471 4.989 -8.525 557 HG13 VAL 67 HG13 VAL 67 -14.921 5.710 -10.037 558 HG21 VAL 67 HG21 VAL 67 -13.242 2.508 -11.155 559 HG22 VAL 67 HG22 VAL 67 -12.605 4.003 -10.477 560 HG23 VAL 67 HG23 VAL 67 -13.748 4.060 -11.817 561 H ASN 68 HN ASN 68 -16.437 1.120 -8.212 562 HA ASN 68 HA ASN 68 -15.656 -1.255 -9.842 563 HB2 ASN 68 HB2 ASN 68 -16.223 -1.543 -7.411 564 HB3 ASN 68 HB1 ASN 68 -17.841 -0.939 -7.759 565 HD21 ASN 68 HD21 ASN 68 -18.742 -3.046 -7.134 566 HD22 ASN 68 HD22 ASN 68 -18.629 -4.379 -8.178 567 H LYS 69 HN LYS 69 -17.795 1.426 -9.708 568 HA LYS 69 HA LYS 69 -20.001 0.330 -11.191 569 HB2 LYS 69 HB2 LYS 69 -19.836 2.548 -9.796 570 HB3 LYS 69 HB1 LYS 69 -19.243 3.251 -11.300 571 HG2 LYS 69 HG2 LYS 69 -21.269 2.560 -12.470 572 HG3 LYS 69 HG1 LYS 69 -21.854 1.726 -11.031 573 HD2 LYS 69 HD2 LYS 69 -21.953 3.851 -9.814 574 HD3 LYS 69 HD1 LYS 69 -21.309 4.702 -11.218 575 HE2 LYS 69 HE2 LYS 69 -23.737 4.945 -11.181 576 HE3 LYS 69 HE1 LYS 69 -23.276 3.924 -12.543 577 HZ1 LYS 69 HZ1 LYS 69 -25.145 3.014 -11.266 578 HZ2 LYS 69 HZ2 LYS 69 -24.152 2.915 -9.890 579 HZ3 LYS 69 HZ3 LYS 69 -23.802 1.977 -11.263 580 H LEU 70 HN LEU 70 -20.586 1.188 -13.404 581 HA LEU 70 HA LEU 70 -20.121 1.627 -15.650 582 HB2 LEU 70 HB2 LEU 70 -18.119 3.011 -14.534 583 HB3 LEU 70 HB1 LEU 70 -17.150 1.691 -15.186 584 HG LEU 70 HG LEU 70 -18.558 2.162 -17.389 585 HD11 LEU 70 HD11 LEU 70 -20.038 3.847 -16.363 586 HD12 LEU 70 HD12 LEU 70 -19.074 4.561 -17.655 587 HD13 LEU 70 HD13 LEU 70 -18.636 4.842 -15.969 588 HD21 LEU 70 HD21 LEU 70 -16.803 3.817 -18.087 589 HD22 LEU 70 HD22 LEU 70 -16.135 2.395 -17.287 590 HD23 LEU 70 HD23 LEU 70 -16.281 3.913 -16.405 591 H GLU 71 HN GLU 71 -20.343 -0.975 -14.514 592 HA GLU 71 HA GLU 71 -18.605 -2.530 -16.402 593 HB2 GLU 71 HB2 GLU 71 -18.695 -4.360 -14.626 594 HB3 GLU 71 HB1 GLU 71 -17.677 -2.966 -14.256 595 HG2 GLU 71 HG2 GLU 71 -19.434 -1.994 -12.871 596 HG3 GLU 71 HG1 GLU 71 -20.536 -3.303 -13.302 597 H HIS 72 HN HIS 72 -19.752 -5.020 -15.923 598 HA HIS 72 HA HIS 72 -21.843 -5.256 -17.672 599 HB2 HIS 72 HB2 HIS 72 -21.588 -6.779 -15.067 600 HB3 HIS 72 HB1 HIS 72 -22.509 -7.307 -16.474 601 HD2 HIS 72 HD2 HIS 72 -19.326 -8.339 -15.096 602 HE1 HIS 72 HE1 HIS 72 -18.452 -8.069 -19.219 603 HE2 HIS 72 HE2 HIS 72 -17.664 -8.999 -16.993 604 H HIS 73 HN HIS 73 -22.724 -5.657 -14.270 605 HA HIS 73 HA HIS 73 -24.598 -3.474 -14.166 606 HB2 HIS 73 HB2 HIS 73 -25.811 -4.851 -15.807 607 HB3 HIS 73 HB1 HIS 73 -25.712 -6.243 -14.731 608 HD2 HIS 73 HD2 HIS 73 -27.317 -2.596 -14.502 609 HE1 HIS 73 HE1 HIS 73 -29.613 -5.293 -12.200 610 HE2 HIS 73 HE2 HIS 73 -29.434 -2.895 -13.007 611 H HIS 74 HN HIS 74 -22.730 -4.158 -12.360 612 HA HIS 74 HA HIS 74 -22.330 -4.886 -10.160 613 HB2 HIS 74 HB2 HIS 74 -25.301 -4.358 -9.889 614 HB3 HIS 74 HB1 HIS 74 -24.091 -4.316 -8.604 615 HD2 HIS 74 HD2 HIS 74 -21.833 -2.463 -10.228 616 HE1 HIS 74 HE1 HIS 74 -24.964 0.364 -10.457 617 HE2 HIS 74 HE2 HIS 74 -22.456 0.034 -10.652 618 H HIS 75 HN HIS 75 -24.018 -6.224 -8.345 619 HA HIS 75 HA HIS 75 -24.701 -8.792 -9.731 620 HB2 HIS 75 HB2 HIS 75 -22.821 -8.334 -7.415 621 HB3 HIS 75 HB1 HIS 75 -23.689 -9.864 -7.550 622 HD2 HIS 75 HD2 HIS 75 -22.751 -11.578 -9.566 623 HE1 HIS 75 HE1 HIS 75 -19.831 -8.972 -11.155 624 HE2 HIS 75 HE2 HIS 75 -20.771 -11.326 -11.245 625 H HIS 76 HN HIS 76 -26.566 -9.678 -9.040 626 HA HIS 76 HA HIS 76 -28.167 -8.193 -7.072 627 HB2 HIS 76 HB2 HIS 76 -28.641 -10.304 -9.135 628 HB3 HIS 76 HB1 HIS 76 -29.755 -10.289 -7.768 629 HD2 HIS 76 HD2 HIS 76 -31.761 -9.229 -9.614 630 HE1 HIS 76 HE1 HIS 76 -29.993 -5.396 -9.783 631 HE2 HIS 76 HE2 HIS 76 -32.076 -6.738 -10.325 632 H HIS 77 HN HIS 77 -29.243 -9.313 -5.283 633 HA HIS 77 HA HIS 77 -27.542 -10.549 -3.478 634 HB2 HIS 77 HB2 HIS 77 -29.432 -10.898 -2.142 635 HB3 HIS 77 HB1 HIS 77 -30.010 -9.659 -3.250 636 HD2 HIS 77 HD2 HIS 77 -31.194 -11.181 -5.732 637 HE1 HIS 77 HE1 HIS 77 -32.863 -14.032 -3.101 638 HE2 HIS 77 HE2 HIS 77 -32.916 -13.122 -5.468 639 H1 MET 1 HT1 MET 1 -8.706 -6.801 -13.719 640 H2 MET 1 HT2 MET 1 -9.561 -8.018 -12.899 641 H3 MET 1 HT3 MET 1 -9.406 -8.079 -14.589 642 HA MET 1 HA MET 1 -7.869 -9.635 -13.818 643 HB2 MET 1 HB2 MET 1 -6.547 -6.972 -14.377 644 HB3 MET 1 HB1 MET 1 -5.648 -8.485 -14.257 645 HG2 MET 1 HG2 MET 1 -7.052 -9.452 -16.051 646 HG3 MET 1 HG1 MET 1 -7.911 -7.917 -16.192 647 HE1 MET 1 HE1 MET 1 -5.878 -7.847 -19.431 648 HE2 MET 1 HE2 MET 1 -7.427 -7.507 -18.663 649 HE3 MET 1 HE3 MET 1 -6.787 -9.149 -18.650 650 H GLU 2 HN GLU 2 -6.272 -10.300 -12.270 651 HA GLU 2 HA GLU 2 -6.723 -9.180 -9.615 652 HB2 GLU 2 HB2 GLU 2 -6.475 -11.610 -9.973 653 HB3 GLU 2 HB1 GLU 2 -4.819 -11.351 -10.526 654 HG2 GLU 2 HG2 GLU 2 -4.076 -10.666 -8.396 655 HG3 GLU 2 HG1 GLU 2 -5.715 -10.351 -7.822 656 H LEU 3 HN LEU 3 -4.833 -8.640 -8.179 657 HA LEU 3 HA LEU 3 -3.309 -6.495 -9.236 658 HB2 LEU 3 HB2 LEU 3 -3.803 -6.711 -6.850 659 HB3 LEU 3 HB1 LEU 3 -2.842 -8.184 -6.764 660 HG LEU 3 HG LEU 3 -0.808 -6.936 -7.312 661 HD11 LEU 3 HD11 LEU 3 -2.771 -4.683 -7.730 662 HD12 LEU 3 HD12 LEU 3 -1.432 -5.198 -8.758 663 HD13 LEU 3 HD13 LEU 3 -1.107 -4.327 -7.260 664 HD21 LEU 3 HD21 LEU 3 -0.758 -5.447 -5.287 665 HD22 LEU 3 HD22 LEU 3 -1.392 -7.060 -4.964 666 HD23 LEU 3 HD23 LEU 3 -2.496 -5.694 -5.120 667 H SER 4 HN SER 4 -2.359 -9.857 -8.546 668 HA SER 4 HA SER 4 0.381 -9.581 -9.253 669 HB2 SER 4 HB2 SER 4 -0.228 -11.554 -8.107 670 HB3 SER 4 HB1 SER 4 -1.531 -11.914 -9.235 671 HG SER 4 HG SER 4 1.266 -12.091 -9.609 672 H ASN 5 HN ASN 5 -2.484 -10.162 -11.237 673 HA ASN 5 HA ASN 5 -1.176 -10.948 -13.629 674 HB2 ASN 5 HB2 ASN 5 -3.583 -11.162 -13.329 675 HB3 ASN 5 HB1 ASN 5 -3.753 -9.410 -13.232 676 HD21 ASN 5 HD21 ASN 5 -3.671 -8.195 -15.208 677 HD22 ASN 5 HD22 ASN 5 -3.623 -8.935 -16.734 678 H GLU 6 HN GLU 6 -2.051 -7.644 -12.506 679 HA GLU 6 HA GLU 6 -1.074 -6.401 -14.919 680 HB2 GLU 6 HB2 GLU 6 -1.504 -5.237 -12.152 681 HB3 GLU 6 HB1 GLU 6 -1.100 -4.289 -13.577 682 HG2 GLU 6 HG2 GLU 6 -3.366 -4.114 -13.886 683 HG3 GLU 6 HG1 GLU 6 -3.270 -5.755 -14.502 684 H LEU 7 HN LEU 7 0.415 -6.948 -11.720 685 HA LEU 7 HA LEU 7 2.850 -5.566 -12.298 686 HB2 LEU 7 HB2 LEU 7 2.011 -7.709 -10.363 687 HB3 LEU 7 HB1 LEU 7 3.731 -7.366 -10.535 688 HG LEU 7 HG LEU 7 3.401 -5.051 -9.921 689 HD11 LEU 7 HD11 LEU 7 1.376 -4.383 -10.912 690 HD12 LEU 7 HD12 LEU 7 0.973 -4.401 -9.194 691 HD13 LEU 7 HD13 LEU 7 0.479 -5.742 -10.232 692 HD21 LEU 7 HD21 LEU 7 3.363 -6.946 -8.146 693 HD22 LEU 7 HD22 LEU 7 1.640 -6.593 -8.011 694 HD23 LEU 7 HD23 LEU 7 2.827 -5.343 -7.642 695 H LYS 8 HN LYS 8 1.837 -8.921 -12.882 696 HA LYS 8 HA LYS 8 4.357 -9.893 -13.794 697 HB2 LYS 8 HB2 LYS 8 2.370 -11.310 -13.251 698 HB3 LYS 8 HB1 LYS 8 1.594 -10.730 -14.727 699 HG2 LYS 8 HG2 LYS 8 3.426 -11.646 -16.074 700 HG3 LYS 8 HG1 LYS 8 4.252 -12.183 -14.611 701 HD2 LYS 8 HD2 LYS 8 2.333 -13.635 -14.061 702 HD3 LYS 8 HD1 LYS 8 1.520 -13.114 -15.539 703 HE2 LYS 8 HE2 LYS 8 3.372 -14.011 -16.887 704 HE3 LYS 8 HE1 LYS 8 4.203 -14.521 -15.418 705 HZ1 LYS 8 HZ1 LYS 8 1.879 -15.680 -15.018 706 HZ2 LYS 8 HZ2 LYS 8 3.122 -16.432 -15.901 707 HZ3 LYS 8 HZ3 LYS 8 1.848 -15.654 -16.713 708 H VAL 9 HN VAL 9 1.639 -8.412 -15.591 709 HA VAL 9 HA VAL 9 2.837 -8.638 -18.178 710 HB VAL 9 HB VAL 9 0.829 -6.639 -17.099 711 HG11 VAL 9 HG11 VAL 9 1.818 -7.221 -19.896 712 HG12 VAL 9 HG12 VAL 9 1.749 -5.665 -19.069 713 HG13 VAL 9 HG13 VAL 9 0.259 -6.453 -19.591 714 HG21 VAL 9 HG21 VAL 9 0.272 -9.136 -17.094 715 HG22 VAL 9 HG22 VAL 9 0.368 -9.065 -18.853 716 HG23 VAL 9 HG23 VAL 9 -0.839 -8.106 -17.996 717 H GLU 10 HN GLU 10 2.865 -5.945 -15.812 718 HA GLU 10 HA GLU 10 4.384 -4.143 -17.422 719 HB2 GLU 10 HB2 GLU 10 4.302 -4.429 -14.399 720 HB3 GLU 10 HB1 GLU 10 4.901 -3.023 -15.276 721 HG2 GLU 10 HG2 GLU 10 2.094 -4.086 -15.643 722 HG3 GLU 10 HG1 GLU 10 2.491 -2.864 -14.438 723 H ARG 11 HN ARG 11 5.339 -6.712 -15.180 724 HA ARG 11 HA ARG 11 8.121 -6.142 -15.086 725 HB2 ARG 11 HB2 ARG 11 6.632 -7.891 -13.774 726 HB3 ARG 11 HB1 ARG 11 7.114 -8.986 -15.069 727 HG2 ARG 11 HG2 ARG 11 9.541 -8.095 -14.528 728 HG3 ARG 11 HG1 ARG 11 8.821 -7.629 -12.990 729 HD2 ARG 11 HD2 ARG 11 7.900 -10.103 -12.994 730 HD3 ARG 11 HD1 ARG 11 9.223 -10.374 -14.133 731 HE ARG 11 HE ARG 11 9.850 -9.051 -11.545 732 HH11 ARG 11 HH21 ARG 11 10.056 -11.805 -13.652 733 HH12 ARG 11 HH22 ARG 11 11.305 -12.561 -12.724 734 HH21 ARG 11 HH11 ARG 11 11.448 -10.059 -10.337 735 HH22 ARG 11 HH12 ARG 11 12.085 -11.584 -10.857 736 H ILE 12 HN ILE 12 6.227 -8.148 -17.349 737 HA ILE 12 HA ILE 12 8.456 -9.125 -18.853 738 HB ILE 12 HB ILE 12 5.571 -8.632 -19.660 739 HG12 ILE 12 HG12 ILE 12 6.987 -11.234 -19.025 740 HG13 ILE 12 HG11 ILE 12 6.105 -10.305 -17.811 741 HG21 ILE 12 HG21 ILE 12 6.179 -10.355 -21.465 742 HG22 ILE 12 HG22 ILE 12 7.863 -9.984 -21.095 743 HG23 ILE 12 HG23 ILE 12 6.794 -8.720 -21.702 744 HD11 ILE 12 HD11 ILE 12 4.841 -11.140 -20.426 745 HD12 ILE 12 HD12 ILE 12 4.038 -10.561 -18.967 746 HD13 ILE 12 HD13 ILE 12 4.784 -12.159 -18.989 747 H ARG 13 HN ARG 13 6.367 -6.258 -19.308 748 HA ARG 13 HA ARG 13 7.652 -5.373 -21.709 749 HB2 ARG 13 HB2 ARG 13 6.102 -3.866 -19.586 750 HB3 ARG 13 HB1 ARG 13 6.682 -3.114 -21.071 751 HG2 ARG 13 HG2 ARG 13 5.440 -4.999 -22.315 752 HG3 ARG 13 HG1 ARG 13 4.648 -5.335 -20.774 753 HD2 ARG 13 HD2 ARG 13 4.629 -2.687 -22.247 754 HD3 ARG 13 HD1 ARG 13 3.272 -3.804 -22.108 755 HE ARG 13 HE ARG 13 3.846 -3.316 -19.485 756 HH11 ARG 13 HH21 ARG 13 3.504 -1.296 -22.266 757 HH12 ARG 13 HH22 ARG 13 2.922 0.065 -21.368 758 HH21 ARG 13 HH11 ARG 13 3.085 -1.541 -18.311 759 HH22 ARG 13 HH12 ARG 13 2.682 -0.075 -19.132 760 H LEU 14 HN LEU 14 8.243 -4.686 -18.277 761 HA LEU 14 HA LEU 14 10.534 -2.944 -18.968 762 HB2 LEU 14 HB2 LEU 14 9.496 -3.867 -16.266 763 HB3 LEU 14 HB1 LEU 14 10.697 -2.606 -16.540 764 HG LEU 14 HG LEU 14 7.831 -2.538 -17.532 765 HD11 LEU 14 HD11 LEU 14 7.761 -2.213 -15.182 766 HD12 LEU 14 HD12 LEU 14 7.750 -0.586 -15.862 767 HD13 LEU 14 HD13 LEU 14 9.238 -1.250 -15.189 768 HD21 LEU 14 HD21 LEU 14 8.590 -0.023 -17.833 769 HD22 LEU 14 HD22 LEU 14 9.000 -1.210 -19.067 770 HD23 LEU 14 HD23 LEU 14 10.212 -0.718 -17.883 771 H SER 15 HN SER 15 9.945 -6.218 -18.658 772 HA SER 15 HA SER 15 11.281 -8.083 -18.090 773 HB2 SER 15 HB2 SER 15 13.253 -8.197 -19.450 774 HB3 SER 15 HB1 SER 15 12.075 -7.248 -20.350 775 HG SER 15 HG SER 15 13.280 -5.488 -18.942 776 H LEU 16 HN LEU 16 11.136 -6.956 -15.772 777 HA LEU 16 HA LEU 16 13.892 -6.257 -14.814 778 HB2 LEU 16 HB2 LEU 16 11.178 -5.929 -13.497 779 HB3 LEU 16 HB1 LEU 16 12.714 -5.406 -12.804 780 HG LEU 16 HG LEU 16 11.622 -4.457 -15.468 781 HD11 LEU 16 HD11 LEU 16 11.573 -3.190 -12.717 782 HD12 LEU 16 HD12 LEU 16 10.188 -3.609 -13.725 783 HD13 LEU 16 HD13 LEU 16 11.264 -2.296 -14.204 784 HD21 LEU 16 HD21 LEU 16 13.404 -2.593 -14.881 785 HD22 LEU 16 HD22 LEU 16 13.935 -4.110 -15.599 786 HD23 LEU 16 HD23 LEU 16 14.102 -3.853 -13.861 787 H THR 17 HN THR 17 15.008 -7.772 -13.748 788 HA THR 17 HA THR 17 13.690 -10.303 -13.002 789 HB THR 17 HB THR 17 16.109 -10.907 -12.383 790 HG1 THR 17 HG1 THR 17 16.365 -8.314 -13.455 791 HG21 THR 17 HG21 THR 17 15.250 -10.096 -15.165 792 HG22 THR 17 HG22 THR 17 15.243 -11.710 -14.451 793 HG23 THR 17 HG23 THR 17 16.773 -10.931 -14.855 794 H ALA 18 HN ALA 18 14.130 -11.275 -10.877 795 HA ALA 18 HA ALA 18 13.408 -9.510 -8.728 796 HB1 ALA 18 HB1 ALA 18 13.529 -11.485 -7.338 797 HB2 ALA 18 HB2 ALA 18 14.547 -12.311 -8.520 798 HB3 ALA 18 HB3 ALA 18 12.858 -11.970 -8.895 799 H LYS 19 HN LYS 19 16.453 -10.965 -9.789 800 HA LYS 19 HA LYS 19 18.030 -10.270 -7.516 801 HB2 LYS 19 HB2 LYS 19 18.738 -11.824 -9.342 802 HB3 LYS 19 HB1 LYS 19 18.923 -10.434 -10.411 803 HG2 LYS 19 HG2 LYS 19 20.609 -9.474 -8.914 804 HG3 LYS 19 HG1 LYS 19 20.393 -10.814 -7.787 805 HD2 LYS 19 HD2 LYS 19 21.113 -12.401 -9.543 806 HD3 LYS 19 HD1 LYS 19 21.362 -11.051 -10.650 807 HE2 LYS 19 HE2 LYS 19 22.787 -11.436 -8.001 808 HE3 LYS 19 HE1 LYS 19 23.487 -11.730 -9.593 809 HZ1 LYS 19 HZ1 LYS 19 22.847 -9.335 -10.078 810 HZ2 LYS 19 HZ2 LYS 19 24.164 -9.586 -9.035 811 HZ3 LYS 19 HZ3 LYS 19 22.646 -9.159 -8.403 812 H SER 20 HN SER 20 17.399 -8.469 -10.541 813 HA SER 20 HA SER 20 19.084 -6.247 -9.956 814 HB2 SER 20 HB2 SER 20 18.105 -6.664 -12.175 815 HB3 SER 20 HB1 SER 20 16.495 -6.356 -11.533 816 HG SER 20 HG SER 20 18.454 -4.424 -11.101 817 H VAL 21 HN VAL 21 15.595 -6.719 -9.349 818 HA VAL 21 HA VAL 21 15.191 -4.190 -8.071 819 HB VAL 21 HB VAL 21 13.720 -6.821 -7.732 820 HG11 VAL 21 HG11 VAL 21 13.186 -5.421 -5.863 821 HG12 VAL 21 HG12 VAL 21 11.851 -5.268 -7.005 822 HG13 VAL 21 HG13 VAL 21 13.062 -3.992 -6.888 823 HG21 VAL 21 HG21 VAL 21 13.020 -4.389 -9.405 824 HG22 VAL 21 HG22 VAL 21 12.182 -5.942 -9.381 825 HG23 VAL 21 HG23 VAL 21 13.809 -5.828 -10.051 826 H ALA 22 HN ALA 22 15.968 -7.413 -6.784 827 HA ALA 22 HA ALA 22 15.923 -6.705 -4.026 828 HB1 ALA 22 HB1 ALA 22 17.388 -8.835 -5.585 829 HB2 ALA 22 HB2 ALA 22 15.968 -9.017 -4.555 830 HB3 ALA 22 HB3 ALA 22 17.545 -8.689 -3.833 831 H GLU 23 HN GLU 23 18.373 -6.265 -6.518 832 HA GLU 23 HA GLU 23 20.586 -5.738 -4.780 833 HB2 GLU 23 HB2 GLU 23 20.408 -6.043 -7.422 834 HB3 GLU 23 HB1 GLU 23 20.280 -4.288 -7.406 835 HG2 GLU 23 HG2 GLU 23 22.595 -4.604 -7.587 836 HG3 GLU 23 HG1 GLU 23 22.394 -4.409 -5.846 837 H GLU 24 HN GLU 24 18.152 -3.599 -6.268 838 HA GLU 24 HA GLU 24 19.227 -1.233 -4.920 839 HB2 GLU 24 HB2 GLU 24 16.462 -1.392 -6.121 840 HB3 GLU 24 HB1 GLU 24 17.569 -0.021 -6.063 841 HG2 GLU 24 HG2 GLU 24 17.990 -2.536 -7.713 842 HG3 GLU 24 HG1 GLU 24 17.442 -0.986 -8.338 843 H MET 25 HN MET 25 16.338 -3.270 -4.562 844 HA MET 25 HA MET 25 15.247 -1.879 -2.312 845 HB2 MET 25 HB2 MET 25 14.941 -4.681 -3.388 846 HB3 MET 25 HB1 MET 25 14.076 -4.140 -1.950 847 HG2 MET 25 HG2 MET 25 13.976 -2.661 -4.590 848 HG3 MET 25 HG1 MET 25 12.802 -3.893 -4.139 849 HE1 MET 25 HE1 MET 25 11.231 -2.759 -0.990 850 HE2 MET 25 HE2 MET 25 11.755 -4.060 -2.057 851 HE3 MET 25 HE3 MET 25 10.438 -3.002 -2.553 852 H GLY 26 HN GLY 26 17.502 -4.627 -2.577 853 HA2 GLY 26 HA2 GLY 26 19.143 -5.251 -0.970 854 HA3 GLY 26 HA1 GLY 26 18.472 -4.053 0.141 855 H ILE 27 HN ILE 27 16.500 -6.478 -1.495 856 HA ILE 27 HA ILE 27 16.055 -7.839 1.152 857 HB ILE 27 HB ILE 27 13.732 -8.224 0.427 858 HG12 ILE 27 HG12 ILE 27 14.435 -6.439 -1.928 859 HG13 ILE 27 HG11 ILE 27 14.189 -8.179 -2.037 860 HG21 ILE 27 HG21 ILE 27 12.945 -5.950 0.733 861 HG22 ILE 27 HG22 ILE 27 14.498 -5.300 0.205 862 HG23 ILE 27 HG23 ILE 27 14.383 -6.184 1.727 863 HD11 ILE 27 HD11 ILE 27 11.894 -7.923 -1.191 864 HD12 ILE 27 HD12 ILE 27 12.136 -6.964 -2.651 865 HD13 ILE 27 HD13 ILE 27 12.126 -6.179 -1.072 866 H SER 28 HN SER 28 15.159 -10.091 0.844 867 HA SER 28 HA SER 28 16.954 -11.604 -0.812 868 HB2 SER 28 HB2 SER 28 14.538 -12.289 0.849 869 HB3 SER 28 HB1 SER 28 15.360 -13.518 -0.107 870 HG SER 28 HG SER 28 17.218 -12.154 1.158 871 H ARG 29 HN ARG 29 16.419 -12.934 -2.616 872 HA ARG 29 HA ARG 29 14.710 -11.756 -4.592 873 HB2 ARG 29 HB2 ARG 29 15.900 -14.550 -4.403 874 HB3 ARG 29 HB1 ARG 29 15.207 -13.846 -5.866 875 HG2 ARG 29 HG2 ARG 29 16.879 -12.098 -5.900 876 HG3 ARG 29 HG1 ARG 29 17.494 -12.590 -4.324 877 HD2 ARG 29 HD2 ARG 29 19.033 -13.547 -5.817 878 HD3 ARG 29 HD1 ARG 29 17.945 -14.887 -5.461 879 HE ARG 29 HE ARG 29 17.807 -13.234 -7.957 880 HH11 ARG 29 HH21 ARG 29 17.288 -16.238 -6.250 881 HH12 ARG 29 HH22 ARG 29 16.814 -17.082 -7.684 882 HH21 ARG 29 HH11 ARG 29 17.204 -14.359 -9.776 883 HH22 ARG 29 HH12 ARG 29 16.764 -16.030 -9.660 884 H GLN 30 HN GLN 30 14.321 -14.487 -2.363 885 HA GLN 30 HA GLN 30 11.792 -15.400 -3.363 886 HB2 GLN 30 HB2 GLN 30 13.034 -15.609 -0.602 887 HB3 GLN 30 HB1 GLN 30 11.594 -16.488 -1.116 888 HG2 GLN 30 HG2 GLN 30 14.272 -16.670 -2.524 889 HG3 GLN 30 HG1 GLN 30 13.718 -17.822 -1.312 890 HE21 GLN 30 HE21 GLN 30 12.089 -19.351 -1.922 891 HE22 GLN 30 HE22 GLN 30 11.512 -19.491 -3.512 892 H GLN 31 HN GLN 31 12.680 -13.051 -0.846 893 HA GLN 31 HA GLN 31 10.086 -12.563 0.186 894 HB2 GLN 31 HB2 GLN 31 12.546 -10.828 -0.092 895 HB3 GLN 31 HB1 GLN 31 11.076 -10.230 0.677 896 HG2 GLN 31 HG2 GLN 31 12.367 -12.830 1.524 897 HG3 GLN 31 HG1 GLN 31 12.849 -11.282 2.219 898 HE21 GLN 31 HE21 GLN 31 10.659 -9.892 2.770 899 HE22 GLN 31 HE22 GLN 31 9.522 -10.764 3.680 900 H LEU 32 HN LEU 32 11.778 -11.113 -2.593 901 HA LEU 32 HA LEU 32 9.744 -9.209 -3.218 902 HB2 LEU 32 HB2 LEU 32 12.093 -9.269 -4.174 903 HB3 LEU 32 HB1 LEU 32 11.575 -10.622 -5.178 904 HG LEU 32 HG LEU 32 9.630 -8.992 -5.904 905 HD11 LEU 32 HD11 LEU 32 11.766 -7.044 -4.980 906 HD12 LEU 32 HD12 LEU 32 10.173 -7.221 -4.251 907 HD13 LEU 32 HD13 LEU 32 10.323 -6.627 -5.901 908 HD21 LEU 32 HD21 LEU 32 11.397 -9.818 -7.403 909 HD22 LEU 32 HD22 LEU 32 12.501 -8.586 -6.789 910 HD23 LEU 32 HD23 LEU 32 11.075 -8.111 -7.713 911 H CYS 33 HN CYS 33 10.263 -12.568 -4.229 912 HA CYS 33 HA CYS 33 8.109 -12.723 -6.088 913 HB2 CYS 33 HB2 CYS 33 9.337 -14.858 -4.313 914 HB3 CYS 33 HB1 CYS 33 8.227 -15.186 -5.645 915 HG CYS 33 HG CYS 33 10.891 -13.665 -6.233 916 H ASN 34 HN ASN 34 8.241 -13.006 -2.582 917 HA ASN 34 HA ASN 34 5.628 -14.075 -2.165 918 HB2 ASN 34 HB2 ASN 34 7.525 -13.802 -0.463 919 HB3 ASN 34 HB1 ASN 34 7.022 -12.118 -0.326 920 HD21 ASN 34 HD21 ASN 34 6.721 -13.385 2.010 921 HD22 ASN 34 HD22 ASN 34 5.118 -13.864 2.297 922 H ILE 35 HN ILE 35 6.803 -10.743 -2.570 923 HA ILE 35 HA ILE 35 4.345 -9.428 -1.935 924 HB ILE 35 HB ILE 35 6.593 -8.640 -3.818 925 HG12 ILE 35 HG12 ILE 35 5.953 -7.699 -1.003 926 HG13 ILE 35 HG11 ILE 35 7.136 -8.951 -1.372 927 HG21 ILE 35 HG21 ILE 35 5.632 -6.305 -3.430 928 HG22 ILE 35 HG22 ILE 35 4.195 -7.105 -2.792 929 HG23 ILE 35 HG23 ILE 35 4.677 -7.361 -4.469 930 HD11 ILE 35 HD11 ILE 35 8.397 -6.936 -1.208 931 HD12 ILE 35 HD12 ILE 35 7.215 -6.033 -2.157 932 HD13 ILE 35 HD13 ILE 35 8.234 -7.240 -2.938 933 H GLU 36 HN GLU 36 5.661 -10.642 -5.019 934 HA GLU 36 HA GLU 36 3.362 -9.812 -6.571 935 HB2 GLU 36 HB2 GLU 36 5.510 -11.870 -7.167 936 HB3 GLU 36 HB1 GLU 36 4.357 -11.231 -8.341 937 HG2 GLU 36 HG2 GLU 36 5.219 -8.931 -7.874 938 HG3 GLU 36 HG1 GLU 36 6.439 -9.641 -6.814 939 H GLN 37 HN GLN 37 4.216 -12.708 -4.772 940 HA GLN 37 HA GLN 37 1.868 -14.175 -5.848 941 HB2 GLN 37 HB2 GLN 37 4.040 -14.969 -3.877 942 HB3 GLN 37 HB1 GLN 37 2.756 -16.039 -4.439 943 HG2 GLN 37 HG2 GLN 37 4.760 -14.664 -6.255 944 HG3 GLN 37 HG1 GLN 37 4.886 -16.337 -5.712 945 HE21 GLN 37 HE21 GLN 37 3.944 -14.612 -8.354 946 HE22 GLN 37 HE22 GLN 37 2.724 -15.628 -8.954 947 H SER 38 HN SER 38 2.047 -11.774 -3.773 948 HA SER 38 HA SER 38 0.952 -12.819 -1.330 949 HB2 SER 38 HB2 SER 38 0.690 -10.582 -0.685 950 HB3 SER 38 HB1 SER 38 2.027 -10.501 -1.828 951 HG SER 38 HG SER 38 0.337 -8.940 -2.202 952 H GLU 39 HN GLU 39 -1.238 -12.612 -0.567 953 HA GLU 39 HA GLU 39 -3.222 -13.408 -2.502 954 HB2 GLU 39 HB2 GLU 39 -4.800 -13.052 -0.495 955 HB3 GLU 39 HB1 GLU 39 -3.521 -14.252 -0.304 956 HG2 GLU 39 HG2 GLU 39 -2.213 -12.830 1.050 957 HG3 GLU 39 HG1 GLU 39 -3.083 -11.387 0.541 958 H THR 40 HN THR 40 -2.497 -10.337 -0.860 959 HA THR 40 HA THR 40 -3.847 -8.846 -2.955 960 HB THR 40 HB THR 40 -5.097 -8.851 -0.189 961 HG1 THR 40 HG1 THR 40 -5.631 -10.672 -1.463 962 HG21 THR 40 HG21 THR 40 -6.841 -7.469 -1.529 963 HG22 THR 40 HG22 THR 40 -5.534 -7.217 -2.684 964 HG23 THR 40 HG23 THR 40 -5.357 -6.667 -1.018 965 H ALA 41 HN ALA 41 -3.778 -6.449 -2.423 966 HA ALA 41 HA ALA 41 -1.210 -5.853 -1.140 967 HB1 ALA 41 HB1 ALA 41 -1.986 -3.440 -1.883 968 HB2 ALA 41 HB2 ALA 41 -3.212 -4.330 -2.786 969 HB3 ALA 41 HB3 ALA 41 -1.504 -4.615 -3.108 970 HA PRO 42 HA PRO 42 -2.846 -4.594 2.794 971 HB2 PRO 42 HB2 PRO 42 -1.208 -2.418 3.369 972 HB3 PRO 42 HB1 PRO 42 -0.738 -4.116 3.573 973 HG2 PRO 42 HG2 PRO 42 -0.086 -2.230 1.356 974 HG3 PRO 42 HG1 PRO 42 0.912 -3.493 2.095 975 HD2 PRO 42 HD2 PRO 42 -0.311 -3.818 -0.319 976 HD3 PRO 42 HD1 PRO 42 -0.006 -5.171 0.793 977 H VAL 43 HN VAL 43 -4.130 -2.966 3.854 978 HA VAL 43 HA VAL 43 -5.802 -1.418 2.135 979 HB VAL 43 HB VAL 43 -6.673 -0.441 4.277 980 HG11 VAL 43 HG11 VAL 43 -7.305 -2.678 5.289 981 HG12 VAL 43 HG12 VAL 43 -6.208 -3.432 4.134 982 HG13 VAL 43 HG13 VAL 43 -7.617 -2.541 3.559 983 HG21 VAL 43 HG21 VAL 43 -4.428 -0.422 5.423 984 HG22 VAL 43 HG22 VAL 43 -4.539 -2.177 5.553 985 HG23 VAL 43 HG23 VAL 43 -5.709 -1.155 6.388 986 H VAL 44 HN VAL 44 -2.824 -0.636 3.810 987 HA VAL 44 HA VAL 44 -2.993 2.171 3.936 988 HB VAL 44 HB VAL 44 -1.108 0.667 4.761 989 HG11 VAL 44 HG11 VAL 44 -0.918 -0.341 2.351 990 HG12 VAL 44 HG12 VAL 44 0.546 -0.109 3.301 991 HG13 VAL 44 HG13 VAL 44 0.123 1.047 2.040 992 HG21 VAL 44 HG21 VAL 44 -0.380 3.129 3.144 993 HG22 VAL 44 HG22 VAL 44 0.635 2.399 4.388 994 HG23 VAL 44 HG23 VAL 44 -0.918 3.111 4.823 995 H VAL 45 HN VAL 45 -2.256 0.067 1.179 996 HA VAL 45 HA VAL 45 -1.508 2.139 -0.651 997 HB VAL 45 HB VAL 45 -2.752 -0.590 -1.116 998 HG11 VAL 45 HG11 VAL 45 -3.194 0.690 -3.083 999 HG12 VAL 45 HG12 VAL 45 -1.745 -0.253 -3.438 1000 HG13 VAL 45 HG13 VAL 45 -1.606 1.456 -3.023 1001 HG21 VAL 45 HG21 VAL 45 -0.438 -0.352 -0.012 1002 HG22 VAL 45 HG22 VAL 45 0.108 0.291 -1.560 1003 HG23 VAL 45 HG23 VAL 45 -0.522 -1.352 -1.462 1004 H LYS 46 HN LYS 46 -4.629 0.593 0.078 1005 HA LYS 46 HA LYS 46 -6.169 2.041 -1.840 1006 HB2 LYS 46 HB2 LYS 46 -6.904 0.786 0.815 1007 HB3 LYS 46 HB1 LYS 46 -8.096 1.485 -0.283 1008 HG2 LYS 46 HG2 LYS 46 -7.376 -0.059 -2.061 1009 HG3 LYS 46 HG1 LYS 46 -6.161 -0.746 -0.982 1010 HD2 LYS 46 HD2 LYS 46 -7.972 -1.414 0.588 1011 HD3 LYS 46 HD1 LYS 46 -9.163 -0.801 -0.560 1012 HE2 LYS 46 HE2 LYS 46 -7.121 -2.940 -1.214 1013 HE3 LYS 46 HE1 LYS 46 -8.788 -3.275 -0.744 1014 HZ1 LYS 46 HZ1 LYS 46 -9.173 -1.496 -2.673 1015 HZ2 LYS 46 HZ2 LYS 46 -9.109 -3.170 -2.953 1016 HZ3 LYS 46 HZ3 LYS 46 -7.738 -2.206 -3.233 1017 H TYR 47 HN TYR 47 -5.211 2.782 1.497 1018 HA TYR 47 HA TYR 47 -6.832 5.086 1.886 1019 HB2 TYR 47 HB2 TYR 47 -5.436 3.934 3.635 1020 HB3 TYR 47 HB1 TYR 47 -4.002 4.643 2.891 1021 HD1 TYR 47 HD2 TYR 47 -3.782 7.152 2.770 1022 HD2 TYR 47 HD1 TYR 47 -6.852 5.210 5.060 1023 HE1 TYR 47 HE2 TYR 47 -4.175 9.250 4.031 1024 HE2 TYR 47 HE1 TYR 47 -7.240 7.311 6.320 1025 HH TYR 47 HH TYR 47 -6.052 10.293 5.315 1026 H ILE 48 HN ILE 48 -3.518 4.783 0.593 1027 HA ILE 48 HA ILE 48 -3.200 7.564 -0.035 1028 HB ILE 48 HB ILE 48 -1.915 5.180 -1.409 1029 HG12 ILE 48 HG12 ILE 48 -0.851 6.783 0.934 1030 HG13 ILE 48 HG11 ILE 48 -1.705 5.253 1.133 1031 HG21 ILE 48 HG21 ILE 48 -0.099 6.816 -1.847 1032 HG22 ILE 48 HG22 ILE 48 -1.082 8.076 -1.101 1033 HG23 ILE 48 HG23 ILE 48 -1.619 7.308 -2.595 1034 HD11 ILE 48 HD11 ILE 48 0.831 5.678 -0.473 1035 HD12 ILE 48 HD12 ILE 48 -0.044 4.151 -0.344 1036 HD13 ILE 48 HD13 ILE 48 0.714 4.858 1.085 1037 H ALA 49 HN ALA 49 -4.382 4.773 -1.880 1038 HA ALA 49 HA ALA 49 -4.729 6.015 -4.388 1039 HB1 ALA 49 HB1 ALA 49 -5.083 3.558 -3.770 1040 HB2 ALA 49 HB2 ALA 49 -6.261 4.248 -4.888 1041 HB3 ALA 49 HB3 ALA 49 -6.677 4.037 -3.187 1042 H PHE 50 HN PHE 50 -6.778 6.080 -1.490 1043 HA PHE 50 HA PHE 50 -9.027 7.389 -2.662 1044 HB2 PHE 50 HB2 PHE 50 -8.854 6.376 -0.318 1045 HB3 PHE 50 HB1 PHE 50 -7.996 7.844 0.152 1046 HD1 PHE 50 HD1 PHE 50 -11.205 6.486 -1.095 1047 HD2 PHE 50 HD2 PHE 50 -9.157 9.948 0.412 1048 HE1 PHE 50 HE1 PHE 50 -13.377 7.644 -0.805 1049 HE2 PHE 50 HE2 PHE 50 -11.332 11.106 0.703 1050 HZ PHE 50 HZ PHE 50 -13.441 9.953 0.095 1051 H LEU 51 HN LEU 51 -6.068 8.634 -1.125 1052 HA LEU 51 HA LEU 51 -6.680 11.415 -1.458 1053 HB2 LEU 51 HB2 LEU 51 -4.042 9.935 -1.268 1054 HB3 LEU 51 HB1 LEU 51 -4.171 11.692 -1.253 1055 HG LEU 51 HG LEU 51 -5.599 9.872 0.706 1056 HD11 LEU 51 HD11 LEU 51 -3.838 10.822 2.302 1057 HD12 LEU 51 HD12 LEU 51 -2.948 11.311 0.862 1058 HD13 LEU 51 HD13 LEU 51 -3.283 9.604 1.155 1059 HD21 LEU 51 HD21 LEU 51 -5.528 12.208 1.979 1060 HD22 LEU 51 HD22 LEU 51 -6.784 11.883 0.790 1061 HD23 LEU 51 HD23 LEU 51 -5.383 12.858 0.345 1062 H ARG 52 HN ARG 52 -4.986 9.079 -3.548 1063 HA ARG 52 HA ARG 52 -4.279 11.002 -5.563 1064 HB2 ARG 52 HB2 ARG 52 -3.134 8.870 -5.489 1065 HB3 ARG 52 HB1 ARG 52 -4.649 7.993 -5.648 1066 HG2 ARG 52 HG2 ARG 52 -3.446 7.994 -7.780 1067 HG3 ARG 52 HG1 ARG 52 -4.939 8.909 -7.938 1068 HD2 ARG 52 HD2 ARG 52 -2.655 10.600 -7.129 1069 HD3 ARG 52 HD1 ARG 52 -2.414 9.816 -8.686 1070 HE ARG 52 HE ARG 52 -4.587 11.745 -8.047 1071 HH11 ARG 52 HH21 ARG 52 -3.059 9.564 -10.265 1072 HH12 ARG 52 HH22 ARG 52 -3.779 10.285 -11.662 1073 HH21 ARG 52 HH11 ARG 52 -5.558 12.657 -9.888 1074 HH22 ARG 52 HH12 ARG 52 -5.182 12.018 -11.453 1075 H SER 53 HN SER 53 -7.212 9.268 -4.816 1076 HA SER 53 HA SER 53 -8.475 9.494 -7.372 1077 HB2 SER 53 HB2 SER 53 -10.470 8.907 -6.257 1078 HB3 SER 53 HB1 SER 53 -9.211 8.158 -5.280 1079 HG SER 53 HG SER 53 -10.779 10.428 -4.781 1080 H LYS 54 HN LYS 54 -7.812 11.792 -4.856 1081 HA LYS 54 HA LYS 54 -9.713 13.774 -5.986 1082 HB2 LYS 54 HB2 LYS 54 -7.868 13.805 -3.582 1083 HB3 LYS 54 HB1 LYS 54 -8.835 15.193 -4.084 1084 HG2 LYS 54 HG2 LYS 54 -10.890 13.836 -3.880 1085 HG3 LYS 54 HG1 LYS 54 -9.923 12.453 -3.371 1086 HD2 LYS 54 HD2 LYS 54 -9.149 13.679 -1.401 1087 HD3 LYS 54 HD1 LYS 54 -10.036 15.113 -1.920 1088 HE2 LYS 54 HE2 LYS 54 -12.158 13.859 -1.761 1089 HE3 LYS 54 HE1 LYS 54 -11.273 12.429 -1.233 1090 HZ1 LYS 54 HZ1 LYS 54 -12.311 14.132 0.469 1091 HZ2 LYS 54 HZ2 LYS 54 -10.823 14.916 0.232 1092 HZ3 LYS 54 HZ3 LYS 54 -10.863 13.315 0.798 1093 H GLY 55 HN GLY 55 -6.735 12.661 -6.785 1094 HA2 GLY 55 HA2 GLY 55 -5.288 13.589 -8.423 1095 HA3 GLY 55 HA1 GLY 55 -6.082 15.147 -8.214 1096 H VAL 56 HN VAL 56 -4.898 13.388 -5.404 1097 HA VAL 56 HA VAL 56 -3.272 15.654 -4.650 1098 HB VAL 56 HB VAL 56 -3.423 12.823 -3.579 1099 HG11 VAL 56 HG11 VAL 56 -1.255 13.579 -2.937 1100 HG12 VAL 56 HG12 VAL 56 -2.284 13.937 -1.549 1101 HG13 VAL 56 HG13 VAL 56 -1.827 15.225 -2.664 1102 HG21 VAL 56 HG21 VAL 56 -4.413 15.474 -2.493 1103 HG22 VAL 56 HG22 VAL 56 -4.725 13.881 -1.807 1104 HG23 VAL 56 HG23 VAL 56 -5.422 14.322 -3.366 1105 H ASP 57 HN ASP 57 -1.195 16.090 -5.184 1106 HA ASP 57 HA ASP 57 0.168 14.733 -7.255 1107 HB2 ASP 57 HB2 ASP 57 1.192 16.575 -5.084 1108 HB3 ASP 57 HB1 ASP 57 2.162 16.059 -6.465 1109 H LEU 58 HN LEU 58 0.547 12.545 -6.960 1110 HA LEU 58 HA LEU 58 1.886 11.625 -4.478 1111 HB2 LEU 58 HB2 LEU 58 0.028 10.467 -6.248 1112 HB3 LEU 58 HB1 LEU 58 1.528 9.632 -6.637 1113 HG LEU 58 HG LEU 58 1.754 9.350 -4.042 1114 HD11 LEU 58 HD11 LEU 58 -0.229 9.457 -2.762 1115 HD12 LEU 58 HD12 LEU 58 -1.245 9.606 -4.195 1116 HD13 LEU 58 HD13 LEU 58 -0.218 10.951 -3.697 1117 HD21 LEU 58 HD21 LEU 58 0.146 7.340 -4.164 1118 HD22 LEU 58 HD22 LEU 58 1.422 7.402 -5.380 1119 HD23 LEU 58 HD23 LEU 58 -0.221 7.883 -5.801 1120 H ASN 59 HN ASN 59 2.619 12.690 -7.640 1121 HA ASN 59 HA ASN 59 4.980 11.158 -8.165 1122 HB2 ASN 59 HB2 ASN 59 5.534 13.047 -9.729 1123 HB3 ASN 59 HB1 ASN 59 3.914 12.389 -9.950 1124 HD21 ASN 59 HD21 ASN 59 3.846 14.785 -10.953 1125 HD22 ASN 59 HD22 ASN 59 3.292 15.982 -9.885 1126 H ALA 60 HN ALA 60 4.478 14.243 -6.465 1127 HA ALA 60 HA ALA 60 7.352 14.574 -6.009 1128 HB1 ALA 60 HB1 ALA 60 5.985 16.558 -6.279 1129 HB2 ALA 60 HB2 ALA 60 6.604 16.521 -4.627 1130 HB3 ALA 60 HB3 ALA 60 4.933 16.057 -4.954 1131 H LEU 61 HN LEU 61 4.553 13.356 -4.248 1132 HA LEU 61 HA LEU 61 5.725 13.334 -1.651 1133 HB2 LEU 61 HB2 LEU 61 3.320 12.959 -2.028 1134 HB3 LEU 61 HB1 LEU 61 3.674 11.452 -2.868 1135 HG LEU 61 HG LEU 61 4.630 10.502 -0.817 1136 HD11 LEU 61 HD11 LEU 61 4.177 13.295 0.221 1137 HD12 LEU 61 HD12 LEU 61 5.585 12.252 0.407 1138 HD13 LEU 61 HD13 LEU 61 4.126 11.931 1.339 1139 HD21 LEU 61 HD21 LEU 61 1.872 11.726 -0.644 1140 HD22 LEU 61 HD22 LEU 61 2.485 10.643 0.606 1141 HD23 LEU 61 HD23 LEU 61 2.313 10.068 -1.052 1142 H PHE 62 HN PHE 62 5.708 10.882 -4.235 1143 HA PHE 62 HA PHE 62 7.391 9.072 -2.660 1144 HB2 PHE 62 HB2 PHE 62 6.061 8.999 -5.353 1145 HB3 PHE 62 HB1 PHE 62 7.359 7.850 -5.018 1146 HD1 PHE 62 HD1 PHE 62 7.173 6.392 -2.918 1147 HD2 PHE 62 HD2 PHE 62 3.892 8.663 -4.490 1148 HE1 PHE 62 HE1 PHE 62 5.586 4.988 -1.633 1149 HE2 PHE 62 HE2 PHE 62 2.300 7.253 -3.203 1150 HZ PHE 62 HZ PHE 62 3.150 5.416 -1.777 1151 H ASP 63 HN ASP 63 7.863 11.373 -5.307 1152 HA ASP 63 HA ASP 63 10.461 10.512 -6.096 1153 HB2 ASP 63 HB2 ASP 63 9.179 12.131 -7.403 1154 HB3 ASP 63 HB1 ASP 63 9.271 13.295 -6.084 1155 H ARG 64 HN ARG 64 9.456 12.827 -3.581 1156 HA ARG 64 HA ARG 64 12.069 13.677 -2.830 1157 HB2 ARG 64 HB2 ARG 64 9.758 14.616 -2.148 1158 HB3 ARG 64 HB1 ARG 64 9.768 13.379 -0.893 1159 HG2 ARG 64 HG2 ARG 64 12.124 14.324 -0.296 1160 HG3 ARG 64 HG1 ARG 64 11.633 15.725 -1.247 1161 HD2 ARG 64 HD2 ARG 64 9.468 15.667 0.205 1162 HD3 ARG 64 HD1 ARG 64 10.423 14.662 1.296 1163 HE ARG 64 HE ARG 64 12.102 16.760 0.984 1164 HH11 ARG 64 HH21 ARG 64 8.685 16.582 1.485 1165 HH12 ARG 64 HH22 ARG 64 8.595 18.102 2.305 1166 HH21 ARG 64 HH11 ARG 64 11.990 18.751 2.059 1167 HH22 ARG 64 HH12 ARG 64 10.459 19.325 2.633 1168 H ILE 65 HN ILE 65 10.069 10.961 -1.702 1169 HA ILE 65 HA ILE 65 11.790 10.124 0.409 1170 HB ILE 65 HB ILE 65 9.839 8.565 -1.310 1171 HG12 ILE 65 HG12 ILE 65 9.602 9.558 1.549 1172 HG13 ILE 65 HG11 ILE 65 8.989 10.451 0.158 1173 HG21 ILE 65 HG21 ILE 65 9.930 6.943 0.668 1174 HG22 ILE 65 HG22 ILE 65 11.408 7.773 1.153 1175 HG23 ILE 65 HG23 ILE 65 11.335 6.938 -0.398 1176 HD11 ILE 65 HD11 ILE 65 8.119 7.718 1.122 1177 HD12 ILE 65 HD12 ILE 65 7.674 8.359 -0.456 1178 HD13 ILE 65 HD13 ILE 65 7.140 9.179 1.009 1179 H ILE 66 HN ILE 66 11.697 9.153 -3.036 1180 HA ILE 66 HA ILE 66 13.801 7.205 -2.777 1181 HB ILE 66 HB ILE 66 12.939 8.767 -5.233 1182 HG12 ILE 66 HG12 ILE 66 12.057 6.008 -4.346 1183 HG13 ILE 66 HG11 ILE 66 11.126 7.470 -4.012 1184 HG21 ILE 66 HG21 ILE 66 14.624 6.295 -4.798 1185 HG22 ILE 66 HG22 ILE 66 14.999 7.719 -5.767 1186 HG23 ILE 66 HG23 ILE 66 13.790 6.568 -6.326 1187 HD11 ILE 66 HD11 ILE 66 10.369 6.323 -6.097 1188 HD12 ILE 66 HD12 ILE 66 11.978 6.567 -6.778 1189 HD13 ILE 66 HD13 ILE 66 10.961 7.957 -6.400 1190 H VAL 67 HN VAL 67 14.459 9.602 -5.169 1191 HA VAL 67 HA VAL 67 16.322 10.932 -5.568 1192 HB VAL 67 HB VAL 67 16.386 11.346 -2.574 1193 HG11 VAL 67 HG11 VAL 67 17.152 13.623 -3.334 1194 HG12 VAL 67 HG12 VAL 67 17.188 13.007 -4.985 1195 HG13 VAL 67 HG13 VAL 67 18.264 12.324 -3.766 1196 HG21 VAL 67 HG21 VAL 67 14.842 13.305 -3.174 1197 HG22 VAL 67 HG22 VAL 67 14.102 11.704 -3.204 1198 HG23 VAL 67 HG23 VAL 67 14.568 12.489 -4.713 1199 H ASN 68 HN ASN 68 18.276 10.172 -6.117 1200 HA ASN 68 HA ASN 68 19.496 7.993 -4.595 1201 HB2 ASN 68 HB2 ASN 68 19.421 8.396 -7.194 1202 HB3 ASN 68 HB1 ASN 68 20.833 9.405 -6.897 1203 HD21 ASN 68 HD21 ASN 68 21.792 7.556 -8.323 1204 HD22 ASN 68 HD22 ASN 68 22.401 6.201 -7.501 1205 H LYS 69 HN LYS 69 22.246 8.723 -5.191 1206 HA LYS 69 HA LYS 69 22.770 10.333 -2.805 1207 HB2 LYS 69 HB2 LYS 69 24.567 9.025 -4.865 1208 HB3 LYS 69 HB1 LYS 69 25.179 9.922 -3.474 1209 HG2 LYS 69 HG2 LYS 69 23.954 8.408 -1.958 1210 HG3 LYS 69 HG1 LYS 69 23.347 7.508 -3.348 1211 HD2 LYS 69 HD2 LYS 69 25.623 6.889 -3.987 1212 HD3 LYS 69 HD1 LYS 69 26.282 7.866 -2.673 1213 HE2 LYS 69 HE2 LYS 69 26.206 5.506 -2.004 1214 HE3 LYS 69 HE1 LYS 69 25.072 6.447 -1.035 1215 HZ1 LYS 69 HZ1 LYS 69 24.019 5.344 -3.504 1216 HZ2 LYS 69 HZ2 LYS 69 23.304 5.451 -1.967 1217 HZ3 LYS 69 HZ3 LYS 69 24.413 4.209 -2.307 1218 H LEU 70 HN LEU 70 22.211 12.487 -3.197 1219 HA LEU 70 HA LEU 70 23.803 13.899 -5.294 1220 HB2 LEU 70 HB2 LEU 70 21.209 13.530 -5.721 1221 HB3 LEU 70 HB1 LEU 70 21.035 14.853 -4.569 1222 HG LEU 70 HG LEU 70 22.700 14.913 -7.095 1223 HD11 LEU 70 HD11 LEU 70 20.074 16.258 -6.386 1224 HD12 LEU 70 HD12 LEU 70 20.294 14.967 -7.567 1225 HD13 LEU 70 HD13 LEU 70 20.995 16.558 -7.860 1226 HD21 LEU 70 HD21 LEU 70 23.765 16.371 -5.564 1227 HD22 LEU 70 HD22 LEU 70 22.233 16.903 -4.869 1228 HD23 LEU 70 HD23 LEU 70 22.702 17.436 -6.484 1229 H GLU 71 HN GLU 71 21.547 14.715 -2.661 1230 HA GLU 71 HA GLU 71 23.587 16.631 -1.594 1231 HB2 GLU 71 HB2 GLU 71 21.620 17.680 -0.434 1232 HB3 GLU 71 HB1 GLU 71 21.526 17.749 -2.190 1233 HG2 GLU 71 HG2 GLU 71 20.128 15.584 -2.029 1234 HG3 GLU 71 HG1 GLU 71 20.005 15.939 -0.305 1235 H HIS 72 HN HIS 72 24.049 13.993 -0.976 1236 HA HIS 72 HA HIS 72 23.614 14.009 1.950 1237 HB2 HIS 72 HB2 HIS 72 22.406 12.022 0.063 1238 HB3 HIS 72 HB1 HIS 72 23.075 11.381 1.559 1239 HD2 HIS 72 HD2 HIS 72 19.991 11.055 1.765 1240 HE1 HIS 72 HE1 HIS 72 19.759 14.864 3.577 1241 HE2 HIS 72 HE2 HIS 72 18.525 12.685 3.183 1242 H HIS 73 HN HIS 73 24.828 12.108 2.935 1243 HA HIS 73 HA HIS 73 27.071 11.046 1.394 1244 HB2 HIS 73 HB2 HIS 73 28.756 12.066 3.010 1245 HB3 HIS 73 HB1 HIS 73 28.029 13.200 1.874 1246 HD2 HIS 73 HD2 HIS 73 25.530 12.446 4.662 1247 HE1 HIS 73 HE1 HIS 73 27.566 15.951 5.855 1248 HE2 HIS 73 HE2 HIS 73 25.581 14.446 6.336 1249 H HIS 74 HN HIS 74 25.281 9.475 2.386 1250 HA HIS 74 HA HIS 74 24.722 7.832 3.962 1251 HB2 HIS 74 HB2 HIS 74 27.685 7.953 4.566 1252 HB3 HIS 74 HB1 HIS 74 26.606 6.577 4.801 1253 HD2 HIS 74 HD2 HIS 74 25.241 6.114 1.986 1254 HE1 HIS 74 HE1 HIS 74 29.030 6.676 0.205 1255 HE2 HIS 74 HE2 HIS 74 26.684 5.788 -0.164 1256 H HIS 75 HN HIS 75 27.140 8.127 6.238 1257 HA HIS 75 HA HIS 75 25.615 10.057 7.940 1258 HB2 HIS 75 HB2 HIS 75 24.847 7.805 8.547 1259 HB3 HIS 75 HB1 HIS 75 26.517 7.272 8.742 1260 HD2 HIS 75 HD2 HIS 75 25.107 7.009 11.527 1261 HE1 HIS 75 HE1 HIS 75 26.370 10.933 12.447 1262 HE2 HIS 75 HE2 HIS 75 25.476 8.767 13.417 1263 H HIS 76 HN HIS 76 28.075 8.003 9.264 1264 HA HIS 76 HA HIS 76 30.254 9.867 8.674 1265 HB2 HIS 76 HB2 HIS 76 28.662 10.126 11.104 1266 HB3 HIS 76 HB1 HIS 76 30.321 9.724 11.529 1267 HD2 HIS 76 HD2 HIS 76 30.631 12.478 12.420 1268 HE1 HIS 76 HE1 HIS 76 30.673 14.087 8.513 1269 HE2 HIS 76 HE2 HIS 76 31.147 14.576 10.955 1270 H HIS 77 HN HIS 77 29.485 6.960 8.472 1271 HA HIS 77 HA HIS 77 32.062 5.908 9.504 1272 HB2 HIS 77 HB2 HIS 77 29.334 4.786 10.182 1273 HB3 HIS 77 HB1 HIS 77 30.822 3.851 10.338 1274 HD2 HIS 77 HD2 HIS 77 32.536 4.681 12.462 1275 HE1 HIS 77 HE1 HIS 77 29.879 7.546 14.070 1276 HE2 HIS 77 HE2 HIS 77 32.046 6.285 14.461 Start of MODEL 16 1 H1 MET 1 HT1 MET 1 11.757 17.055 4.210 2 H2 MET 1 HT2 MET 1 11.309 15.461 3.831 3 H3 MET 1 HT3 MET 1 11.643 15.891 5.440 4 HA MET 1 HA MET 1 9.734 17.429 5.395 5 HB2 MET 1 HB2 MET 1 9.818 17.540 2.827 6 HB3 MET 1 HB1 MET 1 8.998 15.979 2.841 7 HG2 MET 1 HG2 MET 1 7.302 17.688 2.662 8 HG3 MET 1 HG1 MET 1 7.213 17.023 4.293 9 HE1 MET 1 HE1 MET 1 6.497 21.016 4.064 10 HE2 MET 1 HE2 MET 1 5.759 19.435 3.824 11 HE3 MET 1 HE3 MET 1 6.734 20.147 2.541 12 H GLU 2 HN GLU 2 10.617 14.184 4.962 13 HA GLU 2 HA GLU 2 9.818 12.187 5.870 14 HB2 GLU 2 HB2 GLU 2 9.834 13.649 7.935 15 HB3 GLU 2 HB1 GLU 2 8.118 13.945 7.659 16 HG2 GLU 2 HG2 GLU 2 7.701 11.502 7.735 17 HG3 GLU 2 HG1 GLU 2 9.413 11.231 8.058 18 H LEU 3 HN LEU 3 8.465 10.875 4.857 19 HA LEU 3 HA LEU 3 6.248 11.776 3.312 20 HB2 LEU 3 HB2 LEU 3 7.482 9.690 2.815 21 HB3 LEU 3 HB1 LEU 3 6.885 8.980 4.314 22 HG LEU 3 HG LEU 3 4.556 9.205 3.486 23 HD11 LEU 3 HD11 LEU 3 4.489 9.666 0.877 24 HD12 LEU 3 HD12 LEU 3 5.982 10.548 1.203 25 HD13 LEU 3 HD13 LEU 3 4.488 11.010 2.017 26 HD21 LEU 3 HD21 LEU 3 6.053 7.180 2.993 27 HD22 LEU 3 HD22 LEU 3 6.219 7.840 1.365 28 HD23 LEU 3 HD23 LEU 3 4.629 7.380 1.969 29 H SER 4 HN SER 4 6.424 10.207 6.478 30 HA SER 4 HA SER 4 3.642 9.823 6.898 31 HB2 SER 4 HB2 SER 4 5.835 10.403 8.910 32 HB3 SER 4 HB1 SER 4 4.237 9.786 9.318 33 HG SER 4 HG SER 4 6.381 8.549 8.011 34 H ASN 5 HN ASN 5 5.709 12.615 7.580 35 HA ASN 5 HA ASN 5 3.785 14.185 8.987 36 HB2 ASN 5 HB2 ASN 5 6.173 14.741 8.971 37 HB3 ASN 5 HB1 ASN 5 6.103 15.047 7.236 38 HD21 ASN 5 HD21 ASN 5 5.960 16.598 10.220 39 HD22 ASN 5 HD22 ASN 5 5.172 18.019 9.734 40 H GLU 6 HN GLU 6 4.542 13.959 5.531 41 HA GLU 6 HA GLU 6 2.753 16.047 4.694 42 HB2 GLU 6 HB2 GLU 6 3.973 13.674 3.267 43 HB3 GLU 6 HB1 GLU 6 2.926 14.826 2.437 44 HG2 GLU 6 HG2 GLU 6 4.500 16.655 3.335 45 HG3 GLU 6 HG1 GLU 6 5.600 15.343 3.753 46 H LEU 7 HN LEU 7 2.338 12.587 5.204 47 HA LEU 7 HA LEU 7 -0.220 12.304 3.992 48 HB2 LEU 7 HB2 LEU 7 1.404 10.503 4.950 49 HB3 LEU 7 HB1 LEU 7 0.589 10.807 6.481 50 HG LEU 7 HG LEU 7 -1.616 10.466 5.119 51 HD11 LEU 7 HD11 LEU 7 -1.189 8.718 3.271 52 HD12 LEU 7 HD12 LEU 7 0.476 9.294 3.270 53 HD13 LEU 7 HD13 LEU 7 -0.839 10.398 2.873 54 HD21 LEU 7 HD21 LEU 7 0.278 8.184 5.766 55 HD22 LEU 7 HD22 LEU 7 -1.446 7.984 5.450 56 HD23 LEU 7 HD23 LEU 7 -0.908 8.912 6.850 57 H LYS 8 HN LYS 8 0.683 13.152 7.314 58 HA LYS 8 HA LYS 8 -2.010 13.301 8.318 59 HB2 LYS 8 HB2 LYS 8 0.028 13.133 9.746 60 HB3 LYS 8 HB1 LYS 8 0.447 14.784 9.296 61 HG2 LYS 8 HG2 LYS 8 -1.707 15.576 10.228 62 HG3 LYS 8 HG1 LYS 8 -2.098 13.929 10.712 63 HD2 LYS 8 HD2 LYS 8 0.450 15.265 11.631 64 HD3 LYS 8 HD1 LYS 8 -1.064 15.499 12.500 65 HE2 LYS 8 HE2 LYS 8 -1.266 12.986 12.657 66 HE3 LYS 8 HE1 LYS 8 0.364 12.875 11.997 67 HZ1 LYS 8 HZ1 LYS 8 0.833 14.582 13.912 68 HZ2 LYS 8 HZ2 LYS 8 0.834 12.907 14.195 69 HZ3 LYS 8 HZ3 LYS 8 -0.525 13.839 14.605 70 H VAL 9 HN VAL 9 0.181 15.698 6.907 71 HA VAL 9 HA VAL 9 -1.441 18.001 7.364 72 HB VAL 9 HB VAL 9 0.574 17.380 5.187 73 HG11 VAL 9 HG11 VAL 9 0.618 19.935 4.982 74 HG12 VAL 9 HG12 VAL 9 -0.910 19.929 5.861 75 HG13 VAL 9 HG13 VAL 9 -0.793 19.130 4.293 76 HG21 VAL 9 HG21 VAL 9 1.341 17.479 7.599 77 HG22 VAL 9 HG22 VAL 9 0.797 19.156 7.635 78 HG23 VAL 9 HG23 VAL 9 2.099 18.673 6.548 79 H GLU 10 HN GLU 10 -1.289 15.765 4.574 80 HA GLU 10 HA GLU 10 -3.182 17.113 2.939 81 HB2 GLU 10 HB2 GLU 10 -2.549 14.152 3.188 82 HB3 GLU 10 HB1 GLU 10 -3.475 14.867 1.870 83 HG2 GLU 10 HG2 GLU 10 -0.697 15.837 2.557 84 HG3 GLU 10 HG1 GLU 10 -0.953 14.479 1.462 85 H ARG 11 HN ARG 11 -3.573 14.624 5.433 86 HA ARG 11 HA ARG 11 -6.390 14.239 5.128 87 HB2 ARG 11 HB2 ARG 11 -4.727 12.812 6.456 88 HB3 ARG 11 HB1 ARG 11 -4.853 14.032 7.723 89 HG2 ARG 11 HG2 ARG 11 -6.545 12.611 8.432 90 HG3 ARG 11 HG1 ARG 11 -7.485 13.632 7.345 91 HD2 ARG 11 HD2 ARG 11 -8.090 11.519 6.573 92 HD3 ARG 11 HD1 ARG 11 -6.709 11.857 5.529 93 HE ARG 11 HE ARG 11 -5.581 10.082 6.587 94 HH11 ARG 11 HH21 ARG 11 -8.115 11.313 8.602 95 HH12 ARG 11 HH22 ARG 11 -7.923 10.079 9.802 96 HH21 ARG 11 HH11 ARG 11 -5.339 8.481 8.144 97 HH22 ARG 11 HH12 ARG 11 -6.357 8.485 9.546 98 H ILE 12 HN ILE 12 -4.545 16.316 7.351 99 HA ILE 12 HA ILE 12 -6.846 17.504 8.601 100 HB ILE 12 HB ILE 12 -3.980 18.458 8.344 101 HG12 ILE 12 HG12 ILE 12 -5.457 17.309 10.727 102 HG13 ILE 12 HG11 ILE 12 -4.511 16.319 9.617 103 HG21 ILE 12 HG21 ILE 12 -4.689 19.894 10.365 104 HG22 ILE 12 HG22 ILE 12 -6.348 19.582 9.853 105 HG23 ILE 12 HG23 ILE 12 -5.238 20.430 8.777 106 HD11 ILE 12 HD11 ILE 12 -3.487 18.624 11.300 107 HD12 ILE 12 HD12 ILE 12 -2.526 17.767 10.096 108 HD13 ILE 12 HD13 ILE 12 -3.118 16.914 11.523 109 H ARG 13 HN ARG 13 -4.769 18.532 5.913 110 HA ARG 13 HA ARG 13 -5.996 21.066 5.455 111 HB2 ARG 13 HB2 ARG 13 -3.840 20.311 4.414 112 HB3 ARG 13 HB1 ARG 13 -4.764 19.217 3.385 113 HG2 ARG 13 HG2 ARG 13 -6.027 21.166 2.484 114 HG3 ARG 13 HG1 ARG 13 -5.039 22.236 3.476 115 HD2 ARG 13 HD2 ARG 13 -4.144 22.171 1.207 116 HD3 ARG 13 HD1 ARG 13 -3.010 21.398 2.316 117 HE ARG 13 HE ARG 13 -4.927 19.642 0.894 118 HH11 ARG 13 HH21 ARG 13 -1.720 20.876 1.286 119 HH12 ARG 13 HH22 ARG 13 -0.992 19.606 0.365 120 HH21 ARG 13 HH11 ARG 13 -3.985 18.009 -0.323 121 HH22 ARG 13 HH12 ARG 13 -2.267 17.990 -0.542 122 H LEU 14 HN LEU 14 -6.725 17.828 4.221 123 HA LEU 14 HA LEU 14 -9.009 18.806 2.639 124 HB2 LEU 14 HB2 LEU 14 -8.061 15.994 3.278 125 HB3 LEU 14 HB1 LEU 14 -9.294 16.404 2.088 126 HG LEU 14 HG LEU 14 -6.493 17.551 1.967 127 HD11 LEU 14 HD11 LEU 14 -6.569 14.982 1.859 128 HD12 LEU 14 HD12 LEU 14 -5.816 15.809 0.497 129 HD13 LEU 14 HD13 LEU 14 -7.459 15.186 0.348 130 HD21 LEU 14 HD21 LEU 14 -8.832 17.354 0.049 131 HD22 LEU 14 HD22 LEU 14 -7.196 17.691 -0.513 132 HD23 LEU 14 HD23 LEU 14 -7.990 18.804 0.595 133 H SER 15 HN SER 15 -8.418 18.095 5.831 134 HA SER 15 HA SER 15 -9.758 17.464 7.657 135 HB2 SER 15 HB2 SER 15 -10.477 19.778 7.152 136 HB3 SER 15 HB1 SER 15 -11.731 19.150 6.089 137 HG SER 15 HG SER 15 -11.737 19.434 8.760 138 H LEU 16 HN LEU 16 -9.736 15.221 6.698 139 HA LEU 16 HA LEU 16 -12.467 14.360 5.797 140 HB2 LEU 16 HB2 LEU 16 -9.832 12.876 5.640 141 HB3 LEU 16 HB1 LEU 16 -11.374 12.324 4.990 142 HG LEU 16 HG LEU 16 -9.934 14.856 4.143 143 HD11 LEU 16 HD11 LEU 16 -9.668 13.562 1.981 144 HD12 LEU 16 HD12 LEU 16 -10.201 12.126 2.855 145 HD13 LEU 16 HD13 LEU 16 -8.712 12.944 3.329 146 HD21 LEU 16 HD21 LEU 16 -11.696 14.544 2.207 147 HD22 LEU 16 HD22 LEU 16 -12.206 15.283 3.720 148 HD23 LEU 16 HD23 LEU 16 -12.571 13.586 3.404 149 H THR 17 HN THR 17 -13.652 13.051 7.044 150 HA THR 17 HA THR 17 -12.778 12.543 9.787 151 HB THR 17 HB THR 17 -15.086 11.390 9.887 152 HG1 THR 17 HG1 THR 17 -15.013 12.414 7.266 153 HG21 THR 17 HG21 THR 17 -16.247 13.562 9.927 154 HG22 THR 17 HG22 THR 17 -14.899 14.298 9.060 155 HG23 THR 17 HG23 THR 17 -14.662 13.676 10.692 156 H ALA 18 HN ALA 18 -12.473 10.528 10.730 157 HA ALA 18 HA ALA 18 -11.332 8.481 9.026 158 HB1 ALA 18 HB1 ALA 18 -11.951 8.616 11.985 159 HB2 ALA 18 HB2 ALA 18 -10.373 8.754 11.212 160 HB3 ALA 18 HB3 ALA 18 -11.214 7.201 11.235 161 H LYS 19 HN LYS 19 -14.356 8.895 10.773 162 HA LYS 19 HA LYS 19 -15.374 6.253 10.502 163 HB2 LYS 19 HB2 LYS 19 -16.303 8.254 11.858 164 HB3 LYS 19 HB1 LYS 19 -17.085 8.741 10.357 165 HG2 LYS 19 HG2 LYS 19 -18.282 6.639 10.225 166 HG3 LYS 19 HG1 LYS 19 -17.408 6.001 11.616 167 HD2 LYS 19 HD2 LYS 19 -18.946 8.572 11.939 168 HD3 LYS 19 HD1 LYS 19 -19.834 7.050 11.915 169 HE2 LYS 19 HE2 LYS 19 -17.519 7.694 13.768 170 HE3 LYS 19 HE1 LYS 19 -19.225 7.687 14.224 171 HZ1 LYS 19 HZ1 LYS 19 -18.546 5.276 12.909 172 HZ2 LYS 19 HZ2 LYS 19 -19.162 5.503 14.476 173 HZ3 LYS 19 HZ3 LYS 19 -17.485 5.538 14.206 174 H SER 20 HN SER 20 -15.794 9.105 8.419 175 HA SER 20 HA SER 20 -17.414 7.813 6.447 176 HB2 SER 20 HB2 SER 20 -17.354 10.198 6.418 177 HB3 SER 20 HB1 SER 20 -15.594 10.222 6.376 178 HG SER 20 HG SER 20 -15.774 9.190 4.295 179 H VAL 21 HN VAL 21 -13.903 8.411 6.567 180 HA VAL 21 HA VAL 21 -13.301 7.113 4.081 181 HB VAL 21 HB VAL 21 -11.614 7.619 6.549 182 HG11 VAL 21 HG11 VAL 21 -10.503 5.838 5.457 183 HG12 VAL 21 HG12 VAL 21 -9.711 7.282 4.833 184 HG13 VAL 21 HG13 VAL 21 -10.915 6.447 3.854 185 HG21 VAL 21 HG21 VAL 21 -12.546 9.557 5.146 186 HG22 VAL 21 HG22 VAL 21 -11.505 8.974 3.847 187 HG23 VAL 21 HG23 VAL 21 -10.797 9.523 5.367 188 H ALA 22 HN ALA 22 -13.298 5.957 7.432 189 HA ALA 22 HA ALA 22 -12.330 3.329 6.927 190 HB1 ALA 22 HB1 ALA 22 -14.060 4.536 9.084 191 HB2 ALA 22 HB2 ALA 22 -12.391 3.981 9.200 192 HB3 ALA 22 HB3 ALA 22 -13.705 2.809 9.081 193 H GLU 23 HN GLU 23 -15.559 4.721 6.747 194 HA GLU 23 HA GLU 23 -16.995 2.264 6.479 195 HB2 GLU 23 HB2 GLU 23 -18.067 4.445 7.002 196 HB3 GLU 23 HB1 GLU 23 -17.697 4.999 5.369 197 HG2 GLU 23 HG2 GLU 23 -19.126 3.364 4.381 198 HG3 GLU 23 HG1 GLU 23 -19.290 2.486 5.899 199 H GLU 24 HN GLU 24 -15.698 4.481 4.000 200 HA GLU 24 HA GLU 24 -16.572 2.764 1.808 201 HB2 GLU 24 HB2 GLU 24 -14.378 4.750 1.361 202 HB3 GLU 24 HB1 GLU 24 -15.834 4.453 0.410 203 HG2 GLU 24 HG2 GLU 24 -16.918 5.438 2.765 204 HG3 GLU 24 HG1 GLU 24 -15.402 6.331 2.670 205 H MET 25 HN MET 25 -13.582 3.325 3.563 206 HA MET 25 HA MET 25 -11.873 1.734 1.899 207 HB2 MET 25 HB2 MET 25 -11.747 2.616 4.785 208 HB3 MET 25 HB1 MET 25 -10.487 1.617 4.067 209 HG2 MET 25 HG2 MET 25 -11.396 4.252 2.886 210 HG3 MET 25 HG1 MET 25 -10.027 4.104 3.986 211 HE1 MET 25 HE1 MET 25 -8.333 2.537 3.852 212 HE2 MET 25 HE2 MET 25 -7.329 2.418 2.412 213 HE3 MET 25 HE3 MET 25 -8.493 1.149 2.766 214 H GLY 26 HN GLY 26 -13.847 1.008 4.739 215 HA2 GLY 26 HA2 GLY 26 -14.897 -1.097 5.178 216 HA3 GLY 26 HA1 GLY 26 -13.827 -1.862 4.002 217 H ILE 27 HN ILE 27 -12.658 0.297 6.501 218 HA ILE 27 HA ILE 27 -11.511 -2.039 7.993 219 HB ILE 27 HB ILE 27 -9.431 -0.753 8.292 220 HG12 ILE 27 HG12 ILE 27 -10.693 1.185 6.323 221 HG13 ILE 27 HG11 ILE 27 -10.429 1.513 8.034 222 HG21 ILE 27 HG21 ILE 27 -10.230 -1.050 5.384 223 HG22 ILE 27 HG22 ILE 27 -9.683 -2.367 6.424 224 HG23 ILE 27 HG23 ILE 27 -8.585 -1.048 6.020 225 HD11 ILE 27 HD11 ILE 27 -8.342 1.068 5.894 226 HD12 ILE 27 HD12 ILE 27 -7.962 0.994 7.614 227 HD13 ILE 27 HD13 ILE 27 -8.571 2.492 6.910 228 H SER 28 HN SER 28 -10.725 -1.372 10.179 229 HA SER 28 HA SER 28 -12.838 0.028 11.585 230 HB2 SER 28 HB2 SER 28 -10.230 -1.234 12.419 231 HB3 SER 28 HB1 SER 28 -11.232 -0.354 13.570 232 HG SER 28 HG SER 28 -11.759 -2.726 12.152 233 H ARG 29 HN ARG 29 -12.507 1.863 12.984 234 HA ARG 29 HA ARG 29 -11.188 4.062 11.707 235 HB2 ARG 29 HB2 ARG 29 -11.993 3.916 14.625 236 HB3 ARG 29 HB1 ARG 29 -11.879 5.356 13.610 237 HG2 ARG 29 HG2 ARG 29 -13.665 4.056 12.122 238 HG3 ARG 29 HG1 ARG 29 -13.992 3.216 13.638 239 HD2 ARG 29 HD2 ARG 29 -14.309 6.140 13.000 240 HD3 ARG 29 HD1 ARG 29 -15.488 5.025 13.693 241 HE ARG 29 HE ARG 29 -13.112 5.500 15.353 242 HH11 ARG 29 HH21 ARG 29 -16.364 6.358 14.545 243 HH12 ARG 29 HH22 ARG 29 -16.674 7.112 16.073 244 HH21 ARG 29 HH11 ARG 29 -13.509 6.480 17.333 245 HH22 ARG 29 HH12 ARG 29 -15.061 7.180 17.648 246 H GLN 30 HN GLN 30 -10.299 1.881 14.315 247 HA GLN 30 HA GLN 30 -7.936 3.259 15.187 248 HB2 GLN 30 HB2 GLN 30 -9.012 1.425 16.486 249 HB3 GLN 30 HB1 GLN 30 -8.522 0.279 15.237 250 HG2 GLN 30 HG2 GLN 30 -6.174 0.729 15.661 251 HG3 GLN 30 HG1 GLN 30 -6.584 2.026 16.781 252 HE21 GLN 30 HE21 GLN 30 -4.990 -0.163 17.658 253 HE22 GLN 30 HE22 GLN 30 -5.888 -1.086 18.763 254 H GLN 31 HN GLN 31 -8.517 0.795 12.710 255 HA GLN 31 HA GLN 31 -5.821 0.259 11.995 256 HB2 GLN 31 HB2 GLN 31 -8.420 0.219 10.454 257 HB3 GLN 31 HB1 GLN 31 -6.893 -0.195 9.672 258 HG2 GLN 31 HG2 GLN 31 -7.776 -1.510 12.245 259 HG3 GLN 31 HG1 GLN 31 -8.248 -2.143 10.668 260 HE21 GLN 31 HE21 GLN 31 -6.675 -3.834 12.145 261 HE22 GLN 31 HE22 GLN 31 -5.087 -3.861 11.550 262 H LEU 32 HN LEU 32 -8.082 2.735 10.825 263 HA LEU 32 HA LEU 32 -6.303 3.921 8.923 264 HB2 LEU 32 HB2 LEU 32 -8.750 4.351 8.972 265 HB3 LEU 32 HB1 LEU 32 -8.554 5.202 10.502 266 HG LEU 32 HG LEU 32 -7.030 6.820 9.374 267 HD11 LEU 32 HD11 LEU 32 -7.649 5.043 7.023 268 HD12 LEU 32 HD12 LEU 32 -6.105 5.739 7.517 269 HD13 LEU 32 HD13 LEU 32 -7.323 6.757 6.756 270 HD21 LEU 32 HD21 LEU 32 -9.766 6.497 8.109 271 HD22 LEU 32 HD22 LEU 32 -8.807 7.977 8.096 272 HD23 LEU 32 HD23 LEU 32 -9.412 7.332 9.622 273 H CYS 33 HN CYS 33 -6.978 4.632 12.330 274 HA CYS 33 HA CYS 33 -5.220 6.880 12.557 275 HB2 CYS 33 HB2 CYS 33 -7.053 5.786 14.209 276 HB3 CYS 33 HB1 CYS 33 -5.603 5.088 14.929 277 HG CYS 33 HG CYS 33 -5.149 8.027 14.509 278 H ASN 34 HN ASN 34 -4.737 3.422 12.835 279 HA ASN 34 HA ASN 34 -2.102 3.459 13.948 280 HB2 ASN 34 HB2 ASN 34 -3.514 1.425 13.855 281 HB3 ASN 34 HB1 ASN 34 -3.386 1.423 12.099 282 HD21 ASN 34 HD21 ASN 34 -2.367 -0.806 12.518 283 HD22 ASN 34 HD22 ASN 34 -0.708 -0.860 12.870 284 H ILE 35 HN ILE 35 -3.321 3.661 10.649 285 HA ILE 35 HA ILE 35 -0.823 3.402 9.289 286 HB ILE 35 HB ILE 35 -3.366 4.858 8.531 287 HG12 ILE 35 HG12 ILE 35 -2.209 2.227 7.562 288 HG13 ILE 35 HG11 ILE 35 -3.422 2.353 8.834 289 HG21 ILE 35 HG21 ILE 35 -1.644 5.873 7.221 290 HG22 ILE 35 HG22 ILE 35 -2.369 4.652 6.178 291 HG23 ILE 35 HG23 ILE 35 -0.827 4.331 6.970 292 HD11 ILE 35 HD11 ILE 35 -4.658 1.947 6.843 293 HD12 ILE 35 HD12 ILE 35 -3.693 3.097 5.918 294 HD13 ILE 35 HD13 ILE 35 -4.827 3.677 7.135 295 H GLU 36 HN GLU 36 -2.554 6.226 10.552 296 HA GLU 36 HA GLU 36 -0.758 8.236 9.610 297 HB2 GLU 36 HB2 GLU 36 -2.568 8.125 12.040 298 HB3 GLU 36 HB1 GLU 36 -1.680 9.573 11.564 299 HG2 GLU 36 HG2 GLU 36 -2.837 9.708 9.474 300 HG3 GLU 36 HG1 GLU 36 -3.537 8.103 9.681 301 H GLN 37 HN GLN 37 -0.699 6.177 12.475 302 HA GLN 37 HA GLN 37 1.683 7.549 13.554 303 HB2 GLN 37 HB2 GLN 37 0.102 5.128 14.475 304 HB3 GLN 37 HB1 GLN 37 1.509 5.760 15.332 305 HG2 GLN 37 HG2 GLN 37 0.392 7.926 15.616 306 HG3 GLN 37 HG1 GLN 37 -1.001 7.347 14.703 307 HE21 GLN 37 HE21 GLN 37 -0.415 8.088 17.741 308 HE22 GLN 37 HE22 GLN 37 -1.182 6.821 18.570 309 H SER 38 HN SER 38 1.232 5.499 11.072 310 HA SER 38 HA SER 38 3.140 3.405 11.526 311 HB2 SER 38 HB2 SER 38 1.441 3.369 9.713 312 HB3 SER 38 HB1 SER 38 2.318 4.653 8.890 313 HG SER 38 HG SER 38 3.747 2.400 9.695 314 H GLU 39 HN GLU 39 5.294 3.268 11.015 315 HA GLU 39 HA GLU 39 6.752 5.834 10.778 316 HB2 GLU 39 HB2 GLU 39 7.533 2.997 11.441 317 HB3 GLU 39 HB1 GLU 39 8.758 4.209 11.073 318 HG2 GLU 39 HG2 GLU 39 6.630 4.556 13.202 319 HG3 GLU 39 HG1 GLU 39 8.256 3.957 13.532 320 H THR 40 HN THR 40 8.070 2.879 9.511 321 HA THR 40 HA THR 40 8.589 4.185 6.946 322 HB THR 40 HB THR 40 9.180 1.348 7.829 323 HG1 THR 40 HG1 THR 40 11.158 2.161 8.401 324 HG21 THR 40 HG21 THR 40 11.000 1.675 6.032 325 HG22 THR 40 HG22 THR 40 10.031 3.040 5.478 326 HG23 THR 40 HG23 THR 40 9.350 1.412 5.468 327 H ALA 41 HN ALA 41 8.103 3.053 4.894 328 HA ALA 41 HA ALA 41 5.283 2.184 4.883 329 HB1 ALA 41 HB1 ALA 41 7.199 3.347 2.939 330 HB2 ALA 41 HB2 ALA 41 5.474 3.643 3.111 331 HB3 ALA 41 HB3 ALA 41 6.041 2.216 2.242 332 HA PRO 42 HA PRO 42 6.151 -2.093 4.281 333 HB2 PRO 42 HB2 PRO 42 4.197 -2.846 2.494 334 HB3 PRO 42 HB1 PRO 42 3.880 -2.487 4.203 335 HG2 PRO 42 HG2 PRO 42 3.480 -0.756 1.805 336 HG3 PRO 42 HG1 PRO 42 2.447 -0.959 3.231 337 HD2 PRO 42 HD2 PRO 42 4.110 1.183 2.922 338 HD3 PRO 42 HD1 PRO 42 3.696 0.515 4.515 339 H VAL 43 HN VAL 43 6.870 -3.715 2.750 340 HA VAL 43 HA VAL 43 8.719 -2.755 0.812 341 HB VAL 43 HB VAL 43 8.853 -5.151 0.095 342 HG11 VAL 43 HG11 VAL 43 8.794 -4.607 3.076 343 HG12 VAL 43 HG12 VAL 43 10.175 -4.418 1.997 344 HG13 VAL 43 HG13 VAL 43 9.536 -6.026 2.337 345 HG21 VAL 43 HG21 VAL 43 6.627 -5.527 2.132 346 HG22 VAL 43 HG22 VAL 43 7.462 -6.810 1.258 347 HG23 VAL 43 HG23 VAL 43 6.434 -5.676 0.385 348 H VAL 44 HN VAL 44 5.337 -3.393 0.619 349 HA VAL 44 HA VAL 44 5.061 -3.926 -2.172 350 HB VAL 44 HB VAL 44 3.209 -2.524 -0.221 351 HG11 VAL 44 HG11 VAL 44 1.451 -3.214 -1.950 352 HG12 VAL 44 HG12 VAL 44 2.794 -3.459 -3.067 353 HG13 VAL 44 HG13 VAL 44 2.487 -1.857 -2.396 354 HG21 VAL 44 HG21 VAL 44 2.031 -4.770 -0.365 355 HG22 VAL 44 HG22 VAL 44 3.605 -4.808 0.429 356 HG23 VAL 44 HG23 VAL 44 3.445 -5.369 -1.234 357 H VAL 45 HN VAL 45 5.059 -0.876 -0.353 358 HA VAL 45 HA VAL 45 4.648 0.849 -2.609 359 HB VAL 45 HB VAL 45 6.013 1.367 0.048 360 HG11 VAL 45 HG11 VAL 45 5.387 3.786 -0.553 361 HG12 VAL 45 HG12 VAL 45 5.173 3.202 -2.204 362 HG13 VAL 45 HG13 VAL 45 6.752 3.088 -1.426 363 HG21 VAL 45 HG21 VAL 45 3.534 0.668 -0.041 364 HG22 VAL 45 HG22 VAL 45 3.248 2.211 -0.845 365 HG23 VAL 45 HG23 VAL 45 3.902 2.176 0.794 366 H LYS 46 HN LYS 46 7.576 -0.365 -1.018 367 HA LYS 46 HA LYS 46 9.478 1.138 -2.515 368 HB2 LYS 46 HB2 LYS 46 9.653 -1.609 -1.247 369 HB3 LYS 46 HB1 LYS 46 11.044 -0.772 -1.936 370 HG2 LYS 46 HG2 LYS 46 10.666 1.118 -0.387 371 HG3 LYS 46 HG1 LYS 46 9.288 0.266 0.310 372 HD2 LYS 46 HD2 LYS 46 10.745 -1.555 1.052 373 HD3 LYS 46 HD1 LYS 46 12.133 -0.789 0.278 374 HE2 LYS 46 HE2 LYS 46 12.148 -0.278 2.671 375 HE3 LYS 46 HE1 LYS 46 11.822 1.193 1.755 376 HZ1 LYS 46 HZ1 LYS 46 9.415 -0.188 2.331 377 HZ2 LYS 46 HZ2 LYS 46 9.864 1.399 2.737 378 HZ3 LYS 46 HZ3 LYS 46 10.276 0.109 3.762 379 H TYR 47 HN TYR 47 8.011 -2.033 -3.134 380 HA TYR 47 HA TYR 47 9.474 -2.654 -5.511 381 HB2 TYR 47 HB2 TYR 47 8.019 -4.246 -4.189 382 HB3 TYR 47 HB1 TYR 47 6.613 -3.431 -4.874 383 HD1 TYR 47 HD1 TYR 47 6.135 -3.555 -7.299 384 HD2 TYR 47 HD2 TYR 47 9.411 -5.681 -5.528 385 HE1 TYR 47 HE1 TYR 47 6.333 -4.947 -9.343 386 HE2 TYR 47 HE2 TYR 47 9.613 -7.079 -7.573 387 HH TYR 47 HH TYR 47 7.330 -7.452 -9.769 388 H ILE 48 HN ILE 48 6.403 -0.969 -4.978 389 HA ILE 48 HA ILE 48 5.730 -0.531 -7.720 390 HB ILE 48 HB ILE 48 5.078 1.068 -5.223 391 HG12 ILE 48 HG12 ILE 48 3.339 -0.792 -6.867 392 HG13 ILE 48 HG11 ILE 48 4.235 -1.318 -5.443 393 HG21 ILE 48 HG21 ILE 48 3.183 1.933 -6.725 394 HG22 ILE 48 HG22 ILE 48 4.137 1.332 -8.079 395 HG23 ILE 48 HG23 ILE 48 4.790 2.590 -7.031 396 HD11 ILE 48 HD11 ILE 48 1.764 -0.589 -5.124 397 HD12 ILE 48 HD12 ILE 48 2.376 1.054 -5.303 398 HD13 ILE 48 HD13 ILE 48 2.960 0.032 -3.991 399 H ALA 49 HN ALA 49 7.615 1.365 -5.398 400 HA ALA 49 HA ALA 49 8.102 3.643 -7.024 401 HB1 ALA 49 HB1 ALA 49 9.893 4.147 -5.506 402 HB2 ALA 49 HB2 ALA 49 10.096 2.446 -5.084 403 HB3 ALA 49 HB3 ALA 49 8.665 3.319 -4.542 404 H PHE 50 HN PHE 50 9.639 0.474 -6.918 405 HA PHE 50 HA PHE 50 11.928 1.071 -8.509 406 HB2 PHE 50 HB2 PHE 50 11.276 -1.116 -7.203 407 HB3 PHE 50 HB1 PHE 50 10.466 -1.568 -8.703 408 HD1 PHE 50 HD2 PHE 50 13.732 -0.095 -7.586 409 HD2 PHE 50 HD1 PHE 50 11.723 -2.791 -10.262 410 HE1 PHE 50 HE2 PHE 50 15.913 -0.768 -8.543 411 HE2 PHE 50 HE1 PHE 50 13.909 -3.466 -11.216 412 HZ PHE 50 HZ PHE 50 16.003 -2.455 -10.356 413 H LEU 51 HN LEU 51 8.694 -0.087 -9.406 414 HA LEU 51 HA LEU 51 9.180 -0.081 -12.241 415 HB2 LEU 51 HB2 LEU 51 6.701 -0.053 -10.523 416 HB3 LEU 51 HB1 LEU 51 6.563 0.112 -12.272 417 HG LEU 51 HG LEU 51 6.371 -2.262 -11.329 418 HD11 LEU 51 HD11 LEU 51 7.495 -3.242 -13.204 419 HD12 LEU 51 HD12 LEU 51 8.609 -1.887 -13.337 420 HD13 LEU 51 HD13 LEU 51 6.905 -1.667 -13.728 421 HD21 LEU 51 HD21 LEU 51 9.385 -2.073 -11.130 422 HD22 LEU 51 HD22 LEU 51 8.343 -3.410 -10.636 423 HD23 LEU 51 HD23 LEU 51 8.328 -1.897 -9.728 424 H ARG 52 HN ARG 52 7.971 2.330 -10.010 425 HA ARG 52 HA ARG 52 7.152 4.276 -11.917 426 HB2 ARG 52 HB2 ARG 52 6.775 4.295 -9.387 427 HB3 ARG 52 HB1 ARG 52 8.429 4.884 -9.244 428 HG2 ARG 52 HG2 ARG 52 7.385 6.945 -9.391 429 HG3 ARG 52 HG1 ARG 52 7.534 6.631 -11.120 430 HD2 ARG 52 HD2 ARG 52 5.243 7.306 -10.622 431 HD3 ARG 52 HD1 ARG 52 5.257 5.603 -11.084 432 HE ARG 52 HE ARG 52 4.707 5.021 -8.838 433 HH11 ARG 52 HH21 ARG 52 5.427 8.384 -9.210 434 HH12 ARG 52 HH22 ARG 52 4.846 8.805 -7.634 435 HH21 ARG 52 HH11 ARG 52 3.952 5.566 -6.797 436 HH22 ARG 52 HH12 ARG 52 4.014 7.215 -6.271 437 H SER 53 HN SER 53 10.287 3.816 -10.297 438 HA SER 53 HA SER 53 11.623 6.071 -11.345 439 HB2 SER 53 HB2 SER 53 12.539 4.582 -9.569 440 HB3 SER 53 HB1 SER 53 12.818 3.340 -10.785 441 HG SER 53 HG SER 53 14.704 4.426 -10.684 442 H LYS 54 HN LYS 54 10.543 3.254 -12.971 443 HA LYS 54 HA LYS 54 12.418 3.693 -15.250 444 HB2 LYS 54 HB2 LYS 54 10.400 1.486 -14.746 445 HB3 LYS 54 HB1 LYS 54 11.546 1.549 -16.086 446 HG2 LYS 54 HG2 LYS 54 13.428 1.516 -14.516 447 HG3 LYS 54 HG1 LYS 54 12.314 1.520 -13.149 448 HD2 LYS 54 HD2 LYS 54 11.366 -0.637 -13.955 449 HD3 LYS 54 HD1 LYS 54 12.554 -0.647 -15.257 450 HE2 LYS 54 HE2 LYS 54 13.377 -2.023 -13.424 451 HE3 LYS 54 HE1 LYS 54 14.373 -0.574 -13.549 452 HZ1 LYS 54 HZ1 LYS 54 13.854 -0.852 -11.282 453 HZ2 LYS 54 HZ2 LYS 54 12.209 -1.130 -11.605 454 HZ3 LYS 54 HZ3 LYS 54 12.872 0.417 -11.828 455 H GLY 55 HN GLY 55 9.774 5.165 -14.294 456 HA2 GLY 55 HA2 GLY 55 8.160 6.441 -15.414 457 HA3 GLY 55 HA1 GLY 55 9.003 6.060 -16.914 458 H VAL 56 HN VAL 56 7.610 3.649 -14.722 459 HA VAL 56 HA VAL 56 6.173 2.404 -16.913 460 HB VAL 56 HB VAL 56 6.105 2.001 -13.915 461 HG11 VAL 56 HG11 VAL 56 3.933 1.325 -14.620 462 HG12 VAL 56 HG12 VAL 56 4.878 -0.165 -14.584 463 HG13 VAL 56 HG13 VAL 56 4.551 0.634 -16.121 464 HG21 VAL 56 HG21 VAL 56 8.009 1.266 -15.786 465 HG22 VAL 56 HG22 VAL 56 6.973 -0.162 -15.756 466 HG23 VAL 56 HG23 VAL 56 7.728 0.414 -14.270 467 H ASP 57 HN ASP 57 5.476 4.906 -14.688 468 HA ASP 57 HA ASP 57 3.599 6.241 -14.345 469 HB2 ASP 57 HB2 ASP 57 2.976 5.136 -17.093 470 HB3 ASP 57 HB1 ASP 57 1.999 6.365 -16.299 471 H LEU 58 HN LEU 58 2.499 5.428 -12.649 472 HA LEU 58 HA LEU 58 0.829 2.998 -12.930 473 HB2 LEU 58 HB2 LEU 58 1.114 4.765 -10.486 474 HB3 LEU 58 HB1 LEU 58 0.625 3.073 -10.548 475 HG LEU 58 HG LEU 58 3.370 4.000 -11.438 476 HD11 LEU 58 HD11 LEU 58 2.550 2.898 -8.746 477 HD12 LEU 58 HD12 LEU 58 2.961 4.583 -9.062 478 HD13 LEU 58 HD13 LEU 58 4.185 3.328 -9.252 479 HD21 LEU 58 HD21 LEU 58 2.142 1.321 -10.709 480 HD22 LEU 58 HD22 LEU 58 3.869 1.570 -10.957 481 HD23 LEU 58 HD23 LEU 58 2.744 1.819 -12.289 482 H ASN 59 HN ASN 59 0.507 6.236 -13.542 483 HA ASN 59 HA ASN 59 -1.989 6.948 -12.370 484 HB2 ASN 59 HB2 ASN 59 -0.929 7.782 -15.091 485 HB3 ASN 59 HB1 ASN 59 -2.121 8.651 -14.124 486 HD21 ASN 59 HD21 ASN 59 1.092 8.764 -14.929 487 HD22 ASN 59 HD22 ASN 59 1.711 9.494 -13.529 488 H ALA 60 HN ALA 60 -1.261 5.403 -15.491 489 HA ALA 60 HA ALA 60 -4.043 5.150 -16.265 490 HB1 ALA 60 HB1 ALA 60 -1.503 3.832 -17.242 491 HB2 ALA 60 HB2 ALA 60 -2.404 5.134 -18.017 492 HB3 ALA 60 HB3 ALA 60 -3.083 3.507 -17.953 493 H LEU 61 HN LEU 61 -1.701 3.063 -14.638 494 HA LEU 61 HA LEU 61 -3.190 0.638 -14.723 495 HB2 LEU 61 HB2 LEU 61 -0.731 1.182 -13.888 496 HB3 LEU 61 HB1 LEU 61 -1.515 1.341 -12.319 497 HG LEU 61 HG LEU 61 -1.671 -1.084 -14.130 498 HD11 LEU 61 HD11 LEU 61 0.522 -0.931 -13.128 499 HD12 LEU 61 HD12 LEU 61 -0.389 -2.162 -12.255 500 HD13 LEU 61 HD13 LEU 61 -0.174 -0.560 -11.549 501 HD21 LEU 61 HD21 LEU 61 -2.646 -2.058 -11.908 502 HD22 LEU 61 HD22 LEU 61 -3.696 -1.086 -12.934 503 HD23 LEU 61 HD23 LEU 61 -2.966 -0.371 -11.499 504 H PHE 62 HN PHE 62 -2.953 2.997 -12.060 505 HA PHE 62 HA PHE 62 -5.055 1.760 -10.514 506 HB2 PHE 62 HB2 PHE 62 -3.555 4.365 -10.372 507 HB3 PHE 62 HB1 PHE 62 -4.968 4.122 -9.347 508 HD1 PHE 62 HD1 PHE 62 -5.048 1.896 -7.997 509 HD2 PHE 62 HD2 PHE 62 -1.464 3.562 -9.667 510 HE1 PHE 62 HE1 PHE 62 -3.693 0.559 -6.411 511 HE2 PHE 62 HE2 PHE 62 -0.102 2.223 -8.084 512 HZ PHE 62 HZ PHE 62 -1.218 0.721 -6.453 513 H ASP 63 HN ASP 63 -4.986 4.446 -12.811 514 HA ASP 63 HA ASP 63 -7.572 5.490 -12.348 515 HB2 ASP 63 HB2 ASP 63 -5.815 5.286 -14.782 516 HB3 ASP 63 HB1 ASP 63 -7.452 5.900 -14.964 517 H ARG 64 HN ARG 64 -6.524 2.620 -14.079 518 HA ARG 64 HA ARG 64 -8.998 1.978 -15.351 519 HB2 ARG 64 HB2 ARG 64 -6.818 0.172 -14.273 520 HB3 ARG 64 HB1 ARG 64 -8.096 -0.334 -15.376 521 HG2 ARG 64 HG2 ARG 64 -6.721 2.065 -16.378 522 HG3 ARG 64 HG1 ARG 64 -5.592 0.740 -16.123 523 HD2 ARG 64 HD2 ARG 64 -8.169 0.476 -17.690 524 HD3 ARG 64 HD1 ARG 64 -6.596 0.803 -18.416 525 HE ARG 64 HE ARG 64 -5.845 -1.407 -17.703 526 HH11 ARG 64 HH21 ARG 64 -9.196 -0.735 -17.093 527 HH12 ARG 64 HH22 ARG 64 -9.611 -2.403 -16.899 528 HH21 ARG 64 HH11 ARG 64 -6.401 -3.563 -17.449 529 HH22 ARG 64 HH12 ARG 64 -8.043 -3.993 -17.099 530 H ILE 65 HN ILE 65 -7.658 0.855 -12.234 531 HA ILE 65 HA ILE 65 -10.020 -0.624 -11.499 532 HB ILE 65 HB ILE 65 -7.760 0.493 -9.812 533 HG12 ILE 65 HG12 ILE 65 -8.333 -2.359 -10.660 534 HG13 ILE 65 HG11 ILE 65 -7.279 -1.285 -11.578 535 HG21 ILE 65 HG21 ILE 65 -10.087 -1.322 -9.133 536 HG22 ILE 65 HG22 ILE 65 -9.611 0.173 -8.326 537 HG23 ILE 65 HG23 ILE 65 -8.614 -1.273 -8.164 538 HD11 ILE 65 HD11 ILE 65 -5.877 -2.576 -10.109 539 HD12 ILE 65 HD12 ILE 65 -6.904 -2.222 -8.721 540 HD13 ILE 65 HD13 ILE 65 -5.941 -0.940 -9.457 541 H ILE 66 HN ILE 66 -8.860 2.645 -10.703 542 HA ILE 66 HA ILE 66 -10.894 3.310 -8.843 543 HB ILE 66 HB ILE 66 -9.394 5.116 -10.764 544 HG12 ILE 66 HG12 ILE 66 -8.936 4.625 -7.808 545 HG13 ILE 66 HG11 ILE 66 -8.071 3.743 -9.068 546 HG21 ILE 66 HG21 ILE 66 -11.316 6.317 -10.026 547 HG22 ILE 66 HG22 ILE 66 -9.995 6.851 -8.986 548 HG23 ILE 66 HG23 ILE 66 -11.173 5.682 -8.387 549 HD11 ILE 66 HD11 ILE 66 -7.166 5.827 -9.960 550 HD12 ILE 66 HD12 ILE 66 -6.804 5.734 -8.236 551 HD13 ILE 66 HD13 ILE 66 -8.114 6.767 -8.808 552 H VAL 67 HN VAL 67 -12.995 3.658 -9.072 553 HA VAL 67 HA VAL 67 -14.183 3.754 -11.790 554 HB VAL 67 HB VAL 67 -16.313 3.335 -10.612 555 HG11 VAL 67 HG11 VAL 67 -15.704 1.092 -9.677 556 HG12 VAL 67 HG12 VAL 67 -14.005 1.544 -9.810 557 HG13 VAL 67 HG13 VAL 67 -14.995 1.404 -11.262 558 HG21 VAL 67 HG21 VAL 67 -15.968 4.517 -8.535 559 HG22 VAL 67 HG22 VAL 67 -14.551 3.539 -8.148 560 HG23 VAL 67 HG23 VAL 67 -16.158 2.811 -8.134 561 H ASN 68 HN ASN 68 -13.267 5.859 -9.293 562 HA ASN 68 HA ASN 68 -15.350 7.793 -9.380 563 HB2 ASN 68 HB2 ASN 68 -13.811 8.172 -7.664 564 HB3 ASN 68 HB1 ASN 68 -12.423 7.835 -8.685 565 HD21 ASN 68 HD21 ASN 68 -13.187 10.280 -6.959 566 HD22 ASN 68 HD22 ASN 68 -13.004 11.593 -8.016 567 H LYS 69 HN LYS 69 -12.437 7.401 -11.389 568 HA LYS 69 HA LYS 69 -11.857 8.345 -13.447 569 HB2 LYS 69 HB2 LYS 69 -13.820 6.996 -14.112 570 HB3 LYS 69 HB1 LYS 69 -14.864 8.388 -13.821 571 HG2 LYS 69 HG2 LYS 69 -13.651 9.678 -15.523 572 HG3 LYS 69 HG1 LYS 69 -12.550 8.325 -15.784 573 HD2 LYS 69 HD2 LYS 69 -14.449 6.919 -16.505 574 HD3 LYS 69 HD1 LYS 69 -15.544 8.280 -16.261 575 HE2 LYS 69 HE2 LYS 69 -14.313 9.589 -17.943 576 HE3 LYS 69 HE1 LYS 69 -13.194 8.246 -18.178 577 HZ1 LYS 69 HZ1 LYS 69 -14.818 6.951 -19.158 578 HZ2 LYS 69 HZ2 LYS 69 -15.176 8.496 -19.766 579 HZ3 LYS 69 HZ3 LYS 69 -16.097 7.847 -18.495 580 H LEU 70 HN LEU 70 -11.027 10.297 -13.592 581 HA LEU 70 HA LEU 70 -12.106 12.649 -12.375 582 HB2 LEU 70 HB2 LEU 70 -10.016 12.285 -14.539 583 HB3 LEU 70 HB1 LEU 70 -10.354 13.829 -13.757 584 HG LEU 70 HG LEU 70 -9.549 11.305 -12.277 585 HD11 LEU 70 HD11 LEU 70 -7.930 13.627 -13.326 586 HD12 LEU 70 HD12 LEU 70 -7.612 11.899 -13.488 587 HD13 LEU 70 HD13 LEU 70 -7.389 12.696 -11.930 588 HD21 LEU 70 HD21 LEU 70 -10.230 14.117 -11.455 589 HD22 LEU 70 HD22 LEU 70 -8.972 13.270 -10.553 590 HD23 LEU 70 HD23 LEU 70 -10.595 12.592 -10.646 591 H GLU 71 HN GLU 71 -12.264 11.363 -15.640 592 HA GLU 71 HA GLU 71 -13.684 11.889 -17.416 593 HB2 GLU 71 HB2 GLU 71 -15.390 11.906 -15.499 594 HB3 GLU 71 HB1 GLU 71 -15.223 13.658 -15.507 595 HG2 GLU 71 HG2 GLU 71 -16.763 13.745 -17.182 596 HG3 GLU 71 HG1 GLU 71 -15.589 12.960 -18.236 597 H HIS 72 HN HIS 72 -11.800 14.051 -15.777 598 HA HIS 72 HA HIS 72 -12.468 16.449 -17.310 599 HB2 HIS 72 HB2 HIS 72 -11.420 17.305 -15.469 600 HB3 HIS 72 HB1 HIS 72 -10.724 15.740 -15.066 601 HD2 HIS 72 HD2 HIS 72 -9.540 19.129 -16.384 602 HE1 HIS 72 HE1 HIS 72 -6.519 16.369 -17.438 603 HE2 HIS 72 HE2 HIS 72 -7.107 18.833 -17.282 604 H HIS 73 HN HIS 73 -11.366 17.242 -19.076 605 HA HIS 73 HA HIS 73 -8.972 15.912 -20.101 606 HB2 HIS 73 HB2 HIS 73 -9.862 15.030 -22.104 607 HB3 HIS 73 HB1 HIS 73 -11.022 14.535 -20.873 608 HD2 HIS 73 HD2 HIS 73 -13.602 15.149 -21.646 609 HE1 HIS 73 HE1 HIS 73 -12.731 18.399 -24.199 610 HE2 HIS 73 HE2 HIS 73 -14.585 16.942 -23.267 611 H HIS 74 HN HIS 74 -8.240 17.000 -22.129 612 HA HIS 74 HA HIS 74 -9.112 19.872 -22.198 613 HB2 HIS 74 HB2 HIS 74 -6.423 18.548 -22.549 614 HB3 HIS 74 HB1 HIS 74 -6.731 20.159 -23.195 615 HD2 HIS 74 HD2 HIS 74 -4.718 19.685 -20.510 616 HE1 HIS 74 HE1 HIS 74 -7.857 21.608 -18.440 617 HE2 HIS 74 HE2 HIS 74 -5.413 20.939 -18.330 618 H HIS 75 HN HIS 75 -10.325 20.214 -23.915 619 HA HIS 75 HA HIS 75 -11.301 19.906 -26.035 620 HB2 HIS 75 HB2 HIS 75 -8.367 20.079 -26.781 621 HB3 HIS 75 HB1 HIS 75 -9.728 20.402 -27.855 622 HD2 HIS 75 HD2 HIS 75 -11.452 22.215 -25.555 623 HE1 HIS 75 HE1 HIS 75 -8.093 24.761 -25.835 624 HE2 HIS 75 HE2 HIS 75 -10.509 24.600 -25.078 625 H HIS 76 HN HIS 76 -9.510 18.700 -28.225 626 HA HIS 76 HA HIS 76 -9.784 15.813 -27.490 627 HB2 HIS 76 HB2 HIS 76 -10.599 16.964 -30.165 628 HB3 HIS 76 HB1 HIS 76 -10.869 15.327 -29.571 629 HD2 HIS 76 HD2 HIS 76 -13.422 17.462 -30.309 630 HE1 HIS 76 HE1 HIS 76 -14.055 17.305 -26.137 631 HE2 HIS 76 HE2 HIS 76 -15.101 17.921 -28.364 632 H HIS 77 HN HIS 77 -8.476 14.420 -28.841 633 HA HIS 77 HA HIS 77 -5.814 15.027 -29.088 634 HB2 HIS 77 HB2 HIS 77 -5.720 13.291 -30.922 635 HB3 HIS 77 HB1 HIS 77 -6.581 12.775 -29.473 636 HD2 HIS 77 HD2 HIS 77 -7.489 11.382 -32.311 637 HE1 HIS 77 HE1 HIS 77 -10.840 13.944 -32.104 638 HE2 HIS 77 HE2 HIS 77 -9.898 11.854 -33.191 639 H1 MET 1 HT1 MET 1 -8.820 -7.991 -15.817 640 H2 MET 1 HT2 MET 1 -8.114 -8.854 -14.537 641 H3 MET 1 HT3 MET 1 -7.696 -9.220 -16.142 642 HA MET 1 HA MET 1 -5.944 -7.905 -15.823 643 HB2 MET 1 HB2 MET 1 -8.278 -6.020 -16.130 644 HB3 MET 1 HB1 MET 1 -6.650 -5.375 -15.922 645 HG2 MET 1 HG2 MET 1 -7.399 -5.726 -18.337 646 HG3 MET 1 HG1 MET 1 -5.863 -6.471 -17.897 647 HE1 MET 1 HE1 MET 1 -6.358 -7.779 -20.232 648 HE2 MET 1 HE2 MET 1 -6.531 -9.491 -19.857 649 HE3 MET 1 HE3 MET 1 -5.354 -8.517 -18.978 650 H GLU 2 HN GLU 2 -6.280 -8.959 -13.455 651 HA GLU 2 HA GLU 2 -6.795 -7.015 -11.344 652 HB2 GLU 2 HB2 GLU 2 -5.808 -9.857 -11.418 653 HB3 GLU 2 HB1 GLU 2 -5.703 -8.934 -9.922 654 HG2 GLU 2 HG2 GLU 2 -8.254 -9.328 -11.516 655 HG3 GLU 2 HG1 GLU 2 -7.802 -10.285 -10.106 656 H LEU 3 HN LEU 3 -5.090 -6.756 -9.599 657 HA LEU 3 HA LEU 3 -2.877 -5.307 -10.652 658 HB2 LEU 3 HB2 LEU 3 -3.580 -6.372 -7.917 659 HB3 LEU 3 HB1 LEU 3 -2.064 -5.511 -8.187 660 HG LEU 3 HG LEU 3 -4.668 -4.299 -9.113 661 HD11 LEU 3 HD11 LEU 3 -3.522 -4.185 -6.308 662 HD12 LEU 3 HD12 LEU 3 -5.097 -4.822 -6.783 663 HD13 LEU 3 HD13 LEU 3 -4.769 -3.094 -6.917 664 HD21 LEU 3 HD21 LEU 3 -3.380 -2.193 -8.610 665 HD22 LEU 3 HD22 LEU 3 -2.620 -3.193 -9.845 666 HD23 LEU 3 HD23 LEU 3 -1.988 -3.194 -8.200 667 H SER 4 HN SER 4 -3.103 -8.559 -9.264 668 HA SER 4 HA SER 4 -0.314 -9.162 -9.304 669 HB2 SER 4 HB2 SER 4 -1.054 -11.526 -9.221 670 HB3 SER 4 HB1 SER 4 -1.956 -10.530 -8.083 671 HG SER 4 HG SER 4 -3.212 -10.440 -10.413 672 H ASN 5 HN ASN 5 -2.853 -9.701 -11.731 673 HA ASN 5 HA ASN 5 -1.068 -10.956 -13.640 674 HB2 ASN 5 HB2 ASN 5 -3.382 -11.471 -13.874 675 HB3 ASN 5 HB1 ASN 5 -3.843 -9.772 -13.825 676 HD21 ASN 5 HD21 ASN 5 -4.423 -9.029 -15.862 677 HD22 ASN 5 HD22 ASN 5 -3.716 -9.523 -17.325 678 H GLU 6 HN GLU 6 -2.450 -7.683 -13.364 679 HA GLU 6 HA GLU 6 -1.172 -6.659 -15.720 680 HB2 GLU 6 HB2 GLU 6 -3.081 -5.517 -14.729 681 HB3 GLU 6 HB1 GLU 6 -2.179 -5.243 -13.239 682 HG2 GLU 6 HG2 GLU 6 -1.092 -3.416 -14.099 683 HG3 GLU 6 HG1 GLU 6 -0.740 -4.237 -15.615 684 H LEU 7 HN LEU 7 -0.259 -6.584 -12.298 685 HA LEU 7 HA LEU 7 2.077 -4.987 -12.572 686 HB2 LEU 7 HB2 LEU 7 1.019 -5.558 -10.393 687 HB3 LEU 7 HB1 LEU 7 1.539 -7.228 -10.596 688 HG LEU 7 HG LEU 7 3.910 -6.462 -10.656 689 HD11 LEU 7 HD11 LEU 7 4.153 -4.013 -9.685 690 HD12 LEU 7 HD12 LEU 7 2.561 -3.783 -10.406 691 HD13 LEU 7 HD13 LEU 7 3.926 -4.256 -11.415 692 HD21 LEU 7 HD21 LEU 7 4.082 -5.938 -8.270 693 HD22 LEU 7 HD22 LEU 7 2.839 -7.162 -8.522 694 HD23 LEU 7 HD23 LEU 7 2.379 -5.486 -8.224 695 H LYS 8 HN LYS 8 1.620 -8.496 -12.766 696 HA LYS 8 HA LYS 8 4.378 -9.159 -13.062 697 HB2 LYS 8 HB2 LYS 8 2.577 -10.816 -12.543 698 HB3 LYS 8 HB1 LYS 8 1.968 -10.622 -14.185 699 HG2 LYS 8 HG2 LYS 8 3.366 -12.606 -14.116 700 HG3 LYS 8 HG1 LYS 8 4.205 -11.370 -15.048 701 HD2 LYS 8 HD2 LYS 8 5.748 -10.929 -13.326 702 HD3 LYS 8 HD1 LYS 8 4.714 -11.637 -12.086 703 HE2 LYS 8 HE2 LYS 8 6.049 -13.180 -14.322 704 HE3 LYS 8 HE1 LYS 8 6.656 -13.078 -12.668 705 HZ1 LYS 8 HZ1 LYS 8 5.385 -15.061 -12.871 706 HZ2 LYS 8 HZ2 LYS 8 4.073 -14.232 -13.562 707 HZ3 LYS 8 HZ3 LYS 8 4.482 -13.975 -11.933 708 H VAL 9 HN VAL 9 1.857 -8.370 -15.401 709 HA VAL 9 HA VAL 9 3.284 -8.956 -17.785 710 HB VAL 9 HB VAL 9 1.121 -6.930 -17.163 711 HG11 VAL 9 HG11 VAL 9 2.159 -6.001 -19.078 712 HG12 VAL 9 HG12 VAL 9 0.838 -6.965 -19.733 713 HG13 VAL 9 HG13 VAL 9 2.488 -7.586 -19.776 714 HG21 VAL 9 HG21 VAL 9 0.756 -9.502 -17.101 715 HG22 VAL 9 HG22 VAL 9 0.926 -9.426 -18.855 716 HG23 VAL 9 HG23 VAL 9 -0.370 -8.537 -18.054 717 H GLU 10 HN GLU 10 3.136 -5.952 -15.885 718 HA GLU 10 HA GLU 10 4.768 -4.410 -17.647 719 HB2 GLU 10 HB2 GLU 10 4.024 -4.210 -14.742 720 HB3 GLU 10 HB1 GLU 10 5.239 -3.118 -15.397 721 HG2 GLU 10 HG2 GLU 10 3.321 -1.848 -15.766 722 HG3 GLU 10 HG1 GLU 10 3.381 -2.731 -17.287 723 H ARG 11 HN ARG 11 5.566 -6.581 -15.013 724 HA ARG 11 HA ARG 11 8.323 -5.931 -14.776 725 HB2 ARG 11 HB2 ARG 11 6.752 -7.631 -13.442 726 HB3 ARG 11 HB1 ARG 11 7.456 -8.799 -14.557 727 HG2 ARG 11 HG2 ARG 11 9.725 -7.556 -13.819 728 HG3 ARG 11 HG1 ARG 11 8.775 -7.225 -12.375 729 HD2 ARG 11 HD2 ARG 11 9.268 -9.966 -13.568 730 HD3 ARG 11 HD1 ARG 11 10.057 -9.312 -12.132 731 HE ARG 11 HE ARG 11 7.358 -9.107 -11.552 732 HH11 ARG 11 HH21 ARG 11 9.492 -11.624 -12.600 733 HH12 ARG 11 HH22 ARG 11 8.602 -12.876 -11.799 734 HH21 ARG 11 HH11 ARG 11 6.206 -10.732 -10.518 735 HH22 ARG 11 HH12 ARG 11 6.751 -12.371 -10.624 736 H ILE 12 HN ILE 12 6.659 -8.207 -16.930 737 HA ILE 12 HA ILE 12 9.035 -9.230 -18.187 738 HB ILE 12 HB ILE 12 6.116 -9.152 -18.955 739 HG12 ILE 12 HG12 ILE 12 6.612 -11.718 -18.910 740 HG13 ILE 12 HG11 ILE 12 8.084 -11.265 -18.053 741 HG21 ILE 12 HG21 ILE 12 6.834 -10.722 -20.869 742 HG22 ILE 12 HG22 ILE 12 8.449 -10.046 -20.651 743 HG23 ILE 12 HG23 ILE 12 7.108 -8.994 -21.100 744 HD11 ILE 12 HD11 ILE 12 5.275 -10.495 -17.226 745 HD12 ILE 12 HD12 ILE 12 6.754 -10.124 -16.341 746 HD13 ILE 12 HD13 ILE 12 6.220 -11.796 -16.505 747 H ARG 13 HN ARG 13 6.841 -6.563 -19.013 748 HA ARG 13 HA ARG 13 7.879 -5.837 -21.517 749 HB2 ARG 13 HB2 ARG 13 6.782 -4.262 -19.205 750 HB3 ARG 13 HB1 ARG 13 7.395 -3.405 -20.618 751 HG2 ARG 13 HG2 ARG 13 5.723 -4.235 -22.015 752 HG3 ARG 13 HG1 ARG 13 5.445 -5.664 -21.024 753 HD2 ARG 13 HD2 ARG 13 3.859 -4.596 -19.773 754 HD3 ARG 13 HD1 ARG 13 4.843 -3.147 -19.592 755 HE ARG 13 HE ARG 13 2.885 -3.672 -21.742 756 HH11 ARG 13 HH21 ARG 13 5.434 -1.721 -20.421 757 HH12 ARG 13 HH22 ARG 13 5.003 -0.322 -21.345 758 HH21 ARG 13 HH11 ARG 13 2.334 -1.855 -22.933 759 HH22 ARG 13 HH12 ARG 13 3.256 -0.399 -22.763 760 H LEU 14 HN LEU 14 9.064 -4.969 -18.282 761 HA LEU 14 HA LEU 14 11.529 -3.802 -19.499 762 HB2 LEU 14 HB2 LEU 14 10.686 -3.840 -16.583 763 HB3 LEU 14 HB1 LEU 14 11.938 -2.841 -17.320 764 HG LEU 14 HG LEU 14 8.970 -2.698 -17.914 765 HD11 LEU 14 HD11 LEU 14 9.875 -1.735 -15.714 766 HD12 LEU 14 HD12 LEU 14 8.986 -0.628 -16.756 767 HD13 LEU 14 HD13 LEU 14 10.744 -0.569 -16.713 768 HD21 LEU 14 HD21 LEU 14 10.001 -2.123 -19.950 769 HD22 LEU 14 HD22 LEU 14 11.384 -1.376 -19.152 770 HD23 LEU 14 HD23 LEU 14 9.821 -0.560 -19.156 771 H SER 15 HN SER 15 10.428 -6.742 -18.548 772 HA SER 15 HA SER 15 11.405 -8.681 -17.621 773 HB2 SER 15 HB2 SER 15 13.729 -7.684 -19.289 774 HB3 SER 15 HB1 SER 15 13.384 -9.356 -18.848 775 HG SER 15 HG SER 15 12.414 -9.232 -20.753 776 H LEU 16 HN LEU 16 11.498 -7.801 -15.435 777 HA LEU 16 HA LEU 16 14.264 -7.043 -14.541 778 HB2 LEU 16 HB2 LEU 16 11.697 -6.733 -12.972 779 HB3 LEU 16 HB1 LEU 16 13.262 -6.002 -12.636 780 HG LEU 16 HG LEU 16 11.586 -5.440 -15.096 781 HD11 LEU 16 HD11 LEU 16 12.010 -3.918 -12.514 782 HD12 LEU 16 HD12 LEU 16 10.482 -4.463 -13.205 783 HD13 LEU 16 HD13 LEU 16 11.383 -3.160 -13.979 784 HD21 LEU 16 HD21 LEU 16 13.868 -5.080 -15.665 785 HD22 LEU 16 HD22 LEU 16 14.240 -4.409 -14.076 786 HD23 LEU 16 HD23 LEU 16 13.264 -3.487 -15.220 787 H THR 17 HN THR 17 15.334 -8.383 -13.248 788 HA THR 17 HA THR 17 14.160 -11.005 -12.624 789 HB THR 17 HB THR 17 16.434 -11.582 -11.880 790 HG1 THR 17 HG1 THR 17 16.776 -9.340 -11.096 791 HG21 THR 17 HG21 THR 17 17.550 -11.332 -14.013 792 HG22 THR 17 HG22 THR 17 16.519 -9.967 -14.439 793 HG23 THR 17 HG23 THR 17 15.831 -11.586 -14.314 794 H ALA 18 HN ALA 18 14.067 -11.882 -10.513 795 HA ALA 18 HA ALA 18 13.125 -10.073 -8.491 796 HB1 ALA 18 HB1 ALA 18 13.177 -12.155 -7.040 797 HB2 ALA 18 HB2 ALA 18 13.887 -13.002 -8.413 798 HB3 ALA 18 HB3 ALA 18 12.262 -12.332 -8.539 799 H LYS 19 HN LYS 19 16.159 -11.751 -9.040 800 HA LYS 19 HA LYS 19 17.406 -11.160 -6.537 801 HB2 LYS 19 HB2 LYS 19 18.260 -12.808 -8.219 802 HB3 LYS 19 HB1 LYS 19 18.723 -11.458 -9.253 803 HG2 LYS 19 HG2 LYS 19 20.224 -10.603 -7.521 804 HG3 LYS 19 HG1 LYS 19 19.724 -11.891 -6.425 805 HD2 LYS 19 HD2 LYS 19 20.611 -13.577 -7.996 806 HD3 LYS 19 HD1 LYS 19 21.116 -12.289 -9.093 807 HE2 LYS 19 HE2 LYS 19 23.073 -12.803 -7.858 808 HE3 LYS 19 HE1 LYS 19 22.441 -11.350 -7.085 809 HZ1 LYS 19 HZ1 LYS 19 22.390 -14.130 -6.133 810 HZ2 LYS 19 HZ2 LYS 19 21.184 -13.050 -5.618 811 HZ3 LYS 19 HZ3 LYS 19 22.819 -12.718 -5.299 812 H SER 20 HN SER 20 17.310 -9.395 -9.616 813 HA SER 20 HA SER 20 19.094 -7.292 -8.905 814 HB2 SER 20 HB2 SER 20 16.671 -7.269 -10.731 815 HB3 SER 20 HB1 SER 20 17.870 -5.983 -10.661 816 HG SER 20 HG SER 20 18.299 -7.511 -12.323 817 H VAL 21 HN VAL 21 15.553 -7.530 -8.594 818 HA VAL 21 HA VAL 21 15.183 -4.963 -7.365 819 HB VAL 21 HB VAL 21 13.528 -7.495 -7.156 820 HG11 VAL 21 HG11 VAL 21 11.702 -5.740 -6.638 821 HG12 VAL 21 HG12 VAL 21 13.035 -4.646 -6.281 822 HG13 VAL 21 HG13 VAL 21 12.838 -6.129 -5.346 823 HG21 VAL 21 HG21 VAL 21 12.139 -6.406 -8.884 824 HG22 VAL 21 HG22 VAL 21 13.793 -6.628 -9.458 825 HG23 VAL 21 HG23 VAL 21 13.253 -5.038 -8.918 826 H ALA 22 HN ALA 22 15.603 -8.214 -5.992 827 HA ALA 22 HA ALA 22 15.363 -7.427 -3.243 828 HB1 ALA 22 HB1 ALA 22 16.620 -9.791 -4.644 829 HB2 ALA 22 HB2 ALA 22 15.162 -9.757 -3.654 830 HB3 ALA 22 HB3 ALA 22 16.749 -9.606 -2.895 831 H GLU 23 HN GLU 23 17.944 -7.214 -5.550 832 HA GLU 23 HA GLU 23 20.152 -7.015 -3.721 833 HB2 GLU 23 HB2 GLU 23 20.332 -7.377 -6.217 834 HB3 GLU 23 HB1 GLU 23 19.873 -5.688 -6.435 835 HG2 GLU 23 HG2 GLU 23 21.820 -4.990 -5.076 836 HG3 GLU 23 HG1 GLU 23 22.287 -6.680 -4.891 837 H GLU 24 HN GLU 24 18.070 -4.597 -5.255 838 HA GLU 24 HA GLU 24 19.366 -2.338 -3.943 839 HB2 GLU 24 HB2 GLU 24 16.559 -2.217 -5.036 840 HB3 GLU 24 HB1 GLU 24 17.825 -0.994 -5.094 841 HG2 GLU 24 HG2 GLU 24 17.807 -3.589 -6.652 842 HG3 GLU 24 HG1 GLU 24 17.457 -2.001 -7.311 843 H MET 25 HN MET 25 16.138 -3.818 -3.571 844 HA MET 25 HA MET 25 15.426 -2.335 -1.222 845 HB2 MET 25 HB2 MET 25 14.432 -4.941 -2.392 846 HB3 MET 25 HB1 MET 25 13.730 -4.231 -0.938 847 HG2 MET 25 HG2 MET 25 13.182 -2.186 -2.163 848 HG3 MET 25 HG1 MET 25 13.963 -2.819 -3.612 849 HE1 MET 25 HE1 MET 25 10.054 -4.020 -1.635 850 HE2 MET 25 HE2 MET 25 11.417 -3.121 -0.974 851 HE3 MET 25 HE3 MET 25 11.477 -4.880 -1.034 852 H GLY 26 HN GLY 26 16.912 -5.515 -1.682 853 HA2 GLY 26 HA2 GLY 26 18.397 -6.614 -0.193 854 HA3 GLY 26 HA1 GLY 26 18.057 -5.383 1.028 855 H ILE 27 HN ILE 27 15.887 -7.532 -0.790 856 HA ILE 27 HA ILE 27 14.921 -8.658 1.819 857 HB ILE 27 HB ILE 27 12.685 -8.836 0.755 858 HG12 ILE 27 HG12 ILE 27 13.840 -7.052 -1.410 859 HG13 ILE 27 HG11 ILE 27 13.612 -8.787 -1.620 860 HG21 ILE 27 HG21 ILE 27 13.205 -6.931 2.198 861 HG22 ILE 27 HG22 ILE 27 12.174 -6.410 0.866 862 HG23 ILE 27 HG23 ILE 27 13.902 -6.060 0.831 863 HD11 ILE 27 HD11 ILE 27 11.281 -7.169 -0.647 864 HD12 ILE 27 HD12 ILE 27 11.304 -8.626 -1.641 865 HD13 ILE 27 HD13 ILE 27 11.725 -7.070 -2.350 866 H SER 28 HN SER 28 13.937 -10.804 1.604 867 HA SER 28 HA SER 28 15.656 -12.608 0.181 868 HB2 SER 28 HB2 SER 28 14.419 -13.088 2.331 869 HB3 SER 28 HB1 SER 28 12.949 -13.237 1.374 870 HG SER 28 HG SER 28 15.282 -14.659 0.686 871 H ARG 29 HN ARG 29 15.178 -13.963 -1.567 872 HA ARG 29 HA ARG 29 13.721 -12.790 -3.728 873 HB2 ARG 29 HB2 ARG 29 14.544 -15.685 -3.379 874 HB3 ARG 29 HB1 ARG 29 14.175 -14.884 -4.905 875 HG2 ARG 29 HG2 ARG 29 16.056 -13.269 -4.406 876 HG3 ARG 29 HG1 ARG 29 16.496 -14.304 -3.046 877 HD2 ARG 29 HD2 ARG 29 16.711 -14.845 -5.991 878 HD3 ARG 29 HD1 ARG 29 17.860 -15.204 -4.705 879 HE ARG 29 HE ARG 29 15.779 -16.970 -5.646 880 HH11 ARG 29 HH21 ARG 29 17.483 -15.923 -2.817 881 HH12 ARG 29 HH22 ARG 29 17.258 -17.424 -1.985 882 HH21 ARG 29 HH11 ARG 29 15.487 -18.905 -4.566 883 HH22 ARG 29 HH12 ARG 29 16.131 -19.109 -2.971 884 H GLN 30 HN GLN 30 12.916 -15.307 -1.381 885 HA GLN 30 HA GLN 30 10.447 -16.150 -2.571 886 HB2 GLN 30 HB2 GLN 30 9.950 -17.144 -0.393 887 HB3 GLN 30 HB1 GLN 30 11.655 -17.400 -0.754 888 HG2 GLN 30 HG2 GLN 30 12.195 -15.369 0.618 889 HG3 GLN 30 HG1 GLN 30 10.496 -15.271 1.072 890 HE21 GLN 30 HE21 GLN 30 10.255 -18.288 1.129 891 HE22 GLN 30 HE22 GLN 30 11.016 -18.754 2.573 892 H GLN 31 HN GLN 31 11.279 -13.586 -0.305 893 HA GLN 31 HA GLN 31 8.652 -12.792 0.434 894 HB2 GLN 31 HB2 GLN 31 10.975 -11.997 1.330 895 HB3 GLN 31 HB1 GLN 31 10.904 -10.815 0.027 896 HG2 GLN 31 HG2 GLN 31 8.755 -11.186 2.136 897 HG3 GLN 31 HG1 GLN 31 9.995 -9.934 2.177 898 HE21 GLN 31 HE21 GLN 31 6.882 -9.966 1.668 899 HE22 GLN 31 HE22 GLN 31 6.721 -8.956 0.315 900 H LEU 32 HN LEU 32 10.693 -11.909 -2.315 901 HA LEU 32 HA LEU 32 8.956 -9.908 -3.395 902 HB2 LEU 32 HB2 LEU 32 11.408 -10.516 -4.061 903 HB3 LEU 32 HB1 LEU 32 10.656 -11.709 -5.121 904 HG LEU 32 HG LEU 32 9.234 -9.856 -6.072 905 HD11 LEU 32 HD11 LEU 32 9.185 -7.953 -4.835 906 HD12 LEU 32 HD12 LEU 32 10.727 -7.566 -5.587 907 HD13 LEU 32 HD13 LEU 32 10.688 -8.331 -4.002 908 HD21 LEU 32 HD21 LEU 32 12.246 -9.801 -6.319 909 HD22 LEU 32 HD22 LEU 32 11.206 -8.804 -7.336 910 HD23 LEU 32 HD23 LEU 32 11.077 -10.563 -7.399 911 H CYS 33 HN CYS 33 9.163 -13.398 -3.902 912 HA CYS 33 HA CYS 33 7.197 -13.581 -5.971 913 HB2 CYS 33 HB2 CYS 33 8.070 -15.593 -3.874 914 HB3 CYS 33 HB1 CYS 33 7.020 -15.983 -5.237 915 HG CYS 33 HG CYS 33 9.126 -15.016 -6.747 916 H ASN 34 HN ASN 34 6.948 -13.521 -2.455 917 HA ASN 34 HA ASN 34 4.207 -14.303 -2.222 918 HB2 ASN 34 HB2 ASN 34 6.024 -12.584 -0.528 919 HB3 ASN 34 HB1 ASN 34 4.332 -12.813 -0.090 920 HD21 ASN 34 HD21 ASN 34 5.348 -15.610 -1.670 921 HD22 ASN 34 HD22 ASN 34 5.767 -16.531 -0.308 922 H ILE 35 HN ILE 35 5.739 -11.152 -2.756 923 HA ILE 35 HA ILE 35 3.361 -9.569 -2.584 924 HB ILE 35 HB ILE 35 5.947 -9.129 -4.114 925 HG12 ILE 35 HG12 ILE 35 4.950 -7.852 -1.551 926 HG13 ILE 35 HG11 ILE 35 5.996 -9.269 -1.576 927 HG21 ILE 35 HG21 ILE 35 5.162 -6.692 -4.040 928 HG22 ILE 35 HG22 ILE 35 3.564 -7.324 -3.647 929 HG23 ILE 35 HG23 ILE 35 4.323 -7.741 -5.182 930 HD11 ILE 35 HD11 ILE 35 6.659 -6.597 -2.852 931 HD12 ILE 35 HD12 ILE 35 7.711 -8.010 -2.800 932 HD13 ILE 35 HD13 ILE 35 7.294 -7.169 -1.310 933 H GLU 36 HN GLU 36 4.978 -11.138 -5.315 934 HA GLU 36 HA GLU 36 3.148 -10.204 -7.327 935 HB2 GLU 36 HB2 GLU 36 5.520 -11.259 -7.591 936 HB3 GLU 36 HB1 GLU 36 4.678 -12.803 -7.501 937 HG2 GLU 36 HG2 GLU 36 4.861 -12.232 -9.831 938 HG3 GLU 36 HG1 GLU 36 3.177 -11.994 -9.370 939 H GLN 37 HN GLN 37 3.144 -12.950 -5.134 940 HA GLN 37 HA GLN 37 0.877 -14.247 -6.493 941 HB2 GLN 37 HB2 GLN 37 2.358 -14.839 -3.913 942 HB3 GLN 37 HB1 GLN 37 1.005 -15.809 -4.499 943 HG2 GLN 37 HG2 GLN 37 2.221 -16.292 -6.574 944 HG3 GLN 37 HG1 GLN 37 3.560 -15.276 -6.045 945 HE21 GLN 37 HE21 GLN 37 5.236 -16.687 -5.497 946 HE22 GLN 37 HE22 GLN 37 5.063 -18.066 -4.523 947 H SER 38 HN SER 38 1.130 -11.577 -4.588 948 HA SER 38 HA SER 38 -1.230 -12.088 -2.886 949 HB2 SER 38 HB2 SER 38 0.432 -9.584 -3.284 950 HB3 SER 38 HB1 SER 38 -0.838 -9.781 -2.080 951 HG SER 38 HG SER 38 1.614 -10.319 -1.693 952 H GLU 39 HN GLU 39 -3.199 -11.871 -3.713 953 HA GLU 39 HA GLU 39 -3.664 -10.168 -6.104 954 HB2 GLU 39 HB2 GLU 39 -5.360 -12.237 -4.675 955 HB3 GLU 39 HB1 GLU 39 -5.939 -11.284 -6.044 956 HG2 GLU 39 HG2 GLU 39 -4.124 -12.157 -7.446 957 HG3 GLU 39 HG1 GLU 39 -3.488 -13.072 -6.081 958 H THR 40 HN THR 40 -3.869 -9.994 -2.736 959 HA THR 40 HA THR 40 -6.051 -7.940 -2.829 960 HB THR 40 HB THR 40 -6.099 -8.221 -0.351 961 HG1 THR 40 HG1 THR 40 -4.094 -8.977 0.098 962 HG21 THR 40 HG21 THR 40 -7.702 -9.472 -1.603 963 HG22 THR 40 HG22 THR 40 -7.004 -10.599 -0.440 964 HG23 THR 40 HG23 THR 40 -6.485 -10.636 -2.125 965 H ALA 41 HN ALA 41 -5.610 -5.866 -2.366 966 HA ALA 41 HA ALA 41 -2.780 -5.125 -2.033 967 HB1 ALA 41 HB1 ALA 41 -3.812 -2.758 -2.307 968 HB2 ALA 41 HB2 ALA 41 -5.292 -3.618 -2.739 969 HB3 ALA 41 HB3 ALA 41 -3.832 -3.840 -3.702 970 HA PRO 42 HA PRO 42 -3.207 -4.229 2.303 971 HB2 PRO 42 HB2 PRO 42 -1.258 -2.342 2.624 972 HB3 PRO 42 HB1 PRO 42 -0.902 -4.052 2.321 973 HG2 PRO 42 HG2 PRO 42 -0.937 -1.766 0.394 974 HG3 PRO 42 HG1 PRO 42 0.244 -3.080 0.561 975 HD2 PRO 42 HD2 PRO 42 -1.707 -3.115 -1.342 976 HD3 PRO 42 HD1 PRO 42 -1.076 -4.598 -0.592 977 H VAL 43 HN VAL 43 -3.807 -2.576 3.832 978 HA VAL 43 HA VAL 43 -5.810 -0.763 2.891 979 HB VAL 43 HB VAL 43 -5.894 0.025 5.220 980 HG11 VAL 43 HG11 VAL 43 -6.259 -2.170 6.311 981 HG12 VAL 43 HG12 VAL 43 -5.424 -2.960 4.974 982 HG13 VAL 43 HG13 VAL 43 -6.949 -2.121 4.689 983 HG21 VAL 43 HG21 VAL 43 -4.253 -0.959 6.860 984 HG22 VAL 43 HG22 VAL 43 -3.522 0.183 5.732 985 HG23 VAL 43 HG23 VAL 43 -3.311 -1.552 5.493 986 H VAL 44 HN VAL 44 -2.400 -0.338 3.663 987 HA VAL 44 HA VAL 44 -2.363 2.516 3.770 988 HB VAL 44 HB VAL 44 -0.245 0.518 2.930 989 HG11 VAL 44 HG11 VAL 44 0.458 2.573 1.967 990 HG12 VAL 44 HG12 VAL 44 1.312 2.484 3.508 991 HG13 VAL 44 HG13 VAL 44 -0.116 3.508 3.347 992 HG21 VAL 44 HG21 VAL 44 -0.539 2.105 5.493 993 HG22 VAL 44 HG22 VAL 44 0.583 0.781 5.178 994 HG23 VAL 44 HG23 VAL 44 -1.147 0.463 5.296 995 H VAL 45 HN VAL 45 -1.755 0.293 1.052 996 HA VAL 45 HA VAL 45 -1.384 2.368 -0.905 997 HB VAL 45 HB VAL 45 -2.174 -0.545 -1.172 998 HG11 VAL 45 HG11 VAL 45 -1.359 -0.158 -3.582 999 HG12 VAL 45 HG12 VAL 45 -1.570 1.563 -3.254 1000 HG13 VAL 45 HG13 VAL 45 -2.955 0.473 -3.175 1001 HG21 VAL 45 HG21 VAL 45 0.452 0.770 -1.891 1002 HG22 VAL 45 HG22 VAL 45 0.126 -0.940 -1.613 1003 HG23 VAL 45 HG23 VAL 45 0.137 0.188 -0.258 1004 H LYS 46 HN LYS 46 -4.194 0.424 0.048 1005 HA LYS 46 HA LYS 46 -6.012 1.460 -1.891 1006 HB2 LYS 46 HB2 LYS 46 -6.279 -0.540 -0.219 1007 HB3 LYS 46 HB1 LYS 46 -6.873 0.685 0.901 1008 HG2 LYS 46 HG2 LYS 46 -8.626 1.332 -0.660 1009 HG3 LYS 46 HG1 LYS 46 -7.991 0.230 -1.882 1010 HD2 LYS 46 HD2 LYS 46 -8.419 -1.677 -0.343 1011 HD3 LYS 46 HD1 LYS 46 -9.133 -0.555 0.815 1012 HE2 LYS 46 HE2 LYS 46 -10.825 0.101 -0.853 1013 HE3 LYS 46 HE1 LYS 46 -10.106 -1.010 -2.020 1014 HZ1 LYS 46 HZ1 LYS 46 -10.639 -2.310 0.449 1015 HZ2 LYS 46 HZ2 LYS 46 -11.173 -2.707 -1.114 1016 HZ3 LYS 46 HZ3 LYS 46 -12.049 -1.600 -0.170 1017 H TYR 47 HN TYR 47 -5.117 2.556 1.341 1018 HA TYR 47 HA TYR 47 -7.042 4.647 1.593 1019 HB2 TYR 47 HB2 TYR 47 -5.790 3.953 3.541 1020 HB3 TYR 47 HB1 TYR 47 -4.257 4.328 2.754 1021 HD1 TYR 47 HD1 TYR 47 -7.462 5.891 3.887 1022 HD2 TYR 47 HD2 TYR 47 -3.315 6.484 2.935 1023 HE1 TYR 47 HE1 TYR 47 -7.603 8.231 4.696 1024 HE2 TYR 47 HE2 TYR 47 -3.464 8.819 3.750 1025 HH TYR 47 HH TYR 47 -5.212 10.538 4.067 1026 H ILE 48 HN ILE 48 -3.774 4.605 0.219 1027 HA ILE 48 HA ILE 48 -3.582 7.398 -0.348 1028 HB ILE 48 HB ILE 48 -2.342 4.991 -1.725 1029 HG12 ILE 48 HG12 ILE 48 -1.110 7.011 0.172 1030 HG13 ILE 48 HG11 ILE 48 -1.757 5.458 0.698 1031 HG21 ILE 48 HG21 ILE 48 -0.687 6.712 -2.576 1032 HG22 ILE 48 HG22 ILE 48 -1.829 7.953 -2.065 1033 HG23 ILE 48 HG23 ILE 48 -2.285 6.796 -3.314 1034 HD11 ILE 48 HD11 ILE 48 -0.198 4.378 -1.013 1035 HD12 ILE 48 HD12 ILE 48 0.596 5.124 0.373 1036 HD13 ILE 48 HD13 ILE 48 0.566 5.956 -1.181 1037 H ALA 49 HN ALA 49 -4.806 4.671 -2.243 1038 HA ALA 49 HA ALA 49 -5.385 6.065 -4.652 1039 HB1 ALA 49 HB1 ALA 49 -7.087 4.217 -4.994 1040 HB2 ALA 49 HB2 ALA 49 -6.707 3.663 -3.364 1041 HB3 ALA 49 HB3 ALA 49 -5.461 3.646 -4.609 1042 H PHE 50 HN PHE 50 -7.196 5.723 -1.653 1043 HA PHE 50 HA PHE 50 -9.682 6.811 -2.551 1044 HB2 PHE 50 HB2 PHE 50 -9.222 5.639 -0.332 1045 HB3 PHE 50 HB1 PHE 50 -8.508 7.153 0.218 1046 HD1 PHE 50 HD2 PHE 50 -11.627 5.793 -1.353 1047 HD2 PHE 50 HD1 PHE 50 -9.891 8.809 1.168 1048 HE1 PHE 50 HE2 PHE 50 -13.892 6.653 -0.822 1049 HE2 PHE 50 HE1 PHE 50 -12.157 9.668 1.698 1050 HZ PHE 50 HZ PHE 50 -14.156 8.590 0.703 1051 H LEU 51 HN LEU 51 -6.747 8.326 -1.251 1052 HA LEU 51 HA LEU 51 -7.723 11.004 -1.085 1053 HB2 LEU 51 HB2 LEU 51 -4.938 9.971 -1.719 1054 HB3 LEU 51 HB1 LEU 51 -5.302 11.655 -1.347 1055 HG LEU 51 HG LEU 51 -5.871 9.310 0.493 1056 HD11 LEU 51 HD11 LEU 51 -3.953 9.943 1.754 1057 HD12 LEU 51 HD12 LEU 51 -3.772 11.457 0.869 1058 HD13 LEU 51 HD13 LEU 51 -3.413 9.921 0.075 1059 HD21 LEU 51 HD21 LEU 51 -7.393 10.932 1.188 1060 HD22 LEU 51 HD22 LEU 51 -6.387 12.271 0.635 1061 HD23 LEU 51 HD23 LEU 51 -5.982 11.418 2.126 1062 H ARG 52 HN ARG 52 -6.291 9.197 -3.774 1063 HA ARG 52 HA ARG 52 -6.212 11.355 -5.623 1064 HB2 ARG 52 HB2 ARG 52 -5.075 9.327 -6.225 1065 HB3 ARG 52 HB1 ARG 52 -6.533 8.363 -6.007 1066 HG2 ARG 52 HG2 ARG 52 -6.019 8.745 -8.408 1067 HG3 ARG 52 HG1 ARG 52 -7.567 9.463 -7.968 1068 HD2 ARG 52 HD2 ARG 52 -6.547 11.662 -7.775 1069 HD3 ARG 52 HD1 ARG 52 -4.944 10.980 -8.053 1070 HE ARG 52 HE ARG 52 -7.111 11.186 -10.088 1071 HH11 ARG 52 HH21 ARG 52 -3.802 10.656 -9.215 1072 HH12 ARG 52 HH22 ARG 52 -3.248 10.705 -10.851 1073 HH21 ARG 52 HH11 ARG 52 -6.387 11.242 -12.195 1074 HH22 ARG 52 HH12 ARG 52 -4.701 11.035 -12.531 1075 H SER 53 HN SER 53 -8.788 9.164 -4.650 1076 HA SER 53 HA SER 53 -10.705 9.722 -6.648 1077 HB2 SER 53 HB2 SER 53 -10.808 8.057 -4.657 1078 HB3 SER 53 HB1 SER 53 -11.430 9.417 -3.730 1079 HG SER 53 HG SER 53 -13.150 9.558 -5.128 1080 H LYS 54 HN LYS 54 -9.465 11.696 -4.109 1081 HA LYS 54 HA LYS 54 -11.656 13.699 -4.410 1082 HB2 LYS 54 HB2 LYS 54 -9.290 13.681 -2.513 1083 HB3 LYS 54 HB1 LYS 54 -10.674 14.768 -2.446 1084 HG2 LYS 54 HG2 LYS 54 -10.826 11.754 -2.152 1085 HG3 LYS 54 HG1 LYS 54 -10.851 12.897 -0.811 1086 HD2 LYS 54 HD2 LYS 54 -12.857 13.989 -2.054 1087 HD3 LYS 54 HD1 LYS 54 -12.926 12.479 -2.962 1088 HE2 LYS 54 HE2 LYS 54 -13.019 12.680 0.055 1089 HE3 LYS 54 HE1 LYS 54 -14.420 12.442 -0.988 1090 HZ1 LYS 54 HZ1 LYS 54 -13.515 10.385 -1.760 1091 HZ2 LYS 54 HZ2 LYS 54 -13.521 10.360 -0.061 1092 HZ3 LYS 54 HZ3 LYS 54 -12.071 10.631 -0.904 1093 H GLY 55 HN GLY 55 -8.747 12.913 -5.794 1094 HA2 GLY 55 HA2 GLY 55 -7.530 14.092 -7.432 1095 HA3 GLY 55 HA1 GLY 55 -8.542 15.505 -7.126 1096 H VAL 56 HN VAL 56 -6.636 13.708 -4.735 1097 HA VAL 56 HA VAL 56 -5.461 16.158 -3.714 1098 HB VAL 56 HB VAL 56 -4.902 13.226 -3.187 1099 HG11 VAL 56 HG11 VAL 56 -3.657 14.249 -1.132 1100 HG12 VAL 56 HG12 VAL 56 -3.568 15.709 -2.120 1101 HG13 VAL 56 HG13 VAL 56 -2.825 14.217 -2.690 1102 HG21 VAL 56 HG21 VAL 56 -6.999 13.896 -2.280 1103 HG22 VAL 56 HG22 VAL 56 -6.353 15.440 -1.721 1104 HG23 VAL 56 HG23 VAL 56 -5.870 13.940 -0.927 1105 H ASP 57 HN ASP 57 -4.651 13.953 -6.196 1106 HA ASP 57 HA ASP 57 -2.853 13.836 -7.682 1107 HB2 ASP 57 HB2 ASP 57 -2.412 16.664 -6.667 1108 HB3 ASP 57 HB1 ASP 57 -1.609 15.956 -8.063 1109 H LEU 58 HN LEU 58 -2.107 12.277 -5.856 1110 HA LEU 58 HA LEU 58 0.140 13.209 -4.234 1111 HB2 LEU 58 HB2 LEU 58 0.346 10.879 -3.532 1112 HB3 LEU 58 HB1 LEU 58 -1.337 11.385 -3.446 1113 HG LEU 58 HG LEU 58 -0.810 10.283 -6.101 1114 HD11 LEU 58 HD11 LEU 58 0.028 8.582 -3.745 1115 HD12 LEU 58 HD12 LEU 58 0.945 8.928 -5.208 1116 HD13 LEU 58 HD13 LEU 58 -0.475 7.886 -5.285 1117 HD21 LEU 58 HD21 LEU 58 -3.029 10.433 -5.076 1118 HD22 LEU 58 HD22 LEU 58 -2.527 9.352 -3.780 1119 HD23 LEU 58 HD23 LEU 58 -2.653 8.745 -5.431 1120 H ASN 59 HN ASN 59 -0.120 12.843 -7.414 1121 HA ASN 59 HA ASN 59 2.024 11.134 -8.215 1122 HB2 ASN 59 HB2 ASN 59 1.173 13.716 -9.565 1123 HB3 ASN 59 HB1 ASN 59 1.933 12.319 -10.327 1124 HD21 ASN 59 HD21 ASN 59 -1.095 13.734 -9.520 1125 HD22 ASN 59 HD22 ASN 59 -2.073 12.398 -9.896 1126 H ALA 60 HN ALA 60 1.913 14.577 -7.385 1127 HA ALA 60 HA ALA 60 4.775 14.965 -7.828 1128 HB1 ALA 60 HB1 ALA 60 2.863 16.727 -7.990 1129 HB2 ALA 60 HB2 ALA 60 4.385 17.224 -7.249 1130 HB3 ALA 60 HB3 ALA 60 2.997 16.816 -6.237 1131 H LEU 61 HN LEU 61 2.737 13.959 -5.222 1132 HA LEU 61 HA LEU 61 4.390 14.712 -3.023 1133 HB2 LEU 61 HB2 LEU 61 2.075 13.930 -2.704 1134 HB3 LEU 61 HB1 LEU 61 2.515 12.339 -3.320 1135 HG LEU 61 HG LEU 61 4.060 12.009 -1.433 1136 HD11 LEU 61 HD11 LEU 61 4.909 14.100 -0.852 1137 HD12 LEU 61 HD12 LEU 61 3.765 13.826 0.461 1138 HD13 LEU 61 HD13 LEU 61 3.327 14.876 -0.887 1139 HD21 LEU 61 HD21 LEU 61 2.345 12.089 0.436 1140 HD22 LEU 61 HD22 LEU 61 1.821 11.249 -1.023 1141 HD23 LEU 61 HD23 LEU 61 1.256 12.888 -0.697 1142 H PHE 62 HN PHE 62 4.207 11.656 -4.846 1143 HA PHE 62 HA PHE 62 6.450 10.492 -3.419 1144 HB2 PHE 62 HB2 PHE 62 4.696 9.731 -5.717 1145 HB3 PHE 62 HB1 PHE 62 6.286 8.967 -5.677 1146 HD1 PHE 62 HD2 PHE 62 3.409 9.772 -3.382 1147 HD2 PHE 62 HD1 PHE 62 6.554 7.021 -4.402 1148 HE1 PHE 62 HE2 PHE 62 2.639 8.225 -1.603 1149 HE2 PHE 62 HE1 PHE 62 5.780 5.479 -2.623 1150 HZ PHE 62 HZ PHE 62 3.823 6.079 -1.225 1151 H ASP 63 HN ASP 63 6.106 12.107 -6.594 1152 HA ASP 63 HA ASP 63 8.811 11.749 -7.448 1153 HB2 ASP 63 HB2 ASP 63 6.929 14.063 -7.965 1154 HB3 ASP 63 HB1 ASP 63 8.413 13.750 -8.860 1155 H ARG 64 HN ARG 64 7.411 13.657 -4.974 1156 HA ARG 64 HA ARG 64 9.392 15.726 -4.758 1157 HB2 ARG 64 HB2 ARG 64 7.050 15.436 -3.589 1158 HB3 ARG 64 HB1 ARG 64 7.965 14.576 -2.367 1159 HG2 ARG 64 HG2 ARG 64 7.913 16.844 -1.620 1160 HG3 ARG 64 HG1 ARG 64 9.528 16.584 -2.267 1161 HD2 ARG 64 HD2 ARG 64 8.159 18.754 -2.939 1162 HD3 ARG 64 HD1 ARG 64 9.155 17.928 -4.133 1163 HE ARG 64 HE ARG 64 7.180 17.464 -5.313 1164 HH11 ARG 64 HH21 ARG 64 6.515 17.881 -1.941 1165 HH12 ARG 64 HH22 ARG 64 4.804 17.696 -2.129 1166 HH21 ARG 64 HH11 ARG 64 4.969 17.197 -5.552 1167 HH22 ARG 64 HH12 ARG 64 3.929 17.314 -4.173 1168 H ILE 65 HN ILE 65 9.038 12.536 -3.304 1169 HA ILE 65 HA ILE 65 11.579 12.790 -1.843 1170 HB ILE 65 HB ILE 65 9.585 10.520 -2.109 1171 HG12 ILE 65 HG12 ILE 65 10.279 12.261 0.272 1172 HG13 ILE 65 HG11 ILE 65 8.929 12.592 -0.811 1173 HG21 ILE 65 HG21 ILE 65 12.198 10.743 -0.607 1174 HG22 ILE 65 HG22 ILE 65 11.671 9.463 -1.700 1175 HG23 ILE 65 HG23 ILE 65 10.932 9.620 -0.108 1176 HD11 ILE 65 HD11 ILE 65 9.303 10.016 0.748 1177 HD12 ILE 65 HD12 ILE 65 7.923 10.426 -0.271 1178 HD13 ILE 65 HD13 ILE 65 8.221 11.329 1.213 1179 H ILE 66 HN ILE 66 10.278 10.721 -4.459 1180 HA ILE 66 HA ILE 66 12.360 9.026 -4.984 1181 HB ILE 66 HB ILE 66 10.787 10.602 -7.030 1182 HG12 ILE 66 HG12 ILE 66 10.472 7.741 -6.069 1183 HG13 ILE 66 HG11 ILE 66 9.556 9.090 -5.400 1184 HG21 ILE 66 HG21 ILE 66 11.430 8.600 -8.502 1185 HG22 ILE 66 HG22 ILE 66 12.681 8.265 -7.307 1186 HG23 ILE 66 HG23 ILE 66 12.695 9.789 -8.194 1187 HD11 ILE 66 HD11 ILE 66 8.422 9.483 -7.441 1188 HD12 ILE 66 HD12 ILE 66 8.446 7.728 -7.296 1189 HD13 ILE 66 HD13 ILE 66 9.586 8.539 -8.369 1190 H VAL 67 HN VAL 67 14.451 9.213 -5.303 1191 HA VAL 67 HA VAL 67 15.763 11.763 -5.545 1192 HB VAL 67 HB VAL 67 17.838 10.396 -5.736 1193 HG11 VAL 67 HG11 VAL 67 15.844 9.574 -3.605 1194 HG12 VAL 67 HG12 VAL 67 16.991 10.912 -3.520 1195 HG13 VAL 67 HG13 VAL 67 17.576 9.247 -3.525 1196 HG21 VAL 67 HG21 VAL 67 16.894 8.531 -7.054 1197 HG22 VAL 67 HG22 VAL 67 15.883 8.070 -5.683 1198 HG23 VAL 67 HG23 VAL 67 17.638 7.935 -5.570 1199 H ASN 68 HN ASN 68 17.495 12.069 -7.198 1200 HA ASN 68 HA ASN 68 18.077 12.612 -9.357 1201 HB2 ASN 68 HB2 ASN 68 18.259 10.863 -10.903 1202 HB3 ASN 68 HB1 ASN 68 18.307 10.047 -9.344 1203 HD21 ASN 68 HD21 ASN 68 15.673 11.180 -11.561 1204 HD22 ASN 68 HD22 ASN 68 14.807 9.721 -11.494 1205 H LYS 69 HN LYS 69 17.302 13.833 -10.950 1206 HA LYS 69 HA LYS 69 14.378 14.239 -11.063 1207 HB2 LYS 69 HB2 LYS 69 16.710 15.773 -12.233 1208 HB3 LYS 69 HB1 LYS 69 15.022 16.221 -12.480 1209 HG2 LYS 69 HG2 LYS 69 14.757 16.279 -9.972 1210 HG3 LYS 69 HG1 LYS 69 16.502 16.067 -9.840 1211 HD2 LYS 69 HD2 LYS 69 15.117 18.324 -11.327 1212 HD3 LYS 69 HD1 LYS 69 15.855 18.467 -9.732 1213 HE2 LYS 69 HE2 LYS 69 17.184 18.073 -12.402 1214 HE3 LYS 69 HE1 LYS 69 17.572 19.232 -11.129 1215 HZ1 LYS 69 HZ1 LYS 69 18.190 17.242 -9.746 1216 HZ2 LYS 69 HZ2 LYS 69 19.228 17.589 -11.046 1217 HZ3 LYS 69 HZ3 LYS 69 18.104 16.321 -11.167 1218 H LEU 70 HN LEU 70 13.254 13.112 -12.492 1219 HA LEU 70 HA LEU 70 14.459 11.739 -14.742 1220 HB2 LEU 70 HB2 LEU 70 11.555 12.193 -14.007 1221 HB3 LEU 70 HB1 LEU 70 12.119 11.075 -15.250 1222 HG LEU 70 HG LEU 70 12.907 10.948 -12.322 1223 HD11 LEU 70 HD11 LEU 70 11.090 9.052 -13.822 1224 HD12 LEU 70 HD12 LEU 70 10.472 10.417 -12.892 1225 HD13 LEU 70 HD13 LEU 70 11.374 9.134 -12.085 1226 HD21 LEU 70 HD21 LEU 70 13.633 9.359 -14.776 1227 HD22 LEU 70 HD22 LEU 70 13.542 8.528 -13.222 1228 HD23 LEU 70 HD23 LEU 70 14.657 9.874 -13.435 1229 H GLU 71 HN GLU 71 14.248 12.180 -16.914 1230 HA GLU 71 HA GLU 71 14.299 14.872 -17.755 1231 HB2 GLU 71 HB2 GLU 71 13.577 12.400 -19.369 1232 HB3 GLU 71 HB1 GLU 71 14.061 13.955 -20.050 1233 HG2 GLU 71 HG2 GLU 71 16.234 13.791 -18.877 1234 HG3 GLU 71 HG1 GLU 71 15.753 12.233 -18.207 1235 H HIS 72 HN HIS 72 12.673 16.300 -17.655 1236 HA HIS 72 HA HIS 72 10.081 15.638 -18.799 1237 HB2 HIS 72 HB2 HIS 72 10.097 14.881 -16.292 1238 HB3 HIS 72 HB1 HIS 72 10.002 16.606 -15.943 1239 HD2 HIS 72 HD2 HIS 72 7.975 14.939 -18.928 1240 HE1 HIS 72 HE1 HIS 72 5.229 16.423 -16.101 1241 HE2 HIS 72 HE2 HIS 72 5.480 15.381 -18.396 1242 H HIS 73 HN HIS 73 10.599 17.328 -20.208 1243 HA HIS 73 HA HIS 73 9.937 19.997 -19.182 1244 HB2 HIS 73 HB2 HIS 73 12.661 19.260 -19.388 1245 HB3 HIS 73 HB1 HIS 73 12.363 20.252 -20.812 1246 HD2 HIS 73 HD2 HIS 73 12.786 20.678 -16.990 1247 HE1 HIS 73 HE1 HIS 73 11.511 24.406 -18.511 1248 HE2 HIS 73 HE2 HIS 73 12.408 23.204 -16.464 1249 H HIS 74 HN HIS 74 10.625 21.507 -21.351 1250 HA HIS 74 HA HIS 74 10.053 20.291 -23.890 1251 HB2 HIS 74 HB2 HIS 74 7.785 21.354 -24.203 1252 HB3 HIS 74 HB1 HIS 74 7.809 20.004 -23.069 1253 HD2 HIS 74 HD2 HIS 74 9.273 22.906 -21.168 1254 HE1 HIS 74 HE1 HIS 74 5.114 23.173 -20.497 1255 HE2 HIS 74 HE2 HIS 74 7.386 24.002 -19.740 1256 H HIS 75 HN HIS 75 11.927 21.665 -24.199 1257 HA HIS 75 HA HIS 75 13.043 23.664 -24.713 1258 HB2 HIS 75 HB2 HIS 75 11.580 23.244 -26.698 1259 HB3 HIS 75 HB1 HIS 75 10.367 24.309 -25.986 1260 HD2 HIS 75 HD2 HIS 75 13.773 25.811 -25.247 1261 HE1 HIS 75 HE1 HIS 75 12.553 27.575 -28.883 1262 HE2 HIS 75 HE2 HIS 75 14.225 27.703 -26.980 1263 H HIS 76 HN HIS 76 13.321 24.574 -22.675 1264 HA HIS 76 HA HIS 76 11.566 25.841 -20.979 1265 HB2 HIS 76 HB2 HIS 76 14.242 27.071 -21.673 1266 HB3 HIS 76 HB1 HIS 76 13.400 27.117 -20.125 1267 HD2 HIS 76 HD2 HIS 76 14.154 25.073 -18.414 1268 HE1 HIS 76 HE1 HIS 76 15.962 22.547 -21.275 1269 HE2 HIS 76 HE2 HIS 76 15.502 22.872 -18.802 1270 H HIS 77 HN HIS 77 9.868 26.873 -22.050 1271 HA HIS 77 HA HIS 77 10.461 29.625 -22.956 1272 HB2 HIS 77 HB2 HIS 77 10.509 28.548 -25.085 1273 HB3 HIS 77 HB1 HIS 77 9.141 27.515 -24.677 1274 HD2 HIS 77 HD2 HIS 77 9.713 30.725 -26.586 1275 HE1 HIS 77 HE1 HIS 77 5.713 30.955 -25.249 1276 HE2 HIS 77 HE2 HIS 77 7.435 31.978 -26.807 Start of MODEL 17 1 H1 MET 1 HT1 MET 1 9.803 14.932 10.778 2 H2 MET 1 HT2 MET 1 8.500 13.860 10.971 3 H3 MET 1 HT3 MET 1 8.271 15.528 11.194 4 HA MET 1 HA MET 1 7.400 15.221 9.102 5 HB2 MET 1 HB2 MET 1 9.373 16.885 9.260 6 HB3 MET 1 HB1 MET 1 10.309 15.659 8.405 7 HG2 MET 1 HG2 MET 1 9.416 17.128 6.731 8 HG3 MET 1 HG1 MET 1 8.474 15.641 6.650 9 HE1 MET 1 HE1 MET 1 8.157 19.124 6.188 10 HE2 MET 1 HE2 MET 1 8.668 19.300 7.865 11 HE3 MET 1 HE3 MET 1 7.056 19.824 7.384 12 H GLU 2 HN GLU 2 7.757 12.644 9.958 13 HA GLU 2 HA GLU 2 9.373 11.147 8.014 14 HB2 GLU 2 HB2 GLU 2 7.472 10.259 10.202 15 HB3 GLU 2 HB1 GLU 2 8.380 9.146 9.176 16 HG2 GLU 2 HG2 GLU 2 10.491 10.334 9.915 17 HG3 GLU 2 HG1 GLU 2 9.506 11.209 11.085 18 H LEU 3 HN LEU 3 7.877 9.020 7.321 19 HA LEU 3 HA LEU 3 6.351 9.969 5.129 20 HB2 LEU 3 HB2 LEU 3 7.420 7.579 5.711 21 HB3 LEU 3 HB1 LEU 3 5.794 7.240 6.292 22 HG LEU 3 HG LEU 3 5.925 6.560 3.966 23 HD11 LEU 3 HD11 LEU 3 3.876 7.861 4.867 24 HD12 LEU 3 HD12 LEU 3 4.035 7.708 3.117 25 HD13 LEU 3 HD13 LEU 3 4.488 9.215 3.917 26 HD21 LEU 3 HD21 LEU 3 6.397 9.293 2.885 27 HD22 LEU 3 HD22 LEU 3 7.007 7.739 2.325 28 HD23 LEU 3 HD23 LEU 3 7.797 8.560 3.665 29 H SER 4 HN SER 4 5.226 8.486 8.162 30 HA SER 4 HA SER 4 2.429 8.880 7.601 31 HB2 SER 4 HB2 SER 4 2.130 8.353 10.013 32 HB3 SER 4 HB1 SER 4 3.202 7.204 9.220 33 HG SER 4 HG SER 4 4.663 9.244 10.090 34 H ASN 5 HN ASN 5 4.897 10.827 9.166 35 HA ASN 5 HA ASN 5 3.203 12.750 10.436 36 HB2 ASN 5 HB2 ASN 5 5.708 12.448 10.766 37 HB3 ASN 5 HB1 ASN 5 5.930 13.289 9.232 38 HD21 ASN 5 HD21 ASN 5 5.135 15.572 9.117 39 HD22 ASN 5 HD22 ASN 5 4.982 16.481 10.543 40 H GLU 6 HN GLU 6 4.659 12.675 7.195 41 HA GLU 6 HA GLU 6 3.692 15.250 6.338 42 HB2 GLU 6 HB2 GLU 6 4.398 12.741 4.767 43 HB3 GLU 6 HB1 GLU 6 4.082 14.314 4.040 44 HG2 GLU 6 HG2 GLU 6 5.988 15.297 5.050 45 HG3 GLU 6 HG1 GLU 6 6.183 13.953 6.175 46 H LEU 7 HN LEU 7 2.422 11.974 6.200 47 HA LEU 7 HA LEU 7 0.151 12.483 4.564 48 HB2 LEU 7 HB2 LEU 7 1.051 10.206 5.169 49 HB3 LEU 7 HB1 LEU 7 0.393 10.423 6.790 50 HG LEU 7 HG LEU 7 -1.875 10.747 5.779 51 HD11 LEU 7 HD11 LEU 7 -0.262 10.412 3.269 52 HD12 LEU 7 HD12 LEU 7 -1.668 11.427 3.580 53 HD13 LEU 7 HD13 LEU 7 -1.877 9.704 3.301 54 HD21 LEU 7 HD21 LEU 7 -0.942 8.497 6.563 55 HD22 LEU 7 HD22 LEU 7 -0.645 8.140 4.862 56 HD23 LEU 7 HD23 LEU 7 -2.290 8.421 5.428 57 H LYS 8 HN LYS 8 0.604 12.633 8.074 58 HA LYS 8 HA LYS 8 -2.127 13.144 8.770 59 HB2 LYS 8 HB2 LYS 8 0.487 13.847 10.134 60 HB3 LYS 8 HB1 LYS 8 -1.090 14.173 10.851 61 HG2 LYS 8 HG2 LYS 8 -1.665 11.810 10.776 62 HG3 LYS 8 HG1 LYS 8 -0.164 11.439 9.933 63 HD2 LYS 8 HD2 LYS 8 0.290 10.900 12.200 64 HD3 LYS 8 HD1 LYS 8 1.037 12.480 11.963 65 HE2 LYS 8 HE2 LYS 8 -0.780 13.601 13.058 66 HE3 LYS 8 HE1 LYS 8 -1.772 12.145 13.050 67 HZ1 LYS 8 HZ1 LYS 8 0.733 12.584 14.571 68 HZ2 LYS 8 HZ2 LYS 8 -0.090 11.100 14.484 69 HZ3 LYS 8 HZ3 LYS 8 -0.833 12.446 15.205 70 H VAL 9 HN VAL 9 0.551 15.247 7.852 71 HA VAL 9 HA VAL 9 -0.630 17.760 8.464 72 HB VAL 9 HB VAL 9 1.322 16.977 6.273 73 HG11 VAL 9 HG11 VAL 9 0.333 19.672 7.223 74 HG12 VAL 9 HG12 VAL 9 0.379 19.052 5.574 75 HG13 VAL 9 HG13 VAL 9 1.880 19.483 6.396 76 HG21 VAL 9 HG21 VAL 9 1.878 18.455 8.854 77 HG22 VAL 9 HG22 VAL 9 3.028 17.642 7.791 78 HG23 VAL 9 HG23 VAL 9 1.910 16.693 8.772 79 H GLU 10 HN GLU 10 -0.736 15.822 5.482 80 HA GLU 10 HA GLU 10 -2.349 17.691 3.996 81 HB2 GLU 10 HB2 GLU 10 -1.661 14.765 3.730 82 HB3 GLU 10 HB1 GLU 10 -2.899 15.459 2.684 83 HG2 GLU 10 HG2 GLU 10 -0.808 15.620 1.512 84 HG3 GLU 10 HG1 GLU 10 -1.224 17.246 2.046 85 H ARG 11 HN ARG 11 -3.088 14.931 6.055 86 HA ARG 11 HA ARG 11 -5.898 14.763 5.585 87 HB2 ARG 11 HB2 ARG 11 -4.548 13.118 6.942 88 HB3 ARG 11 HB1 ARG 11 -4.412 14.332 8.213 89 HG2 ARG 11 HG2 ARG 11 -6.920 14.398 8.339 90 HG3 ARG 11 HG1 ARG 11 -6.969 13.075 7.176 91 HD2 ARG 11 HD2 ARG 11 -7.151 12.129 9.404 92 HD3 ARG 11 HD1 ARG 11 -5.560 11.714 8.761 93 HE ARG 11 HE ARG 11 -5.433 14.181 10.256 94 HH11 ARG 11 HH21 ARG 11 -5.708 10.739 10.561 95 HH12 ARG 11 HH22 ARG 11 -4.950 10.696 12.118 96 HH21 ARG 11 HH11 ARG 11 -4.448 14.120 12.280 97 HH22 ARG 11 HH12 ARG 11 -4.239 12.602 13.085 98 H ILE 12 HN ILE 12 -3.972 16.627 7.877 99 HA ILE 12 HA ILE 12 -6.167 18.030 9.103 100 HB ILE 12 HB ILE 12 -3.203 18.675 8.933 101 HG12 ILE 12 HG12 ILE 12 -4.829 17.656 11.278 102 HG13 ILE 12 HG11 ILE 12 -4.025 16.568 10.148 103 HG21 ILE 12 HG21 ILE 12 -4.315 20.746 9.378 104 HG22 ILE 12 HG22 ILE 12 -3.794 20.142 10.952 105 HG23 ILE 12 HG23 ILE 12 -5.477 19.970 10.453 106 HD11 ILE 12 HD11 ILE 12 -2.540 16.916 12.026 107 HD12 ILE 12 HD12 ILE 12 -2.715 18.667 11.898 108 HD13 ILE 12 HD13 ILE 12 -1.867 17.772 10.638 109 H ARG 13 HN ARG 13 -3.932 18.809 6.453 110 HA ARG 13 HA ARG 13 -4.735 21.490 5.995 111 HB2 ARG 13 HB2 ARG 13 -2.782 20.374 4.891 112 HB3 ARG 13 HB1 ARG 13 -3.911 19.446 3.903 113 HG2 ARG 13 HG2 ARG 13 -4.855 21.583 3.028 114 HG3 ARG 13 HG1 ARG 13 -3.650 22.467 3.961 115 HD2 ARG 13 HD2 ARG 13 -2.982 20.373 1.881 116 HD3 ARG 13 HD1 ARG 13 -3.031 22.108 1.567 117 HE ARG 13 HE ARG 13 -1.227 21.024 3.693 118 HH11 ARG 13 HH21 ARG 13 -1.746 22.772 0.737 119 HH12 ARG 13 HH22 ARG 13 -0.121 23.357 0.667 120 HH21 ARG 13 HH11 ARG 13 0.876 21.782 3.582 121 HH22 ARG 13 HH12 ARG 13 1.356 22.798 2.265 122 H LEU 14 HN LEU 14 -6.026 18.447 4.694 123 HA LEU 14 HA LEU 14 -8.222 19.913 3.337 124 HB2 LEU 14 HB2 LEU 14 -7.533 16.955 3.436 125 HB3 LEU 14 HB1 LEU 14 -8.829 17.657 2.470 126 HG LEU 14 HG LEU 14 -5.891 18.381 2.213 127 HD11 LEU 14 HD11 LEU 14 -7.691 16.556 0.603 128 HD12 LEU 14 HD12 LEU 14 -6.169 16.143 1.393 129 HD13 LEU 14 HD13 LEU 14 -6.174 17.196 -0.021 130 HD21 LEU 14 HD21 LEU 14 -6.928 19.290 -0.056 131 HD22 LEU 14 HD22 LEU 14 -7.023 20.263 1.407 132 HD23 LEU 14 HD23 LEU 14 -8.424 19.329 0.880 133 H SER 15 HN SER 15 -7.592 18.751 6.370 134 HA SER 15 HA SER 15 -8.920 17.969 8.159 135 HB2 SER 15 HB2 SER 15 -9.408 20.392 8.019 136 HB3 SER 15 HB1 SER 15 -10.768 20.047 6.955 137 HG SER 15 HG SER 15 -10.421 18.976 9.565 138 H LEU 16 HN LEU 16 -9.160 15.912 6.890 139 HA LEU 16 HA LEU 16 -11.961 15.460 5.934 140 HB2 LEU 16 HB2 LEU 16 -9.500 13.713 5.649 141 HB3 LEU 16 HB1 LEU 16 -11.075 13.425 4.908 142 HG LEU 16 HG LEU 16 -9.363 15.877 4.419 143 HD11 LEU 16 HD11 LEU 16 -8.380 13.795 3.478 144 HD12 LEU 16 HD12 LEU 16 -8.925 14.898 2.215 145 HD13 LEU 16 HD13 LEU 16 -9.895 13.486 2.629 146 HD21 LEU 16 HD21 LEU 16 -11.561 16.563 3.983 147 HD22 LEU 16 HD22 LEU 16 -12.070 14.958 3.458 148 HD23 LEU 16 HD23 LEU 16 -11.068 15.956 2.405 149 H THR 17 HN THR 17 -13.312 14.193 7.004 150 HA THR 17 HA THR 17 -12.655 13.330 9.696 151 HB THR 17 HB THR 17 -15.019 12.379 9.591 152 HG1 THR 17 HG1 THR 17 -14.574 12.967 6.983 153 HG21 THR 17 HG21 THR 17 -14.628 15.285 8.822 154 HG22 THR 17 HG22 THR 17 -14.479 14.635 10.454 155 HG23 THR 17 HG23 THR 17 -16.041 14.610 9.635 156 H ALA 18 HN ALA 18 -12.227 11.332 10.417 157 HA ALA 18 HA ALA 18 -11.137 9.355 8.660 158 HB1 ALA 18 HB1 ALA 18 -10.372 9.482 10.952 159 HB2 ALA 18 HB2 ALA 18 -11.168 7.922 10.750 160 HB3 ALA 18 HB3 ALA 18 -12.007 9.241 11.561 161 H LYS 19 HN LYS 19 -14.263 9.701 10.243 162 HA LYS 19 HA LYS 19 -15.314 7.120 9.629 163 HB2 LYS 19 HB2 LYS 19 -16.359 8.696 11.241 164 HB3 LYS 19 HB1 LYS 19 -16.797 9.759 9.904 165 HG2 LYS 19 HG2 LYS 19 -18.187 8.005 8.928 166 HG3 LYS 19 HG1 LYS 19 -17.690 6.877 10.189 167 HD2 LYS 19 HD2 LYS 19 -18.705 8.349 11.898 168 HD3 LYS 19 HD1 LYS 19 -19.219 9.461 10.628 169 HE2 LYS 19 HE2 LYS 19 -20.571 7.664 9.603 170 HE3 LYS 19 HE1 LYS 19 -20.064 6.558 10.879 171 HZ1 LYS 19 HZ1 LYS 19 -21.733 8.989 11.127 172 HZ2 LYS 19 HZ2 LYS 19 -20.999 8.254 12.472 173 HZ3 LYS 19 HZ3 LYS 19 -22.134 7.395 11.545 174 H SER 20 HN SER 20 -15.431 10.202 7.853 175 HA SER 20 HA SER 20 -17.093 9.349 5.711 176 HB2 SER 20 HB2 SER 20 -16.083 11.231 4.451 177 HB3 SER 20 HB1 SER 20 -16.500 11.716 6.091 178 HG SER 20 HG SER 20 -14.343 11.480 6.665 179 H VAL 21 HN VAL 21 -13.518 9.406 5.909 180 HA VAL 21 HA VAL 21 -13.154 8.115 3.347 181 HB VAL 21 HB VAL 21 -11.281 8.375 5.726 182 HG11 VAL 21 HG11 VAL 21 -10.823 7.407 2.890 183 HG12 VAL 21 HG12 VAL 21 -10.530 6.513 4.380 184 HG13 VAL 21 HG13 VAL 21 -9.517 7.897 3.968 185 HG21 VAL 21 HG21 VAL 21 -10.377 10.264 4.589 186 HG22 VAL 21 HG22 VAL 21 -12.125 10.462 4.468 187 HG23 VAL 21 HG23 VAL 21 -11.211 9.855 3.089 188 H ALA 22 HN ALA 22 -13.183 6.948 6.698 189 HA ALA 22 HA ALA 22 -12.464 4.249 6.206 190 HB1 ALA 22 HB1 ALA 22 -14.425 5.235 8.305 191 HB2 ALA 22 HB2 ALA 22 -12.674 5.339 8.470 192 HB3 ALA 22 HB3 ALA 22 -13.455 3.764 8.373 193 H GLU 23 HN GLU 23 -15.700 5.740 6.345 194 HA GLU 23 HA GLU 23 -17.131 3.311 5.763 195 HB2 GLU 23 HB2 GLU 23 -18.089 5.459 6.762 196 HB3 GLU 23 HB1 GLU 23 -18.058 6.129 5.131 197 HG2 GLU 23 HG2 GLU 23 -19.456 4.199 4.362 198 HG3 GLU 23 HG1 GLU 23 -19.562 3.658 6.036 199 H GLU 24 HN GLU 24 -15.875 5.933 3.729 200 HA GLU 24 HA GLU 24 -17.048 5.022 1.263 201 HB2 GLU 24 HB2 GLU 24 -16.214 7.301 1.497 202 HB3 GLU 24 HB1 GLU 24 -14.584 6.715 1.811 203 HG2 GLU 24 HG2 GLU 24 -15.953 5.877 -0.741 204 HG3 GLU 24 HG1 GLU 24 -15.295 7.507 -0.636 205 H MET 25 HN MET 25 -13.917 4.444 2.812 206 HA MET 25 HA MET 25 -12.768 2.870 0.698 207 HB2 MET 25 HB2 MET 25 -12.218 3.094 3.662 208 HB3 MET 25 HB1 MET 25 -11.304 1.996 2.628 209 HG2 MET 25 HG2 MET 25 -10.658 3.886 1.183 210 HG3 MET 25 HG1 MET 25 -11.581 4.986 2.206 211 HE1 MET 25 HE1 MET 25 -9.046 2.369 1.894 212 HE2 MET 25 HE2 MET 25 -9.164 1.893 3.585 213 HE3 MET 25 HE3 MET 25 -7.730 2.743 3.014 214 H GLY 26 HN GLY 26 -14.732 2.076 3.524 215 HA2 GLY 26 HA2 GLY 26 -16.312 0.175 3.347 216 HA3 GLY 26 HA1 GLY 26 -15.088 -0.702 2.427 217 H ILE 27 HN ILE 27 -13.795 1.124 4.985 218 HA ILE 27 HA ILE 27 -13.732 -1.277 6.791 219 HB ILE 27 HB ILE 27 -11.418 -0.624 7.393 220 HG12 ILE 27 HG12 ILE 27 -11.630 1.299 5.052 221 HG13 ILE 27 HG11 ILE 27 -11.680 1.802 6.739 222 HG21 ILE 27 HG21 ILE 27 -11.693 -2.342 5.725 223 HG22 ILE 27 HG22 ILE 27 -10.388 -1.289 5.186 224 HG23 ILE 27 HG23 ILE 27 -11.991 -1.147 4.465 225 HD11 ILE 27 HD11 ILE 27 -9.450 0.737 7.085 226 HD12 ILE 27 HD12 ILE 27 -9.406 2.049 5.907 227 HD13 ILE 27 HD13 ILE 27 -9.393 0.372 5.360 228 H SER 28 HN SER 28 -13.189 -0.695 9.037 229 HA SER 28 HA SER 28 -14.756 1.655 9.878 230 HB2 SER 28 HB2 SER 28 -13.557 -0.713 11.309 231 HB3 SER 28 HB1 SER 28 -14.190 0.667 12.204 232 HG SER 28 HG SER 28 -15.919 -0.613 11.967 233 H ARG 29 HN ARG 29 -13.838 2.893 11.780 234 HA ARG 29 HA ARG 29 -11.480 4.286 10.983 235 HB2 ARG 29 HB2 ARG 29 -13.047 4.190 13.568 236 HB3 ARG 29 HB1 ARG 29 -11.613 5.201 13.395 237 HG2 ARG 29 HG2 ARG 29 -12.673 6.270 11.396 238 HG3 ARG 29 HG1 ARG 29 -14.134 5.335 11.715 239 HD2 ARG 29 HD2 ARG 29 -14.444 6.395 13.853 240 HD3 ARG 29 HD1 ARG 29 -12.862 7.170 13.753 241 HE ARG 29 HE ARG 29 -14.839 7.843 11.645 242 HH11 ARG 29 HH21 ARG 29 -13.107 8.699 14.531 243 HH12 ARG 29 HH22 ARG 29 -13.446 10.389 14.373 244 HH21 ARG 29 HH11 ARG 29 -15.264 10.046 11.448 245 HH22 ARG 29 HH12 ARG 29 -14.664 11.144 12.644 246 H GLN 30 HN GLN 30 -12.023 1.652 13.256 247 HA GLN 30 HA GLN 30 -9.657 1.570 14.702 248 HB2 GLN 30 HB2 GLN 30 -11.541 -0.094 14.864 249 HB3 GLN 30 HB1 GLN 30 -10.953 -0.839 13.378 250 HG2 GLN 30 HG2 GLN 30 -10.072 -2.082 15.275 251 HG3 GLN 30 HG1 GLN 30 -8.745 -1.222 14.497 252 HE21 GLN 30 HE21 GLN 30 -7.413 -0.853 16.334 253 HE22 GLN 30 HE22 GLN 30 -7.908 0.057 17.679 254 H GLN 31 HN GLN 31 -10.177 0.152 11.480 255 HA GLN 31 HA GLN 31 -7.402 -0.583 11.098 256 HB2 GLN 31 HB2 GLN 31 -9.737 -0.268 9.189 257 HB3 GLN 31 HB1 GLN 31 -8.145 -0.824 8.672 258 HG2 GLN 31 HG2 GLN 31 -8.272 -2.690 10.281 259 HG3 GLN 31 HG1 GLN 31 -9.862 -2.135 10.802 260 HE21 GLN 31 HE21 GLN 31 -10.059 -4.620 9.913 261 HE22 GLN 31 HE22 GLN 31 -10.611 -4.726 8.313 262 H LEU 32 HN LEU 32 -9.383 2.192 10.206 263 HA LEU 32 HA LEU 32 -7.541 3.448 8.443 264 HB2 LEU 32 HB2 LEU 32 -10.044 4.019 9.029 265 HB3 LEU 32 HB1 LEU 32 -9.338 5.025 10.289 266 HG LEU 32 HG LEU 32 -7.813 5.943 8.344 267 HD11 LEU 32 HD11 LEU 32 -9.153 5.988 6.183 268 HD12 LEU 32 HD12 LEU 32 -10.147 4.704 6.854 269 HD13 LEU 32 HD13 LEU 32 -8.428 4.436 6.577 270 HD21 LEU 32 HD21 LEU 32 -9.315 7.421 9.442 271 HD22 LEU 32 HD22 LEU 32 -10.730 6.608 8.775 272 HD23 LEU 32 HD23 LEU 32 -9.693 7.572 7.725 273 H CYS 33 HN CYS 33 -7.989 3.729 11.932 274 HA CYS 33 HA CYS 33 -5.951 5.726 12.340 275 HB2 CYS 33 HB2 CYS 33 -7.885 4.965 13.922 276 HB3 CYS 33 HB1 CYS 33 -6.767 3.699 14.430 277 HG CYS 33 HG CYS 33 -5.070 5.915 14.785 278 H ASN 34 HN ASN 34 -5.979 2.204 12.348 279 HA ASN 34 HA ASN 34 -3.370 1.782 13.442 280 HB2 ASN 34 HB2 ASN 34 -4.995 0.093 11.508 281 HB3 ASN 34 HB1 ASN 34 -3.523 -0.452 12.308 282 HD21 ASN 34 HD21 ASN 34 -4.829 1.500 14.595 283 HD22 ASN 34 HD22 ASN 34 -5.804 0.386 15.424 284 H ILE 35 HN ILE 35 -4.510 2.296 10.128 285 HA ILE 35 HA ILE 35 -2.054 1.738 8.782 286 HB ILE 35 HB ILE 35 -4.363 3.570 8.061 287 HG12 ILE 35 HG12 ILE 35 -3.570 0.876 6.929 288 HG13 ILE 35 HG11 ILE 35 -4.716 1.056 8.255 289 HG21 ILE 35 HG21 ILE 35 -3.352 3.282 5.700 290 HG22 ILE 35 HG22 ILE 35 -1.870 2.810 6.534 291 HG23 ILE 35 HG23 ILE 35 -2.551 4.415 6.788 292 HD11 ILE 35 HD11 ILE 35 -6.160 2.453 6.836 293 HD12 ILE 35 HD12 ILE 35 -5.873 0.890 6.070 294 HD13 ILE 35 HD13 ILE 35 -5.004 2.320 5.512 295 H GLU 36 HN GLU 36 -3.370 4.758 10.108 296 HA GLU 36 HA GLU 36 -1.282 6.494 9.229 297 HB2 GLU 36 HB2 GLU 36 -3.512 7.158 10.293 298 HB3 GLU 36 HB1 GLU 36 -2.794 6.738 11.848 299 HG2 GLU 36 HG2 GLU 36 -0.849 8.331 11.100 300 HG3 GLU 36 HG1 GLU 36 -2.033 8.953 9.951 301 H GLN 37 HN GLN 37 -1.595 4.368 12.031 302 HA GLN 37 HA GLN 37 0.910 5.298 13.249 303 HB2 GLN 37 HB2 GLN 37 -0.940 2.972 13.876 304 HB3 GLN 37 HB1 GLN 37 0.504 3.352 14.815 305 HG2 GLN 37 HG2 GLN 37 -0.380 5.587 15.313 306 HG3 GLN 37 HG1 GLN 37 -1.808 5.258 14.333 307 HE21 GLN 37 HE21 GLN 37 -2.671 5.834 16.726 308 HE22 GLN 37 HE22 GLN 37 -2.963 4.484 17.711 309 H SER 38 HN SER 38 0.693 4.000 10.475 310 HA SER 38 HA SER 38 2.243 1.525 10.709 311 HB2 SER 38 HB2 SER 38 1.529 3.248 8.313 312 HB3 SER 38 HB1 SER 38 2.308 1.670 8.217 313 HG SER 38 HG SER 38 -0.135 2.096 9.589 314 H GLU 39 HN GLU 39 2.956 4.760 10.995 315 HA GLU 39 HA GLU 39 4.916 6.033 10.949 316 HB2 GLU 39 HB2 GLU 39 6.411 3.409 11.115 317 HB3 GLU 39 HB1 GLU 39 6.876 4.973 11.772 318 HG2 GLU 39 HG2 GLU 39 4.483 3.354 12.691 319 HG3 GLU 39 HG1 GLU 39 6.037 3.413 13.516 320 H THR 40 HN THR 40 6.247 3.145 9.375 321 HA THR 40 HA THR 40 7.123 4.842 7.102 322 HB THR 40 HB THR 40 8.601 2.987 6.541 323 HG1 THR 40 HG1 THR 40 8.545 1.104 7.811 324 HG21 THR 40 HG21 THR 40 9.878 2.822 8.700 325 HG22 THR 40 HG22 THR 40 8.531 3.638 9.497 326 HG23 THR 40 HG23 THR 40 9.451 4.471 8.244 327 H ALA 41 HN ALA 41 6.977 3.851 4.914 328 HA ALA 41 HA ALA 41 4.251 2.851 4.513 329 HB1 ALA 41 HB1 ALA 41 4.720 4.599 3.018 330 HB2 ALA 41 HB2 ALA 41 4.974 3.170 2.017 331 HB3 ALA 41 HB3 ALA 41 6.354 4.021 2.711 332 HA PRO 42 HA PRO 42 5.491 -1.289 3.610 333 HB2 PRO 42 HB2 PRO 42 3.624 -1.565 1.356 334 HB3 PRO 42 HB1 PRO 42 3.506 -2.247 2.988 335 HG2 PRO 42 HG2 PRO 42 1.870 -0.275 2.066 336 HG3 PRO 42 HG1 PRO 42 2.294 -0.482 3.777 337 HD2 PRO 42 HD2 PRO 42 3.407 1.461 1.776 338 HD3 PRO 42 HD1 PRO 42 2.980 1.701 3.478 339 H VAL 43 HN VAL 43 6.745 -2.584 2.225 340 HA VAL 43 HA VAL 43 8.357 -1.218 0.266 341 HB VAL 43 HB VAL 43 9.250 -3.517 -0.233 342 HG11 VAL 43 HG11 VAL 43 10.321 -2.271 1.509 343 HG12 VAL 43 HG12 VAL 43 10.099 -3.910 2.122 344 HG13 VAL 43 HG13 VAL 43 9.018 -2.618 2.646 345 HG21 VAL 43 HG21 VAL 43 7.374 -4.430 1.968 346 HG22 VAL 43 HG22 VAL 43 8.454 -5.426 0.991 347 HG23 VAL 43 HG23 VAL 43 7.039 -4.677 0.253 348 H VAL 44 HN VAL 44 5.342 -2.878 0.105 349 HA VAL 44 HA VAL 44 5.383 -3.707 -2.642 350 HB VAL 44 HB VAL 44 2.910 -2.760 -1.169 351 HG11 VAL 44 HG11 VAL 44 1.773 -4.326 -2.565 352 HG12 VAL 44 HG12 VAL 44 3.282 -5.097 -3.051 353 HG13 VAL 44 HG13 VAL 44 2.896 -3.476 -3.627 354 HG21 VAL 44 HG21 VAL 44 4.531 -5.284 -0.791 355 HG22 VAL 44 HG22 VAL 44 2.807 -5.230 -0.422 356 HG23 VAL 44 HG23 VAL 44 3.928 -4.177 0.443 357 H VAL 45 HN VAL 45 4.370 -0.709 -1.042 358 HA VAL 45 HA VAL 45 3.334 0.643 -3.314 359 HB VAL 45 HB VAL 45 4.707 1.709 -0.827 360 HG11 VAL 45 HG11 VAL 45 3.362 3.830 -1.514 361 HG12 VAL 45 HG12 VAL 45 3.342 3.114 -3.125 362 HG13 VAL 45 HG13 VAL 45 4.879 3.504 -2.353 363 HG21 VAL 45 HG21 VAL 45 1.802 1.418 -1.647 364 HG22 VAL 45 HG22 VAL 45 2.349 2.216 -0.174 365 HG23 VAL 45 HG23 VAL 45 2.627 0.488 -0.398 366 H LYS 46 HN LYS 46 6.612 0.555 -1.950 367 HA LYS 46 HA LYS 46 7.812 2.289 -3.907 368 HB2 LYS 46 HB2 LYS 46 8.975 0.150 -2.105 369 HB3 LYS 46 HB1 LYS 46 9.964 1.192 -3.128 370 HG2 LYS 46 HG2 LYS 46 8.937 3.182 -2.016 371 HG3 LYS 46 HG1 LYS 46 8.082 2.093 -0.927 372 HD2 LYS 46 HD2 LYS 46 11.091 2.019 -1.240 373 HD3 LYS 46 HD1 LYS 46 10.302 3.068 -0.064 374 HE2 LYS 46 HE2 LYS 46 9.108 0.952 0.784 375 HE3 LYS 46 HE1 LYS 46 10.270 0.048 -0.185 376 HZ1 LYS 46 HZ1 LYS 46 10.638 1.035 2.352 377 HZ2 LYS 46 HZ2 LYS 46 11.573 2.038 1.348 378 HZ3 LYS 46 HZ3 LYS 46 11.815 0.355 1.340 379 H TYR 47 HN TYR 47 7.281 -1.202 -3.723 380 HA TYR 47 HA TYR 47 8.890 -1.991 -5.934 381 HB2 TYR 47 HB2 TYR 47 7.837 -3.605 -4.354 382 HB3 TYR 47 HB1 TYR 47 6.252 -3.200 -5.020 383 HD1 TYR 47 HD2 TYR 47 9.515 -4.775 -5.732 384 HD2 TYR 47 HD1 TYR 47 5.569 -3.965 -7.220 385 HE1 TYR 47 HE2 TYR 47 9.884 -6.380 -7.588 386 HE2 TYR 47 HE1 TYR 47 5.941 -5.568 -9.076 387 HH TYR 47 HH TYR 47 8.375 -7.816 -9.102 388 H ILE 48 HN ILE 48 5.376 -1.277 -5.853 389 HA ILE 48 HA ILE 48 5.062 -1.408 -8.716 390 HB ILE 48 HB ILE 48 2.886 -0.274 -8.305 391 HG12 ILE 48 HG12 ILE 48 3.897 -0.088 -5.452 392 HG13 ILE 48 HG11 ILE 48 3.623 1.273 -6.533 393 HG21 ILE 48 HG21 ILE 48 3.352 -2.335 -6.146 394 HG22 ILE 48 HG22 ILE 48 3.326 -2.761 -7.857 395 HG23 ILE 48 HG23 ILE 48 1.895 -2.062 -7.100 396 HD11 ILE 48 HD11 ILE 48 1.602 -0.545 -5.237 397 HD12 ILE 48 HD12 ILE 48 1.191 0.310 -6.723 398 HD13 ILE 48 HD13 ILE 48 1.638 1.217 -5.278 399 H ALA 49 HN ALA 49 6.046 1.106 -6.498 400 HA ALA 49 HA ALA 49 5.676 3.357 -8.262 401 HB1 ALA 49 HB1 ALA 49 7.091 4.569 -6.728 402 HB2 ALA 49 HB2 ALA 49 7.801 3.077 -6.112 403 HB3 ALA 49 HB3 ALA 49 6.118 3.464 -5.754 404 H PHE 50 HN PHE 50 8.289 1.042 -7.734 405 HA PHE 50 HA PHE 50 10.292 2.300 -9.344 406 HB2 PHE 50 HB2 PHE 50 10.779 0.400 -7.828 407 HB3 PHE 50 HB1 PHE 50 9.809 -0.662 -8.850 408 HD1 PHE 50 HD1 PHE 50 12.653 1.774 -9.109 409 HD2 PHE 50 HD2 PHE 50 10.893 -1.874 -10.541 410 HE1 PHE 50 HE1 PHE 50 14.622 1.396 -10.567 411 HE2 PHE 50 HE2 PHE 50 12.862 -2.252 -11.997 412 HZ PHE 50 HZ PHE 50 14.726 -0.616 -12.012 413 H LEU 51 HN LEU 51 7.783 -0.098 -10.089 414 HA LEU 51 HA LEU 51 8.407 -0.364 -12.883 415 HB2 LEU 51 HB2 LEU 51 5.804 -0.756 -11.363 416 HB3 LEU 51 HB1 LEU 51 6.024 -1.200 -13.053 417 HG LEU 51 HG LEU 51 7.749 -2.258 -10.791 418 HD11 LEU 51 HD11 LEU 51 5.428 -3.030 -10.525 419 HD12 LEU 51 HD12 LEU 51 6.463 -4.357 -11.055 420 HD13 LEU 51 HD13 LEU 51 5.401 -3.553 -12.210 421 HD21 LEU 51 HD21 LEU 51 8.085 -4.066 -12.703 422 HD22 LEU 51 HD22 LEU 51 9.014 -2.573 -12.734 423 HD23 LEU 51 HD23 LEU 51 7.593 -2.744 -13.763 424 H ARG 52 HN ARG 52 6.336 1.819 -11.053 425 HA ARG 52 HA ARG 52 5.077 3.136 -13.255 426 HB2 ARG 52 HB2 ARG 52 4.361 3.392 -10.873 427 HB3 ARG 52 HB1 ARG 52 5.835 4.308 -10.553 428 HG2 ARG 52 HG2 ARG 52 5.161 5.997 -12.214 429 HG3 ARG 52 HG1 ARG 52 3.700 5.075 -12.567 430 HD2 ARG 52 HD2 ARG 52 2.931 5.367 -10.253 431 HD3 ARG 52 HD1 ARG 52 4.411 6.244 -9.858 432 HE ARG 52 HE ARG 52 3.239 7.583 -12.050 433 HH11 ARG 52 HH21 ARG 52 2.499 6.784 -8.759 434 HH12 ARG 52 HH22 ARG 52 1.524 8.195 -8.513 435 HH21 ARG 52 HH11 ARG 52 1.963 9.403 -11.728 436 HH22 ARG 52 HH12 ARG 52 1.219 9.668 -10.187 437 H SER 53 HN SER 53 8.134 3.750 -11.551 438 HA SER 53 HA SER 53 8.814 6.191 -12.877 439 HB2 SER 53 HB2 SER 53 11.086 5.770 -12.107 440 HB3 SER 53 HB1 SER 53 9.971 5.269 -10.840 441 HG SER 53 HG SER 53 10.606 3.279 -11.098 442 H LYS 54 HN LYS 54 8.826 2.906 -13.902 443 HA LYS 54 HA LYS 54 10.668 3.338 -16.153 444 HB2 LYS 54 HB2 LYS 54 8.849 0.995 -15.498 445 HB3 LYS 54 HB1 LYS 54 10.117 0.997 -16.721 446 HG2 LYS 54 HG2 LYS 54 10.749 1.659 -13.842 447 HG3 LYS 54 HG1 LYS 54 10.674 -0.016 -14.387 448 HD2 LYS 54 HD2 LYS 54 12.345 0.529 -16.164 449 HD3 LYS 54 HD1 LYS 54 12.473 2.157 -15.509 450 HE2 LYS 54 HE2 LYS 54 14.282 0.878 -14.588 451 HE3 LYS 54 HE1 LYS 54 13.109 1.138 -13.299 452 HZ1 LYS 54 HZ1 LYS 54 12.339 -1.039 -13.462 453 HZ2 LYS 54 HZ2 LYS 54 14.024 -1.198 -13.609 454 HZ3 LYS 54 HZ3 LYS 54 13.036 -1.284 -14.989 455 H GLY 55 HN GLY 55 7.740 4.462 -15.571 456 HA2 GLY 55 HA2 GLY 55 6.268 5.543 -17.072 457 HA3 GLY 55 HA1 GLY 55 7.105 4.767 -18.415 458 H VAL 56 HN VAL 56 6.226 2.591 -15.942 459 HA VAL 56 HA VAL 56 4.429 1.149 -17.675 460 HB VAL 56 HB VAL 56 4.983 0.891 -14.706 461 HG11 VAL 56 HG11 VAL 56 3.958 -1.445 -15.135 462 HG12 VAL 56 HG12 VAL 56 3.262 -0.728 -16.589 463 HG13 VAL 56 HG13 VAL 56 2.840 -0.086 -15.001 464 HG21 VAL 56 HG21 VAL 56 6.796 0.419 -16.496 465 HG22 VAL 56 HG22 VAL 56 5.799 -0.960 -16.955 466 HG23 VAL 56 HG23 VAL 56 6.469 -0.860 -15.327 467 H ASP 57 HN ASP 57 2.275 1.251 -17.872 468 HA ASP 57 HA ASP 57 0.818 3.503 -16.806 469 HB2 ASP 57 HB2 ASP 57 0.419 2.326 -19.025 470 HB3 ASP 57 HB1 ASP 57 -0.349 1.029 -18.114 471 H LEU 58 HN LEU 58 1.214 3.097 -14.532 472 HA LEU 58 HA LEU 58 -0.238 0.851 -13.279 473 HB2 LEU 58 HB2 LEU 58 2.060 1.597 -12.506 474 HB3 LEU 58 HB1 LEU 58 1.322 3.102 -11.968 475 HG LEU 58 HG LEU 58 -0.302 1.653 -10.606 476 HD11 LEU 58 HD11 LEU 58 -0.054 -0.521 -11.485 477 HD12 LEU 58 HD12 LEU 58 0.849 -0.595 -9.979 478 HD13 LEU 58 HD13 LEU 58 1.704 -0.417 -11.507 479 HD21 LEU 58 HD21 LEU 58 2.632 1.497 -9.860 480 HD22 LEU 58 HD22 LEU 58 1.260 1.455 -8.755 481 HD23 LEU 58 HD23 LEU 58 1.625 2.931 -9.649 482 H ASN 59 HN ASN 59 -0.411 4.351 -13.653 483 HA ASN 59 HA ASN 59 -2.420 4.890 -11.697 484 HB2 ASN 59 HB2 ASN 59 -2.843 6.954 -12.981 485 HB3 ASN 59 HB1 ASN 59 -1.112 6.673 -12.815 486 HD21 ASN 59 HD21 ASN 59 -0.002 5.684 -14.771 487 HD22 ASN 59 HD22 ASN 59 -0.648 5.986 -16.312 488 H ALA 60 HN ALA 60 -2.703 4.161 -15.167 489 HA ALA 60 HA ALA 60 -5.589 4.238 -15.205 490 HB1 ALA 60 HB1 ALA 60 -3.852 2.646 -17.105 491 HB2 ALA 60 HB2 ALA 60 -3.983 4.402 -17.208 492 HB3 ALA 60 HB3 ALA 60 -5.416 3.398 -17.427 493 H LEU 61 HN LEU 61 -3.198 1.725 -14.641 494 HA LEU 61 HA LEU 61 -4.871 -0.553 -14.840 495 HB2 LEU 61 HB2 LEU 61 -2.417 -0.672 -14.630 496 HB3 LEU 61 HB1 LEU 61 -2.519 -0.057 -12.981 497 HG LEU 61 HG LEU 61 -4.244 -2.435 -13.507 498 HD11 LEU 61 HD11 LEU 61 -2.340 -4.019 -13.365 499 HD12 LEU 61 HD12 LEU 61 -1.222 -2.666 -13.546 500 HD13 LEU 61 HD13 LEU 61 -2.323 -3.081 -14.858 501 HD21 LEU 61 HD21 LEU 61 -2.193 -1.754 -11.369 502 HD22 LEU 61 HD22 LEU 61 -3.303 -3.123 -11.319 503 HD23 LEU 61 HD23 LEU 61 -3.928 -1.479 -11.247 504 H PHE 62 HN PHE 62 -4.158 1.544 -12.065 505 HA PHE 62 HA PHE 62 -5.887 0.077 -10.252 506 HB2 PHE 62 HB2 PHE 62 -4.374 2.677 -10.210 507 HB3 PHE 62 HB1 PHE 62 -5.652 2.461 -9.015 508 HD1 PHE 62 HD1 PHE 62 -2.810 0.502 -10.511 509 HD2 PHE 62 HD2 PHE 62 -5.048 1.494 -6.980 510 HE1 PHE 62 HE1 PHE 62 -1.304 -0.922 -9.150 511 HE2 PHE 62 HE2 PHE 62 -3.542 0.075 -5.627 512 HZ PHE 62 HZ PHE 62 -1.667 -1.132 -6.707 513 H ASP 63 HN ASP 63 -6.192 3.195 -11.936 514 HA ASP 63 HA ASP 63 -8.629 4.112 -11.111 515 HB2 ASP 63 HB2 ASP 63 -7.093 5.056 -12.919 516 HB3 ASP 63 HB1 ASP 63 -7.935 4.006 -14.055 517 H ARG 64 HN ARG 64 -8.172 1.387 -13.368 518 HA ARG 64 HA ARG 64 -11.079 1.101 -13.752 519 HB2 ARG 64 HB2 ARG 64 -10.437 -0.969 -14.968 520 HB3 ARG 64 HB1 ARG 64 -9.624 0.472 -15.571 521 HG2 ARG 64 HG2 ARG 64 -7.564 -0.120 -14.584 522 HG3 ARG 64 HG1 ARG 64 -8.308 -1.259 -13.480 523 HD2 ARG 64 HD2 ARG 64 -7.765 -2.900 -14.952 524 HD3 ARG 64 HD1 ARG 64 -8.958 -2.235 -16.063 525 HE ARG 64 HE ARG 64 -6.085 -1.998 -16.310 526 HH11 ARG 64 HH21 ARG 64 -9.132 -0.456 -16.922 527 HH12 ARG 64 HH22 ARG 64 -8.537 0.451 -18.270 528 HH21 ARG 64 HH11 ARG 64 -5.334 -0.848 -18.078 529 HH22 ARG 64 HH12 ARG 64 -6.397 0.221 -18.928 530 H ILE 65 HN ILE 65 -8.634 -0.138 -11.631 531 HA ILE 65 HA ILE 65 -10.022 -2.493 -10.745 532 HB ILE 65 HB ILE 65 -7.886 -0.789 -9.422 533 HG12 ILE 65 HG12 ILE 65 -7.500 -2.259 -11.582 534 HG13 ILE 65 HG11 ILE 65 -6.331 -2.327 -10.271 535 HG21 ILE 65 HG21 ILE 65 -7.604 -2.939 -7.998 536 HG22 ILE 65 HG22 ILE 65 -9.250 -3.315 -8.504 537 HG23 ILE 65 HG23 ILE 65 -8.926 -1.845 -7.585 538 HD11 ILE 65 HD11 ILE 65 -7.135 -4.407 -9.507 539 HD12 ILE 65 HD12 ILE 65 -7.180 -4.573 -11.259 540 HD13 ILE 65 HD13 ILE 65 -8.659 -4.244 -10.364 541 H ILE 66 HN ILE 66 -9.894 0.834 -9.555 542 HA ILE 66 HA ILE 66 -11.593 0.345 -7.269 543 HB ILE 66 HB ILE 66 -11.764 2.838 -7.183 544 HG12 ILE 66 HG12 ILE 66 -10.034 2.760 -9.680 545 HG13 ILE 66 HG11 ILE 66 -11.748 3.174 -9.679 546 HG21 ILE 66 HG21 ILE 66 -9.831 1.597 -6.213 547 HG22 ILE 66 HG22 ILE 66 -9.401 3.225 -6.740 548 HG23 ILE 66 HG23 ILE 66 -8.957 1.831 -7.727 549 HD11 ILE 66 HD11 ILE 66 -10.366 5.214 -9.615 550 HD12 ILE 66 HD12 ILE 66 -9.576 4.640 -8.147 551 HD13 ILE 66 HD13 ILE 66 -11.293 5.046 -8.124 552 H VAL 67 HN VAL 67 -12.212 0.524 -10.572 553 HA VAL 67 HA VAL 67 -14.627 1.873 -10.858 554 HB VAL 67 HB VAL 67 -13.279 0.596 -12.627 555 HG11 VAL 67 HG11 VAL 67 -13.538 -1.598 -11.250 556 HG12 VAL 67 HG12 VAL 67 -13.699 -1.693 -13.003 557 HG13 VAL 67 HG13 VAL 67 -15.138 -1.694 -11.984 558 HG21 VAL 67 HG21 VAL 67 -15.251 0.299 -14.044 559 HG22 VAL 67 HG22 VAL 67 -15.454 1.739 -13.046 560 HG23 VAL 67 HG23 VAL 67 -16.293 0.247 -12.622 561 H ASN 68 HN ASN 68 -16.693 1.537 -10.326 562 HA ASN 68 HA ASN 68 -18.499 0.750 -9.072 563 HB2 ASN 68 HB2 ASN 68 -17.343 -1.846 -10.119 564 HB3 ASN 68 HB1 ASN 68 -18.907 -1.719 -9.312 565 HD21 ASN 68 HD21 ASN 68 -17.577 -1.823 -12.349 566 HD22 ASN 68 HD22 ASN 68 -18.756 -0.951 -13.206 567 H LYS 69 HN LYS 69 -18.974 -1.266 -7.422 568 HA LYS 69 HA LYS 69 -16.683 -1.426 -5.499 569 HB2 LYS 69 HB2 LYS 69 -18.236 0.387 -4.785 570 HB3 LYS 69 HB1 LYS 69 -19.560 -0.775 -4.769 571 HG2 LYS 69 HG2 LYS 69 -18.398 -2.113 -3.066 572 HG3 LYS 69 HG1 LYS 69 -17.027 -1.006 -3.115 573 HD2 LYS 69 HD2 LYS 69 -18.496 0.837 -2.366 574 HD3 LYS 69 HD1 LYS 69 -19.857 -0.283 -2.297 575 HE2 LYS 69 HE2 LYS 69 -18.687 -1.632 -0.608 576 HE3 LYS 69 HE1 LYS 69 -17.296 -0.552 -0.693 577 HZ1 LYS 69 HZ1 LYS 69 -18.446 1.155 0.311 578 HZ2 LYS 69 HZ2 LYS 69 -19.055 -0.198 1.137 579 HZ3 LYS 69 HZ3 LYS 69 -19.969 0.530 -0.097 580 H LEU 70 HN LEU 70 -19.954 -2.442 -4.816 581 HA LEU 70 HA LEU 70 -20.815 -4.552 -4.290 582 HB2 LEU 70 HB2 LEU 70 -19.129 -5.375 -6.674 583 HB3 LEU 70 HB1 LEU 70 -20.510 -6.255 -6.015 584 HG LEU 70 HG LEU 70 -20.619 -3.447 -7.160 585 HD11 LEU 70 HD11 LEU 70 -20.232 -5.209 -8.870 586 HD12 LEU 70 HD12 LEU 70 -21.828 -4.475 -9.027 587 HD13 LEU 70 HD13 LEU 70 -21.657 -6.066 -8.285 588 HD21 LEU 70 HD21 LEU 70 -23.171 -4.122 -7.080 589 HD22 LEU 70 HD22 LEU 70 -22.386 -3.532 -5.619 590 HD23 LEU 70 HD23 LEU 70 -22.637 -5.262 -5.844 591 H GLU 71 HN GLU 71 -17.748 -3.754 -3.716 592 HA GLU 71 HA GLU 71 -16.886 -6.459 -2.820 593 HB2 GLU 71 HB2 GLU 71 -15.308 -5.108 -4.207 594 HB3 GLU 71 HB1 GLU 71 -15.297 -3.878 -2.944 595 HG2 GLU 71 HG2 GLU 71 -13.402 -5.164 -2.406 596 HG3 GLU 71 HG1 GLU 71 -14.627 -5.866 -1.357 597 H HIS 72 HN HIS 72 -16.633 -6.940 -0.735 598 HA HIS 72 HA HIS 72 -16.691 -4.862 1.356 599 HB2 HIS 72 HB2 HIS 72 -18.546 -6.099 2.557 600 HB3 HIS 72 HB1 HIS 72 -19.054 -5.242 1.103 601 HD2 HIS 72 HD2 HIS 72 -21.139 -7.437 1.276 602 HE1 HIS 72 HE1 HIS 72 -18.576 -10.177 -0.664 603 HE2 HIS 72 HE2 HIS 72 -20.970 -9.727 0.040 604 H HIS 73 HN HIS 73 -15.514 -5.513 3.123 605 HA HIS 73 HA HIS 73 -13.826 -7.827 2.910 606 HB2 HIS 73 HB2 HIS 73 -14.418 -6.103 5.338 607 HB3 HIS 73 HB1 HIS 73 -13.084 -7.247 5.199 608 HD2 HIS 73 HD2 HIS 73 -13.449 -3.580 4.815 609 HE1 HIS 73 HE1 HIS 73 -10.585 -4.603 1.883 610 HE2 HIS 73 HE2 HIS 73 -11.617 -2.686 3.186 611 H HIS 74 HN HIS 74 -13.715 -9.615 4.442 612 HA HIS 74 HA HIS 74 -16.434 -10.636 5.118 613 HB2 HIS 74 HB2 HIS 74 -14.967 -12.070 3.723 614 HB3 HIS 74 HB1 HIS 74 -13.761 -12.077 5.010 615 HD2 HIS 74 HD2 HIS 74 -14.711 -15.028 4.679 616 HE1 HIS 74 HE1 HIS 74 -17.729 -14.329 7.552 617 HE2 HIS 74 HE2 HIS 74 -16.413 -16.119 6.328 618 H HIS 75 HN HIS 75 -15.563 -8.661 6.835 619 HA HIS 75 HA HIS 75 -15.157 -8.191 9.094 620 HB2 HIS 75 HB2 HIS 75 -17.182 -9.757 9.118 621 HB3 HIS 75 HB1 HIS 75 -16.063 -11.033 9.588 622 HD2 HIS 75 HD2 HIS 75 -18.195 -8.429 11.309 623 HE1 HIS 75 HE1 HIS 75 -15.059 -9.241 14.018 624 HE2 HIS 75 HE2 HIS 75 -17.331 -8.147 13.753 625 H HIS 76 HN HIS 76 -12.842 -8.302 8.337 626 HA HIS 76 HA HIS 76 -11.342 -10.114 10.143 627 HB2 HIS 76 HB2 HIS 76 -11.423 -11.269 7.940 628 HB3 HIS 76 HB1 HIS 76 -10.689 -9.848 7.195 629 HD2 HIS 76 HD2 HIS 76 -9.601 -12.060 10.350 630 HE1 HIS 76 HE1 HIS 76 -6.195 -11.143 8.027 631 HE2 HIS 76 HE2 HIS 76 -7.017 -12.329 10.112 632 H HIS 77 HN HIS 77 -9.373 -9.262 10.788 633 HA HIS 77 HA HIS 77 -9.089 -6.465 10.982 634 HB2 HIS 77 HB2 HIS 77 -7.086 -8.723 11.228 635 HB3 HIS 77 HB1 HIS 77 -6.655 -7.045 11.560 636 HD2 HIS 77 HD2 HIS 77 -7.205 -6.311 14.166 637 HE1 HIS 77 HE1 HIS 77 -10.063 -9.292 15.049 638 HE2 HIS 77 HE2 HIS 77 -8.762 -7.330 15.992 639 H1 MET 1 HT1 MET 1 -9.325 -8.865 -15.313 640 H2 MET 1 HT2 MET 1 -7.823 -8.419 -15.969 641 H3 MET 1 HT3 MET 1 -8.336 -7.759 -14.491 642 HA MET 1 HA MET 1 -8.363 -10.578 -14.332 643 HB2 MET 1 HB2 MET 1 -5.797 -9.261 -15.245 644 HB3 MET 1 HB1 MET 1 -5.862 -10.851 -14.486 645 HG2 MET 1 HG2 MET 1 -7.392 -11.628 -16.278 646 HG3 MET 1 HG1 MET 1 -7.265 -10.050 -17.055 647 HE1 MET 1 HE1 MET 1 -4.056 -9.266 -16.792 648 HE2 MET 1 HE2 MET 1 -5.388 -8.999 -17.913 649 HE3 MET 1 HE3 MET 1 -3.896 -9.735 -18.488 650 H GLU 2 HN GLU 2 -6.406 -11.020 -12.600 651 HA GLU 2 HA GLU 2 -7.124 -9.346 -10.317 652 HB2 GLU 2 HB2 GLU 2 -5.110 -11.608 -10.508 653 HB3 GLU 2 HB1 GLU 2 -5.737 -10.901 -9.018 654 HG2 GLU 2 HG2 GLU 2 -8.071 -11.524 -9.881 655 HG3 GLU 2 HG1 GLU 2 -7.243 -12.504 -11.092 656 H LEU 3 HN LEU 3 -5.493 -8.348 -8.923 657 HA LEU 3 HA LEU 3 -3.776 -6.559 -10.340 658 HB2 LEU 3 HB2 LEU 3 -3.919 -7.366 -7.421 659 HB3 LEU 3 HB1 LEU 3 -2.843 -6.101 -8.005 660 HG LEU 3 HG LEU 3 -5.823 -6.082 -8.545 661 HD11 LEU 3 HD11 LEU 3 -5.854 -4.342 -6.675 662 HD12 LEU 3 HD12 LEU 3 -4.265 -4.950 -6.212 663 HD13 LEU 3 HD13 LEU 3 -5.668 -6.018 -6.160 664 HD21 LEU 3 HD21 LEU 3 -5.174 -3.521 -8.627 665 HD22 LEU 3 HD22 LEU 3 -4.821 -4.544 -10.012 666 HD23 LEU 3 HD23 LEU 3 -3.539 -4.129 -8.879 667 H SER 4 HN SER 4 -3.070 -9.459 -8.436 668 HA SER 4 HA SER 4 -0.221 -9.374 -8.780 669 HB2 SER 4 HB2 SER 4 -1.978 -11.811 -8.349 670 HB3 SER 4 HB1 SER 4 -0.257 -11.681 -7.992 671 HG SER 4 HG SER 4 -0.724 -10.200 -6.400 672 H ASN 5 HN ASN 5 -2.847 -10.836 -10.629 673 HA ASN 5 HA ASN 5 -1.226 -12.339 -12.457 674 HB2 ASN 5 HB2 ASN 5 -3.702 -12.626 -12.162 675 HB3 ASN 5 HB1 ASN 5 -3.942 -11.065 -12.946 676 HD21 ASN 5 HD21 ASN 5 -2.510 -10.994 -15.169 677 HD22 ASN 5 HD22 ASN 5 -2.734 -12.352 -16.162 678 H GLU 6 HN GLU 6 -2.621 -9.067 -12.623 679 HA GLU 6 HA GLU 6 -1.484 -8.446 -15.208 680 HB2 GLU 6 HB2 GLU 6 -3.461 -7.293 -13.948 681 HB3 GLU 6 HB1 GLU 6 -2.206 -6.365 -13.130 682 HG2 GLU 6 HG2 GLU 6 -2.466 -6.569 -16.147 683 HG3 GLU 6 HG1 GLU 6 -3.128 -5.247 -15.192 684 H LEU 7 HN LEU 7 -0.493 -7.906 -11.869 685 HA LEU 7 HA LEU 7 1.750 -6.232 -12.407 686 HB2 LEU 7 HB2 LEU 7 0.742 -6.580 -10.139 687 HB3 LEU 7 HB1 LEU 7 1.393 -8.217 -10.133 688 HG LEU 7 HG LEU 7 3.693 -7.256 -10.418 689 HD11 LEU 7 HD11 LEU 7 2.095 -4.702 -10.361 690 HD12 LEU 7 HD12 LEU 7 3.467 -5.141 -11.380 691 HD13 LEU 7 HD13 LEU 7 3.730 -4.709 -9.696 692 HD21 LEU 7 HD21 LEU 7 2.952 -7.854 -8.188 693 HD22 LEU 7 HD22 LEU 7 2.075 -6.331 -8.028 694 HD23 LEU 7 HD23 LEU 7 3.836 -6.332 -8.093 695 H LYS 8 HN LYS 8 1.412 -9.744 -12.145 696 HA LYS 8 HA LYS 8 4.179 -10.407 -12.391 697 HB2 LYS 8 HB2 LYS 8 2.364 -12.000 -11.695 698 HB3 LYS 8 HB1 LYS 8 1.794 -12.016 -13.365 699 HG2 LYS 8 HG2 LYS 8 3.956 -12.880 -14.124 700 HG3 LYS 8 HG1 LYS 8 4.583 -12.806 -12.477 701 HD2 LYS 8 HD2 LYS 8 2.853 -14.419 -11.750 702 HD3 LYS 8 HD1 LYS 8 2.249 -14.507 -13.404 703 HE2 LYS 8 HE2 LYS 8 3.686 -16.377 -13.221 704 HE3 LYS 8 HE1 LYS 8 4.666 -15.167 -14.051 705 HZ1 LYS 8 HZ1 LYS 8 4.693 -15.655 -11.120 706 HZ2 LYS 8 HZ2 LYS 8 5.693 -14.578 -11.973 707 HZ3 LYS 8 HZ3 LYS 8 5.847 -16.253 -12.210 708 H VAL 9 HN VAL 9 1.624 -9.885 -14.778 709 HA VAL 9 HA VAL 9 3.086 -10.637 -17.113 710 HB VAL 9 HB VAL 9 0.845 -8.630 -16.710 711 HG11 VAL 9 HG11 VAL 9 1.884 -7.963 -18.746 712 HG12 VAL 9 HG12 VAL 9 0.553 -9.008 -19.243 713 HG13 VAL 9 HG13 VAL 9 2.202 -9.631 -19.220 714 HG21 VAL 9 HG21 VAL 9 -0.604 -10.383 -17.400 715 HG22 VAL 9 HG22 VAL 9 0.514 -11.153 -16.276 716 HG23 VAL 9 HG23 VAL 9 0.733 -11.357 -18.013 717 H GLU 10 HN GLU 10 2.671 -7.479 -15.523 718 HA GLU 10 HA GLU 10 4.112 -5.857 -17.310 719 HB2 GLU 10 HB2 GLU 10 3.836 -5.768 -14.292 720 HB3 GLU 10 HB1 GLU 10 4.679 -4.509 -15.192 721 HG2 GLU 10 HG2 GLU 10 1.890 -5.337 -15.996 722 HG3 GLU 10 HG1 GLU 10 2.127 -4.205 -14.668 723 H ARG 11 HN ARG 11 5.299 -7.868 -14.639 724 HA ARG 11 HA ARG 11 8.055 -7.149 -14.802 725 HB2 ARG 11 HB2 ARG 11 7.163 -8.438 -12.918 726 HB3 ARG 11 HB1 ARG 11 6.764 -9.778 -13.992 727 HG2 ARG 11 HG2 ARG 11 9.102 -10.173 -14.473 728 HG3 ARG 11 HG1 ARG 11 9.574 -8.714 -13.600 729 HD2 ARG 11 HD2 ARG 11 8.950 -9.649 -11.500 730 HD3 ARG 11 HD1 ARG 11 8.075 -10.977 -12.265 731 HE ARG 11 HE ARG 11 10.916 -10.929 -12.943 732 HH11 ARG 11 HH21 ARG 11 8.494 -11.937 -10.677 733 HH12 ARG 11 HH22 ARG 11 9.434 -13.264 -10.081 734 HH21 ARG 11 HH11 ARG 11 12.132 -12.654 -12.166 735 HH22 ARG 11 HH12 ARG 11 11.482 -13.669 -10.923 736 H ILE 12 HN ILE 12 6.191 -9.681 -16.453 737 HA ILE 12 HA ILE 12 8.405 -10.840 -17.865 738 HB ILE 12 HB ILE 12 5.433 -10.793 -18.485 739 HG12 ILE 12 HG12 ILE 12 7.193 -13.021 -17.418 740 HG13 ILE 12 HG11 ILE 12 6.256 -11.945 -16.380 741 HG21 ILE 12 HG21 ILE 12 6.511 -11.228 -20.571 742 HG22 ILE 12 HG22 ILE 12 6.075 -12.814 -19.933 743 HG23 ILE 12 HG23 ILE 12 7.738 -12.238 -19.810 744 HD11 ILE 12 HD11 ILE 12 5.077 -13.658 -18.588 745 HD12 ILE 12 HD12 ILE 12 4.181 -12.665 -17.442 746 HD13 ILE 12 HD13 ILE 12 5.061 -14.081 -16.877 747 H ARG 13 HN ARG 13 6.072 -8.294 -18.735 748 HA ARG 13 HA ARG 13 6.910 -7.911 -21.431 749 HB2 ARG 13 HB2 ARG 13 5.839 -5.876 -19.445 750 HB3 ARG 13 HB1 ARG 13 5.962 -5.614 -21.184 751 HG2 ARG 13 HG2 ARG 13 4.544 -7.786 -21.392 752 HG3 ARG 13 HG1 ARG 13 4.169 -7.524 -19.692 753 HD2 ARG 13 HD2 ARG 13 2.419 -6.374 -20.732 754 HD3 ARG 13 HD1 ARG 13 3.585 -5.081 -20.473 755 HE ARG 13 HE ARG 13 4.099 -5.100 -22.824 756 HH11 ARG 13 HH21 ARG 13 1.777 -7.502 -21.886 757 HH12 ARG 13 HH22 ARG 13 1.264 -7.807 -23.510 758 HH21 ARG 13 HH11 ARG 13 3.425 -5.503 -24.929 759 HH22 ARG 13 HH12 ARG 13 2.192 -6.683 -25.222 760 H LEU 14 HN LEU 14 8.037 -6.421 -18.408 761 HA LEU 14 HA LEU 14 10.209 -5.009 -19.863 762 HB2 LEU 14 HB2 LEU 14 9.420 -5.030 -16.927 763 HB3 LEU 14 HB1 LEU 14 10.715 -4.049 -17.611 764 HG LEU 14 HG LEU 14 7.815 -3.907 -18.494 765 HD11 LEU 14 HD11 LEU 14 9.423 -2.285 -16.514 766 HD12 LEU 14 HD12 LEU 14 7.838 -3.026 -16.292 767 HD13 LEU 14 HD13 LEU 14 8.011 -1.610 -17.327 768 HD21 LEU 14 HD21 LEU 14 9.050 -3.081 -20.307 769 HD22 LEU 14 HD22 LEU 14 10.351 -2.475 -19.284 770 HD23 LEU 14 HD23 LEU 14 8.816 -1.614 -19.365 771 H SER 15 HN SER 15 9.665 -8.013 -18.590 772 HA SER 15 HA SER 15 11.035 -9.718 -17.705 773 HB2 SER 15 HB2 SER 15 12.945 -8.551 -19.745 774 HB3 SER 15 HB1 SER 15 12.896 -10.215 -19.168 775 HG SER 15 HG SER 15 10.861 -10.433 -20.110 776 H LEU 16 HN LEU 16 11.105 -7.759 -15.919 777 HA LEU 16 HA LEU 16 13.806 -6.801 -15.369 778 HB2 LEU 16 HB2 LEU 16 11.244 -6.788 -13.751 779 HB3 LEU 16 HB1 LEU 16 12.749 -6.060 -13.193 780 HG LEU 16 HG LEU 16 11.476 -5.352 -15.843 781 HD11 LEU 16 HD11 LEU 16 11.149 -3.980 -13.157 782 HD12 LEU 16 HD12 LEU 16 9.879 -4.789 -14.076 783 HD13 LEU 16 HD13 LEU 16 10.619 -3.314 -14.700 784 HD21 LEU 16 HD21 LEU 16 13.699 -4.599 -15.901 785 HD22 LEU 16 HD22 LEU 16 13.744 -4.262 -14.171 786 HD23 LEU 16 HD23 LEU 16 12.868 -3.189 -15.259 787 H THR 17 HN THR 17 15.214 -7.540 -13.841 788 HA THR 17 HA THR 17 14.826 -10.347 -12.967 789 HB THR 17 HB THR 17 17.249 -10.135 -12.295 790 HG1 THR 17 HG1 THR 17 16.880 -7.597 -13.502 791 HG21 THR 17 HG21 THR 17 18.074 -10.009 -14.659 792 HG22 THR 17 HG22 THR 17 16.465 -9.473 -15.144 793 HG23 THR 17 HG23 THR 17 16.687 -11.080 -14.452 794 H ALA 18 HN ALA 18 14.662 -10.947 -10.874 795 HA ALA 18 HA ALA 18 13.716 -9.092 -8.914 796 HB1 ALA 18 HB1 ALA 18 14.244 -11.114 -7.335 797 HB2 ALA 18 HB2 ALA 18 14.657 -11.961 -8.825 798 HB3 ALA 18 HB3 ALA 18 13.028 -11.331 -8.596 799 H LYS 19 HN LYS 19 16.877 -10.443 -9.617 800 HA LYS 19 HA LYS 19 18.251 -9.606 -7.257 801 HB2 LYS 19 HB2 LYS 19 19.167 -11.200 -8.956 802 HB3 LYS 19 HB1 LYS 19 19.344 -9.856 -10.083 803 HG2 LYS 19 HG2 LYS 19 20.878 -8.728 -8.538 804 HG3 LYS 19 HG1 LYS 19 20.670 -10.024 -7.361 805 HD2 LYS 19 HD2 LYS 19 21.611 -11.643 -8.974 806 HD3 LYS 19 HD1 LYS 19 21.826 -10.346 -10.149 807 HE2 LYS 19 HE2 LYS 19 23.942 -10.754 -8.992 808 HE3 LYS 19 HE1 LYS 19 23.317 -9.172 -8.531 809 HZ1 LYS 19 HZ1 LYS 19 23.976 -11.271 -6.856 810 HZ2 LYS 19 HZ2 LYS 19 22.281 -11.167 -6.820 811 HZ3 LYS 19 HZ3 LYS 19 23.227 -9.811 -6.428 812 H SER 20 HN SER 20 17.767 -8.022 -10.402 813 HA SER 20 HA SER 20 19.304 -5.681 -9.889 814 HB2 SER 20 HB2 SER 20 18.612 -6.076 -12.140 815 HB3 SER 20 HB1 SER 20 16.922 -6.239 -11.675 816 HG SER 20 HG SER 20 17.447 -3.918 -10.841 817 H VAL 21 HN VAL 21 15.804 -6.253 -9.479 818 HA VAL 21 HA VAL 21 15.189 -3.671 -8.406 819 HB VAL 21 HB VAL 21 13.815 -6.345 -7.986 820 HG11 VAL 21 HG11 VAL 21 13.076 -4.875 -6.241 821 HG12 VAL 21 HG12 VAL 21 11.827 -4.821 -7.486 822 HG13 VAL 21 HG13 VAL 21 12.990 -3.504 -7.344 823 HG21 VAL 21 HG21 VAL 21 13.134 -4.053 -9.853 824 HG22 VAL 21 HG22 VAL 21 12.351 -5.632 -9.785 825 HG23 VAL 21 HG23 VAL 21 14.016 -5.496 -10.351 826 H ALA 22 HN ALA 22 15.964 -6.762 -6.818 827 HA ALA 22 HA ALA 22 15.675 -5.834 -4.127 828 HB1 ALA 22 HB1 ALA 22 15.917 -8.259 -4.959 829 HB2 ALA 22 HB2 ALA 22 16.777 -7.843 -3.476 830 HB3 ALA 22 HB3 ALA 22 17.652 -7.951 -5.004 831 H GLU 23 HN GLU 23 18.194 -5.519 -6.493 832 HA GLU 23 HA GLU 23 20.359 -4.876 -4.746 833 HB2 GLU 23 HB2 GLU 23 19.975 -5.125 -7.520 834 HB3 GLU 23 HB1 GLU 23 20.401 -3.428 -7.334 835 HG2 GLU 23 HG2 GLU 23 21.998 -5.845 -6.450 836 HG3 GLU 23 HG1 GLU 23 22.453 -4.635 -7.649 837 H GLU 24 HN GLU 24 17.965 -2.866 -6.408 838 HA GLU 24 HA GLU 24 18.954 -0.351 -5.314 839 HB2 GLU 24 HB2 GLU 24 16.127 -0.799 -6.299 840 HB3 GLU 24 HB1 GLU 24 17.113 0.655 -6.415 841 HG2 GLU 24 HG2 GLU 24 17.723 -1.921 -7.892 842 HG3 GLU 24 HG1 GLU 24 16.837 -0.574 -8.591 843 H MET 25 HN MET 25 16.191 -2.473 -4.621 844 HA MET 25 HA MET 25 15.109 -0.934 -2.460 845 HB2 MET 25 HB2 MET 25 14.881 -3.858 -3.214 846 HB3 MET 25 HB1 MET 25 14.042 -3.177 -1.826 847 HG2 MET 25 HG2 MET 25 13.793 -1.976 -4.583 848 HG3 MET 25 HG1 MET 25 12.729 -3.265 -4.027 849 HE1 MET 25 HE1 MET 25 11.779 -2.964 -1.271 850 HE2 MET 25 HE2 MET 25 10.808 -3.071 -2.737 851 HE3 MET 25 HE3 MET 25 10.428 -1.853 -1.525 852 H GLY 26 HN GLY 26 17.462 -3.564 -2.602 853 HA2 GLY 26 HA2 GLY 26 19.198 -4.043 -1.078 854 HA3 GLY 26 HA1 GLY 26 18.621 -2.731 -0.047 855 H ILE 27 HN ILE 27 16.569 -5.330 -1.223 856 HA ILE 27 HA ILE 27 16.366 -6.388 1.587 857 HB ILE 27 HB ILE 27 14.028 -6.971 1.060 858 HG12 ILE 27 HG12 ILE 27 14.483 -5.431 -1.520 859 HG13 ILE 27 HG11 ILE 27 14.344 -7.184 -1.421 860 HG21 ILE 27 HG21 ILE 27 13.131 -4.748 1.221 861 HG22 ILE 27 HG22 ILE 27 14.555 -4.055 0.440 862 HG23 ILE 27 HG23 ILE 27 14.684 -4.744 2.058 863 HD11 ILE 27 HD11 ILE 27 12.088 -6.942 -0.426 864 HD12 ILE 27 HD12 ILE 27 12.183 -6.213 -2.030 865 HD13 ILE 27 HD13 ILE 27 12.218 -5.190 -0.594 866 H SER 28 HN SER 28 15.700 -8.658 1.687 867 HA SER 28 HA SER 28 17.387 -10.318 0.070 868 HB2 SER 28 HB2 SER 28 15.101 -11.047 1.924 869 HB3 SER 28 HB1 SER 28 16.253 -12.196 1.250 870 HG SER 28 HG SER 28 17.721 -10.315 2.246 871 H ARG 29 HN ARG 29 16.834 -11.838 -1.484 872 HA ARG 29 HA ARG 29 14.880 -11.076 -3.415 873 HB2 ARG 29 HB2 ARG 29 16.423 -13.656 -3.002 874 HB3 ARG 29 HB1 ARG 29 15.379 -13.374 -4.396 875 HG2 ARG 29 HG2 ARG 29 16.695 -11.373 -4.984 876 HG3 ARG 29 HG1 ARG 29 17.735 -11.644 -3.586 877 HD2 ARG 29 HD2 ARG 29 18.807 -12.517 -5.620 878 HD3 ARG 29 HD1 ARG 29 18.404 -13.843 -4.529 879 HE ARG 29 HE ARG 29 16.193 -13.748 -6.135 880 HH11 ARG 29 HH21 ARG 29 19.601 -13.720 -6.773 881 HH12 ARG 29 HH22 ARG 29 19.442 -14.525 -8.299 882 HH21 ARG 29 HH11 ARG 29 15.995 -14.800 -8.114 883 HH22 ARG 29 HH12 ARG 29 17.411 -15.133 -9.053 884 H GLN 30 HN GLN 30 14.801 -13.346 -0.740 885 HA GLN 30 HA GLN 30 12.450 -14.797 -1.413 886 HB2 GLN 30 HB2 GLN 30 13.523 -13.975 1.311 887 HB3 GLN 30 HB1 GLN 30 12.272 -15.192 1.056 888 HG2 GLN 30 HG2 GLN 30 15.068 -15.325 -0.115 889 HG3 GLN 30 HG1 GLN 30 14.548 -16.191 1.330 890 HE21 GLN 30 HE21 GLN 30 15.134 -16.797 -1.819 891 HE22 GLN 30 HE22 GLN 30 13.952 -17.972 -2.140 892 H GLN 31 HN GLN 31 12.851 -11.751 0.389 893 HA GLN 31 HA GLN 31 10.059 -11.365 0.961 894 HB2 GLN 31 HB2 GLN 31 12.369 -9.404 0.736 895 HB3 GLN 31 HB1 GLN 31 10.755 -8.946 1.282 896 HG2 GLN 31 HG2 GLN 31 10.896 -10.562 3.123 897 HG3 GLN 31 HG1 GLN 31 12.487 -11.078 2.566 898 HE21 GLN 31 HE21 GLN 31 10.985 -9.036 4.772 899 HE22 GLN 31 HE22 GLN 31 12.257 -7.941 5.026 900 H LEU 32 HN LEU 32 12.148 -10.231 -1.681 901 HA LEU 32 HA LEU 32 10.174 -8.641 -2.998 902 HB2 LEU 32 HB2 LEU 32 12.698 -8.665 -3.432 903 HB3 LEU 32 HB1 LEU 32 12.424 -10.138 -4.360 904 HG LEU 32 HG LEU 32 10.583 -8.712 -5.594 905 HD11 LEU 32 HD11 LEU 32 11.292 -6.299 -5.737 906 HD12 LEU 32 HD12 LEU 32 12.375 -6.583 -4.379 907 HD13 LEU 32 HD13 LEU 32 10.634 -6.749 -4.169 908 HD21 LEU 32 HD21 LEU 32 12.613 -9.570 -6.676 909 HD22 LEU 32 HD22 LEU 32 13.549 -8.226 -6.023 910 HD23 LEU 32 HD23 LEU 32 12.282 -7.924 -7.213 911 H CYS 33 HN CYS 33 11.099 -12.030 -3.337 912 HA CYS 33 HA CYS 33 9.490 -12.694 -5.584 913 HB2 CYS 33 HB2 CYS 33 11.280 -14.057 -4.089 914 HB3 CYS 33 HB1 CYS 33 9.803 -14.731 -3.403 915 HG CYS 33 HG CYS 33 10.087 -14.749 -6.501 916 H ASN 34 HN ASN 34 8.737 -12.510 -2.150 917 HA ASN 34 HA ASN 34 6.142 -13.726 -2.197 918 HB2 ASN 34 HB2 ASN 34 7.095 -11.436 -0.446 919 HB3 ASN 34 HB1 ASN 34 5.760 -12.529 -0.096 920 HD21 ASN 34 HD21 ASN 34 7.817 -14.628 -1.450 921 HD22 ASN 34 HD22 ASN 34 8.745 -15.083 -0.103 922 H ILE 35 HN ILE 35 7.208 -10.371 -2.671 923 HA ILE 35 HA ILE 35 4.636 -9.158 -2.745 924 HB ILE 35 HB ILE 35 7.236 -8.364 -4.104 925 HG12 ILE 35 HG12 ILE 35 5.878 -7.216 -1.645 926 HG13 ILE 35 HG11 ILE 35 7.125 -8.461 -1.565 927 HG21 ILE 35 HG21 ILE 35 4.598 -6.909 -3.833 928 HG22 ILE 35 HG22 ILE 35 5.498 -7.245 -5.311 929 HG23 ILE 35 HG23 ILE 35 6.115 -6.068 -4.151 930 HD11 ILE 35 HD11 ILE 35 8.228 -6.339 -1.264 931 HD12 ILE 35 HD12 ILE 35 7.403 -5.649 -2.664 932 HD13 ILE 35 HD13 ILE 35 8.624 -6.899 -2.889 933 H GLU 36 HN GLU 36 6.627 -10.510 -5.345 934 HA GLU 36 HA GLU 36 4.820 -9.865 -7.490 935 HB2 GLU 36 HB2 GLU 36 7.322 -10.627 -7.567 936 HB3 GLU 36 HB1 GLU 36 6.665 -12.261 -7.500 937 HG2 GLU 36 HG2 GLU 36 6.913 -11.729 -9.824 938 HG3 GLU 36 HG1 GLU 36 5.189 -11.631 -9.469 939 H GLN 37 HN GLN 37 5.059 -12.546 -5.224 940 HA GLN 37 HA GLN 37 2.877 -14.023 -6.615 941 HB2 GLN 37 HB2 GLN 37 4.724 -15.410 -5.895 942 HB3 GLN 37 HB1 GLN 37 4.680 -14.720 -4.273 943 HG2 GLN 37 HG2 GLN 37 2.637 -15.786 -3.747 944 HG3 GLN 37 HG1 GLN 37 2.287 -16.148 -5.438 945 HE21 GLN 37 HE21 GLN 37 2.258 -18.233 -3.529 946 HE22 GLN 37 HE22 GLN 37 3.584 -19.255 -3.803 947 H SER 38 HN SER 38 3.233 -11.665 -4.255 948 HA SER 38 HA SER 38 1.336 -12.440 -2.277 949 HB2 SER 38 HB2 SER 38 2.823 -10.557 -1.905 950 HB3 SER 38 HB1 SER 38 2.124 -9.686 -3.266 951 HG SER 38 HG SER 38 0.620 -10.588 -1.039 952 H GLU 39 HN GLU 39 -0.843 -11.920 -2.035 953 HA GLU 39 HA GLU 39 -2.439 -12.105 -4.424 954 HB2 GLU 39 HB2 GLU 39 -3.140 -11.529 -1.532 955 HB3 GLU 39 HB1 GLU 39 -4.355 -11.696 -2.797 956 HG2 GLU 39 HG2 GLU 39 -2.286 -13.858 -2.465 957 HG3 GLU 39 HG1 GLU 39 -3.658 -13.802 -1.360 958 H THR 40 HN THR 40 -4.095 -9.963 -2.555 959 HA THR 40 HA THR 40 -3.737 -7.808 -4.522 960 HB THR 40 HB THR 40 -5.676 -6.790 -3.433 961 HG1 THR 40 HG1 THR 40 -4.916 -8.496 -1.432 962 HG21 THR 40 HG21 THR 40 -7.272 -8.773 -3.647 963 HG22 THR 40 HG22 THR 40 -5.845 -9.755 -3.977 964 HG23 THR 40 HG23 THR 40 -6.270 -8.424 -5.054 965 H ALA 41 HN ALA 41 -3.720 -5.542 -3.669 966 HA ALA 41 HA ALA 41 -1.405 -5.200 -1.952 967 HB1 ALA 41 HB1 ALA 41 -1.396 -3.541 -3.576 968 HB2 ALA 41 HB2 ALA 41 -2.276 -2.656 -2.329 969 HB3 ALA 41 HB3 ALA 41 -3.153 -3.454 -3.633 970 HA PRO 42 HA PRO 42 -3.509 -4.607 1.884 971 HB2 PRO 42 HB2 PRO 42 -1.947 -2.702 3.099 972 HB3 PRO 42 HB1 PRO 42 -1.444 -4.390 2.892 973 HG2 PRO 42 HG2 PRO 42 -0.715 -1.990 1.268 974 HG3 PRO 42 HG1 PRO 42 0.303 -3.339 1.805 975 HD2 PRO 42 HD2 PRO 42 -0.696 -3.185 -0.728 976 HD3 PRO 42 HD1 PRO 42 -0.400 -4.734 0.089 977 H VAL 43 HN VAL 43 -4.773 -3.111 3.153 978 HA VAL 43 HA VAL 43 -6.364 -1.302 1.653 979 HB VAL 43 HB VAL 43 -7.068 -0.460 3.973 980 HG11 VAL 43 HG11 VAL 43 -7.107 -3.410 3.288 981 HG12 VAL 43 HG12 VAL 43 -8.333 -2.204 2.898 982 HG13 VAL 43 HG13 VAL 43 -8.083 -2.696 4.572 983 HG21 VAL 43 HG21 VAL 43 -5.317 -2.748 4.922 984 HG22 VAL 43 HG22 VAL 43 -6.222 -1.601 5.910 985 HG23 VAL 43 HG23 VAL 43 -4.809 -1.061 5.004 986 H VAL 44 HN VAL 44 -3.265 -0.937 3.022 987 HA VAL 44 HA VAL 44 -3.181 1.848 3.622 988 HB VAL 44 HB VAL 44 -1.007 0.017 2.542 989 HG11 VAL 44 HG11 VAL 44 0.479 1.756 3.701 990 HG12 VAL 44 HG12 VAL 44 -0.941 2.801 3.718 991 HG13 VAL 44 HG13 VAL 44 -0.268 2.255 2.182 992 HG21 VAL 44 HG21 VAL 44 -1.842 -0.809 4.648 993 HG22 VAL 44 HG22 VAL 44 -1.866 0.812 5.335 994 HG23 VAL 44 HG23 VAL 44 -0.327 0.027 4.989 995 H VAL 45 HN VAL 45 -2.568 0.089 0.599 996 HA VAL 45 HA VAL 45 -1.809 2.337 -0.990 997 HB VAL 45 HB VAL 45 -3.205 -0.217 -1.865 998 HG11 VAL 45 HG11 VAL 45 -1.665 1.933 -3.331 999 HG12 VAL 45 HG12 VAL 45 -3.286 1.330 -3.673 1000 HG13 VAL 45 HG13 VAL 45 -1.881 0.315 -3.999 1001 HG21 VAL 45 HG21 VAL 45 -0.752 -0.827 -2.428 1002 HG22 VAL 45 HG22 VAL 45 -1.228 -0.886 -0.733 1003 HG23 VAL 45 HG23 VAL 45 -0.313 0.490 -1.341 1004 H LYS 46 HN LYS 46 -4.966 0.851 -0.353 1005 HA LYS 46 HA LYS 46 -6.551 2.380 -2.147 1006 HB2 LYS 46 HB2 LYS 46 -7.311 1.422 0.640 1007 HB3 LYS 46 HB1 LYS 46 -8.430 1.823 -0.659 1008 HG2 LYS 46 HG2 LYS 46 -6.353 -0.381 -0.809 1009 HG3 LYS 46 HG1 LYS 46 -8.055 -0.640 -0.426 1010 HD2 LYS 46 HD2 LYS 46 -8.540 0.598 -2.651 1011 HD3 LYS 46 HD1 LYS 46 -6.840 0.314 -3.019 1012 HE2 LYS 46 HE2 LYS 46 -7.148 -2.093 -2.734 1013 HE3 LYS 46 HE1 LYS 46 -8.843 -1.839 -2.313 1014 HZ1 LYS 46 HZ1 LYS 46 -7.638 -1.959 -4.880 1015 HZ2 LYS 46 HZ2 LYS 46 -8.445 -0.478 -4.675 1016 HZ3 LYS 46 HZ3 LYS 46 -9.284 -1.942 -4.471 1017 H TYR 47 HN TYR 47 -5.485 3.067 1.152 1018 HA TYR 47 HA TYR 47 -6.937 5.493 1.550 1019 HB2 TYR 47 HB2 TYR 47 -5.683 4.168 3.310 1020 HB3 TYR 47 HB1 TYR 47 -4.186 4.818 2.643 1021 HD1 TYR 47 HD1 TYR 47 -3.691 7.237 2.777 1022 HD2 TYR 47 HD2 TYR 47 -7.206 5.548 4.574 1023 HE1 TYR 47 HE1 TYR 47 -4.014 9.304 4.108 1024 HE2 TYR 47 HE2 TYR 47 -7.523 7.622 5.899 1025 HH TYR 47 HH TYR 47 -5.973 9.509 6.752 1026 H ILE 48 HN ILE 48 -3.704 4.864 0.224 1027 HA ILE 48 HA ILE 48 -2.951 7.589 -0.220 1028 HB ILE 48 HB ILE 48 -2.114 5.002 -1.571 1029 HG12 ILE 48 HG12 ILE 48 -0.603 6.782 0.358 1030 HG13 ILE 48 HG11 ILE 48 -1.582 5.414 0.885 1031 HG21 ILE 48 HG21 ILE 48 -0.083 6.530 -2.227 1032 HG22 ILE 48 HG22 ILE 48 -1.243 7.843 -2.026 1033 HG23 ILE 48 HG23 ILE 48 -1.547 6.576 -3.209 1034 HD11 ILE 48 HD11 ILE 48 0.593 5.120 -1.194 1035 HD12 ILE 48 HD12 ILE 48 -0.195 3.852 -0.258 1036 HD13 ILE 48 HD13 ILE 48 0.923 4.963 0.531 1037 H ALA 49 HN ALA 49 -4.569 5.201 -2.284 1038 HA ALA 49 HA ALA 49 -4.701 6.738 -4.671 1039 HB1 ALA 49 HB1 ALA 49 -6.627 4.661 -3.574 1040 HB2 ALA 49 HB2 ALA 49 -5.267 4.361 -4.655 1041 HB3 ALA 49 HB3 ALA 49 -6.662 5.276 -5.227 1042 H PHE 50 HN PHE 50 -6.750 6.713 -1.797 1043 HA PHE 50 HA PHE 50 -8.900 8.282 -2.827 1044 HB2 PHE 50 HB2 PHE 50 -8.655 7.037 -0.526 1045 HB3 PHE 50 HB1 PHE 50 -7.918 8.542 0.026 1046 HD1 PHE 50 HD1 PHE 50 -10.898 7.393 -1.953 1047 HD2 PHE 50 HD2 PHE 50 -9.342 10.164 0.940 1048 HE1 PHE 50 HE1 PHE 50 -13.154 8.389 -1.693 1049 HE2 PHE 50 HE2 PHE 50 -11.598 11.158 1.196 1050 HZ PHE 50 HZ PHE 50 -13.504 10.271 -0.117 1051 H LEU 51 HN LEU 51 -5.923 9.221 -1.102 1052 HA LEU 51 HA LEU 51 -6.379 12.063 -1.268 1053 HB2 LEU 51 HB2 LEU 51 -3.802 10.467 -1.042 1054 HB3 LEU 51 HB1 LEU 51 -3.895 12.218 -0.874 1055 HG LEU 51 HG LEU 51 -5.486 10.284 0.835 1056 HD11 LEU 51 HD11 LEU 51 -2.776 11.556 1.246 1057 HD12 LEU 51 HD12 LEU 51 -3.233 9.862 1.426 1058 HD13 LEU 51 HD13 LEU 51 -3.775 11.052 2.608 1059 HD21 LEU 51 HD21 LEU 51 -5.447 12.450 2.323 1060 HD22 LEU 51 HD22 LEU 51 -6.568 12.373 0.971 1061 HD23 LEU 51 HD23 LEU 51 -5.063 13.276 0.814 1062 H ARG 52 HN ARG 52 -4.751 9.740 -3.349 1063 HA ARG 52 HA ARG 52 -3.623 11.561 -5.209 1064 HB2 ARG 52 HB2 ARG 52 -3.404 8.924 -4.946 1065 HB3 ARG 52 HB1 ARG 52 -4.728 8.895 -6.106 1066 HG2 ARG 52 HG2 ARG 52 -2.126 10.402 -6.532 1067 HG3 ARG 52 HG1 ARG 52 -2.454 8.797 -7.180 1068 HD2 ARG 52 HD2 ARG 52 -4.675 10.065 -8.086 1069 HD3 ARG 52 HD1 ARG 52 -3.570 11.438 -8.015 1070 HE ARG 52 HE ARG 52 -2.415 10.518 -9.841 1071 HH11 ARG 52 HH21 ARG 52 -4.412 8.143 -8.283 1072 HH12 ARG 52 HH22 ARG 52 -4.124 6.939 -9.495 1073 HH21 ARG 52 HH11 ARG 52 -2.060 8.956 -11.409 1074 HH22 ARG 52 HH12 ARG 52 -2.798 7.398 -11.253 1075 H SER 53 HN SER 53 -6.828 10.052 -5.065 1076 HA SER 53 HA SER 53 -7.833 10.952 -7.563 1077 HB2 SER 53 HB2 SER 53 -9.033 9.337 -6.105 1078 HB3 SER 53 HB1 SER 53 -9.347 10.624 -4.946 1079 HG SER 53 HG SER 53 -10.253 10.403 -7.626 1080 H LYS 54 HN LYS 54 -7.472 12.569 -4.467 1081 HA LYS 54 HA LYS 54 -8.961 14.952 -5.273 1082 HB2 LYS 54 HB2 LYS 54 -7.146 14.330 -2.929 1083 HB3 LYS 54 HB1 LYS 54 -7.962 15.881 -3.132 1084 HG2 LYS 54 HG2 LYS 54 -10.140 14.709 -3.189 1085 HG3 LYS 54 HG1 LYS 54 -9.309 13.171 -2.954 1086 HD2 LYS 54 HD2 LYS 54 -8.458 13.928 -0.786 1087 HD3 LYS 54 HD1 LYS 54 -9.203 15.509 -1.025 1088 HE2 LYS 54 HE2 LYS 54 -10.630 14.115 0.406 1089 HE3 LYS 54 HE1 LYS 54 -11.430 14.426 -1.135 1090 HZ1 LYS 54 HZ1 LYS 54 -11.648 12.127 -0.641 1091 HZ2 LYS 54 HZ2 LYS 54 -9.984 11.965 -0.330 1092 HZ3 LYS 54 HZ3 LYS 54 -10.531 12.265 -1.910 1093 H GLY 55 HN GLY 55 -6.117 13.713 -6.260 1094 HA2 GLY 55 HA2 GLY 55 -4.312 14.594 -7.450 1095 HA3 GLY 55 HA1 GLY 55 -5.234 16.092 -7.577 1096 H VAL 56 HN VAL 56 -4.292 14.579 -4.541 1097 HA VAL 56 HA VAL 56 -3.197 17.003 -3.462 1098 HB VAL 56 HB VAL 56 -2.927 14.094 -2.645 1099 HG11 VAL 56 HG11 VAL 56 -0.990 15.110 -1.724 1100 HG12 VAL 56 HG12 VAL 56 -2.178 15.159 -0.419 1101 HG13 VAL 56 HG13 VAL 56 -1.846 16.609 -1.368 1102 HG21 VAL 56 HG21 VAL 56 -5.152 15.429 -2.535 1103 HG22 VAL 56 HG22 VAL 56 -4.389 16.318 -1.221 1104 HG23 VAL 56 HG23 VAL 56 -4.634 14.577 -1.082 1105 H ASP 57 HN ASP 57 -1.920 14.549 -5.478 1106 HA ASP 57 HA ASP 57 0.113 14.436 -6.636 1107 HB2 ASP 57 HB2 ASP 57 -0.028 17.044 -6.294 1108 HB3 ASP 57 HB1 ASP 57 1.210 16.771 -5.070 1109 H LEU 58 HN LEU 58 -0.414 12.896 -4.417 1110 HA LEU 58 HA LEU 58 1.587 12.923 -2.388 1111 HB2 LEU 58 HB2 LEU 58 -0.485 11.652 -2.170 1112 HB3 LEU 58 HB1 LEU 58 -0.043 10.641 -3.543 1113 HG LEU 58 HG LEU 58 2.021 10.758 -1.387 1114 HD11 LEU 58 HD11 LEU 58 -0.756 9.752 -0.846 1115 HD12 LEU 58 HD12 LEU 58 0.332 10.652 0.203 1116 HD13 LEU 58 HD13 LEU 58 0.626 8.942 -0.107 1117 HD21 LEU 58 HD21 LEU 58 1.939 8.253 -1.792 1118 HD22 LEU 58 HD22 LEU 58 2.335 9.213 -3.212 1119 HD23 LEU 58 HD23 LEU 58 0.716 8.557 -3.019 1120 H ASN 59 HN ASN 59 1.414 11.304 -5.540 1121 HA ASN 59 HA ASN 59 3.597 9.606 -5.475 1122 HB2 ASN 59 HB2 ASN 59 3.910 10.099 -7.896 1123 HB3 ASN 59 HB1 ASN 59 2.212 9.886 -7.483 1124 HD21 ASN 59 HD21 ASN 59 0.840 11.840 -7.419 1125 HD22 ASN 59 HD22 ASN 59 1.336 13.269 -8.189 1126 H ALA 60 HN ALA 60 3.661 13.115 -5.866 1127 HA ALA 60 HA ALA 60 6.553 13.283 -6.128 1128 HB1 ALA 60 HB1 ALA 60 6.174 15.718 -5.801 1129 HB2 ALA 60 HB2 ALA 60 4.492 15.389 -5.382 1130 HB3 ALA 60 HB3 ALA 60 5.076 15.050 -7.011 1131 H LEU 61 HN LEU 61 4.218 13.454 -3.514 1132 HA LEU 61 HA LEU 61 5.873 14.485 -1.459 1133 HB2 LEU 61 HB2 LEU 61 3.387 14.161 -1.288 1134 HB3 LEU 61 HB1 LEU 61 3.655 12.423 -1.195 1135 HG LEU 61 HG LEU 61 5.069 12.790 0.838 1136 HD11 LEU 61 HD11 LEU 61 5.857 14.982 0.776 1137 HD12 LEU 61 HD12 LEU 61 4.530 15.147 1.918 1138 HD13 LEU 61 HD13 LEU 61 4.312 15.641 0.241 1139 HD21 LEU 61 HD21 LEU 61 3.230 12.974 2.321 1140 HD22 LEU 61 HD22 LEU 61 2.525 12.332 0.838 1141 HD23 LEU 61 HD23 LEU 61 2.349 14.043 1.232 1142 H PHE 62 HN PHE 62 5.334 11.176 -2.579 1143 HA PHE 62 HA PHE 62 7.024 9.922 -0.592 1144 HB2 PHE 62 HB2 PHE 62 5.719 9.088 -3.162 1145 HB3 PHE 62 HB1 PHE 62 7.007 8.068 -2.529 1146 HD1 PHE 62 HD1 PHE 62 4.341 10.059 -0.789 1147 HD2 PHE 62 HD2 PHE 62 6.020 6.184 -1.580 1148 HE1 PHE 62 HE1 PHE 62 2.760 9.040 0.823 1149 HE2 PHE 62 HE2 PHE 62 4.440 5.170 0.030 1150 HZ PHE 62 HZ PHE 62 2.804 6.593 1.227 1151 H ASP 63 HN ASP 63 7.533 10.929 -3.965 1152 HA ASP 63 HA ASP 63 10.032 9.801 -4.449 1153 HB2 ASP 63 HB2 ASP 63 8.822 11.030 -6.175 1154 HB3 ASP 63 HB1 ASP 63 9.052 12.541 -5.296 1155 H ARG 64 HN ARG 64 9.336 12.861 -2.813 1156 HA ARG 64 HA ARG 64 12.061 13.636 -2.429 1157 HB2 ARG 64 HB2 ARG 64 11.207 15.326 -1.009 1158 HB3 ARG 64 HB1 ARG 64 9.922 15.032 -2.171 1159 HG2 ARG 64 HG2 ARG 64 8.532 14.755 -0.374 1160 HG3 ARG 64 HG1 ARG 64 9.330 13.207 -0.125 1161 HD2 ARG 64 HD2 ARG 64 9.395 14.490 1.947 1162 HD3 ARG 64 HD1 ARG 64 11.027 14.342 1.295 1163 HE ARG 64 HE ARG 64 11.010 16.673 0.777 1164 HH11 ARG 64 HH21 ARG 64 7.952 15.518 1.922 1165 HH12 ARG 64 HH22 ARG 64 7.323 17.107 2.200 1166 HH21 ARG 64 HH11 ARG 64 10.191 18.733 1.139 1167 HH22 ARG 64 HH12 ARG 64 8.584 18.919 1.757 1168 H ILE 65 HN ILE 65 10.437 10.994 -1.166 1169 HA ILE 65 HA ILE 65 11.910 10.953 1.426 1170 HB ILE 65 HB ILE 65 10.073 8.831 0.268 1171 HG12 ILE 65 HG12 ILE 65 8.848 10.942 0.390 1172 HG13 ILE 65 HG11 ILE 65 8.309 9.879 1.686 1173 HG21 ILE 65 HG21 ILE 65 9.838 8.192 2.644 1174 HG22 ILE 65 HG22 ILE 65 10.958 9.475 3.095 1175 HG23 ILE 65 HG23 ILE 65 11.521 8.114 2.125 1176 HD11 ILE 65 HD11 ILE 65 10.080 11.086 3.146 1177 HD12 ILE 65 HD12 ILE 65 8.619 11.975 2.738 1178 HD13 ILE 65 HD13 ILE 65 10.109 12.285 1.863 1179 H ILE 66 HN ILE 66 11.497 8.826 -1.418 1180 HA ILE 66 HA ILE 66 13.713 7.128 -0.712 1181 HB ILE 66 HB ILE 66 13.496 6.307 -3.088 1182 HG12 ILE 66 HG12 ILE 66 11.231 8.319 -3.176 1183 HG13 ILE 66 HG11 ILE 66 12.757 8.503 -4.038 1184 HG21 ILE 66 HG21 ILE 66 10.836 6.542 -1.658 1185 HG22 ILE 66 HG22 ILE 66 12.128 5.467 -1.122 1186 HG23 ILE 66 HG23 ILE 66 11.383 5.231 -2.703 1187 HD11 ILE 66 HD11 ILE 66 11.148 7.574 -5.587 1188 HD12 ILE 66 HD12 ILE 66 10.689 6.322 -4.433 1189 HD13 ILE 66 HD13 ILE 66 12.291 6.297 -5.170 1190 H VAL 67 HN VAL 67 15.800 7.238 -1.207 1191 HA VAL 67 HA VAL 67 16.824 9.091 -3.248 1192 HB VAL 67 HB VAL 67 18.389 10.170 -1.586 1193 HG11 VAL 67 HG11 VAL 67 16.815 11.823 -0.900 1194 HG12 VAL 67 HG12 VAL 67 15.486 10.665 -0.919 1195 HG13 VAL 67 HG13 VAL 67 16.222 11.187 -2.434 1196 HG21 VAL 67 HG21 VAL 67 17.468 10.122 0.828 1197 HG22 VAL 67 HG22 VAL 67 18.345 8.692 0.297 1198 HG23 VAL 67 HG23 VAL 67 16.585 8.679 0.344 1199 H ASN 68 HN ASN 68 19.326 8.729 -1.237 1200 HA ASN 68 HA ASN 68 20.400 6.427 -2.722 1201 HB2 ASN 68 HB2 ASN 68 21.546 8.430 -0.767 1202 HB3 ASN 68 HB1 ASN 68 22.466 7.009 -1.255 1203 HD21 ASN 68 HD21 ASN 68 23.920 7.620 -2.854 1204 HD22 ASN 68 HD22 ASN 68 23.567 8.658 -4.150 1205 H LYS 69 HN LYS 69 18.515 6.757 -0.052 1206 HA LYS 69 HA LYS 69 17.997 5.398 1.776 1207 HB2 LYS 69 HB2 LYS 69 19.402 3.388 -0.002 1208 HB3 LYS 69 HB1 LYS 69 18.529 2.959 1.469 1209 HG2 LYS 69 HG2 LYS 69 16.470 3.946 0.560 1210 HG3 LYS 69 HG1 LYS 69 17.332 4.423 -0.904 1211 HD2 LYS 69 HD2 LYS 69 17.859 2.031 -1.342 1212 HD3 LYS 69 HD1 LYS 69 16.912 1.585 0.077 1213 HE2 LYS 69 HE2 LYS 69 15.810 3.136 -2.282 1214 HE3 LYS 69 HE1 LYS 69 15.629 1.394 -2.069 1215 HZ1 LYS 69 HZ1 LYS 69 13.813 1.901 -0.914 1216 HZ2 LYS 69 HZ2 LYS 69 14.228 3.544 -0.795 1217 HZ3 LYS 69 HZ3 LYS 69 14.851 2.426 0.322 1218 H LEU 70 HN LEU 70 19.359 6.585 3.188 1219 HA LEU 70 HA LEU 70 22.141 5.758 3.613 1220 HB2 LEU 70 HB2 LEU 70 20.409 7.606 5.290 1221 HB3 LEU 70 HB1 LEU 70 22.168 7.479 5.339 1222 HG LEU 70 HG LEU 70 20.546 8.340 2.924 1223 HD11 LEU 70 HD11 LEU 70 21.496 10.563 3.351 1224 HD12 LEU 70 HD12 LEU 70 22.335 9.947 4.775 1225 HD13 LEU 70 HD13 LEU 70 20.573 10.019 4.752 1226 HD21 LEU 70 HD21 LEU 70 22.982 9.065 2.238 1227 HD22 LEU 70 HD22 LEU 70 22.495 7.387 2.033 1228 HD23 LEU 70 HD23 LEU 70 23.482 7.852 3.418 1229 H GLU 71 HN GLU 71 20.351 3.613 3.934 1230 HA GLU 71 HA GLU 71 21.172 2.672 6.536 1231 HB2 GLU 71 HB2 GLU 71 19.231 4.129 7.162 1232 HB3 GLU 71 HB1 GLU 71 18.196 3.089 6.183 1233 HG2 GLU 71 HG2 GLU 71 18.766 1.153 7.552 1234 HG3 GLU 71 HG1 GLU 71 19.917 2.114 8.482 1235 H HIS 72 HN HIS 72 21.405 0.529 6.374 1236 HA HIS 72 HA HIS 72 20.230 -0.884 4.038 1237 HB2 HIS 72 HB2 HIS 72 22.635 -1.149 4.374 1238 HB3 HIS 72 HB1 HIS 72 22.375 -1.696 6.030 1239 HD2 HIS 72 HD2 HIS 72 23.163 -4.376 5.647 1240 HE1 HIS 72 HE1 HIS 72 20.371 -5.288 2.612 1241 HE2 HIS 72 HE2 HIS 72 22.112 -6.259 4.180 1242 H HIS 73 HN HIS 73 18.245 -0.353 5.673 1243 HA HIS 73 HA HIS 73 16.622 -1.209 7.159 1244 HB2 HIS 73 HB2 HIS 73 17.419 -3.818 5.851 1245 HB3 HIS 73 HB1 HIS 73 15.835 -3.371 6.486 1246 HD2 HIS 73 HD2 HIS 73 17.849 -3.051 3.199 1247 HE1 HIS 73 HE1 HIS 73 14.397 -0.656 2.755 1248 HE2 HIS 73 HE2 HIS 73 16.379 -1.674 1.541 1249 H HIS 74 HN HIS 74 16.363 -3.682 8.378 1250 HA HIS 74 HA HIS 74 18.810 -3.877 10.117 1251 HB2 HIS 74 HB2 HIS 74 16.922 -2.648 11.230 1252 HB3 HIS 74 HB1 HIS 74 15.930 -4.095 11.046 1253 HD2 HIS 74 HD2 HIS 74 16.199 -5.819 13.200 1254 HE1 HIS 74 HE1 HIS 74 19.978 -4.499 14.550 1255 HE2 HIS 74 HE2 HIS 74 18.060 -6.094 15.008 1256 H HIS 75 HN HIS 75 16.317 -5.788 11.205 1257 HA HIS 75 HA HIS 75 16.778 -8.097 9.442 1258 HB2 HIS 75 HB2 HIS 75 18.705 -7.985 11.130 1259 HB3 HIS 75 HB1 HIS 75 17.500 -8.309 12.377 1260 HD2 HIS 75 HD2 HIS 75 18.287 -10.102 8.893 1261 HE1 HIS 75 HE1 HIS 75 17.587 -13.029 11.854 1262 HE2 HIS 75 HE2 HIS 75 18.145 -12.653 9.408 1263 H HIS 76 HN HIS 76 14.455 -7.623 9.257 1264 HA HIS 76 HA HIS 76 12.730 -7.967 11.595 1265 HB2 HIS 76 HB2 HIS 76 12.097 -7.778 8.633 1266 HB3 HIS 76 HB1 HIS 76 10.888 -7.807 9.916 1267 HD2 HIS 76 HD2 HIS 76 13.889 -5.431 8.825 1268 HE1 HIS 76 HE1 HIS 76 11.123 -3.203 11.111 1269 HE2 HIS 76 HE2 HIS 76 13.263 -3.077 9.755 1270 H HIS 77 HN HIS 77 10.833 -9.532 11.279 1271 HA HIS 77 HA HIS 77 10.193 -11.758 11.518 1272 HB2 HIS 77 HB2 HIS 77 10.276 -13.058 9.474 1273 HB3 HIS 77 HB1 HIS 77 9.912 -11.381 9.077 1274 HD2 HIS 77 HD2 HIS 77 13.076 -13.786 8.926 1275 HE1 HIS 77 HE1 HIS 77 13.621 -10.609 6.195 1276 HE2 HIS 77 HE2 HIS 77 14.588 -12.793 7.047 Start of MODEL 18 1 H1 MET 1 HT1 MET 1 9.614 18.614 7.677 2 H2 MET 1 HT2 MET 1 10.683 17.447 7.059 3 H3 MET 1 HT3 MET 1 9.701 17.081 8.396 4 HA MET 1 HA MET 1 7.722 17.221 7.055 5 HB2 MET 1 HB2 MET 1 9.720 17.947 4.893 6 HB3 MET 1 HB1 MET 1 8.049 17.485 4.562 7 HG2 MET 1 HG2 MET 1 7.230 19.342 5.925 8 HG3 MET 1 HG1 MET 1 8.879 19.775 6.366 9 HE1 MET 1 HE1 MET 1 6.359 19.137 3.773 10 HE2 MET 1 HE2 MET 1 7.581 18.700 2.583 11 HE3 MET 1 HE3 MET 1 6.695 20.211 2.409 12 H GLU 2 HN GLU 2 8.362 15.088 8.093 13 HA GLU 2 HA GLU 2 9.795 13.174 6.406 14 HB2 GLU 2 HB2 GLU 2 8.284 12.911 9.018 15 HB3 GLU 2 HB1 GLU 2 9.070 11.550 8.215 16 HG2 GLU 2 HG2 GLU 2 10.502 14.111 8.975 17 HG3 GLU 2 HG1 GLU 2 10.496 12.657 9.974 18 H LEU 3 HN LEU 3 8.565 10.921 6.196 19 HA LEU 3 HA LEU 3 6.490 11.306 4.286 20 HB2 LEU 3 HB2 LEU 3 7.944 9.293 4.386 21 HB3 LEU 3 HB1 LEU 3 7.159 8.816 5.889 22 HG LEU 3 HG LEU 3 4.975 8.710 4.679 23 HD11 LEU 3 HD11 LEU 3 5.127 10.137 2.828 24 HD12 LEU 3 HD12 LEU 3 5.324 8.560 2.072 25 HD13 LEU 3 HD13 LEU 3 6.736 9.567 2.389 26 HD21 LEU 3 HD21 LEU 3 5.518 6.650 3.401 27 HD22 LEU 3 HD22 LEU 3 6.322 6.684 4.970 28 HD23 LEU 3 HD23 LEU 3 7.231 7.056 3.507 29 H SER 4 HN SER 4 6.338 10.293 7.710 30 HA SER 4 HA SER 4 3.477 9.974 7.734 31 HB2 SER 4 HB2 SER 4 3.752 9.971 10.197 32 HB3 SER 4 HB1 SER 4 4.924 8.921 9.404 33 HG SER 4 HG SER 4 6.492 10.247 9.943 34 H ASN 5 HN ASN 5 5.616 12.688 8.548 35 HA ASN 5 HA ASN 5 3.595 14.400 9.623 36 HB2 ASN 5 HB2 ASN 5 5.979 14.838 9.939 37 HB3 ASN 5 HB1 ASN 5 6.192 15.064 8.204 38 HD21 ASN 5 HD21 ASN 5 5.396 16.676 11.139 39 HD22 ASN 5 HD22 ASN 5 4.901 18.150 10.455 40 H GLU 6 HN GLU 6 4.848 14.006 6.313 41 HA GLU 6 HA GLU 6 3.220 16.102 5.183 42 HB2 GLU 6 HB2 GLU 6 4.586 13.686 3.951 43 HB3 GLU 6 HB1 GLU 6 3.798 14.955 3.010 44 HG2 GLU 6 HG2 GLU 6 5.306 16.634 3.875 45 HG3 GLU 6 HG1 GLU 6 5.995 15.493 5.031 46 H LEU 7 HN LEU 7 2.795 12.612 5.631 47 HA LEU 7 HA LEU 7 0.402 12.311 4.110 48 HB2 LEU 7 HB2 LEU 7 1.783 10.418 4.982 49 HB3 LEU 7 HB1 LEU 7 1.232 10.800 6.612 50 HG LEU 7 HG LEU 7 -1.121 10.429 5.871 51 HD11 LEU 7 HD11 LEU 7 0.269 9.951 3.245 52 HD12 LEU 7 HD12 LEU 7 -1.254 10.778 3.574 53 HD13 LEU 7 HD13 LEU 7 -1.184 9.019 3.615 54 HD21 LEU 7 HD21 LEU 7 0.864 8.176 5.449 55 HD22 LEU 7 HD22 LEU 7 -0.878 7.929 5.581 56 HD23 LEU 7 HD23 LEU 7 0.024 8.594 6.943 57 H LYS 8 HN LYS 8 0.941 13.171 7.520 58 HA LYS 8 HA LYS 8 -1.862 13.262 8.174 59 HB2 LYS 8 HB2 LYS 8 0.566 14.517 9.456 60 HB3 LYS 8 HB1 LYS 8 -1.054 14.640 10.139 61 HG2 LYS 8 HG2 LYS 8 -1.179 12.119 10.094 62 HG3 LYS 8 HG1 LYS 8 0.522 12.098 9.630 63 HD2 LYS 8 HD2 LYS 8 -0.465 13.534 12.106 64 HD3 LYS 8 HD1 LYS 8 0.022 11.843 12.133 65 HE2 LYS 8 HE2 LYS 8 1.749 14.225 11.399 66 HE3 LYS 8 HE1 LYS 8 1.928 13.168 12.796 67 HZ1 LYS 8 HZ1 LYS 8 2.830 12.790 10.112 68 HZ2 LYS 8 HZ2 LYS 8 1.930 11.463 10.674 69 HZ3 LYS 8 HZ3 LYS 8 3.298 11.991 11.532 70 H VAL 9 HN VAL 9 0.480 15.740 7.141 71 HA VAL 9 HA VAL 9 -1.026 18.055 7.466 72 HB VAL 9 HB VAL 9 0.852 17.218 5.249 73 HG11 VAL 9 HG11 VAL 9 0.908 19.768 4.783 74 HG12 VAL 9 HG12 VAL 9 -0.651 19.812 5.606 75 HG13 VAL 9 HG13 VAL 9 -0.454 18.848 4.143 76 HG21 VAL 9 HG21 VAL 9 2.469 18.469 6.424 77 HG22 VAL 9 HG22 VAL 9 1.561 17.682 7.713 78 HG23 VAL 9 HG23 VAL 9 1.255 19.377 7.323 79 H GLU 10 HN GLU 10 -0.953 16.253 4.358 80 HA GLU 10 HA GLU 10 -3.130 17.595 3.195 81 HB2 GLU 10 HB2 GLU 10 -3.363 15.226 1.967 82 HB3 GLU 10 HB1 GLU 10 -2.001 16.299 1.643 83 HG2 GLU 10 HG2 GLU 10 -0.485 14.952 2.734 84 HG3 GLU 10 HG1 GLU 10 -1.636 14.479 3.972 85 H ARG 11 HN ARG 11 -3.139 14.632 5.142 86 HA ARG 11 HA ARG 11 -5.925 14.115 4.949 87 HB2 ARG 11 HB2 ARG 11 -4.268 12.522 5.831 88 HB3 ARG 11 HB1 ARG 11 -3.986 13.571 7.217 89 HG2 ARG 11 HG2 ARG 11 -6.812 13.163 7.143 90 HG3 ARG 11 HG1 ARG 11 -6.104 11.589 6.804 91 HD2 ARG 11 HD2 ARG 11 -5.076 11.433 8.882 92 HD3 ARG 11 HD1 ARG 11 -5.000 13.176 9.116 93 HE ARG 11 HE ARG 11 -7.134 11.491 9.993 94 HH11 ARG 11 HH21 ARG 11 -6.488 14.511 8.431 95 HH12 ARG 11 HH22 ARG 11 -7.914 15.278 9.047 96 HH21 ARG 11 HH11 ARG 11 -8.972 12.501 10.824 97 HH22 ARG 11 HH12 ARG 11 -9.312 14.145 10.402 98 H ILE 12 HN ILE 12 -4.066 16.102 7.232 99 HA ILE 12 HA ILE 12 -6.294 16.912 8.860 100 HB ILE 12 HB ILE 12 -3.558 18.131 8.380 101 HG12 ILE 12 HG12 ILE 12 -4.629 16.765 10.860 102 HG13 ILE 12 HG11 ILE 12 -3.853 15.858 9.559 103 HG21 ILE 12 HG21 ILE 12 -5.796 18.961 10.234 104 HG22 ILE 12 HG22 ILE 12 -4.899 19.962 9.093 105 HG23 ILE 12 HG23 ILE 12 -4.112 19.373 10.558 106 HD11 ILE 12 HD11 ILE 12 -1.844 17.307 9.779 107 HD12 ILE 12 HD12 ILE 12 -2.194 16.437 11.273 108 HD13 ILE 12 HD13 ILE 12 -2.616 18.144 11.126 109 H ARG 13 HN ARG 13 -4.656 18.404 6.062 110 HA ARG 13 HA ARG 13 -6.032 20.859 6.009 111 HB2 ARG 13 HB2 ARG 13 -4.941 19.119 3.790 112 HB3 ARG 13 HB1 ARG 13 -5.674 20.686 3.456 113 HG2 ARG 13 HG2 ARG 13 -4.042 21.705 5.091 114 HG3 ARG 13 HG1 ARG 13 -3.242 20.135 5.188 115 HD2 ARG 13 HD2 ARG 13 -3.577 21.859 2.710 116 HD3 ARG 13 HD1 ARG 13 -2.066 21.472 3.537 117 HE ARG 13 HE ARG 13 -3.441 19.081 2.702 118 HH11 ARG 13 HH21 ARG 13 -1.509 21.725 1.622 119 HH12 ARG 13 HH22 ARG 13 -0.835 20.851 0.286 120 HH21 ARG 13 HH11 ARG 13 -2.564 17.927 0.975 121 HH22 ARG 13 HH12 ARG 13 -1.429 18.704 -0.078 122 H LEU 14 HN LEU 14 -6.986 17.730 4.603 123 HA LEU 14 HA LEU 14 -9.577 18.855 3.737 124 HB2 LEU 14 HB2 LEU 14 -8.499 16.016 3.645 125 HB3 LEU 14 HB1 LEU 14 -9.968 16.584 2.854 126 HG LEU 14 HG LEU 14 -7.170 17.618 2.296 127 HD11 LEU 14 HD11 LEU 14 -8.957 15.631 0.889 128 HD12 LEU 14 HD12 LEU 14 -7.267 15.451 1.360 129 HD13 LEU 14 HD13 LEU 14 -7.700 16.512 0.021 130 HD21 LEU 14 HD21 LEU 14 -9.915 18.382 1.308 131 HD22 LEU 14 HD22 LEU 14 -8.535 18.533 0.220 132 HD23 LEU 14 HD23 LEU 14 -8.557 19.420 1.741 133 H SER 15 HN SER 15 -8.289 17.850 6.594 134 HA SER 15 HA SER 15 -9.131 16.794 8.535 135 HB2 SER 15 HB2 SER 15 -11.481 18.567 7.815 136 HB3 SER 15 HB1 SER 15 -11.026 18.014 9.426 137 HG SER 15 HG SER 15 -8.964 19.101 8.986 138 H LEU 16 HN LEU 16 -9.327 14.753 7.092 139 HA LEU 16 HA LEU 16 -12.079 13.983 6.394 140 HB2 LEU 16 HB2 LEU 16 -9.539 12.324 6.497 141 HB3 LEU 16 HB1 LEU 16 -11.055 11.849 5.730 142 HG LEU 16 HG LEU 16 -9.394 14.265 4.962 143 HD11 LEU 16 HD11 LEU 16 -8.334 12.086 4.394 144 HD12 LEU 16 HD12 LEU 16 -8.819 12.985 2.956 145 HD13 LEU 16 HD13 LEU 16 -9.794 11.628 3.518 146 HD21 LEU 16 HD21 LEU 16 -11.580 14.824 4.324 147 HD22 LEU 16 HD22 LEU 16 -12.029 13.147 4.009 148 HD23 LEU 16 HD23 LEU 16 -10.987 14.012 2.877 149 H THR 17 HN THR 17 -13.466 12.868 7.674 150 HA THR 17 HA THR 17 -12.715 12.411 10.466 151 HB THR 17 HB THR 17 -15.142 11.523 10.552 152 HG1 THR 17 HG1 THR 17 -16.263 11.595 8.761 153 HG21 THR 17 HG21 THR 17 -14.567 13.762 11.301 154 HG22 THR 17 HG22 THR 17 -16.054 13.842 10.355 155 HG23 THR 17 HG23 THR 17 -14.523 14.343 9.636 156 H ALA 18 HN ALA 18 -12.634 10.413 11.519 157 HA ALA 18 HA ALA 18 -11.596 8.203 10.030 158 HB1 ALA 18 HB1 ALA 18 -12.569 8.568 12.862 159 HB2 ALA 18 HB2 ALA 18 -10.918 8.344 12.292 160 HB3 ALA 18 HB3 ALA 18 -12.043 6.986 12.286 161 H LYS 19 HN LYS 19 -14.808 8.885 11.376 162 HA LYS 19 HA LYS 19 -15.944 6.335 10.794 163 HB2 LYS 19 HB2 LYS 19 -17.166 9.092 11.036 164 HB3 LYS 19 HB1 LYS 19 -18.113 7.614 10.912 165 HG2 LYS 19 HG2 LYS 19 -16.912 6.735 12.928 166 HG3 LYS 19 HG1 LYS 19 -16.124 8.304 13.092 167 HD2 LYS 19 HD2 LYS 19 -19.132 7.950 13.028 168 HD3 LYS 19 HD1 LYS 19 -18.197 8.002 14.521 169 HE2 LYS 19 HE2 LYS 19 -17.271 10.252 13.652 170 HE3 LYS 19 HE1 LYS 19 -18.591 10.199 12.483 171 HZ1 LYS 19 HZ1 LYS 19 -19.736 9.566 14.894 172 HZ2 LYS 19 HZ2 LYS 19 -19.869 11.042 14.063 173 HZ3 LYS 19 HZ3 LYS 19 -18.672 10.838 15.251 174 H SER 20 HN SER 20 -15.883 9.383 8.929 175 HA SER 20 HA SER 20 -17.393 8.382 6.712 176 HB2 SER 20 HB2 SER 20 -16.515 10.322 5.504 177 HB3 SER 20 HB1 SER 20 -16.952 10.796 7.143 178 HG SER 20 HG SER 20 -14.383 9.849 6.826 179 H VAL 21 HN VAL 21 -13.870 8.632 7.253 180 HA VAL 21 HA VAL 21 -13.144 7.464 4.734 181 HB VAL 21 HB VAL 21 -11.625 7.574 7.358 182 HG11 VAL 21 HG11 VAL 21 -10.785 6.894 4.535 183 HG12 VAL 21 HG12 VAL 21 -10.625 5.887 5.975 184 HG13 VAL 21 HG13 VAL 21 -9.637 7.338 5.796 185 HG21 VAL 21 HG21 VAL 21 -11.272 9.323 4.913 186 HG22 VAL 21 HG22 VAL 21 -10.651 9.588 6.542 187 HG23 VAL 21 HG23 VAL 21 -12.376 9.759 6.218 188 H ALA 22 HN ALA 22 -13.426 6.071 8.012 189 HA ALA 22 HA ALA 22 -12.710 3.412 7.240 190 HB1 ALA 22 HB1 ALA 22 -13.756 2.756 9.390 191 HB2 ALA 22 HB2 ALA 22 -14.453 4.370 9.533 192 HB3 ALA 22 HB3 ALA 22 -12.703 4.156 9.582 193 H GLU 23 HN GLU 23 -15.856 5.060 7.466 194 HA GLU 23 HA GLU 23 -17.430 2.729 6.870 195 HB2 GLU 23 HB2 GLU 23 -18.305 4.852 7.889 196 HB3 GLU 23 HB1 GLU 23 -18.114 5.631 6.320 197 HG2 GLU 23 HG2 GLU 23 -19.615 3.864 5.334 198 HG3 GLU 23 HG1 GLU 23 -19.901 3.272 6.972 199 H GLU 24 HN GLU 24 -16.236 5.401 4.815 200 HA GLU 24 HA GLU 24 -17.382 4.381 2.385 201 HB2 GLU 24 HB2 GLU 24 -15.032 6.238 2.872 202 HB3 GLU 24 HB1 GLU 24 -15.755 5.945 1.290 203 HG2 GLU 24 HG2 GLU 24 -17.428 6.857 3.635 204 HG3 GLU 24 HG1 GLU 24 -16.581 8.009 2.605 205 H MET 25 HN MET 25 -14.065 4.192 3.706 206 HA MET 25 HA MET 25 -13.070 2.539 1.573 207 HB2 MET 25 HB2 MET 25 -12.109 3.032 4.395 208 HB3 MET 25 HB1 MET 25 -11.226 2.033 3.242 209 HG2 MET 25 HG2 MET 25 -11.042 3.921 1.700 210 HG3 MET 25 HG1 MET 25 -12.010 4.924 2.779 211 HE1 MET 25 HE1 MET 25 -8.999 2.350 4.043 212 HE2 MET 25 HE2 MET 25 -7.793 3.341 3.232 213 HE3 MET 25 HE3 MET 25 -9.147 2.691 2.314 214 H GLY 26 HN GLY 26 -14.494 1.854 4.744 215 HA2 GLY 26 HA2 GLY 26 -15.713 -0.132 5.292 216 HA3 GLY 26 HA1 GLY 26 -15.054 -0.915 3.853 217 H ILE 27 HN ILE 27 -13.349 0.775 6.502 218 HA ILE 27 HA ILE 27 -11.973 -1.811 7.170 219 HB ILE 27 HB ILE 27 -9.911 -0.500 7.571 220 HG12 ILE 27 HG12 ILE 27 -11.349 1.786 6.197 221 HG13 ILE 27 HG11 ILE 27 -11.162 1.699 7.945 222 HG21 ILE 27 HG21 ILE 27 -9.355 -0.161 5.212 223 HG22 ILE 27 HG22 ILE 27 -11.069 -0.123 4.794 224 HG23 ILE 27 HG23 ILE 27 -10.340 -1.612 5.393 225 HD11 ILE 27 HD11 ILE 27 -9.386 3.017 6.561 226 HD12 ILE 27 HD12 ILE 27 -8.751 1.421 6.159 227 HD13 ILE 27 HD13 ILE 27 -8.836 1.940 7.842 228 H SER 28 HN SER 28 -11.056 -1.828 9.365 229 HA SER 28 HA SER 28 -12.974 -0.823 11.288 230 HB2 SER 28 HB2 SER 28 -11.923 -2.960 11.692 231 HB3 SER 28 HB1 SER 28 -10.317 -2.247 11.579 232 HG SER 28 HG SER 28 -11.670 -2.570 13.737 233 H ARG 29 HN ARG 29 -12.568 0.695 12.954 234 HA ARG 29 HA ARG 29 -11.052 3.014 12.225 235 HB2 ARG 29 HB2 ARG 29 -12.568 2.065 14.632 236 HB3 ARG 29 HB1 ARG 29 -11.449 3.405 14.873 237 HG2 ARG 29 HG2 ARG 29 -13.676 4.270 14.336 238 HG3 ARG 29 HG1 ARG 29 -12.561 4.637 13.019 239 HD2 ARG 29 HD2 ARG 29 -14.700 3.795 12.133 240 HD3 ARG 29 HD1 ARG 29 -13.395 2.664 11.773 241 HE ARG 29 HE ARG 29 -14.410 1.718 14.160 242 HH11 ARG 29 HH21 ARG 29 -15.731 2.620 11.098 243 HH12 ARG 29 HH22 ARG 29 -17.030 1.479 11.175 244 HH21 ARG 29 HH11 ARG 29 -16.101 0.219 14.270 245 HH22 ARG 29 HH12 ARG 29 -17.240 0.122 12.968 246 H GLN 30 HN GLN 30 -10.341 0.226 14.300 247 HA GLN 30 HA GLN 30 -7.973 1.190 15.529 248 HB2 GLN 30 HB2 GLN 30 -9.246 -1.014 15.949 249 HB3 GLN 30 HB1 GLN 30 -8.344 -1.663 14.581 250 HG2 GLN 30 HG2 GLN 30 -7.018 -0.352 16.972 251 HG3 GLN 30 HG1 GLN 30 -7.291 -2.089 16.845 252 HE21 GLN 30 HE21 GLN 30 -6.519 -2.941 14.491 253 HE22 GLN 30 HE22 GLN 30 -4.974 -2.407 14.034 254 H GLN 31 HN GLN 31 -8.481 -0.375 12.380 255 HA GLN 31 HA GLN 31 -5.718 -0.529 11.641 256 HB2 GLN 31 HB2 GLN 31 -8.241 -0.313 9.967 257 HB3 GLN 31 HB1 GLN 31 -6.643 -0.630 9.293 258 HG2 GLN 31 HG2 GLN 31 -7.937 -2.343 11.432 259 HG3 GLN 31 HG1 GLN 31 -8.004 -2.706 9.708 260 HE21 GLN 31 HE21 GLN 31 -6.061 -3.467 8.669 261 HE22 GLN 31 HE22 GLN 31 -4.668 -3.884 9.544 262 H LEU 32 HN LEU 32 -8.199 1.973 11.218 263 HA LEU 32 HA LEU 32 -6.666 3.728 9.580 264 HB2 LEU 32 HB2 LEU 32 -9.091 3.985 9.940 265 HB3 LEU 32 HB1 LEU 32 -8.806 4.369 11.637 266 HG LEU 32 HG LEU 32 -7.492 6.366 10.950 267 HD11 LEU 32 HD11 LEU 32 -6.596 5.914 8.836 268 HD12 LEU 32 HD12 LEU 32 -7.916 7.008 8.437 269 HD13 LEU 32 HD13 LEU 32 -8.116 5.268 8.212 270 HD21 LEU 32 HD21 LEU 32 -9.363 7.706 10.398 271 HD22 LEU 32 HD22 LEU 32 -10.029 6.348 11.303 272 HD23 LEU 32 HD23 LEU 32 -10.163 6.387 9.543 273 H CYS 33 HN CYS 33 -7.039 3.587 13.129 274 HA CYS 33 HA CYS 33 -5.381 5.828 13.701 275 HB2 CYS 33 HB2 CYS 33 -6.956 4.255 15.204 276 HB3 CYS 33 HB1 CYS 33 -5.408 3.516 15.611 277 HG CYS 33 HG CYS 33 -5.155 6.505 15.865 278 H ASN 34 HN ASN 34 -4.626 2.413 13.189 279 HA ASN 34 HA ASN 34 -1.890 2.516 13.995 280 HB2 ASN 34 HB2 ASN 34 -3.284 0.450 13.511 281 HB3 ASN 34 HB1 ASN 34 -3.056 0.788 11.796 282 HD21 ASN 34 HD21 ASN 34 -1.770 -1.179 11.520 283 HD22 ASN 34 HD22 ASN 34 -0.184 -1.280 12.115 284 H ILE 35 HN ILE 35 -3.455 3.056 10.840 285 HA ILE 35 HA ILE 35 -1.034 3.499 9.373 286 HB ILE 35 HB ILE 35 -3.864 4.479 8.896 287 HG12 ILE 35 HG12 ILE 35 -2.287 2.270 7.532 288 HG13 ILE 35 HG11 ILE 35 -3.398 1.983 8.871 289 HG21 ILE 35 HG21 ILE 35 -1.352 4.670 7.224 290 HG22 ILE 35 HG22 ILE 35 -2.467 5.961 7.665 291 HG23 ILE 35 HG23 ILE 35 -2.959 4.734 6.499 292 HD11 ILE 35 HD11 ILE 35 -5.167 3.203 7.457 293 HD12 ILE 35 HD12 ILE 35 -4.688 1.598 6.907 294 HD13 ILE 35 HD13 ILE 35 -4.043 3.030 6.107 295 H GLU 36 HN GLU 36 -3.257 5.699 11.063 296 HA GLU 36 HA GLU 36 -2.094 8.151 10.306 297 HB2 GLU 36 HB2 GLU 36 -4.219 7.930 11.566 298 HB3 GLU 36 HB1 GLU 36 -3.306 7.449 12.996 299 HG2 GLU 36 HG2 GLU 36 -2.156 9.594 13.041 300 HG3 GLU 36 HG1 GLU 36 -2.927 10.075 11.529 301 H GLN 37 HN GLN 37 -1.120 5.898 12.879 302 HA GLN 37 HA GLN 37 1.115 7.715 13.631 303 HB2 GLN 37 HB2 GLN 37 1.484 6.143 15.479 304 HB3 GLN 37 HB1 GLN 37 -0.212 6.623 15.426 305 HG2 GLN 37 HG2 GLN 37 -0.715 4.540 14.137 306 HG3 GLN 37 HG1 GLN 37 0.963 4.044 14.345 307 HE21 GLN 37 HE21 GLN 37 -0.139 2.156 15.548 308 HE22 GLN 37 HE22 GLN 37 -0.491 2.380 17.194 309 H SER 38 HN SER 38 0.533 5.318 11.378 310 HA SER 38 HA SER 38 3.006 3.829 11.571 311 HB2 SER 38 HB2 SER 38 1.016 2.942 10.396 312 HB3 SER 38 HB1 SER 38 1.172 4.218 9.189 313 HG SER 38 HG SER 38 2.175 2.119 8.694 314 H GLU 39 HN GLU 39 4.874 4.060 10.337 315 HA GLU 39 HA GLU 39 5.170 6.488 8.642 316 HB2 GLU 39 HB2 GLU 39 7.368 6.952 9.818 317 HB3 GLU 39 HB1 GLU 39 5.926 7.298 10.770 318 HG2 GLU 39 HG2 GLU 39 6.275 4.778 11.603 319 HG3 GLU 39 HG1 GLU 39 7.935 5.081 11.097 320 H THR 40 HN THR 40 5.049 3.579 8.120 321 HA THR 40 HA THR 40 7.671 3.342 6.711 322 HB THR 40 HB THR 40 8.124 1.886 8.486 323 HG1 THR 40 HG1 THR 40 7.622 0.862 6.198 324 HG21 THR 40 HG21 THR 40 5.999 2.065 9.642 325 HG22 THR 40 HG22 THR 40 6.392 0.358 9.446 326 HG23 THR 40 HG23 THR 40 5.198 1.114 8.392 327 H ALA 41 HN ALA 41 6.987 3.461 4.644 328 HA ALA 41 HA ALA 41 4.398 2.553 3.768 329 HB1 ALA 41 HB1 ALA 41 5.346 4.291 2.475 330 HB2 ALA 41 HB2 ALA 41 5.514 2.870 1.443 331 HB3 ALA 41 HB3 ALA 41 6.901 3.470 2.355 332 HA PRO 42 HA PRO 42 5.374 -1.731 3.088 333 HB2 PRO 42 HB2 PRO 42 3.648 -2.372 1.050 334 HB3 PRO 42 HB1 PRO 42 3.124 -2.103 2.725 335 HG2 PRO 42 HG2 PRO 42 3.002 -0.253 0.386 336 HG3 PRO 42 HG1 PRO 42 1.815 -0.521 1.674 337 HD2 PRO 42 HD2 PRO 42 3.525 1.629 1.648 338 HD3 PRO 42 HD1 PRO 42 2.884 0.915 3.144 339 H VAL 43 HN VAL 43 6.435 -3.198 1.643 340 HA VAL 43 HA VAL 43 8.367 -2.041 -0.104 341 HB VAL 43 HB VAL 43 8.590 -4.255 1.047 342 HG11 VAL 43 HG11 VAL 43 7.461 -6.190 0.191 343 HG12 VAL 43 HG12 VAL 43 6.777 -5.270 -1.146 344 HG13 VAL 43 HG13 VAL 43 6.229 -4.967 0.501 345 HG21 VAL 43 HG21 VAL 43 8.843 -4.314 -1.973 346 HG22 VAL 43 HG22 VAL 43 9.659 -5.410 -0.857 347 HG23 VAL 43 HG23 VAL 43 10.049 -3.690 -0.847 348 H VAL 44 HN VAL 44 5.088 -3.006 -0.607 349 HA VAL 44 HA VAL 44 5.093 -3.569 -3.388 350 HB VAL 44 HB VAL 44 2.993 -2.243 -1.645 351 HG11 VAL 44 HG11 VAL 44 1.447 -3.123 -3.492 352 HG12 VAL 44 HG12 VAL 44 2.899 -3.277 -4.482 353 HG13 VAL 44 HG13 VAL 44 2.404 -1.694 -3.881 354 HG21 VAL 44 HG21 VAL 44 3.348 -5.103 -2.605 355 HG22 VAL 44 HG22 VAL 44 2.004 -4.510 -1.630 356 HG23 VAL 44 HG23 VAL 44 3.635 -4.526 -0.962 357 H VAL 45 HN VAL 45 4.773 -0.462 -1.656 358 HA VAL 45 HA VAL 45 4.404 1.171 -3.966 359 HB VAL 45 HB VAL 45 5.648 1.767 -1.265 360 HG11 VAL 45 HG11 VAL 45 4.997 3.555 -3.607 361 HG12 VAL 45 HG12 VAL 45 6.499 3.459 -2.690 362 HG13 VAL 45 HG13 VAL 45 5.065 4.181 -1.958 363 HG21 VAL 45 HG21 VAL 45 3.503 2.592 -0.664 364 HG22 VAL 45 HG22 VAL 45 3.170 1.086 -1.516 365 HG23 VAL 45 HG23 VAL 45 2.955 2.628 -2.339 366 H LYS 46 HN LYS 46 7.369 0.196 -2.228 367 HA LYS 46 HA LYS 46 9.192 1.637 -3.894 368 HB2 LYS 46 HB2 LYS 46 9.528 -0.894 -2.264 369 HB3 LYS 46 HB1 LYS 46 10.866 -0.062 -3.055 370 HG2 LYS 46 HG2 LYS 46 10.358 1.986 -1.783 371 HG3 LYS 46 HG1 LYS 46 9.005 1.169 -0.999 372 HD2 LYS 46 HD2 LYS 46 10.542 -0.474 -0.017 373 HD3 LYS 46 HD1 LYS 46 11.906 0.304 -0.820 374 HE2 LYS 46 HE2 LYS 46 11.447 2.387 0.422 375 HE3 LYS 46 HE1 LYS 46 10.084 1.606 1.224 376 HZ1 LYS 46 HZ1 LYS 46 12.029 1.531 2.623 377 HZ2 LYS 46 HZ2 LYS 46 12.932 0.780 1.396 378 HZ3 LYS 46 HZ3 LYS 46 11.633 -0.040 2.123 379 H TYR 47 HN TYR 47 7.828 -1.640 -4.115 380 HA TYR 47 HA TYR 47 9.354 -2.509 -6.363 381 HB2 TYR 47 HB2 TYR 47 7.719 -3.850 -4.847 382 HB3 TYR 47 HB1 TYR 47 6.447 -3.236 -5.904 383 HD1 TYR 47 HD2 TYR 47 6.393 -3.857 -8.302 384 HD2 TYR 47 HD1 TYR 47 9.325 -5.477 -5.613 385 HE1 TYR 47 HE2 TYR 47 6.938 -5.620 -9.958 386 HE2 TYR 47 HE1 TYR 47 9.872 -7.238 -7.271 387 HH TYR 47 HH TYR 47 8.384 -8.349 -9.338 388 H ILE 48 HN ILE 48 6.246 -0.818 -6.089 389 HA ILE 48 HA ILE 48 5.751 -0.530 -8.898 390 HB ILE 48 HB ILE 48 4.838 1.077 -6.493 391 HG12 ILE 48 HG12 ILE 48 3.320 -0.903 -8.216 392 HG13 ILE 48 HG11 ILE 48 4.162 -1.366 -6.736 393 HG21 ILE 48 HG21 ILE 48 2.997 1.792 -8.153 394 HG22 ILE 48 HG22 ILE 48 4.112 1.271 -9.417 395 HG23 ILE 48 HG23 ILE 48 4.574 2.567 -8.315 396 HD11 ILE 48 HD11 ILE 48 2.823 0.409 -5.526 397 HD12 ILE 48 HD12 ILE 48 1.863 -0.936 -6.145 398 HD13 ILE 48 HD13 ILE 48 1.878 0.604 -7.002 399 H ALA 49 HN ALA 49 7.354 1.580 -6.507 400 HA ALA 49 HA ALA 49 7.799 3.820 -8.179 401 HB1 ALA 49 HB1 ALA 49 9.718 2.761 -6.080 402 HB2 ALA 49 HB2 ALA 49 8.261 3.680 -5.698 403 HB3 ALA 49 HB3 ALA 49 9.556 4.430 -6.630 404 H PHE 50 HN PHE 50 9.624 0.814 -7.808 405 HA PHE 50 HA PHE 50 11.872 1.535 -9.404 406 HB2 PHE 50 HB2 PHE 50 11.451 -0.547 -7.893 407 HB3 PHE 50 HB1 PHE 50 10.696 -1.252 -9.321 408 HD1 PHE 50 HD2 PHE 50 13.832 -0.013 -7.850 409 HD2 PHE 50 HD1 PHE 50 12.019 -1.833 -11.286 410 HE1 PHE 50 HE2 PHE 50 16.078 -0.603 -8.717 411 HE2 PHE 50 HE1 PHE 50 14.270 -2.433 -12.154 412 HZ PHE 50 HZ PHE 50 16.296 -1.814 -10.869 413 H LEU 51 HN LEU 51 8.806 -0.091 -10.257 414 HA LEU 51 HA LEU 51 9.377 -0.310 -13.061 415 HB2 LEU 51 HB2 LEU 51 6.763 -0.252 -11.527 416 HB3 LEU 51 HB1 LEU 51 6.870 -0.599 -13.253 417 HG LEU 51 HG LEU 51 8.335 -2.157 -11.099 418 HD11 LEU 51 HD11 LEU 51 5.794 -2.827 -12.619 419 HD12 LEU 51 HD12 LEU 51 5.916 -2.475 -10.893 420 HD13 LEU 51 HD13 LEU 51 6.661 -3.932 -11.551 421 HD21 LEU 51 HD21 LEU 51 8.297 -3.824 -13.205 422 HD22 LEU 51 HD22 LEU 51 9.565 -2.618 -13.010 423 HD23 LEU 51 HD23 LEU 51 8.214 -2.303 -14.097 424 H ARG 52 HN ARG 52 7.735 2.175 -11.128 425 HA ARG 52 HA ARG 52 6.906 3.778 -13.350 426 HB2 ARG 52 HB2 ARG 52 7.483 4.453 -10.455 427 HB3 ARG 52 HB1 ARG 52 6.905 5.651 -11.611 428 HG2 ARG 52 HG2 ARG 52 4.979 3.971 -12.092 429 HG3 ARG 52 HG1 ARG 52 5.492 3.173 -10.601 430 HD2 ARG 52 HD2 ARG 52 3.700 4.826 -10.166 431 HD3 ARG 52 HD1 ARG 52 5.207 5.275 -9.361 432 HE ARG 52 HE ARG 52 4.531 6.450 -12.029 433 HH11 ARG 52 HH21 ARG 52 5.280 6.813 -8.650 434 HH12 ARG 52 HH22 ARG 52 5.459 8.530 -8.763 435 HH21 ARG 52 HH11 ARG 52 4.767 8.678 -12.148 436 HH22 ARG 52 HH12 ARG 52 5.166 9.578 -10.722 437 H SER 53 HN SER 53 9.915 3.652 -11.483 438 HA SER 53 HA SER 53 11.095 6.021 -12.514 439 HB2 SER 53 HB2 SER 53 13.222 5.048 -11.836 440 HB3 SER 53 HB1 SER 53 12.003 4.652 -10.627 441 HG SER 53 HG SER 53 12.170 2.862 -12.699 442 H LYS 54 HN LYS 54 10.469 2.953 -14.005 443 HA LYS 54 HA LYS 54 12.364 3.462 -16.223 444 HB2 LYS 54 HB2 LYS 54 10.417 1.229 -15.609 445 HB3 LYS 54 HB1 LYS 54 11.326 1.312 -17.118 446 HG2 LYS 54 HG2 LYS 54 13.438 1.319 -15.854 447 HG3 LYS 54 HG1 LYS 54 12.538 1.267 -14.338 448 HD2 LYS 54 HD2 LYS 54 11.563 -0.896 -14.967 449 HD3 LYS 54 HD1 LYS 54 12.415 -0.846 -16.510 450 HE2 LYS 54 HE2 LYS 54 14.575 -0.830 -15.329 451 HE3 LYS 54 HE1 LYS 54 13.732 -0.856 -13.780 452 HZ1 LYS 54 HZ1 LYS 54 12.606 -2.944 -14.883 453 HZ2 LYS 54 HZ2 LYS 54 14.089 -3.064 -14.062 454 HZ3 LYS 54 HZ3 LYS 54 14.058 -2.982 -15.759 455 H GLY 55 HN GLY 55 9.465 4.705 -15.372 456 HA2 GLY 55 HA2 GLY 55 8.032 6.076 -16.659 457 HA3 GLY 55 HA1 GLY 55 8.870 5.532 -18.113 458 H VAL 56 HN VAL 56 7.669 3.117 -15.895 459 HA VAL 56 HA VAL 56 6.060 1.924 -17.970 460 HB VAL 56 HB VAL 56 6.136 1.422 -14.982 461 HG11 VAL 56 HG11 VAL 56 5.193 -0.839 -15.709 462 HG12 VAL 56 HG12 VAL 56 4.835 -0.088 -17.264 463 HG13 VAL 56 HG13 VAL 56 4.067 0.516 -15.797 464 HG21 VAL 56 HG21 VAL 56 7.684 -0.326 -15.514 465 HG22 VAL 56 HG22 VAL 56 8.240 1.102 -16.385 466 HG23 VAL 56 HG23 VAL 56 7.368 -0.166 -17.241 467 H ASP 57 HN ASP 57 3.951 2.258 -18.476 468 HA ASP 57 HA ASP 57 2.510 4.439 -17.199 469 HB2 ASP 57 HB2 ASP 57 2.073 2.600 -19.527 470 HB3 ASP 57 HB1 ASP 57 0.653 3.402 -18.859 471 H LEU 58 HN LEU 58 2.912 2.801 -15.158 472 HA LEU 58 HA LEU 58 0.765 0.855 -14.813 473 HB2 LEU 58 HB2 LEU 58 3.093 0.837 -13.687 474 HB3 LEU 58 HB1 LEU 58 2.447 2.079 -12.615 475 HG LEU 58 HG LEU 58 0.453 0.360 -12.304 476 HD11 LEU 58 HD11 LEU 58 2.691 -1.597 -12.841 477 HD12 LEU 58 HD12 LEU 58 1.551 -1.153 -14.108 478 HD13 LEU 58 HD13 LEU 58 0.972 -1.915 -12.633 479 HD21 LEU 58 HD21 LEU 58 3.187 -0.099 -11.072 480 HD22 LEU 58 HD22 LEU 58 1.648 -0.628 -10.389 481 HD23 LEU 58 HD23 LEU 58 2.008 1.094 -10.528 482 H ASN 59 HN ASN 59 1.229 4.245 -14.247 483 HA ASN 59 HA ASN 59 -0.758 4.637 -12.234 484 HB2 ASN 59 HB2 ASN 59 -0.342 6.727 -14.358 485 HB3 ASN 59 HB1 ASN 59 -0.451 6.915 -12.606 486 HD21 ASN 59 HD21 ASN 59 1.742 6.661 -15.239 487 HD22 ASN 59 HD22 ASN 59 3.167 6.505 -14.331 488 H ALA 60 HN ALA 60 -0.933 4.374 -15.745 489 HA ALA 60 HA ALA 60 -3.620 5.228 -16.112 490 HB1 ALA 60 HB1 ALA 60 -3.522 3.739 -18.154 491 HB2 ALA 60 HB2 ALA 60 -1.942 3.186 -17.597 492 HB3 ALA 60 HB3 ALA 60 -2.184 4.880 -18.022 493 H LEU 61 HN LEU 61 -2.287 1.978 -15.467 494 HA LEU 61 HA LEU 61 -4.799 0.619 -15.465 495 HB2 LEU 61 HB2 LEU 61 -2.174 0.019 -14.075 496 HB3 LEU 61 HB1 LEU 61 -3.537 -1.098 -14.088 497 HG LEU 61 HG LEU 61 -2.311 0.029 -16.620 498 HD11 LEU 61 HD11 LEU 61 -0.526 -1.175 -15.642 499 HD12 LEU 61 HD12 LEU 61 -1.276 -2.330 -16.744 500 HD13 LEU 61 HD13 LEU 61 -1.598 -2.426 -15.012 501 HD21 LEU 61 HD21 LEU 61 -3.364 -2.232 -17.454 502 HD22 LEU 61 HD22 LEU 61 -4.423 -0.853 -17.183 503 HD23 LEU 61 HD23 LEU 61 -4.324 -2.135 -15.977 504 H PHE 62 HN PHE 62 -2.942 2.171 -12.871 505 HA PHE 62 HA PHE 62 -4.626 1.409 -10.706 506 HB2 PHE 62 HB2 PHE 62 -2.458 3.329 -11.219 507 HB3 PHE 62 HB1 PHE 62 -3.620 3.974 -10.063 508 HD1 PHE 62 HD1 PHE 62 -1.819 0.762 -10.818 509 HD2 PHE 62 HD2 PHE 62 -3.295 3.447 -7.808 510 HE1 PHE 62 HE1 PHE 62 -0.819 -0.664 -9.059 511 HE2 PHE 62 HE2 PHE 62 -2.295 2.023 -6.047 512 HZ PHE 62 HZ PHE 62 -1.057 -0.034 -6.668 513 H ASP 63 HN ASP 63 -4.785 4.224 -12.884 514 HA ASP 63 HA ASP 63 -6.920 5.536 -11.538 515 HB2 ASP 63 HB2 ASP 63 -6.006 5.570 -14.418 516 HB3 ASP 63 HB1 ASP 63 -7.296 6.613 -13.814 517 H ARG 64 HN ARG 64 -6.968 2.965 -14.008 518 HA ARG 64 HA ARG 64 -9.782 3.071 -14.525 519 HB2 ARG 64 HB2 ARG 64 -7.814 0.770 -14.645 520 HB3 ARG 64 HB1 ARG 64 -9.502 0.605 -15.124 521 HG2 ARG 64 HG2 ARG 64 -9.134 2.546 -16.716 522 HG3 ARG 64 HG1 ARG 64 -7.412 2.425 -16.352 523 HD2 ARG 64 HD2 ARG 64 -7.731 -0.115 -16.967 524 HD3 ARG 64 HD1 ARG 64 -9.181 0.461 -17.791 525 HE ARG 64 HE ARG 64 -6.847 2.031 -18.495 526 HH11 ARG 64 HH21 ARG 64 -8.599 -0.894 -19.033 527 HH12 ARG 64 HH22 ARG 64 -7.988 -1.118 -20.638 528 HH21 ARG 64 HH11 ARG 64 -6.038 1.750 -20.583 529 HH22 ARG 64 HH12 ARG 64 -6.539 0.380 -21.516 530 H ILE 65 HN ILE 65 -7.925 1.586 -11.927 531 HA ILE 65 HA ILE 65 -9.974 -0.083 -10.861 532 HB ILE 65 HB ILE 65 -7.793 1.349 -9.323 533 HG12 ILE 65 HG12 ILE 65 -6.790 0.232 -11.217 534 HG13 ILE 65 HG11 ILE 65 -6.461 -0.724 -9.778 535 HG21 ILE 65 HG21 ILE 65 -7.925 -0.647 -7.859 536 HG22 ILE 65 HG22 ILE 65 -9.271 -1.251 -8.824 537 HG23 ILE 65 HG23 ILE 65 -9.448 0.240 -7.899 538 HD11 ILE 65 HD11 ILE 65 -8.353 -1.306 -12.045 539 HD12 ILE 65 HD12 ILE 65 -8.645 -2.016 -10.459 540 HD13 ILE 65 HD13 ILE 65 -7.140 -2.354 -11.312 541 H ILE 66 HN ILE 66 -9.156 3.326 -10.165 542 HA ILE 66 HA ILE 66 -10.748 3.882 -7.987 543 HB ILE 66 HB ILE 66 -10.463 5.542 -10.508 544 HG12 ILE 66 HG12 ILE 66 -9.061 5.756 -7.829 545 HG13 ILE 66 HG11 ILE 66 -8.392 4.874 -9.201 546 HG21 ILE 66 HG21 ILE 66 -12.348 6.440 -9.361 547 HG22 ILE 66 HG22 ILE 66 -10.984 7.433 -8.843 548 HG23 ILE 66 HG23 ILE 66 -11.611 6.171 -7.782 549 HD11 ILE 66 HD11 ILE 66 -7.448 7.095 -9.232 550 HD12 ILE 66 HD12 ILE 66 -9.043 7.830 -9.071 551 HD13 ILE 66 HD13 ILE 66 -8.605 6.991 -10.559 552 H VAL 67 HN VAL 67 -12.818 3.441 -7.519 553 HA VAL 67 HA VAL 67 -14.700 2.587 -9.557 554 HB VAL 67 HB VAL 67 -15.044 3.149 -6.599 555 HG11 VAL 67 HG11 VAL 67 -17.118 1.675 -6.965 556 HG12 VAL 67 HG12 VAL 67 -16.923 2.026 -8.684 557 HG13 VAL 67 HG13 VAL 67 -17.220 3.339 -7.543 558 HG21 VAL 67 HG21 VAL 67 -15.137 0.608 -6.566 559 HG22 VAL 67 HG22 VAL 67 -13.561 1.291 -6.967 560 HG23 VAL 67 HG23 VAL 67 -14.593 0.645 -8.242 561 H ASN 68 HN ASN 68 -16.245 3.760 -10.567 562 HA ASN 68 HA ASN 68 -16.349 6.672 -10.087 563 HB2 ASN 68 HB2 ASN 68 -17.609 4.851 -12.157 564 HB3 ASN 68 HB1 ASN 68 -17.859 6.599 -12.111 565 HD21 ASN 68 HD21 ASN 68 -15.558 4.073 -12.924 566 HD22 ASN 68 HD22 ASN 68 -14.347 5.103 -13.519 567 H LYS 69 HN LYS 69 -17.721 7.366 -8.508 568 HA LYS 69 HA LYS 69 -19.884 5.764 -7.485 569 HB2 LYS 69 HB2 LYS 69 -18.619 7.541 -6.211 570 HB3 LYS 69 HB1 LYS 69 -19.497 8.750 -7.146 571 HG2 LYS 69 HG2 LYS 69 -21.629 7.913 -6.305 572 HG3 LYS 69 HG1 LYS 69 -20.808 6.605 -5.451 573 HD2 LYS 69 HD2 LYS 69 -19.594 8.257 -4.079 574 HD3 LYS 69 HD1 LYS 69 -20.422 9.566 -4.924 575 HE2 LYS 69 HE2 LYS 69 -21.561 9.111 -2.809 576 HE3 LYS 69 HE1 LYS 69 -22.602 8.647 -4.155 577 HZ1 LYS 69 HZ1 LYS 69 -21.963 6.369 -3.874 578 HZ2 LYS 69 HZ2 LYS 69 -22.503 6.966 -2.378 579 HZ3 LYS 69 HZ3 LYS 69 -20.840 6.774 -2.670 580 H LEU 70 HN LEU 70 -20.725 5.473 -9.824 581 HA LEU 70 HA LEU 70 -22.277 5.985 -11.523 582 HB2 LEU 70 HB2 LEU 70 -23.790 7.033 -9.121 583 HB3 LEU 70 HB1 LEU 70 -24.484 6.437 -10.629 584 HG LEU 70 HG LEU 70 -22.822 4.799 -8.693 585 HD11 LEU 70 HD11 LEU 70 -25.792 4.788 -9.309 586 HD12 LEU 70 HD12 LEU 70 -25.043 5.316 -7.801 587 HD13 LEU 70 HD13 LEU 70 -24.967 3.619 -8.276 588 HD21 LEU 70 HD21 LEU 70 -24.038 4.234 -11.397 589 HD22 LEU 70 HD22 LEU 70 -23.864 2.929 -10.224 590 HD23 LEU 70 HD23 LEU 70 -22.441 3.802 -10.784 591 H GLU 71 HN GLU 71 -24.181 7.954 -11.784 592 HA GLU 71 HA GLU 71 -22.504 10.223 -12.576 593 HB2 GLU 71 HB2 GLU 71 -24.765 11.105 -13.422 594 HB3 GLU 71 HB1 GLU 71 -24.150 9.633 -14.169 595 HG2 GLU 71 HG2 GLU 71 -25.930 8.402 -13.439 596 HG3 GLU 71 HG1 GLU 71 -25.764 9.001 -11.792 597 H HIS 72 HN HIS 72 -22.183 11.987 -11.365 598 HA HIS 72 HA HIS 72 -24.281 13.157 -9.719 599 HB2 HIS 72 HB2 HIS 72 -23.501 11.466 -8.141 600 HB3 HIS 72 HB1 HIS 72 -21.825 11.951 -8.400 601 HD2 HIS 72 HD2 HIS 72 -22.526 12.414 -5.373 602 HE1 HIS 72 HE1 HIS 72 -23.632 16.378 -6.327 603 HE2 HIS 72 HE2 HIS 72 -23.013 14.801 -4.439 604 H HIS 73 HN HIS 73 -20.710 13.074 -9.997 605 HA HIS 73 HA HIS 73 -20.425 15.925 -9.697 606 HB2 HIS 73 HB2 HIS 73 -18.602 13.765 -10.773 607 HB3 HIS 73 HB1 HIS 73 -18.118 15.460 -10.714 608 HD2 HIS 73 HD2 HIS 73 -18.528 12.444 -8.295 609 HE1 HIS 73 HE1 HIS 73 -17.602 15.822 -5.934 610 HE2 HIS 73 HE2 HIS 73 -17.888 13.302 -5.917 611 H HIS 74 HN HIS 74 -20.706 13.764 -12.474 612 HA HIS 74 HA HIS 74 -20.727 14.240 -14.791 613 HB2 HIS 74 HB2 HIS 74 -23.060 14.478 -13.973 614 HB3 HIS 74 HB1 HIS 74 -22.779 16.200 -13.726 615 HD2 HIS 74 HD2 HIS 74 -21.366 14.542 -16.999 616 HE1 HIS 74 HE1 HIS 74 -24.657 16.956 -18.078 617 HE2 HIS 74 HE2 HIS 74 -22.734 15.560 -18.967 618 H HIS 75 HN HIS 75 -21.604 17.535 -13.877 619 HA HIS 75 HA HIS 75 -20.099 18.854 -15.805 620 HB2 HIS 75 HB2 HIS 75 -20.588 19.863 -12.991 621 HB3 HIS 75 HB1 HIS 75 -20.291 20.846 -14.425 622 HD2 HIS 75 HD2 HIS 75 -23.144 18.431 -13.080 623 HE1 HIS 75 HE1 HIS 75 -24.770 20.948 -16.057 624 HE2 HIS 75 HE2 HIS 75 -25.306 19.152 -14.347 625 H HIS 76 HN HIS 76 -18.251 20.471 -15.136 626 HA HIS 76 HA HIS 76 -15.909 20.515 -14.951 627 HB2 HIS 76 HB2 HIS 76 -17.015 21.070 -12.632 628 HB3 HIS 76 HB1 HIS 76 -16.338 19.519 -12.136 629 HD2 HIS 76 HD2 HIS 76 -14.981 22.353 -10.961 630 HE1 HIS 76 HE1 HIS 76 -11.814 21.437 -13.604 631 HE2 HIS 76 HE2 HIS 76 -12.491 22.819 -11.587 632 H HIS 77 HN HIS 77 -15.046 18.908 -16.225 633 HA HIS 77 HA HIS 77 -14.986 16.119 -15.312 634 HB2 HIS 77 HB2 HIS 77 -13.429 17.275 -17.630 635 HB3 HIS 77 HB1 HIS 77 -14.036 15.631 -17.427 636 HD2 HIS 77 HD2 HIS 77 -15.024 18.518 -19.494 637 HE1 HIS 77 HE1 HIS 77 -18.731 16.838 -18.363 638 HE2 HIS 77 HE2 HIS 77 -17.590 18.451 -19.955 639 H1 MET 1 HT1 MET 1 -8.235 -7.479 -14.858 640 H2 MET 1 HT2 MET 1 -8.744 -7.567 -13.240 641 H3 MET 1 HT3 MET 1 -9.812 -7.986 -14.491 642 HA MET 1 HA MET 1 -9.179 -10.062 -13.849 643 HB2 MET 1 HB2 MET 1 -6.919 -9.223 -15.696 644 HB3 MET 1 HB1 MET 1 -7.488 -10.873 -15.430 645 HG2 MET 1 HG2 MET 1 -9.762 -10.133 -16.232 646 HG3 MET 1 HG1 MET 1 -9.040 -8.587 -16.675 647 HE1 MET 1 HE1 MET 1 -6.716 -9.119 -19.435 648 HE2 MET 1 HE2 MET 1 -5.988 -9.663 -17.925 649 HE3 MET 1 HE3 MET 1 -7.085 -8.283 -17.919 650 H GLU 2 HN GLU 2 -8.517 -8.861 -11.644 651 HA GLU 2 HA GLU 2 -7.115 -8.919 -9.786 652 HB2 GLU 2 HB2 GLU 2 -5.434 -10.912 -11.318 653 HB3 GLU 2 HB1 GLU 2 -5.597 -10.743 -9.569 654 HG2 GLU 2 HG2 GLU 2 -8.179 -11.165 -10.097 655 HG3 GLU 2 HG1 GLU 2 -7.526 -11.925 -11.548 656 H LEU 3 HN LEU 3 -5.455 -7.637 -9.091 657 HA LEU 3 HA LEU 3 -4.138 -5.908 -10.942 658 HB2 LEU 3 HB2 LEU 3 -4.574 -5.339 -8.552 659 HB3 LEU 3 HB1 LEU 3 -3.376 -6.536 -8.066 660 HG LEU 3 HG LEU 3 -1.655 -5.280 -9.385 661 HD11 LEU 3 HD11 LEU 3 -2.783 -4.045 -11.024 662 HD12 LEU 3 HD12 LEU 3 -2.421 -2.799 -9.834 663 HD13 LEU 3 HD13 LEU 3 -4.036 -3.507 -9.904 664 HD21 LEU 3 HD21 LEU 3 -3.165 -3.872 -7.178 665 HD22 LEU 3 HD22 LEU 3 -1.630 -3.274 -7.807 666 HD23 LEU 3 HD23 LEU 3 -1.710 -4.860 -7.039 667 H SER 4 HN SER 4 -2.992 -8.751 -9.146 668 HA SER 4 HA SER 4 -0.280 -8.656 -9.865 669 HB2 SER 4 HB2 SER 4 -2.066 -11.075 -9.504 670 HB3 SER 4 HB1 SER 4 -0.305 -11.117 -9.515 671 HG SER 4 HG SER 4 -0.499 -9.488 -7.771 672 H ASN 5 HN ASN 5 -3.031 -9.938 -11.720 673 HA ASN 5 HA ASN 5 -1.539 -11.237 -13.745 674 HB2 ASN 5 HB2 ASN 5 -4.114 -11.149 -13.251 675 HB3 ASN 5 HB1 ASN 5 -4.104 -9.775 -14.351 676 HD21 ASN 5 HD21 ASN 5 -1.618 -11.630 -15.488 677 HD22 ASN 5 HD22 ASN 5 -2.463 -12.601 -16.595 678 H GLU 6 HN GLU 6 -2.723 -7.854 -13.648 679 HA GLU 6 HA GLU 6 -1.635 -7.168 -16.229 680 HB2 GLU 6 HB2 GLU 6 -2.571 -5.572 -13.839 681 HB3 GLU 6 HB1 GLU 6 -1.885 -4.776 -15.255 682 HG2 GLU 6 HG2 GLU 6 -4.409 -4.987 -15.276 683 HG3 GLU 6 HG1 GLU 6 -3.602 -5.671 -16.687 684 H LEU 7 HN LEU 7 -0.477 -6.597 -12.900 685 HA LEU 7 HA LEU 7 1.955 -5.314 -13.668 686 HB2 LEU 7 HB2 LEU 7 0.945 -6.708 -11.205 687 HB3 LEU 7 HB1 LEU 7 2.672 -6.366 -11.304 688 HG LEU 7 HG LEU 7 2.164 -3.979 -11.713 689 HD11 LEU 7 HD11 LEU 7 0.032 -4.034 -12.777 690 HD12 LEU 7 HD12 LEU 7 -0.256 -3.286 -11.203 691 HD13 LEU 7 HD13 LEU 7 -0.675 -4.977 -11.470 692 HD21 LEU 7 HD21 LEU 7 2.551 -4.689 -9.426 693 HD22 LEU 7 HD22 LEU 7 0.880 -5.238 -9.273 694 HD23 LEU 7 HD23 LEU 7 1.232 -3.515 -9.422 695 H LYS 8 HN LYS 8 1.173 -8.732 -13.042 696 HA LYS 8 HA LYS 8 3.761 -9.816 -13.257 697 HB2 LYS 8 HB2 LYS 8 1.735 -11.099 -12.614 698 HB3 LYS 8 HB1 LYS 8 1.176 -11.030 -14.285 699 HG2 LYS 8 HG2 LYS 8 3.182 -12.245 -15.013 700 HG3 LYS 8 HG1 LYS 8 3.774 -12.282 -13.352 701 HD2 LYS 8 HD2 LYS 8 1.777 -13.561 -12.668 702 HD3 LYS 8 HD1 LYS 8 1.194 -13.537 -14.333 703 HE2 LYS 8 HE2 LYS 8 2.329 -15.659 -13.884 704 HE3 LYS 8 HE1 LYS 8 3.260 -14.715 -15.048 705 HZ1 LYS 8 HZ1 LYS 8 3.815 -14.479 -12.166 706 HZ2 LYS 8 HZ2 LYS 8 4.843 -14.178 -13.485 707 HZ3 LYS 8 HZ3 LYS 8 4.460 -15.775 -13.051 708 H VAL 9 HN VAL 9 1.449 -9.039 -15.851 709 HA VAL 9 HA VAL 9 2.985 -10.091 -18.003 710 HB VAL 9 HB VAL 9 1.043 -7.762 -17.874 711 HG11 VAL 9 HG11 VAL 9 2.403 -9.091 -20.220 712 HG12 VAL 9 HG12 VAL 9 2.331 -7.373 -19.830 713 HG13 VAL 9 HG13 VAL 9 0.884 -8.210 -20.391 714 HG21 VAL 9 HG21 VAL 9 -0.610 -9.310 -18.576 715 HG22 VAL 9 HG22 VAL 9 0.312 -10.193 -17.359 716 HG23 VAL 9 HG23 VAL 9 0.594 -10.501 -19.073 717 H GLU 10 HN GLU 10 2.938 -6.762 -16.618 718 HA GLU 10 HA GLU 10 5.057 -5.870 -18.374 719 HB2 GLU 10 HB2 GLU 10 3.769 -4.768 -15.878 720 HB3 GLU 10 HB1 GLU 10 5.126 -3.949 -16.658 721 HG2 GLU 10 HG2 GLU 10 3.911 -3.614 -18.672 722 HG3 GLU 10 HG1 GLU 10 2.669 -4.780 -18.220 723 H ARG 11 HN ARG 11 4.897 -7.359 -15.213 724 HA ARG 11 HA ARG 11 7.557 -6.826 -14.331 725 HB2 ARG 11 HB2 ARG 11 5.402 -8.016 -13.209 726 HB3 ARG 11 HB1 ARG 11 6.273 -9.468 -13.672 727 HG2 ARG 11 HG2 ARG 11 7.671 -7.269 -12.128 728 HG3 ARG 11 HG1 ARG 11 6.661 -8.447 -11.298 729 HD2 ARG 11 HD2 ARG 11 9.044 -9.093 -13.043 730 HD3 ARG 11 HD1 ARG 11 8.981 -9.189 -11.287 731 HE ARG 11 HE ARG 11 7.361 -11.034 -11.495 732 HH11 ARG 11 HH21 ARG 11 8.957 -10.033 -14.416 733 HH12 ARG 11 HH22 ARG 11 8.637 -11.523 -15.230 734 HH21 ARG 11 HH11 ARG 11 6.929 -12.946 -12.591 735 HH22 ARG 11 HH12 ARG 11 7.493 -13.151 -14.216 736 H ILE 12 HN ILE 12 6.185 -9.313 -16.443 737 HA ILE 12 HA ILE 12 8.771 -10.679 -16.782 738 HB ILE 12 HB ILE 12 6.070 -11.027 -18.118 739 HG12 ILE 12 HG12 ILE 12 7.473 -12.884 -16.182 740 HG13 ILE 12 HG11 ILE 12 6.399 -11.600 -15.623 741 HG21 ILE 12 HG21 ILE 12 8.678 -12.530 -18.393 742 HG22 ILE 12 HG22 ILE 12 7.696 -11.813 -19.671 743 HG23 ILE 12 HG23 ILE 12 7.123 -13.247 -18.819 744 HD11 ILE 12 HD11 ILE 12 4.546 -12.516 -16.887 745 HD12 ILE 12 HD12 ILE 12 5.245 -13.816 -15.920 746 HD13 ILE 12 HD13 ILE 12 5.598 -13.712 -17.645 747 H ARG 13 HN ARG 13 6.619 -8.597 -18.725 748 HA ARG 13 HA ARG 13 8.134 -8.648 -21.132 749 HB2 ARG 13 HB2 ARG 13 5.836 -7.616 -20.813 750 HB3 ARG 13 HB1 ARG 13 6.636 -6.254 -20.028 751 HG2 ARG 13 HG2 ARG 13 8.035 -5.965 -22.097 752 HG3 ARG 13 HG1 ARG 13 7.047 -7.200 -22.874 753 HD2 ARG 13 HD2 ARG 13 5.936 -4.656 -21.657 754 HD3 ARG 13 HD1 ARG 13 6.286 -4.859 -23.374 755 HE ARG 13 HE ARG 13 4.584 -6.992 -22.526 756 HH11 ARG 13 HH21 ARG 13 4.644 -3.580 -23.074 757 HH12 ARG 13 HH22 ARG 13 2.951 -3.476 -23.427 758 HH21 ARG 13 HH11 ARG 13 2.372 -6.865 -22.984 759 HH22 ARG 13 HH12 ARG 13 1.668 -5.332 -23.376 760 H LEU 14 HN LEU 14 8.355 -6.586 -18.258 761 HA LEU 14 HA LEU 14 10.640 -5.095 -19.322 762 HB2 LEU 14 HB2 LEU 14 9.393 -5.206 -16.559 763 HB3 LEU 14 HB1 LEU 14 10.606 -4.034 -17.074 764 HG LEU 14 HG LEU 14 7.908 -4.385 -18.423 765 HD11 LEU 14 HD11 LEU 14 7.830 -3.569 -16.013 766 HD12 LEU 14 HD12 LEU 14 7.127 -2.482 -17.208 767 HD13 LEU 14 HD13 LEU 14 8.732 -2.154 -16.553 768 HD21 LEU 14 HD21 LEU 14 8.596 -1.955 -19.169 769 HD22 LEU 14 HD22 LEU 14 9.303 -3.337 -19.998 770 HD23 LEU 14 HD23 LEU 14 10.231 -2.484 -18.765 771 H SER 15 HN SER 15 10.232 -8.136 -18.103 772 HA SER 15 HA SER 15 11.606 -9.678 -16.970 773 HB2 SER 15 HB2 SER 15 13.714 -8.236 -18.595 774 HB3 SER 15 HB1 SER 15 13.767 -9.904 -18.032 775 HG SER 15 HG SER 15 11.477 -9.433 -19.355 776 H LEU 16 HN LEU 16 11.363 -8.710 -14.845 777 HA LEU 16 HA LEU 16 13.597 -6.953 -13.942 778 HB2 LEU 16 HB2 LEU 16 10.885 -7.688 -12.910 779 HB3 LEU 16 HB1 LEU 16 12.096 -7.216 -11.724 780 HG LEU 16 HG LEU 16 10.693 -5.311 -12.565 781 HD11 LEU 16 HD11 LEU 16 13.426 -4.663 -13.572 782 HD12 LEU 16 HD12 LEU 16 13.333 -5.281 -11.922 783 HD13 LEU 16 HD13 LEU 16 12.429 -3.842 -12.376 784 HD21 LEU 16 HD21 LEU 16 10.792 -4.588 -14.808 785 HD22 LEU 16 HD22 LEU 16 10.642 -6.339 -14.943 786 HD23 LEU 16 HD23 LEU 16 12.214 -5.568 -15.163 787 H THR 17 HN THR 17 15.172 -7.631 -12.605 788 HA THR 17 HA THR 17 15.355 -10.548 -12.074 789 HB THR 17 HB THR 17 17.732 -9.798 -11.335 790 HG1 THR 17 HG1 THR 17 17.536 -7.636 -12.971 791 HG21 THR 17 HG21 THR 17 17.364 -10.954 -13.430 792 HG22 THR 17 HG22 THR 17 18.443 -9.593 -13.737 793 HG23 THR 17 HG23 THR 17 16.739 -9.487 -14.179 794 H ALA 18 HN ALA 18 14.839 -11.312 -10.129 795 HA ALA 18 HA ALA 18 14.039 -9.646 -7.948 796 HB1 ALA 18 HB1 ALA 18 14.029 -11.824 -6.671 797 HB2 ALA 18 HB2 ALA 18 14.716 -12.594 -8.102 798 HB3 ALA 18 HB3 ALA 18 13.113 -11.865 -8.177 799 H LYS 19 HN LYS 19 17.048 -11.359 -8.683 800 HA LYS 19 HA LYS 19 18.299 -11.007 -6.152 801 HB2 LYS 19 HB2 LYS 19 19.417 -11.258 -8.947 802 HB3 LYS 19 HB1 LYS 19 20.409 -11.309 -7.495 803 HG2 LYS 19 HG2 LYS 19 19.051 -13.224 -6.664 804 HG3 LYS 19 HG1 LYS 19 18.144 -13.207 -8.177 805 HD2 LYS 19 HD2 LYS 19 21.157 -13.497 -8.076 806 HD3 LYS 19 HD1 LYS 19 20.068 -14.882 -8.059 807 HE2 LYS 19 HE2 LYS 19 19.044 -13.908 -10.206 808 HE3 LYS 19 HE1 LYS 19 20.443 -12.836 -10.257 809 HZ1 LYS 19 HZ1 LYS 19 21.789 -14.970 -9.985 810 HZ2 LYS 19 HZ2 LYS 19 21.097 -14.656 -11.504 811 HZ3 LYS 19 HZ3 LYS 19 20.374 -15.777 -10.453 812 H SER 20 HN SER 20 18.441 -9.009 -9.118 813 HA SER 20 HA SER 20 20.204 -7.038 -8.006 814 HB2 SER 20 HB2 SER 20 19.793 -7.315 -10.439 815 HB3 SER 20 HB1 SER 20 18.146 -6.732 -10.211 816 HG SER 20 HG SER 20 19.649 -4.974 -9.041 817 H VAL 21 HN VAL 21 16.652 -7.135 -8.350 818 HA VAL 21 HA VAL 21 16.208 -4.586 -7.106 819 HB VAL 21 HB VAL 21 14.400 -7.007 -7.389 820 HG11 VAL 21 HG11 VAL 21 13.871 -4.183 -6.443 821 HG12 VAL 21 HG12 VAL 21 13.490 -5.695 -5.616 822 HG13 VAL 21 HG13 VAL 21 12.590 -5.229 -7.061 823 HG21 VAL 21 HG21 VAL 21 14.416 -4.402 -8.939 824 HG22 VAL 21 HG22 VAL 21 13.504 -5.866 -9.310 825 HG23 VAL 21 HG23 VAL 21 15.260 -5.851 -9.485 826 H ALA 22 HN ALA 22 16.135 -7.918 -5.841 827 HA ALA 22 HA ALA 22 15.411 -7.231 -3.167 828 HB1 ALA 22 HB1 ALA 22 15.284 -9.528 -4.020 829 HB2 ALA 22 HB2 ALA 22 16.323 -9.469 -2.596 830 HB3 ALA 22 HB3 ALA 22 17.036 -9.572 -4.206 831 H GLU 23 HN GLU 23 18.596 -7.598 -4.723 832 HA GLU 23 HA GLU 23 20.143 -7.260 -2.345 833 HB2 GLU 23 HB2 GLU 23 20.947 -8.077 -4.620 834 HB3 GLU 23 HB1 GLU 23 20.941 -6.392 -5.134 835 HG2 GLU 23 HG2 GLU 23 23.157 -6.694 -4.422 836 HG3 GLU 23 HG1 GLU 23 22.397 -5.977 -3.003 837 H GLU 24 HN GLU 24 19.165 -4.899 -4.842 838 HA GLU 24 HA GLU 24 20.303 -2.633 -3.483 839 HB2 GLU 24 HB2 GLU 24 18.151 -2.900 -5.603 840 HB3 GLU 24 HB1 GLU 24 18.764 -1.344 -5.040 841 HG2 GLU 24 HG2 GLU 24 20.982 -1.838 -5.805 842 HG3 GLU 24 HG1 GLU 24 20.577 -3.529 -6.098 843 H MET 25 HN MET 25 17.050 -4.058 -3.546 844 HA MET 25 HA MET 25 15.802 -2.067 -1.893 845 HB2 MET 25 HB2 MET 25 15.140 -4.946 -2.534 846 HB3 MET 25 HB1 MET 25 14.129 -3.963 -1.479 847 HG2 MET 25 HG2 MET 25 14.927 -3.077 -4.260 848 HG3 MET 25 HG1 MET 25 13.447 -3.979 -3.939 849 HE1 MET 25 HE1 MET 25 11.957 -3.539 -2.195 850 HE2 MET 25 HE2 MET 25 11.043 -2.415 -3.195 851 HE3 MET 25 HE3 MET 25 11.474 -1.968 -1.548 852 H GLY 26 HN GLY 26 17.452 -5.138 -1.168 853 HA2 GLY 26 HA2 GLY 26 18.610 -5.621 0.869 854 HA3 GLY 26 HA1 GLY 26 17.836 -4.222 1.620 855 H ILE 27 HN ILE 27 16.068 -6.703 -0.181 856 HA ILE 27 HA ILE 27 14.891 -7.691 2.404 857 HB ILE 27 HB ILE 27 12.723 -7.894 1.227 858 HG12 ILE 27 HG12 ILE 27 14.189 -6.416 -0.978 859 HG13 ILE 27 HG11 ILE 27 13.549 -8.058 -1.067 860 HG21 ILE 27 HG21 ILE 27 13.751 -5.063 1.005 861 HG22 ILE 27 HG22 ILE 27 13.439 -5.839 2.558 862 HG23 ILE 27 HG23 ILE 27 12.119 -5.600 1.409 863 HD11 ILE 27 HD11 ILE 27 11.269 -7.077 -0.528 864 HD12 ILE 27 HD12 ILE 27 11.919 -6.643 -2.108 865 HD13 ILE 27 HD13 ILE 27 11.986 -5.485 -0.781 866 H SER 28 HN SER 28 13.818 -9.834 2.132 867 HA SER 28 HA SER 28 15.646 -11.669 0.845 868 HB2 SER 28 HB2 SER 28 13.075 -11.969 2.389 869 HB3 SER 28 HB1 SER 28 13.835 -13.360 1.620 870 HG SER 28 HG SER 28 14.545 -11.981 3.865 871 H ARG 29 HN ARG 29 15.122 -13.178 -0.821 872 HA ARG 29 HA ARG 29 13.685 -12.116 -3.053 873 HB2 ARG 29 HB2 ARG 29 14.763 -14.871 -2.412 874 HB3 ARG 29 HB1 ARG 29 13.959 -14.509 -3.942 875 HG2 ARG 29 HG2 ARG 29 15.592 -12.723 -4.393 876 HG3 ARG 29 HG1 ARG 29 16.386 -13.047 -2.852 877 HD2 ARG 29 HD2 ARG 29 16.053 -15.149 -5.004 878 HD3 ARG 29 HD1 ARG 29 17.483 -14.124 -4.884 879 HE ARG 29 HE ARG 29 16.889 -16.400 -3.197 880 HH11 ARG 29 HH21 ARG 29 18.259 -13.235 -3.310 881 HH12 ARG 29 HH22 ARG 29 19.380 -13.531 -2.022 882 HH21 ARG 29 HH11 ARG 29 18.361 -16.805 -1.522 883 HH22 ARG 29 HH12 ARG 29 19.437 -15.548 -1.012 884 H GLN 30 HN GLN 30 12.788 -14.422 -0.515 885 HA GLN 30 HA GLN 30 10.357 -15.355 -1.669 886 HB2 GLN 30 HB2 GLN 30 11.462 -16.320 0.359 887 HB3 GLN 30 HB1 GLN 30 10.947 -14.902 1.273 888 HG2 GLN 30 HG2 GLN 30 8.589 -15.418 0.744 889 HG3 GLN 30 HG1 GLN 30 9.106 -16.845 -0.156 890 HE21 GLN 30 HE21 GLN 30 7.396 -17.156 2.073 891 HE22 GLN 30 HE22 GLN 30 8.253 -17.904 3.334 892 H GLN 31 HN GLN 31 11.033 -12.515 0.383 893 HA GLN 31 HA GLN 31 8.310 -11.661 0.640 894 HB2 GLN 31 HB2 GLN 31 10.219 -10.787 2.011 895 HB3 GLN 31 HB1 GLN 31 10.810 -9.936 0.583 896 HG2 GLN 31 HG2 GLN 31 8.757 -8.637 0.449 897 HG3 GLN 31 HG1 GLN 31 8.054 -9.549 1.785 898 HE21 GLN 31 HE21 GLN 31 8.382 -6.707 1.935 899 HE22 GLN 31 HE22 GLN 31 9.546 -6.364 3.119 900 H LEU 32 HN LEU 32 10.839 -10.944 -1.741 901 HA LEU 32 HA LEU 32 9.359 -9.027 -3.250 902 HB2 LEU 32 HB2 LEU 32 11.877 -9.691 -3.380 903 HB3 LEU 32 HB1 LEU 32 11.330 -10.961 -4.477 904 HG LEU 32 HG LEU 32 10.048 -8.937 -5.658 905 HD11 LEU 32 HD11 LEU 32 11.396 -6.858 -5.540 906 HD12 LEU 32 HD12 LEU 32 12.385 -7.583 -4.273 907 HD13 LEU 32 HD13 LEU 32 10.680 -7.254 -3.980 908 HD21 LEU 32 HD21 LEU 32 11.663 -10.207 -6.866 909 HD22 LEU 32 HD22 LEU 32 12.986 -9.613 -5.863 910 HD23 LEU 32 HD23 LEU 32 12.189 -8.529 -7.004 911 H CYS 33 HN CYS 33 9.619 -12.557 -3.498 912 HA CYS 33 HA CYS 33 8.103 -12.904 -5.865 913 HB2 CYS 33 HB2 CYS 33 9.430 -14.589 -4.237 914 HB3 CYS 33 HB1 CYS 33 7.795 -14.923 -3.667 915 HG CYS 33 HG CYS 33 7.208 -15.397 -6.280 916 H ASN 34 HN ASN 34 7.097 -12.472 -2.507 917 HA ASN 34 HA ASN 34 4.334 -13.096 -2.825 918 HB2 ASN 34 HB2 ASN 34 5.551 -10.998 -1.001 919 HB3 ASN 34 HB1 ASN 34 3.999 -11.806 -0.785 920 HD21 ASN 34 HD21 ASN 34 5.285 -12.276 1.383 921 HD22 ASN 34 HD22 ASN 34 6.157 -13.732 1.411 922 H ILE 35 HN ILE 35 6.176 -10.114 -3.313 923 HA ILE 35 HA ILE 35 3.989 -8.359 -3.768 924 HB ILE 35 HB ILE 35 6.718 -8.278 -5.080 925 HG12 ILE 35 HG12 ILE 35 5.805 -7.075 -2.443 926 HG13 ILE 35 HG11 ILE 35 6.824 -8.508 -2.594 927 HG21 ILE 35 HG21 ILE 35 5.066 -6.728 -6.049 928 HG22 ILE 35 HG22 ILE 35 6.293 -5.841 -5.146 929 HG23 ILE 35 HG23 ILE 35 4.699 -6.107 -4.441 930 HD11 ILE 35 HD11 ILE 35 8.373 -6.748 -2.286 931 HD12 ILE 35 HD12 ILE 35 7.475 -5.659 -3.343 932 HD13 ILE 35 HD13 ILE 35 8.375 -7.009 -4.030 933 H GLU 36 HN GLU 36 5.855 -10.393 -6.017 934 HA GLU 36 HA GLU 36 4.625 -9.559 -8.425 935 HB2 GLU 36 HB2 GLU 36 6.627 -11.088 -8.181 936 HB3 GLU 36 HB1 GLU 36 5.504 -12.384 -7.775 937 HG2 GLU 36 HG2 GLU 36 4.309 -11.878 -9.967 938 HG3 GLU 36 HG1 GLU 36 5.674 -10.836 -10.369 939 H GLN 37 HN GLN 37 3.646 -12.113 -6.122 940 HA GLN 37 HA GLN 37 1.143 -12.532 -7.690 941 HB2 GLN 37 HB2 GLN 37 0.801 -14.468 -6.195 942 HB3 GLN 37 HB1 GLN 37 2.382 -14.537 -6.972 943 HG2 GLN 37 HG2 GLN 37 3.404 -13.553 -4.937 944 HG3 GLN 37 HG1 GLN 37 1.823 -13.557 -4.157 945 HE21 GLN 37 HE21 GLN 37 2.039 -15.221 -2.608 946 HE22 GLN 37 HE22 GLN 37 2.504 -16.811 -2.980 947 H SER 38 HN SER 38 1.520 -10.039 -6.278 948 HA SER 38 HA SER 38 -0.066 -10.215 -3.810 949 HB2 SER 38 HB2 SER 38 1.695 -8.533 -3.967 950 HB3 SER 38 HB1 SER 38 0.944 -7.835 -5.398 951 HG SER 38 HG SER 38 -0.061 -7.942 -2.745 952 H GLU 39 HN GLU 39 -2.136 -10.858 -4.293 953 HA GLU 39 HA GLU 39 -3.653 -9.381 -6.403 954 HB2 GLU 39 HB2 GLU 39 -4.155 -11.973 -4.917 955 HB3 GLU 39 HB1 GLU 39 -5.354 -11.218 -5.968 956 HG2 GLU 39 HG2 GLU 39 -3.916 -11.399 -7.882 957 HG3 GLU 39 HG1 GLU 39 -2.543 -11.875 -6.883 958 H THR 40 HN THR 40 -3.107 -9.449 -3.066 959 HA THR 40 HA THR 40 -5.642 -7.920 -2.549 960 HB THR 40 HB THR 40 -4.175 -9.806 -0.675 961 HG1 THR 40 HG1 THR 40 -5.439 -10.926 -2.118 962 HG21 THR 40 HG21 THR 40 -6.205 -9.308 0.781 963 HG22 THR 40 HG22 THR 40 -6.538 -7.959 -0.303 964 HG23 THR 40 HG23 THR 40 -5.039 -7.995 0.625 965 H ALA 41 HN ALA 41 -4.623 -5.908 -2.845 966 HA ALA 41 HA ALA 41 -2.094 -5.265 -1.604 967 HB1 ALA 41 HB1 ALA 41 -4.235 -3.754 -3.065 968 HB2 ALA 41 HB2 ALA 41 -2.525 -3.911 -3.453 969 HB3 ALA 41 HB3 ALA 41 -3.036 -2.833 -2.154 970 HA PRO 42 HA PRO 42 -3.525 -4.189 2.465 971 HB2 PRO 42 HB2 PRO 42 -1.749 -2.226 3.177 972 HB3 PRO 42 HB1 PRO 42 -1.306 -3.940 3.064 973 HG2 PRO 42 HG2 PRO 42 -0.855 -1.736 1.095 974 HG3 PRO 42 HG1 PRO 42 0.235 -3.045 1.590 975 HD2 PRO 42 HD2 PRO 42 -1.195 -3.128 -0.740 976 HD3 PRO 42 HD1 PRO 42 -0.753 -4.591 0.169 977 H VAL 43 HN VAL 43 -4.469 -2.442 3.783 978 HA VAL 43 HA VAL 43 -6.294 -0.788 2.368 979 HB VAL 43 HB VAL 43 -6.537 0.379 4.636 980 HG11 VAL 43 HG11 VAL 43 -6.653 -2.655 4.593 981 HG12 VAL 43 HG12 VAL 43 -7.897 -1.585 3.947 982 HG13 VAL 43 HG13 VAL 43 -7.557 -1.600 5.677 983 HG21 VAL 43 HG21 VAL 43 -5.351 -0.612 6.517 984 HG22 VAL 43 HG22 VAL 43 -4.167 -0.066 5.330 985 HG23 VAL 43 HG23 VAL 43 -4.567 -1.779 5.454 986 H VAL 44 HN VAL 44 -2.963 -0.305 3.110 987 HA VAL 44 HA VAL 44 -2.868 2.545 3.225 988 HB VAL 44 HB VAL 44 -0.827 0.543 2.207 989 HG11 VAL 44 HG11 VAL 44 -0.188 2.649 1.303 990 HG12 VAL 44 HG12 VAL 44 0.766 2.473 2.776 991 HG13 VAL 44 HG13 VAL 44 -0.663 3.509 2.768 992 HG21 VAL 44 HG21 VAL 44 0.178 0.924 4.456 993 HG22 VAL 44 HG22 VAL 44 -1.439 0.230 4.561 994 HG23 VAL 44 HG23 VAL 44 -1.196 1.948 4.873 995 H VAL 45 HN VAL 45 -2.686 0.295 0.462 996 HA VAL 45 HA VAL 45 -2.198 2.243 -1.554 997 HB VAL 45 HB VAL 45 -3.703 -0.389 -1.690 998 HG11 VAL 45 HG11 VAL 45 -4.367 0.812 -3.624 999 HG12 VAL 45 HG12 VAL 45 -3.015 -0.180 -4.170 1000 HG13 VAL 45 HG13 VAL 45 -2.770 1.534 -3.824 1001 HG21 VAL 45 HG21 VAL 45 -0.832 0.422 -2.237 1002 HG22 VAL 45 HG22 VAL 45 -1.512 -1.135 -2.711 1003 HG23 VAL 45 HG23 VAL 45 -1.408 -0.703 -1.004 1004 H LYS 46 HN LYS 46 -5.255 0.968 -0.234 1005 HA LYS 46 HA LYS 46 -6.999 2.431 -1.943 1006 HB2 LYS 46 HB2 LYS 46 -7.348 1.489 0.918 1007 HB3 LYS 46 HB1 LYS 46 -8.654 2.158 -0.062 1008 HG2 LYS 46 HG2 LYS 46 -8.334 0.382 -1.731 1009 HG3 LYS 46 HG1 LYS 46 -6.997 -0.278 -0.788 1010 HD2 LYS 46 HD2 LYS 46 -8.552 -0.638 1.118 1011 HD3 LYS 46 HD1 LYS 46 -9.882 -0.057 0.117 1012 HE2 LYS 46 HE2 LYS 46 -8.118 -2.429 -0.549 1013 HE3 LYS 46 HE1 LYS 46 -9.741 -2.540 0.131 1014 HZ1 LYS 46 HZ1 LYS 46 -10.524 -2.425 -1.921 1015 HZ2 LYS 46 HZ2 LYS 46 -8.969 -2.179 -2.559 1016 HZ3 LYS 46 HZ3 LYS 46 -9.905 -0.853 -2.059 1017 H TYR 47 HN TYR 47 -5.425 3.262 1.127 1018 HA TYR 47 HA TYR 47 -6.736 5.730 1.598 1019 HB2 TYR 47 HB2 TYR 47 -4.857 4.279 2.920 1020 HB3 TYR 47 HB1 TYR 47 -3.809 5.528 2.251 1021 HD1 TYR 47 HD1 TYR 47 -4.143 7.911 2.870 1022 HD2 TYR 47 HD2 TYR 47 -6.535 4.775 4.557 1023 HE1 TYR 47 HE1 TYR 47 -4.936 9.463 4.638 1024 HE2 TYR 47 HE2 TYR 47 -7.329 6.317 6.302 1025 HH TYR 47 HH TYR 47 -5.894 9.047 7.152 1026 H ILE 48 HN ILE 48 -3.733 5.041 -0.208 1027 HA ILE 48 HA ILE 48 -3.195 7.747 -0.962 1028 HB ILE 48 HB ILE 48 -2.492 5.120 -2.314 1029 HG12 ILE 48 HG12 ILE 48 -0.748 6.951 -0.643 1030 HG13 ILE 48 HG11 ILE 48 -1.649 5.604 0.055 1031 HG21 ILE 48 HG21 ILE 48 -1.599 7.964 -2.812 1032 HG22 ILE 48 HG22 ILE 48 -2.265 6.821 -3.976 1033 HG23 ILE 48 HG23 ILE 48 -0.644 6.575 -3.325 1034 HD11 ILE 48 HD11 ILE 48 0.151 5.174 -2.326 1035 HD12 ILE 48 HD12 ILE 48 -0.421 3.995 -1.147 1036 HD13 ILE 48 HD13 ILE 48 0.806 5.177 -0.688 1037 H ALA 49 HN ALA 49 -4.965 5.130 -2.606 1038 HA ALA 49 HA ALA 49 -5.583 6.610 -4.976 1039 HB1 ALA 49 HB1 ALA 49 -7.389 4.886 -5.252 1040 HB2 ALA 49 HB2 ALA 49 -7.001 4.286 -3.640 1041 HB3 ALA 49 HB3 ALA 49 -5.800 4.191 -4.928 1042 H PHE 50 HN PHE 50 -7.247 6.247 -1.871 1043 HA PHE 50 HA PHE 50 -9.667 7.559 -2.604 1044 HB2 PHE 50 HB2 PHE 50 -8.954 6.234 -0.422 1045 HB3 PHE 50 HB1 PHE 50 -8.498 7.832 0.167 1046 HD1 PHE 50 HD2 PHE 50 -11.322 6.179 -1.666 1047 HD2 PHE 50 HD1 PHE 50 -10.156 9.043 1.317 1048 HE1 PHE 50 HE2 PHE 50 -13.707 6.612 -1.153 1049 HE2 PHE 50 HE1 PHE 50 -12.545 9.473 1.833 1050 HZ PHE 50 HZ PHE 50 -14.320 8.257 0.598 1051 H LEU 51 HN LEU 51 -6.652 8.819 -1.166 1052 HA LEU 51 HA LEU 51 -7.487 11.550 -1.031 1053 HB2 LEU 51 HB2 LEU 51 -4.751 10.273 -1.284 1054 HB3 LEU 51 HB1 LEU 51 -4.985 12.002 -1.033 1055 HG LEU 51 HG LEU 51 -6.104 9.860 0.801 1056 HD11 LEU 51 HD11 LEU 51 -3.814 9.628 1.158 1057 HD12 LEU 51 HD12 LEU 51 -4.212 10.881 2.330 1058 HD13 LEU 51 HD13 LEU 51 -3.472 11.317 0.789 1059 HD21 LEU 51 HD21 LEU 51 -6.111 12.873 0.788 1060 HD22 LEU 51 HD22 LEU 51 -6.028 12.043 2.341 1061 HD23 LEU 51 HD23 LEU 51 -7.386 11.750 1.260 1062 H ARG 52 HN ARG 52 -5.792 9.704 -3.549 1063 HA ARG 52 HA ARG 52 -5.417 11.915 -5.307 1064 HB2 ARG 52 HB2 ARG 52 -4.160 9.865 -5.637 1065 HB3 ARG 52 HB1 ARG 52 -5.642 8.942 -5.866 1066 HG2 ARG 52 HG2 ARG 52 -4.472 9.507 -8.014 1067 HG3 ARG 52 HG1 ARG 52 -6.122 10.115 -7.933 1068 HD2 ARG 52 HD2 ARG 52 -5.386 12.351 -7.521 1069 HD3 ARG 52 HD1 ARG 52 -3.746 11.816 -7.145 1070 HE ARG 52 HE ARG 52 -3.299 11.948 -9.443 1071 HH11 ARG 52 HH21 ARG 52 -6.671 11.487 -8.845 1072 HH12 ARG 52 HH22 ARG 52 -7.110 11.582 -10.516 1073 HH21 ARG 52 HH11 ARG 52 -3.871 12.132 -11.615 1074 HH22 ARG 52 HH12 ARG 52 -5.531 11.964 -12.081 1075 H SER 53 HN SER 53 -8.037 9.560 -4.950 1076 HA SER 53 HA SER 53 -9.574 10.342 -7.212 1077 HB2 SER 53 HB2 SER 53 -9.999 8.299 -5.862 1078 HB3 SER 53 HB1 SER 53 -10.563 9.309 -4.534 1079 HG SER 53 HG SER 53 -11.668 9.679 -7.080 1080 H LYS 54 HN LYS 54 -8.944 11.951 -4.241 1081 HA LYS 54 HA LYS 54 -11.326 13.698 -4.460 1082 HB2 LYS 54 HB2 LYS 54 -9.032 13.546 -2.490 1083 HB3 LYS 54 HB1 LYS 54 -10.293 14.778 -2.414 1084 HG2 LYS 54 HG2 LYS 54 -12.007 13.027 -2.217 1085 HG3 LYS 54 HG1 LYS 54 -10.762 11.782 -2.332 1086 HD2 LYS 54 HD2 LYS 54 -9.705 12.642 -0.277 1087 HD3 LYS 54 HD1 LYS 54 -10.948 13.889 -0.157 1088 HE2 LYS 54 HE2 LYS 54 -12.684 12.166 0.043 1089 HE3 LYS 54 HE1 LYS 54 -11.466 10.904 -0.129 1090 HZ1 LYS 54 HZ1 LYS 54 -10.462 12.396 1.866 1091 HZ2 LYS 54 HZ2 LYS 54 -11.396 10.994 2.089 1092 HZ3 LYS 54 HZ3 LYS 54 -12.126 12.527 2.162 1093 H GLY 55 HN GLY 55 -8.467 13.491 -6.037 1094 HA2 GLY 55 HA2 GLY 55 -7.692 15.126 -7.617 1095 HA3 GLY 55 HA1 GLY 55 -8.477 16.391 -6.669 1096 H VAL 56 HN VAL 56 -6.900 14.435 -4.496 1097 HA VAL 56 HA VAL 56 -4.945 16.424 -3.849 1098 HB VAL 56 HB VAL 56 -4.906 13.488 -3.080 1099 HG11 VAL 56 HG11 VAL 56 -3.893 15.824 -1.446 1100 HG12 VAL 56 HG12 VAL 56 -2.857 15.051 -2.641 1101 HG13 VAL 56 HG13 VAL 56 -3.492 14.115 -1.290 1102 HG21 VAL 56 HG21 VAL 56 -6.117 15.773 -1.520 1103 HG22 VAL 56 HG22 VAL 56 -6.301 14.044 -1.230 1104 HG23 VAL 56 HG23 VAL 56 -7.071 14.791 -2.627 1105 H ASP 57 HN ASP 57 -2.826 16.652 -4.476 1106 HA ASP 57 HA ASP 57 -1.985 15.133 -6.842 1107 HB2 ASP 57 HB2 ASP 57 -0.200 16.747 -7.020 1108 HB3 ASP 57 HB1 ASP 57 -1.676 17.616 -6.609 1109 H LEU 58 HN LEU 58 -1.569 13.044 -6.030 1110 HA LEU 58 HA LEU 58 0.443 12.684 -3.897 1111 HB2 LEU 58 HB2 LEU 58 -1.334 10.887 -5.539 1112 HB3 LEU 58 HB1 LEU 58 0.046 10.184 -4.700 1113 HG LEU 58 HG LEU 58 -2.138 10.146 -3.408 1114 HD11 LEU 58 HD11 LEU 58 -1.062 10.369 -1.377 1115 HD12 LEU 58 HD12 LEU 58 -0.249 11.864 -1.829 1116 HD13 LEU 58 HD13 LEU 58 0.348 10.317 -2.429 1117 HD21 LEU 58 HD21 LEU 58 -3.070 12.147 -2.552 1118 HD22 LEU 58 HD22 LEU 58 -2.752 12.491 -4.253 1119 HD23 LEU 58 HD23 LEU 58 -1.659 13.097 -3.010 1120 H ASN 59 HN ASN 59 0.364 13.126 -7.268 1121 HA ASN 59 HA ASN 59 2.607 11.487 -8.020 1122 HB2 ASN 59 HB2 ASN 59 2.729 13.084 -9.988 1123 HB3 ASN 59 HB1 ASN 59 1.158 12.315 -9.755 1124 HD21 ASN 59 HD21 ASN 59 1.925 15.047 -10.941 1125 HD22 ASN 59 HD22 ASN 59 0.959 16.151 -10.087 1126 H ALA 60 HN ALA 60 2.344 14.957 -7.184 1127 HA ALA 60 HA ALA 60 5.153 15.491 -7.382 1128 HB1 ALA 60 HB1 ALA 60 3.253 17.183 -7.308 1129 HB2 ALA 60 HB2 ALA 60 4.650 17.571 -6.304 1130 HB3 ALA 60 HB3 ALA 60 3.189 16.909 -5.568 1131 H LEU 61 HN LEU 61 3.088 14.483 -4.668 1132 HA LEU 61 HA LEU 61 5.040 14.756 -2.620 1133 HB2 LEU 61 HB2 LEU 61 2.676 14.367 -2.118 1134 HB3 LEU 61 HB1 LEU 61 2.744 12.787 -2.892 1135 HG LEU 61 HG LEU 61 4.324 11.986 -1.203 1136 HD11 LEU 61 HD11 LEU 61 4.261 14.873 -0.337 1137 HD12 LEU 61 HD12 LEU 61 5.650 13.813 -0.575 1138 HD13 LEU 61 HD13 LEU 61 4.618 13.606 0.838 1139 HD21 LEU 61 HD21 LEU 61 2.822 12.271 0.835 1140 HD22 LEU 61 HD22 LEU 61 2.025 11.670 -0.620 1141 HD23 LEU 61 HD23 LEU 61 1.842 13.360 -0.148 1142 H PHE 62 HN PHE 62 4.197 11.945 -4.646 1143 HA PHE 62 HA PHE 62 6.137 10.148 -3.560 1144 HB2 PHE 62 HB2 PHE 62 4.500 10.328 -6.062 1145 HB3 PHE 62 HB1 PHE 62 5.869 9.223 -6.097 1146 HD1 PHE 62 HD2 PHE 62 3.331 10.168 -3.466 1147 HD2 PHE 62 HD1 PHE 62 5.185 7.031 -5.749 1148 HE1 PHE 62 HE2 PHE 62 1.992 8.476 -2.242 1149 HE2 PHE 62 HE1 PHE 62 3.842 5.350 -4.531 1150 HZ PHE 62 HZ PHE 62 2.250 6.069 -2.776 1151 H ASP 63 HN ASP 63 6.316 12.508 -6.197 1152 HA ASP 63 HA ASP 63 8.781 11.732 -7.308 1153 HB2 ASP 63 HB2 ASP 63 7.768 14.565 -6.932 1154 HB3 ASP 63 HB1 ASP 63 8.944 14.025 -8.132 1155 H ARG 64 HN ARG 64 8.114 13.776 -4.482 1156 HA ARG 64 HA ARG 64 10.878 14.445 -4.033 1157 HB2 ARG 64 HB2 ARG 64 8.426 14.520 -2.272 1158 HB3 ARG 64 HB1 ARG 64 10.010 15.040 -1.697 1159 HG2 ARG 64 HG2 ARG 64 8.602 16.159 -4.150 1160 HG3 ARG 64 HG1 ARG 64 8.633 16.936 -2.569 1161 HD2 ARG 64 HD2 ARG 64 10.466 18.013 -3.477 1162 HD3 ARG 64 HD1 ARG 64 11.303 16.562 -2.931 1163 HE ARG 64 HE ARG 64 11.409 15.797 -5.197 1164 HH11 ARG 64 HH21 ARG 64 9.573 18.704 -4.814 1165 HH12 ARG 64 HH22 ARG 64 9.527 19.043 -6.510 1166 HH21 ARG 64 HH11 ARG 64 11.334 16.221 -7.403 1167 HH22 ARG 64 HH12 ARG 64 10.517 17.638 -7.975 1168 H ILE 65 HN ILE 65 8.849 11.780 -2.873 1169 HA ILE 65 HA ILE 65 10.635 10.836 -0.858 1170 HB ILE 65 HB ILE 65 8.823 9.156 -2.607 1171 HG12 ILE 65 HG12 ILE 65 7.530 11.002 -1.743 1172 HG13 ILE 65 HG11 ILE 65 7.120 9.568 -0.817 1173 HG21 ILE 65 HG21 ILE 65 8.670 7.757 -0.557 1174 HG22 ILE 65 HG22 ILE 65 9.861 8.801 0.217 1175 HG23 ILE 65 HG23 ILE 65 10.311 7.842 -1.195 1176 HD11 ILE 65 HD11 ILE 65 7.404 11.192 0.846 1177 HD12 ILE 65 HD12 ILE 65 8.760 11.950 0.015 1178 HD13 ILE 65 HD13 ILE 65 8.979 10.400 0.825 1179 H ILE 66 HN ILE 66 10.376 9.891 -4.311 1180 HA ILE 66 HA ILE 66 12.393 7.902 -4.234 1181 HB ILE 66 HB ILE 66 12.623 8.423 -6.723 1182 HG12 ILE 66 HG12 ILE 66 10.376 10.347 -6.059 1183 HG13 ILE 66 HG11 ILE 66 12.014 10.840 -6.494 1184 HG21 ILE 66 HG21 ILE 66 10.401 7.533 -7.217 1185 HG22 ILE 66 HG22 ILE 66 9.816 8.045 -5.634 1186 HG23 ILE 66 HG23 ILE 66 11.023 6.766 -5.756 1187 HD11 ILE 66 HD11 ILE 66 11.739 9.534 -8.638 1188 HD12 ILE 66 HD12 ILE 66 10.672 10.931 -8.499 1189 HD13 ILE 66 HD13 ILE 66 10.044 9.309 -8.210 1190 H VAL 67 HN VAL 67 14.563 7.971 -4.150 1191 HA VAL 67 HA VAL 67 15.884 10.539 -3.725 1192 HB VAL 67 HB VAL 67 16.468 8.477 -2.445 1193 HG11 VAL 67 HG11 VAL 67 17.841 7.551 -4.974 1194 HG12 VAL 67 HG12 VAL 67 16.235 6.985 -4.512 1195 HG13 VAL 67 HG13 VAL 67 17.619 6.660 -3.469 1196 HG21 VAL 67 HG21 VAL 67 18.067 10.386 -2.757 1197 HG22 VAL 67 HG22 VAL 67 18.763 9.523 -4.128 1198 HG23 VAL 67 HG23 VAL 67 18.869 8.835 -2.508 1199 H ASN 68 HN ASN 68 17.028 11.685 -5.202 1200 HA ASN 68 HA ASN 68 17.053 10.775 -7.995 1201 HB2 ASN 68 HB2 ASN 68 16.533 13.075 -7.711 1202 HB3 ASN 68 HB1 ASN 68 17.854 13.321 -6.573 1203 HD21 ASN 68 HD21 ASN 68 20.009 13.599 -7.440 1204 HD22 ASN 68 HD22 ASN 68 20.287 13.853 -9.094 1205 H LYS 69 HN LYS 69 18.662 9.467 -8.683 1206 HA LYS 69 HA LYS 69 20.973 8.723 -7.334 1207 HB2 LYS 69 HB2 LYS 69 20.497 8.979 -10.315 1208 HB3 LYS 69 HB1 LYS 69 21.897 8.160 -9.617 1209 HG2 LYS 69 HG2 LYS 69 20.388 6.641 -8.380 1210 HG3 LYS 69 HG1 LYS 69 18.994 7.450 -9.096 1211 HD2 LYS 69 HD2 LYS 69 19.763 6.802 -11.347 1212 HD3 LYS 69 HD1 LYS 69 21.164 5.996 -10.638 1213 HE2 LYS 69 HE2 LYS 69 19.655 4.488 -9.383 1214 HE3 LYS 69 HE1 LYS 69 18.261 5.282 -10.117 1215 HZ1 LYS 69 HZ1 LYS 69 19.409 4.694 -12.315 1216 HZ2 LYS 69 HZ2 LYS 69 18.613 3.455 -11.466 1217 HZ3 LYS 69 HZ3 LYS 69 20.306 3.586 -11.395 1218 H LEU 70 HN LEU 70 22.679 9.888 -6.643 1219 HA LEU 70 HA LEU 70 23.232 12.540 -7.826 1220 HB2 LEU 70 HB2 LEU 70 24.603 11.109 -5.529 1221 HB3 LEU 70 HB1 LEU 70 24.748 12.819 -5.938 1222 HG LEU 70 HG LEU 70 22.177 11.428 -5.129 1223 HD11 LEU 70 HD11 LEU 70 23.700 11.636 -3.235 1224 HD12 LEU 70 HD12 LEU 70 22.401 12.818 -3.072 1225 HD13 LEU 70 HD13 LEU 70 23.995 13.331 -3.624 1226 HD21 LEU 70 HD21 LEU 70 21.500 13.947 -4.888 1227 HD22 LEU 70 HD22 LEU 70 21.508 13.227 -6.494 1228 HD23 LEU 70 HD23 LEU 70 22.853 14.246 -5.979 1229 H GLU 71 HN GLU 71 24.050 11.866 -9.877 1230 HA GLU 71 HA GLU 71 26.881 11.542 -9.968 1231 HB2 GLU 71 HB2 GLU 71 26.411 9.206 -9.363 1232 HB3 GLU 71 HB1 GLU 71 25.240 9.078 -10.669 1233 HG2 GLU 71 HG2 GLU 71 27.531 8.078 -11.141 1234 HG3 GLU 71 HG1 GLU 71 26.945 9.223 -12.333 1235 H HIS 72 HN HIS 72 27.515 11.128 -12.437 1236 HA HIS 72 HA HIS 72 26.252 13.136 -13.967 1237 HB2 HIS 72 HB2 HIS 72 27.566 12.349 -15.850 1238 HB3 HIS 72 HB1 HIS 72 28.547 12.272 -14.388 1239 HD2 HIS 72 HD2 HIS 72 29.745 10.180 -16.319 1240 HE1 HIS 72 HE1 HIS 72 27.129 7.255 -14.763 1241 HE2 HIS 72 HE2 HIS 72 29.243 7.629 -16.112 1242 H HIS 73 HN HIS 73 23.969 12.394 -13.534 1243 HA HIS 73 HA HIS 73 23.037 10.712 -15.825 1244 HB2 HIS 73 HB2 HIS 73 22.969 9.704 -13.328 1245 HB3 HIS 73 HB1 HIS 73 21.484 10.646 -13.246 1246 HD2 HIS 73 HD2 HIS 73 19.374 9.675 -14.901 1247 HE1 HIS 73 HE1 HIS 73 21.456 6.297 -16.352 1248 HE2 HIS 73 HE2 HIS 73 19.203 7.460 -16.270 1249 H HIS 74 HN HIS 74 23.260 13.679 -14.803 1250 HA HIS 74 HA HIS 74 20.504 14.596 -14.758 1251 HB2 HIS 74 HB2 HIS 74 21.482 16.840 -14.867 1252 HB3 HIS 74 HB1 HIS 74 22.375 15.864 -13.701 1253 HD2 HIS 74 HD2 HIS 74 24.990 15.017 -14.630 1254 HE1 HIS 74 HE1 HIS 74 25.088 17.730 -17.865 1255 HE2 HIS 74 HE2 HIS 74 26.471 16.130 -16.465 1256 H HIS 75 HN HIS 75 21.670 12.949 -17.075 1257 HA HIS 75 HA HIS 75 21.589 14.739 -19.367 1258 HB2 HIS 75 HB2 HIS 75 21.410 11.712 -19.262 1259 HB3 HIS 75 HB1 HIS 75 21.784 12.688 -20.684 1260 HD2 HIS 75 HD2 HIS 75 23.810 14.624 -18.459 1261 HE1 HIS 75 HE1 HIS 75 26.213 11.180 -18.910 1262 HE2 HIS 75 HE2 HIS 75 26.187 13.599 -18.145 1263 H HIS 76 HN HIS 76 19.921 14.741 -20.998 1264 HA HIS 76 HA HIS 76 17.303 15.048 -20.140 1265 HB2 HIS 76 HB2 HIS 76 16.634 14.956 -22.449 1266 HB3 HIS 76 HB1 HIS 76 18.246 15.663 -22.398 1267 HD2 HIS 76 HD2 HIS 76 16.740 12.048 -23.116 1268 HE1 HIS 76 HE1 HIS 76 20.359 12.477 -25.237 1269 HE2 HIS 76 HE2 HIS 76 18.410 10.923 -24.767 1270 H HIS 77 HN HIS 77 18.985 12.082 -20.400 1271 HA HIS 77 HA HIS 77 18.326 9.871 -20.086 1272 HB2 HIS 77 HB2 HIS 77 17.048 9.713 -18.201 1273 HB3 HIS 77 HB1 HIS 77 16.821 11.453 -18.309 1274 HD2 HIS 77 HD2 HIS 77 14.893 8.168 -19.397 1275 HE1 HIS 77 HE1 HIS 77 12.218 11.426 -19.629 1276 HE2 HIS 77 HE2 HIS 77 12.442 8.911 -19.882 Start of MODEL 19 1 H1 MET 1 HT1 MET 1 11.563 13.556 6.171 2 H2 MET 1 HT2 MET 1 11.218 11.892 6.147 3 H3 MET 1 HT3 MET 1 12.400 12.503 7.204 4 HA MET 1 HA MET 1 10.925 13.084 8.749 5 HB2 MET 1 HB2 MET 1 9.232 13.997 6.411 6 HB3 MET 1 HB1 MET 1 8.719 14.138 8.094 7 HG2 MET 1 HG2 MET 1 10.672 15.513 8.612 8 HG3 MET 1 HG1 MET 1 11.276 15.311 6.967 9 HE1 MET 1 HE1 MET 1 8.591 16.351 9.254 10 HE2 MET 1 HE2 MET 1 7.350 16.044 8.042 11 HE3 MET 1 HE3 MET 1 7.728 17.701 8.505 12 H GLU 2 HN GLU 2 8.977 12.160 9.730 13 HA GLU 2 HA GLU 2 8.623 9.401 9.038 14 HB2 GLU 2 HB2 GLU 2 6.429 10.036 10.660 15 HB3 GLU 2 HB1 GLU 2 8.009 9.519 11.240 16 HG2 GLU 2 HG2 GLU 2 7.431 12.424 10.638 17 HG3 GLU 2 HG1 GLU 2 7.057 11.710 12.206 18 H LEU 3 HN LEU 3 7.070 8.394 7.839 19 HA LEU 3 HA LEU 3 5.637 9.858 5.841 20 HB2 LEU 3 HB2 LEU 3 6.388 7.516 5.589 21 HB3 LEU 3 HB1 LEU 3 5.235 7.016 6.823 22 HG LEU 3 HG LEU 3 4.038 8.609 4.603 23 HD11 LEU 3 HD11 LEU 3 5.231 5.868 4.113 24 HD12 LEU 3 HD12 LEU 3 5.573 7.357 3.233 25 HD13 LEU 3 HD13 LEU 3 3.990 6.592 3.091 26 HD21 LEU 3 HD21 LEU 3 2.220 7.109 4.886 27 HD22 LEU 3 HD22 LEU 3 2.858 7.327 6.516 28 HD23 LEU 3 HD23 LEU 3 3.243 5.866 5.607 29 H SER 4 HN SER 4 4.605 8.367 8.892 30 HA SER 4 HA SER 4 1.817 8.744 8.640 31 HB2 SER 4 HB2 SER 4 3.638 8.734 11.051 32 HB3 SER 4 HB1 SER 4 1.884 8.825 11.190 33 HG SER 4 HG SER 4 3.465 6.781 10.018 34 H ASN 5 HN ASN 5 4.340 11.010 9.609 35 HA ASN 5 HA ASN 5 2.654 13.065 10.643 36 HB2 ASN 5 HB2 ASN 5 5.174 12.904 10.817 37 HB3 ASN 5 HB1 ASN 5 5.255 13.473 9.151 38 HD21 ASN 5 HD21 ASN 5 4.089 15.640 8.748 39 HD22 ASN 5 HD22 ASN 5 4.122 16.790 9.996 40 H GLU 6 HN GLU 6 3.778 12.389 7.334 41 HA GLU 6 HA GLU 6 2.680 14.753 6.132 42 HB2 GLU 6 HB2 GLU 6 3.346 12.005 5.058 43 HB3 GLU 6 HB1 GLU 6 2.707 13.282 4.026 44 HG2 GLU 6 HG2 GLU 6 5.182 13.617 5.742 45 HG3 GLU 6 HG1 GLU 6 5.234 13.104 4.056 46 H LEU 7 HN LEU 7 1.356 11.493 6.673 47 HA LEU 7 HA LEU 7 -1.106 11.880 5.278 48 HB2 LEU 7 HB2 LEU 7 -0.377 10.127 7.640 49 HB3 LEU 7 HB1 LEU 7 -1.935 10.035 6.820 50 HG LEU 7 HG LEU 7 0.739 9.697 5.423 51 HD11 LEU 7 HD11 LEU 7 -0.069 7.240 5.350 52 HD12 LEU 7 HD12 LEU 7 -1.148 7.695 6.667 53 HD13 LEU 7 HD13 LEU 7 0.596 7.833 6.869 54 HD21 LEU 7 HD21 LEU 7 -0.975 8.473 3.791 55 HD22 LEU 7 HD22 LEU 7 -0.762 10.220 3.715 56 HD23 LEU 7 HD23 LEU 7 -2.147 9.540 4.568 57 H LYS 8 HN LYS 8 -0.186 12.474 8.644 58 HA LYS 8 HA LYS 8 -2.769 13.299 9.556 59 HB2 LYS 8 HB2 LYS 8 -0.838 12.700 11.025 60 HB3 LYS 8 HB1 LYS 8 -0.048 14.199 10.534 61 HG2 LYS 8 HG2 LYS 8 -1.865 15.519 11.473 62 HG3 LYS 8 HG1 LYS 8 -2.777 14.058 11.844 63 HD2 LYS 8 HD2 LYS 8 -1.772 14.619 13.906 64 HD3 LYS 8 HD1 LYS 8 -0.722 13.361 13.259 65 HE2 LYS 8 HE2 LYS 8 0.530 15.330 14.177 66 HE3 LYS 8 HE1 LYS 8 0.875 15.024 12.477 67 HZ1 LYS 8 HZ1 LYS 8 -1.234 16.915 13.321 68 HZ2 LYS 8 HZ2 LYS 8 -0.457 16.801 11.814 69 HZ3 LYS 8 HZ3 LYS 8 0.382 17.403 13.163 70 H VAL 9 HN VAL 9 0.003 15.157 8.283 71 HA VAL 9 HA VAL 9 -1.202 17.734 8.564 72 HB VAL 9 HB VAL 9 0.880 16.718 6.605 73 HG11 VAL 9 HG11 VAL 9 -0.153 19.497 7.190 74 HG12 VAL 9 HG12 VAL 9 0.003 18.698 5.626 75 HG13 VAL 9 HG13 VAL 9 1.445 19.223 6.496 76 HG21 VAL 9 HG21 VAL 9 1.319 16.697 9.145 77 HG22 VAL 9 HG22 VAL 9 1.283 18.458 9.047 78 HG23 VAL 9 HG23 VAL 9 2.492 17.548 8.141 79 H GLU 10 HN GLU 10 -1.076 15.511 5.763 80 HA GLU 10 HA GLU 10 -2.556 17.181 3.988 81 HB2 GLU 10 HB2 GLU 10 -2.250 14.166 4.126 82 HB3 GLU 10 HB1 GLU 10 -3.003 15.015 2.775 83 HG2 GLU 10 HG2 GLU 10 -0.957 16.217 2.304 84 HG3 GLU 10 HG1 GLU 10 -0.195 15.584 3.764 85 H ARG 11 HN ARG 11 -3.632 14.605 6.214 86 HA ARG 11 HA ARG 11 -6.391 14.678 5.503 87 HB2 ARG 11 HB2 ARG 11 -5.382 12.910 6.904 88 HB3 ARG 11 HB1 ARG 11 -5.112 14.083 8.191 89 HG2 ARG 11 HG2 ARG 11 -7.409 14.305 8.646 90 HG3 ARG 11 HG1 ARG 11 -7.885 13.654 7.077 91 HD2 ARG 11 HD2 ARG 11 -7.781 11.487 7.823 92 HD3 ARG 11 HD1 ARG 11 -6.296 11.769 8.734 93 HE ARG 11 HE ARG 11 -8.710 12.969 9.911 94 HH11 ARG 11 HH21 ARG 11 -6.548 10.283 9.691 95 HH12 ARG 11 HH22 ARG 11 -6.967 9.653 11.247 96 HH21 ARG 11 HH11 ARG 11 -9.261 12.154 11.947 97 HH22 ARG 11 HH12 ARG 11 -8.501 10.709 12.523 98 H ILE 12 HN ILE 12 -4.543 16.495 7.940 99 HA ILE 12 HA ILE 12 -6.773 18.020 8.927 100 HB ILE 12 HB ILE 12 -3.787 18.560 8.917 101 HG12 ILE 12 HG12 ILE 12 -5.615 17.773 11.199 102 HG13 ILE 12 HG11 ILE 12 -4.744 16.590 10.222 103 HG21 ILE 12 HG21 ILE 12 -6.078 20.075 10.182 104 HG22 ILE 12 HG22 ILE 12 -4.809 20.706 9.134 105 HG23 ILE 12 HG23 ILE 12 -4.423 20.195 10.778 106 HD11 ILE 12 HD11 ILE 12 -3.492 18.839 11.826 107 HD12 ILE 12 HD12 ILE 12 -2.606 17.702 10.809 108 HD13 ILE 12 HD13 ILE 12 -3.456 17.126 12.242 109 H ARG 13 HN ARG 13 -4.333 18.619 6.411 110 HA ARG 13 HA ARG 13 -5.149 21.266 5.763 111 HB2 ARG 13 HB2 ARG 13 -3.103 19.679 4.953 112 HB3 ARG 13 HB1 ARG 13 -4.149 19.501 3.549 113 HG2 ARG 13 HG2 ARG 13 -2.655 21.377 3.162 114 HG3 ARG 13 HG1 ARG 13 -4.283 22.009 3.407 115 HD2 ARG 13 HD2 ARG 13 -3.641 23.167 5.266 116 HD3 ARG 13 HD1 ARG 13 -2.829 21.757 5.944 117 HE ARG 13 HE ARG 13 -1.483 23.338 3.798 118 HH11 ARG 13 HH21 ARG 13 -1.620 22.126 7.057 119 HH12 ARG 13 HH22 ARG 13 0.010 22.578 7.412 120 HH21 ARG 13 HH11 ARG 13 0.628 23.927 4.290 121 HH22 ARG 13 HH12 ARG 13 1.272 23.593 5.862 122 H LEU 14 HN LEU 14 -6.190 18.132 4.457 123 HA LEU 14 HA LEU 14 -8.141 19.430 2.673 124 HB2 LEU 14 HB2 LEU 14 -7.713 16.498 3.345 125 HB3 LEU 14 HB1 LEU 14 -8.681 17.123 2.010 126 HG LEU 14 HG LEU 14 -5.696 17.564 2.360 127 HD11 LEU 14 HD11 LEU 14 -5.340 15.904 0.714 128 HD12 LEU 14 HD12 LEU 14 -7.034 15.902 0.222 129 HD13 LEU 14 HD13 LEU 14 -6.562 15.195 1.769 130 HD21 LEU 14 HD21 LEU 14 -6.437 19.401 1.095 131 HD22 LEU 14 HD22 LEU 14 -7.724 18.479 0.320 132 HD23 LEU 14 HD23 LEU 14 -6.045 18.230 -0.162 133 H SER 15 HN SER 15 -7.991 18.714 5.914 134 HA SER 15 HA SER 15 -9.588 18.279 7.590 135 HB2 SER 15 HB2 SER 15 -11.679 19.759 7.214 136 HB3 SER 15 HB1 SER 15 -10.114 20.559 7.325 137 HG SER 15 HG SER 15 -10.057 20.519 5.021 138 H LEU 16 HN LEU 16 -9.611 16.043 6.270 139 HA LEU 16 HA LEU 16 -12.348 15.494 5.220 140 HB2 LEU 16 HB2 LEU 16 -9.821 13.822 5.268 141 HB3 LEU 16 HB1 LEU 16 -11.350 13.302 4.559 142 HG LEU 16 HG LEU 16 -9.912 15.837 3.733 143 HD11 LEU 16 HD11 LEU 16 -9.884 13.150 2.332 144 HD12 LEU 16 HD12 LEU 16 -8.550 13.776 3.301 145 HD13 LEU 16 HD13 LEU 16 -9.039 14.615 1.829 146 HD21 LEU 16 HD21 LEU 16 -12.303 14.299 2.710 147 HD22 LEU 16 HD22 LEU 16 -11.366 15.315 1.615 148 HD23 LEU 16 HD23 LEU 16 -12.150 16.028 3.018 149 H THR 17 HN THR 17 -13.747 14.095 6.236 150 HA THR 17 HA THR 17 -13.271 13.631 9.087 151 HB THR 17 HB THR 17 -15.595 12.651 8.979 152 HG1 THR 17 HG1 THR 17 -15.004 12.949 6.308 153 HG21 THR 17 HG21 THR 17 -15.306 15.378 7.695 154 HG22 THR 17 HG22 THR 17 -15.101 15.070 9.419 155 HG23 THR 17 HG23 THR 17 -16.667 14.799 8.655 156 H ALA 18 HN ALA 18 -12.793 11.713 10.043 157 HA ALA 18 HA ALA 18 -11.698 9.558 8.506 158 HB1 ALA 18 HB1 ALA 18 -10.886 9.870 10.733 159 HB2 ALA 18 HB2 ALA 18 -11.786 8.354 10.766 160 HB3 ALA 18 HB3 ALA 18 -12.514 9.826 11.407 161 H LYS 19 HN LYS 19 -14.856 10.099 10.003 162 HA LYS 19 HA LYS 19 -15.897 7.460 9.688 163 HB2 LYS 19 HB2 LYS 19 -16.955 9.268 11.053 164 HB3 LYS 19 HB1 LYS 19 -17.411 10.085 9.558 165 HG2 LYS 19 HG2 LYS 19 -18.733 8.128 8.874 166 HG3 LYS 19 HG1 LYS 19 -18.254 7.279 10.344 167 HD2 LYS 19 HD2 LYS 19 -19.332 9.037 11.708 168 HD3 LYS 19 HD1 LYS 19 -19.824 9.873 10.235 169 HE2 LYS 19 HE2 LYS 19 -21.685 8.523 11.072 170 HE3 LYS 19 HE1 LYS 19 -21.104 7.852 9.547 171 HZ1 LYS 19 HZ1 LYS 19 -20.980 5.950 10.680 172 HZ2 LYS 19 HZ2 LYS 19 -21.054 6.719 12.194 173 HZ3 LYS 19 HZ3 LYS 19 -19.571 6.592 11.375 174 H SER 20 HN SER 20 -16.096 10.311 7.544 175 HA SER 20 HA SER 20 -17.624 9.059 5.490 176 HB2 SER 20 HB2 SER 20 -17.251 11.500 5.629 177 HB3 SER 20 HB1 SER 20 -15.545 11.258 5.262 178 HG SER 20 HG SER 20 -16.417 10.121 3.323 179 H VAL 21 HN VAL 21 -14.103 9.377 5.915 180 HA VAL 21 HA VAL 21 -13.419 7.965 3.503 181 HB VAL 21 HB VAL 21 -11.857 8.421 6.063 182 HG11 VAL 21 HG11 VAL 21 -10.875 6.535 4.932 183 HG12 VAL 21 HG12 VAL 21 -9.878 7.940 4.557 184 HG13 VAL 21 HG13 VAL 21 -11.023 7.329 3.364 185 HG21 VAL 21 HG21 VAL 21 -12.406 10.498 4.936 186 HG22 VAL 21 HG22 VAL 21 -11.929 9.827 3.376 187 HG23 VAL 21 HG23 VAL 21 -10.711 10.134 4.613 188 H ALA 22 HN ALA 22 -13.792 6.945 6.890 189 HA ALA 22 HA ALA 22 -12.930 4.262 6.604 190 HB1 ALA 22 HB1 ALA 22 -14.126 3.825 8.652 191 HB2 ALA 22 HB2 ALA 22 -15.178 5.220 8.393 192 HB3 ALA 22 HB3 ALA 22 -13.470 5.459 8.762 193 H GLU 23 HN GLU 23 -16.195 5.649 6.191 194 HA GLU 23 HA GLU 23 -17.440 3.131 5.626 195 HB2 GLU 23 HB2 GLU 23 -18.225 5.970 4.911 196 HB3 GLU 23 HB1 GLU 23 -19.260 4.570 4.613 197 HG2 GLU 23 HG2 GLU 23 -19.051 4.009 7.077 198 HG3 GLU 23 HG1 GLU 23 -18.241 5.563 7.293 199 H GLU 24 HN GLU 24 -15.859 5.544 3.553 200 HA GLU 24 HA GLU 24 -16.585 4.196 1.084 201 HB2 GLU 24 HB2 GLU 24 -15.682 6.681 1.594 202 HB3 GLU 24 HB1 GLU 24 -14.131 5.930 1.231 203 HG2 GLU 24 HG2 GLU 24 -14.974 6.787 -0.844 204 HG3 GLU 24 HG1 GLU 24 -15.206 5.040 -0.905 205 H MET 25 HN MET 25 -13.685 4.266 3.134 206 HA MET 25 HA MET 25 -12.089 2.528 1.513 207 HB2 MET 25 HB2 MET 25 -12.037 3.265 4.443 208 HB3 MET 25 HB1 MET 25 -10.852 2.169 3.735 209 HG2 MET 25 HG2 MET 25 -11.410 4.944 2.660 210 HG3 MET 25 HG1 MET 25 -10.119 4.592 3.805 211 HE1 MET 25 HE1 MET 25 -8.585 2.875 3.644 212 HE2 MET 25 HE2 MET 25 -7.482 2.887 2.271 213 HE3 MET 25 HE3 MET 25 -8.685 1.610 2.412 214 H GLY 26 HN GLY 26 -14.349 1.915 4.180 215 HA2 GLY 26 HA2 GLY 26 -15.662 -0.113 4.329 216 HA3 GLY 26 HA1 GLY 26 -14.455 -0.945 3.346 217 H ILE 27 HN ILE 27 -13.482 1.118 6.007 218 HA ILE 27 HA ILE 27 -12.848 -1.313 7.654 219 HB ILE 27 HB ILE 27 -10.733 -0.231 8.312 220 HG12 ILE 27 HG12 ILE 27 -11.377 1.796 6.145 221 HG13 ILE 27 HG11 ILE 27 -11.496 2.128 7.873 222 HG21 ILE 27 HG21 ILE 27 -10.856 -1.814 6.387 223 HG22 ILE 27 HG22 ILE 27 -9.549 -0.642 6.227 224 HG23 ILE 27 HG23 ILE 27 -11.037 -0.435 5.304 225 HD11 ILE 27 HD11 ILE 27 -9.078 1.444 8.087 226 HD12 ILE 27 HD12 ILE 27 -9.339 2.910 7.142 227 HD13 ILE 27 HD13 ILE 27 -9.004 1.382 6.327 228 H SER 28 HN SER 28 -12.368 -0.689 9.961 229 HA SER 28 HA SER 28 -14.581 0.837 11.006 230 HB2 SER 28 HB2 SER 28 -12.174 -0.503 12.225 231 HB3 SER 28 HB1 SER 28 -13.279 0.451 13.212 232 HG SER 28 HG SER 28 -13.561 -2.044 12.258 233 H ARG 29 HN ARG 29 -14.437 2.750 12.314 234 HA ARG 29 HA ARG 29 -12.834 4.839 11.218 235 HB2 ARG 29 HB2 ARG 29 -14.993 5.188 12.416 236 HB3 ARG 29 HB1 ARG 29 -14.198 4.746 13.926 237 HG2 ARG 29 HG2 ARG 29 -12.625 6.620 13.660 238 HG3 ARG 29 HG1 ARG 29 -13.397 7.059 12.138 239 HD2 ARG 29 HD2 ARG 29 -15.554 7.363 13.388 240 HD3 ARG 29 HD1 ARG 29 -14.669 7.088 14.891 241 HE ARG 29 HE ARG 29 -13.432 9.168 13.301 242 HH11 ARG 29 HH21 ARG 29 -16.031 8.403 15.441 243 HH12 ARG 29 HH22 ARG 29 -16.177 10.020 16.045 244 HH21 ARG 29 HH11 ARG 29 -13.610 11.272 14.079 245 HH22 ARG 29 HH12 ARG 29 -14.807 11.645 15.273 246 H GLN 30 HN GLN 30 -12.474 2.918 14.198 247 HA GLN 30 HA GLN 30 -10.138 4.292 15.139 248 HB2 GLN 30 HB2 GLN 30 -11.666 2.624 16.405 249 HB3 GLN 30 HB1 GLN 30 -10.699 1.362 15.643 250 HG2 GLN 30 HG2 GLN 30 -9.530 3.633 17.283 251 HG3 GLN 30 HG1 GLN 30 -9.875 2.027 17.925 252 HE21 GLN 30 HE21 GLN 30 -7.241 3.615 17.198 253 HE22 GLN 30 HE22 GLN 30 -6.334 2.453 16.357 254 H GLN 31 HN GLN 31 -10.631 1.561 12.954 255 HA GLN 31 HA GLN 31 -7.885 0.792 12.717 256 HB2 GLN 31 HB2 GLN 31 -10.267 0.546 10.866 257 HB3 GLN 31 HB1 GLN 31 -8.674 -0.068 10.420 258 HG2 GLN 31 HG2 GLN 31 -9.995 -0.820 13.034 259 HG3 GLN 31 HG1 GLN 31 -10.282 -1.730 11.550 260 HE21 GLN 31 HE21 GLN 31 -7.856 -1.944 10.338 261 HE22 GLN 31 HE22 GLN 31 -6.707 -2.663 11.358 262 H LEU 32 HN LEU 32 -9.856 3.241 11.086 263 HA LEU 32 HA LEU 32 -7.980 3.957 9.066 264 HB2 LEU 32 HB2 LEU 32 -10.397 4.737 9.259 265 HB3 LEU 32 HB1 LEU 32 -9.858 5.835 10.525 266 HG LEU 32 HG LEU 32 -8.111 6.663 8.780 267 HD11 LEU 32 HD11 LEU 32 -10.072 5.151 7.034 268 HD12 LEU 32 HD12 LEU 32 -8.314 5.029 7.049 269 HD13 LEU 32 HD13 LEU 32 -9.092 6.478 6.421 270 HD21 LEU 32 HD21 LEU 32 -9.910 8.138 7.705 271 HD22 LEU 32 HD22 LEU 32 -9.851 8.139 9.468 272 HD23 LEU 32 HD23 LEU 32 -11.084 7.198 8.628 273 H CYS 33 HN CYS 33 -8.453 5.156 12.372 274 HA CYS 33 HA CYS 33 -6.297 7.056 12.283 275 HB2 CYS 33 HB2 CYS 33 -7.682 5.668 14.588 276 HB3 CYS 33 HB1 CYS 33 -6.491 6.956 14.791 277 HG CYS 33 HG CYS 33 -8.126 8.536 13.404 278 H ASN 34 HN ASN 34 -6.557 3.654 13.075 279 HA ASN 34 HA ASN 34 -3.988 3.286 14.279 280 HB2 ASN 34 HB2 ASN 34 -5.931 1.674 14.340 281 HB3 ASN 34 HB1 ASN 34 -5.571 1.267 12.664 282 HD21 ASN 34 HD21 ASN 34 -5.170 -0.972 13.631 283 HD22 ASN 34 HD22 ASN 34 -3.636 -1.294 14.282 284 H ILE 35 HN ILE 35 -5.074 3.216 10.904 285 HA ILE 35 HA ILE 35 -2.709 2.131 9.747 286 HB ILE 35 HB ILE 35 -4.770 4.068 8.668 287 HG12 ILE 35 HG12 ILE 35 -4.295 1.138 8.054 288 HG13 ILE 35 HG11 ILE 35 -5.440 1.703 9.269 289 HG21 ILE 35 HG21 ILE 35 -3.805 3.286 6.409 290 HG22 ILE 35 HG22 ILE 35 -2.388 2.780 7.329 291 HG23 ILE 35 HG23 ILE 35 -2.869 4.477 7.311 292 HD11 ILE 35 HD11 ILE 35 -6.685 1.353 7.237 293 HD12 ILE 35 HD12 ILE 35 -5.501 2.257 6.293 294 HD13 ILE 35 HD13 ILE 35 -6.527 3.095 7.453 295 H GLU 36 HN GLU 36 -3.636 5.464 10.455 296 HA GLU 36 HA GLU 36 -1.282 6.669 9.351 297 HB2 GLU 36 HB2 GLU 36 -2.440 8.115 11.668 298 HB3 GLU 36 HB1 GLU 36 -2.249 8.647 9.999 299 HG2 GLU 36 HG2 GLU 36 -4.432 6.824 11.034 300 HG3 GLU 36 HG1 GLU 36 -4.621 8.519 10.613 301 H GLN 37 HN GLN 37 -2.056 5.368 12.534 302 HA GLN 37 HA GLN 37 0.758 5.903 13.427 303 HB2 GLN 37 HB2 GLN 37 -1.652 5.110 15.096 304 HB3 GLN 37 HB1 GLN 37 -0.079 5.640 15.692 305 HG2 GLN 37 HG2 GLN 37 -2.008 7.309 14.048 306 HG3 GLN 37 HG1 GLN 37 -1.694 7.496 15.772 307 HE21 GLN 37 HE21 GLN 37 -0.955 8.988 12.962 308 HE22 GLN 37 HE22 GLN 37 0.617 9.531 13.299 309 H SER 38 HN SER 38 0.149 3.812 11.564 310 HA SER 38 HA SER 38 0.007 1.281 13.041 311 HB2 SER 38 HB2 SER 38 0.588 0.371 10.682 312 HB3 SER 38 HB1 SER 38 -0.959 1.179 10.887 313 HG SER 38 HG SER 38 -0.007 2.090 9.114 314 H GLU 39 HN GLU 39 2.341 1.691 10.469 315 HA GLU 39 HA GLU 39 4.649 1.952 12.201 316 HB2 GLU 39 HB2 GLU 39 5.547 -0.313 11.872 317 HB3 GLU 39 HB1 GLU 39 3.997 -0.372 12.714 318 HG2 GLU 39 HG2 GLU 39 2.951 -0.677 10.361 319 HG3 GLU 39 HG1 GLU 39 4.588 -1.049 9.828 320 H THR 40 HN THR 40 6.189 0.180 10.271 321 HA THR 40 HA THR 40 6.862 2.257 8.386 322 HB THR 40 HB THR 40 8.438 0.592 7.488 323 HG1 THR 40 HG1 THR 40 7.281 -1.272 7.579 324 HG21 THR 40 HG21 THR 40 8.972 1.814 9.578 325 HG22 THR 40 HG22 THR 40 9.692 0.203 9.558 326 HG23 THR 40 HG23 THR 40 8.239 0.509 10.511 327 H ALA 41 HN ALA 41 6.942 1.827 6.003 328 HA ALA 41 HA ALA 41 4.294 0.918 5.103 329 HB1 ALA 41 HB1 ALA 41 4.914 2.956 4.108 330 HB2 ALA 41 HB2 ALA 41 5.280 1.782 2.844 331 HB3 ALA 41 HB3 ALA 41 6.576 2.430 3.849 332 HA PRO 42 HA PRO 42 5.782 -2.997 3.601 333 HB2 PRO 42 HB2 PRO 42 4.032 -3.477 1.547 334 HB3 PRO 42 HB1 PRO 42 3.569 -3.571 3.259 335 HG2 PRO 42 HG2 PRO 42 3.121 -1.360 1.301 336 HG3 PRO 42 HG1 PRO 42 2.034 -2.005 2.542 337 HD2 PRO 42 HD2 PRO 42 3.460 0.302 2.891 338 HD3 PRO 42 HD1 PRO 42 2.989 -0.764 4.234 339 H VAL 43 HN VAL 43 7.056 -3.939 1.966 340 HA VAL 43 HA VAL 43 8.581 -2.174 0.309 341 HB VAL 43 HB VAL 43 9.479 -4.302 1.138 342 HG11 VAL 43 HG11 VAL 43 7.391 -5.608 1.025 343 HG12 VAL 43 HG12 VAL 43 8.706 -6.429 0.183 344 HG13 VAL 43 HG13 VAL 43 7.468 -5.573 -0.735 345 HG21 VAL 43 HG21 VAL 43 10.291 -3.281 -1.030 346 HG22 VAL 43 HG22 VAL 43 9.245 -4.421 -1.877 347 HG23 VAL 43 HG23 VAL 43 10.572 -5.014 -0.878 348 H VAL 44 HN VAL 44 5.540 -3.670 -0.153 349 HA VAL 44 HA VAL 44 5.473 -4.048 -2.965 350 HB VAL 44 HB VAL 44 3.255 -3.150 -1.099 351 HG11 VAL 44 HG11 VAL 44 3.239 -4.286 -3.903 352 HG12 VAL 44 HG12 VAL 44 2.564 -2.750 -3.360 353 HG13 VAL 44 HG13 VAL 44 1.813 -4.267 -2.864 354 HG21 VAL 44 HG21 VAL 44 4.087 -5.221 -0.283 355 HG22 VAL 44 HG22 VAL 44 4.340 -5.854 -1.909 356 HG23 VAL 44 HG23 VAL 44 2.703 -5.663 -1.283 357 H VAL 45 HN VAL 45 4.805 -1.158 -1.003 358 HA VAL 45 HA VAL 45 3.968 0.548 -3.116 359 HB VAL 45 HB VAL 45 5.402 1.176 -0.522 360 HG11 VAL 45 HG11 VAL 45 4.107 2.962 -2.591 361 HG12 VAL 45 HG12 VAL 45 5.741 3.069 -1.935 362 HG13 VAL 45 HG13 VAL 45 4.355 3.474 -0.922 363 HG21 VAL 45 HG21 VAL 45 3.073 0.058 -0.547 364 HG22 VAL 45 HG22 VAL 45 2.484 1.581 -1.210 365 HG23 VAL 45 HG23 VAL 45 3.237 1.545 0.384 366 H LYS 46 HN LYS 46 7.231 -0.127 -1.830 367 HA LYS 46 HA LYS 46 8.617 1.775 -3.439 368 HB2 LYS 46 HB2 LYS 46 9.517 -0.918 -2.374 369 HB3 LYS 46 HB1 LYS 46 10.593 0.301 -3.057 370 HG2 LYS 46 HG2 LYS 46 9.873 1.908 -1.323 371 HG3 LYS 46 HG1 LYS 46 8.811 0.680 -0.632 372 HD2 LYS 46 HD2 LYS 46 10.760 -0.775 -0.214 373 HD3 LYS 46 HD1 LYS 46 11.821 0.455 -0.901 374 HE2 LYS 46 HE2 LYS 46 11.821 0.604 1.542 375 HE3 LYS 46 HE1 LYS 46 11.093 2.048 0.838 376 HZ1 LYS 46 HZ1 LYS 46 8.906 1.062 1.208 377 HZ2 LYS 46 HZ2 LYS 46 9.763 1.229 2.665 378 HZ3 LYS 46 HZ3 LYS 46 9.627 -0.295 1.927 379 H TYR 47 HN TYR 47 7.719 -1.624 -4.038 380 HA TYR 47 HA TYR 47 9.042 -1.890 -6.549 381 HB2 TYR 47 HB2 TYR 47 7.696 -3.613 -5.006 382 HB3 TYR 47 HB1 TYR 47 6.367 -3.201 -6.083 383 HD1 TYR 47 HD2 TYR 47 8.104 -2.754 -8.627 384 HD2 TYR 47 HD1 TYR 47 8.022 -5.873 -5.683 385 HE1 TYR 47 HE2 TYR 47 9.006 -4.319 -10.283 386 HE2 TYR 47 HE1 TYR 47 8.933 -7.456 -7.359 387 HH TYR 47 HH TYR 47 9.519 -7.746 -9.489 388 H ILE 48 HN ILE 48 5.622 -1.084 -5.856 389 HA ILE 48 HA ILE 48 4.722 -0.542 -8.429 390 HB ILE 48 HB ILE 48 4.139 0.936 -5.848 391 HG12 ILE 48 HG12 ILE 48 2.501 -1.129 -7.351 392 HG13 ILE 48 HG11 ILE 48 3.601 -1.537 -6.034 393 HG21 ILE 48 HG21 ILE 48 2.847 1.108 -8.575 394 HG22 ILE 48 HG22 ILE 48 3.480 2.427 -7.588 395 HG23 ILE 48 HG23 ILE 48 2.010 1.585 -7.098 396 HD11 ILE 48 HD11 ILE 48 1.466 0.564 -5.655 397 HD12 ILE 48 HD12 ILE 48 2.307 -0.390 -4.435 398 HD13 ILE 48 HD13 ILE 48 1.093 -1.148 -5.460 399 H ALA 49 HN ALA 49 6.753 1.479 -6.364 400 HA ALA 49 HA ALA 49 6.708 3.819 -8.024 401 HB1 ALA 49 HB1 ALA 49 8.475 4.605 -6.662 402 HB2 ALA 49 HB2 ALA 49 9.068 2.974 -6.339 403 HB3 ALA 49 HB3 ALA 49 7.570 3.531 -5.596 404 H PHE 50 HN PHE 50 8.828 0.967 -7.926 405 HA PHE 50 HA PHE 50 10.700 1.861 -9.889 406 HB2 PHE 50 HB2 PHE 50 10.852 -0.170 -8.301 407 HB3 PHE 50 HB1 PHE 50 9.889 -1.027 -9.504 408 HD1 PHE 50 HD2 PHE 50 13.077 0.787 -8.932 409 HD2 PHE 50 HD1 PHE 50 10.847 -1.756 -11.580 410 HE1 PHE 50 HE2 PHE 50 15.123 0.394 -10.275 411 HE2 PHE 50 HE1 PHE 50 12.894 -2.148 -12.922 412 HZ PHE 50 HZ PHE 50 15.032 -1.074 -12.271 413 H LEU 51 HN LEU 51 7.724 -0.080 -10.193 414 HA LEU 51 HA LEU 51 7.888 -0.460 -13.023 415 HB2 LEU 51 HB2 LEU 51 5.525 -0.389 -11.126 416 HB3 LEU 51 HB1 LEU 51 5.388 -0.854 -12.820 417 HG LEU 51 HG LEU 51 7.247 -2.198 -10.834 418 HD11 LEU 51 HD11 LEU 51 4.513 -3.051 -11.832 419 HD12 LEU 51 HD12 LEU 51 4.909 -2.550 -10.189 420 HD13 LEU 51 HD13 LEU 51 5.589 -4.038 -10.845 421 HD21 LEU 51 HD21 LEU 51 6.578 -2.621 -13.741 422 HD22 LEU 51 HD22 LEU 51 6.941 -4.033 -12.749 423 HD23 LEU 51 HD23 LEU 51 8.134 -2.751 -12.920 424 H ARG 52 HN ARG 52 6.337 2.070 -11.063 425 HA ARG 52 HA ARG 52 5.187 3.480 -13.286 426 HB2 ARG 52 HB2 ARG 52 4.460 3.828 -10.945 427 HB3 ARG 52 HB1 ARG 52 6.025 4.554 -10.575 428 HG2 ARG 52 HG2 ARG 52 5.628 6.377 -12.096 429 HG3 ARG 52 HG1 ARG 52 4.181 5.598 -12.740 430 HD2 ARG 52 HD2 ARG 52 3.543 7.348 -11.148 431 HD3 ARG 52 HD1 ARG 52 3.121 5.765 -10.496 432 HE ARG 52 HE ARG 52 5.757 6.603 -9.630 433 HH11 ARG 52 HH21 ARG 52 2.353 6.964 -9.163 434 HH12 ARG 52 HH22 ARG 52 2.498 7.416 -7.497 435 HH21 ARG 52 HH11 ARG 52 5.957 7.194 -7.458 436 HH22 ARG 52 HH12 ARG 52 4.536 7.546 -6.534 437 H SER 53 HN SER 53 8.322 3.673 -11.660 438 HA SER 53 HA SER 53 9.289 6.032 -12.921 439 HB2 SER 53 HB2 SER 53 10.689 3.557 -11.893 440 HB3 SER 53 HB1 SER 53 11.572 4.935 -12.544 441 HG SER 53 HG SER 53 10.354 6.213 -10.982 442 H LYS 54 HN LYS 54 8.696 2.867 -14.147 443 HA LYS 54 HA LYS 54 10.413 3.254 -16.527 444 HB2 LYS 54 HB2 LYS 54 8.501 1.025 -15.764 445 HB3 LYS 54 HB1 LYS 54 9.609 0.988 -17.131 446 HG2 LYS 54 HG2 LYS 54 10.597 1.424 -14.310 447 HG3 LYS 54 HG1 LYS 54 10.351 -0.198 -14.954 448 HD2 LYS 54 HD2 LYS 54 11.883 0.342 -16.838 449 HD3 LYS 54 HD1 LYS 54 12.173 1.927 -16.130 450 HE2 LYS 54 HE2 LYS 54 13.048 0.870 -14.088 451 HE3 LYS 54 HE1 LYS 54 12.765 -0.722 -14.793 452 HZ1 LYS 54 HZ1 LYS 54 14.203 0.894 -16.603 453 HZ2 LYS 54 HZ2 LYS 54 14.663 -0.579 -15.893 454 HZ3 LYS 54 HZ3 LYS 54 14.998 0.889 -15.105 455 H GLY 55 HN GLY 55 7.537 4.442 -15.557 456 HA2 GLY 55 HA2 GLY 55 5.941 5.636 -16.826 457 HA3 GLY 55 HA1 GLY 55 6.704 5.031 -18.297 458 H VAL 56 HN VAL 56 5.771 2.792 -15.787 459 HA VAL 56 HA VAL 56 4.138 1.275 -17.611 460 HB VAL 56 HB VAL 56 4.496 1.163 -14.607 461 HG11 VAL 56 HG11 VAL 56 3.425 -1.161 -14.924 462 HG12 VAL 56 HG12 VAL 56 2.808 -0.536 -16.454 463 HG13 VAL 56 HG13 VAL 56 2.335 0.226 -14.936 464 HG21 VAL 56 HG21 VAL 56 6.332 0.538 -16.366 465 HG22 VAL 56 HG22 VAL 56 5.340 -0.890 -16.651 466 HG23 VAL 56 HG23 VAL 56 6.006 -0.584 -15.047 467 H ASP 57 HN ASP 57 1.947 1.268 -17.914 468 HA ASP 57 HA ASP 57 0.415 3.584 -17.170 469 HB2 ASP 57 HB2 ASP 57 -0.303 0.903 -18.374 470 HB3 ASP 57 HB1 ASP 57 -1.518 2.142 -18.059 471 H LEU 58 HN LEU 58 1.155 3.086 -14.777 472 HA LEU 58 HA LEU 58 -0.222 1.090 -13.257 473 HB2 LEU 58 HB2 LEU 58 1.796 2.314 -12.459 474 HB3 LEU 58 HB1 LEU 58 0.846 3.794 -12.376 475 HG LEU 58 HG LEU 58 -0.685 2.667 -10.741 476 HD11 LEU 58 HD11 LEU 58 0.494 0.585 -9.631 477 HD12 LEU 58 HD12 LEU 58 1.260 0.416 -11.211 478 HD13 LEU 58 HD13 LEU 58 -0.496 0.362 -11.071 479 HD21 LEU 58 HD21 LEU 58 0.989 2.678 -8.866 480 HD22 LEU 58 HD22 LEU 58 1.064 4.104 -9.896 481 HD23 LEU 58 HD23 LEU 58 2.266 2.825 -10.072 482 H ASN 59 HN ASN 59 -0.936 4.485 -14.007 483 HA ASN 59 HA ASN 59 -3.219 4.777 -12.356 484 HB2 ASN 59 HB2 ASN 59 -3.843 6.612 -13.930 485 HB3 ASN 59 HB1 ASN 59 -2.152 6.688 -13.433 486 HD21 ASN 59 HD21 ASN 59 -3.025 7.886 -15.886 487 HD22 ASN 59 HD22 ASN 59 -2.337 7.024 -17.176 488 H ALA 60 HN ALA 60 -2.966 3.651 -15.728 489 HA ALA 60 HA ALA 60 -5.788 3.322 -16.110 490 HB1 ALA 60 HB1 ALA 60 -3.849 3.314 -17.844 491 HB2 ALA 60 HB2 ALA 60 -5.219 2.241 -18.122 492 HB3 ALA 60 HB3 ALA 60 -3.715 1.599 -17.461 493 H LEU 61 HN LEU 61 -3.258 1.160 -14.882 494 HA LEU 61 HA LEU 61 -4.818 -1.223 -14.783 495 HB2 LEU 61 HB2 LEU 61 -2.266 -0.834 -14.414 496 HB3 LEU 61 HB1 LEU 61 -2.706 -0.532 -12.736 497 HG LEU 61 HG LEU 61 -3.429 -3.043 -14.278 498 HD11 LEU 61 HD11 LEU 61 -1.243 -2.530 -12.237 499 HD12 LEU 61 HD12 LEU 61 -1.008 -2.894 -13.946 500 HD13 LEU 61 HD13 LEU 61 -1.683 -4.118 -12.869 501 HD21 LEU 61 HD21 LEU 61 -3.907 -2.072 -11.463 502 HD22 LEU 61 HD22 LEU 61 -3.707 -3.801 -11.756 503 HD23 LEU 61 HD23 LEU 61 -5.004 -2.917 -12.555 504 H PHE 62 HN PHE 62 -4.132 1.156 -12.199 505 HA PHE 62 HA PHE 62 -5.967 -0.041 -10.318 506 HB2 PHE 62 HB2 PHE 62 -4.393 2.504 -10.495 507 HB3 PHE 62 HB1 PHE 62 -5.716 2.451 -9.331 508 HD1 PHE 62 HD2 PHE 62 -2.754 0.451 -10.476 509 HD2 PHE 62 HD1 PHE 62 -5.347 1.511 -7.221 510 HE1 PHE 62 HE2 PHE 62 -1.325 -0.844 -8.913 511 HE2 PHE 62 HE1 PHE 62 -3.927 0.216 -5.663 512 HZ PHE 62 HZ PHE 62 -1.912 -0.960 -6.506 513 H ASP 63 HN ASP 63 -6.236 2.713 -12.556 514 HA ASP 63 HA ASP 63 -8.707 3.752 -11.786 515 HB2 ASP 63 HB2 ASP 63 -7.336 4.668 -13.620 516 HB3 ASP 63 HB1 ASP 63 -7.709 3.259 -14.609 517 H ARG 64 HN ARG 64 -8.063 0.915 -13.813 518 HA ARG 64 HA ARG 64 -10.823 0.283 -14.313 519 HB2 ARG 64 HB2 ARG 64 -8.773 -0.534 -15.581 520 HB3 ARG 64 HB1 ARG 64 -8.481 -1.638 -14.241 521 HG2 ARG 64 HG2 ARG 64 -11.199 -1.620 -15.547 522 HG3 ARG 64 HG1 ARG 64 -9.870 -2.433 -16.361 523 HD2 ARG 64 HD2 ARG 64 -9.480 -3.675 -14.130 524 HD3 ARG 64 HD1 ARG 64 -11.065 -3.064 -13.659 525 HE ARG 64 HE ARG 64 -12.073 -4.494 -15.275 526 HH11 ARG 64 HH21 ARG 64 -8.626 -4.418 -15.496 527 HH12 ARG 64 HH22 ARG 64 -8.533 -5.814 -16.514 528 HH21 ARG 64 HH11 ARG 64 -11.962 -6.313 -16.605 529 HH22 ARG 64 HH12 ARG 64 -10.418 -6.886 -17.144 530 H ILE 65 HN ILE 65 -8.460 -0.939 -11.916 531 HA ILE 65 HA ILE 65 -10.251 -2.806 -10.685 532 HB ILE 65 HB ILE 65 -7.799 -1.386 -9.601 533 HG12 ILE 65 HG12 ILE 65 -8.173 -4.252 -10.523 534 HG13 ILE 65 HG11 ILE 65 -7.565 -2.970 -11.571 535 HG21 ILE 65 HG21 ILE 65 -7.858 -3.356 -7.945 536 HG22 ILE 65 HG22 ILE 65 -9.538 -3.570 -8.435 537 HG23 ILE 65 HG23 ILE 65 -9.026 -2.065 -7.674 538 HD11 ILE 65 HD11 ILE 65 -5.718 -4.261 -10.522 539 HD12 ILE 65 HD12 ILE 65 -6.316 -3.788 -8.932 540 HD13 ILE 65 HD13 ILE 65 -5.697 -2.564 -10.039 541 H ILE 66 HN ILE 66 -9.455 0.574 -9.871 542 HA ILE 66 HA ILE 66 -10.911 0.773 -7.475 543 HB ILE 66 HB ILE 66 -10.469 2.837 -9.649 544 HG12 ILE 66 HG12 ILE 66 -9.100 2.473 -6.970 545 HG13 ILE 66 HG11 ILE 66 -8.482 1.780 -8.468 546 HG21 ILE 66 HG21 ILE 66 -11.631 3.055 -6.867 547 HG22 ILE 66 HG22 ILE 66 -12.289 3.682 -8.378 548 HG23 ILE 66 HG23 ILE 66 -10.862 4.431 -7.661 549 HD11 ILE 66 HD11 ILE 66 -8.465 4.083 -9.460 550 HD12 ILE 66 HD12 ILE 66 -7.370 3.904 -8.088 551 HD13 ILE 66 HD13 ILE 66 -8.921 4.719 -7.880 552 H VAL 67 HN VAL 67 -12.841 -0.435 -7.631 553 HA VAL 67 HA VAL 67 -14.961 0.706 -9.424 554 HB VAL 67 HB VAL 67 -14.484 -1.650 -9.899 555 HG11 VAL 67 HG11 VAL 67 -15.291 -2.220 -7.035 556 HG12 VAL 67 HG12 VAL 67 -13.613 -2.149 -7.573 557 HG13 VAL 67 HG13 VAL 67 -14.699 -3.371 -8.232 558 HG21 VAL 67 HG21 VAL 67 -16.863 -0.680 -9.860 559 HG22 VAL 67 HG22 VAL 67 -17.063 -1.526 -8.325 560 HG23 VAL 67 HG23 VAL 67 -16.729 -2.437 -9.799 561 H ASN 68 HN ASN 68 -16.679 1.630 -8.471 562 HA ASN 68 HA ASN 68 -16.736 2.020 -5.603 563 HB2 ASN 68 HB2 ASN 68 -18.241 2.955 -7.980 564 HB3 ASN 68 HB1 ASN 68 -19.221 2.872 -6.521 565 HD21 ASN 68 HD21 ASN 68 -18.288 5.310 -7.954 566 HD22 ASN 68 HD22 ASN 68 -17.387 6.198 -6.824 567 H LYS 69 HN LYS 69 -19.394 1.830 -4.912 568 HA LYS 69 HA LYS 69 -20.911 0.306 -4.006 569 HB2 LYS 69 HB2 LYS 69 -20.328 -1.063 -6.654 570 HB3 LYS 69 HB1 LYS 69 -21.611 -1.554 -5.548 571 HG2 LYS 69 HG2 LYS 69 -22.634 0.672 -5.710 572 HG3 LYS 69 HG1 LYS 69 -21.334 1.207 -6.776 573 HD2 LYS 69 HD2 LYS 69 -21.975 -0.568 -8.401 574 HD3 LYS 69 HD1 LYS 69 -23.326 -1.005 -7.355 575 HE2 LYS 69 HE2 LYS 69 -22.894 1.721 -8.614 576 HE3 LYS 69 HE1 LYS 69 -24.053 0.514 -9.166 577 HZ1 LYS 69 HZ1 LYS 69 -24.972 0.598 -6.831 578 HZ2 LYS 69 HZ2 LYS 69 -25.254 1.966 -7.800 579 HZ3 LYS 69 HZ3 LYS 69 -24.044 2.000 -6.608 580 H LEU 70 HN LEU 70 -17.829 -0.081 -3.891 581 HA LEU 70 HA LEU 70 -16.291 -1.714 -3.154 582 HB2 LEU 70 HB2 LEU 70 -18.659 -1.810 -1.283 583 HB3 LEU 70 HB1 LEU 70 -17.232 -2.803 -0.988 584 HG LEU 70 HG LEU 70 -15.819 -0.754 -1.073 585 HD11 LEU 70 HD11 LEU 70 -17.152 1.443 -0.836 586 HD12 LEU 70 HD12 LEU 70 -18.514 0.540 -1.499 587 HD13 LEU 70 HD13 LEU 70 -17.041 0.739 -2.448 588 HD21 LEU 70 HD21 LEU 70 -16.524 -1.489 1.112 589 HD22 LEU 70 HD22 LEU 70 -18.126 -0.785 0.894 590 HD23 LEU 70 HD23 LEU 70 -16.719 0.264 1.068 591 H GLU 71 HN GLU 71 -16.441 -3.052 -5.077 592 HA GLU 71 HA GLU 71 -18.083 -5.535 -4.805 593 HB2 GLU 71 HB2 GLU 71 -16.662 -4.159 -7.091 594 HB3 GLU 71 HB1 GLU 71 -17.131 -5.852 -7.222 595 HG2 GLU 71 HG2 GLU 71 -19.124 -3.743 -6.375 596 HG3 GLU 71 HG1 GLU 71 -18.802 -4.056 -8.080 597 H HIS 72 HN HIS 72 -14.764 -4.361 -5.243 598 HA HIS 72 HA HIS 72 -13.554 -6.984 -5.245 599 HB2 HIS 72 HB2 HIS 72 -11.456 -5.810 -5.083 600 HB3 HIS 72 HB1 HIS 72 -12.500 -4.856 -6.135 601 HD2 HIS 72 HD2 HIS 72 -13.146 -2.298 -5.148 602 HE1 HIS 72 HE1 HIS 72 -11.162 -2.674 -1.438 603 HE2 HIS 72 HE2 HIS 72 -12.378 -1.069 -2.979 604 H HIS 73 HN HIS 73 -14.216 -4.566 -2.731 605 HA HIS 73 HA HIS 73 -12.865 -6.104 -0.661 606 HB2 HIS 73 HB2 HIS 73 -12.978 -3.733 -0.341 607 HB3 HIS 73 HB1 HIS 73 -14.720 -3.709 -0.609 608 HD2 HIS 73 HD2 HIS 73 -12.229 -4.187 2.317 609 HE1 HIS 73 HE1 HIS 73 -16.061 -5.178 3.792 610 HE2 HIS 73 HE2 HIS 73 -13.648 -4.736 4.437 611 H HIS 74 HN HIS 74 -13.688 -7.877 0.279 612 HA HIS 74 HA HIS 74 -16.350 -8.074 1.299 613 HB2 HIS 74 HB2 HIS 74 -17.067 -8.330 -1.003 614 HB3 HIS 74 HB1 HIS 74 -15.813 -9.530 -1.309 615 HD2 HIS 74 HD2 HIS 74 -16.273 -12.067 0.052 616 HE1 HIS 74 HE1 HIS 74 -20.350 -11.274 0.824 617 HE2 HIS 74 HE2 HIS 74 -18.556 -13.068 0.817 618 H HIS 75 HN HIS 75 -15.763 -9.175 3.111 619 HA HIS 75 HA HIS 75 -14.453 -11.824 2.814 620 HB2 HIS 75 HB2 HIS 75 -13.180 -9.416 3.977 621 HB3 HIS 75 HB1 HIS 75 -13.162 -10.788 5.079 622 HD2 HIS 75 HD2 HIS 75 -12.049 -10.178 1.291 623 HE1 HIS 75 HE1 HIS 75 -9.602 -13.159 3.015 624 HE2 HIS 75 HE2 HIS 75 -10.029 -11.786 0.924 625 H HIS 76 HN HIS 76 -15.497 -9.485 5.306 626 HA HIS 76 HA HIS 76 -16.511 -11.624 6.998 627 HB2 HIS 76 HB2 HIS 76 -17.489 -9.550 8.258 628 HB3 HIS 76 HB1 HIS 76 -15.742 -9.777 8.220 629 HD2 HIS 76 HD2 HIS 76 -18.372 -7.685 6.057 630 HE1 HIS 76 HE1 HIS 76 -14.661 -5.666 6.105 631 HE2 HIS 76 HE2 HIS 76 -17.067 -5.553 5.310 632 H HIS 77 HN HIS 77 -18.756 -11.824 7.635 633 HA HIS 77 HA HIS 77 -20.614 -12.241 5.644 634 HB2 HIS 77 HB2 HIS 77 -21.260 -11.170 8.407 635 HB3 HIS 77 HB1 HIS 77 -22.342 -12.097 7.368 636 HD2 HIS 77 HD2 HIS 77 -19.066 -12.712 9.503 637 HE1 HIS 77 HE1 HIS 77 -20.703 -16.457 8.439 638 HE2 HIS 77 HE2 HIS 77 -18.905 -15.298 9.801 639 H1 MET 1 HT1 MET 1 -9.135 -11.937 -14.187 640 H2 MET 1 HT2 MET 1 -9.634 -10.479 -13.471 641 H3 MET 1 HT3 MET 1 -9.067 -11.755 -12.502 642 HA MET 1 HA MET 1 -6.907 -11.527 -13.849 643 HB2 MET 1 HB2 MET 1 -8.285 -8.859 -14.287 644 HB3 MET 1 HB1 MET 1 -6.568 -9.147 -14.571 645 HG2 MET 1 HG2 MET 1 -8.806 -10.709 -15.898 646 HG3 MET 1 HG1 MET 1 -7.965 -9.356 -16.651 647 HE1 MET 1 HE1 MET 1 -5.525 -9.985 -18.209 648 HE2 MET 1 HE2 MET 1 -4.398 -10.332 -16.900 649 HE3 MET 1 HE3 MET 1 -5.627 -9.087 -16.689 650 H GLU 2 HN GLU 2 -5.845 -11.738 -11.946 651 HA GLU 2 HA GLU 2 -6.560 -10.136 -9.607 652 HB2 GLU 2 HB2 GLU 2 -4.250 -12.050 -10.043 653 HB3 GLU 2 HB1 GLU 2 -4.777 -11.404 -8.489 654 HG2 GLU 2 HG2 GLU 2 -6.990 -12.456 -8.803 655 HG3 GLU 2 HG1 GLU 2 -6.448 -13.122 -10.344 656 H LEU 3 HN LEU 3 -5.020 -8.772 -8.474 657 HA LEU 3 HA LEU 3 -3.704 -6.873 -10.154 658 HB2 LEU 3 HB2 LEU 3 -4.547 -6.343 -7.906 659 HB3 LEU 3 HB1 LEU 3 -3.367 -7.438 -7.190 660 HG LEU 3 HG LEU 3 -2.180 -5.395 -9.009 661 HD11 LEU 3 HD11 LEU 3 -2.355 -3.567 -7.359 662 HD12 LEU 3 HD12 LEU 3 -3.434 -4.559 -6.377 663 HD13 LEU 3 HD13 LEU 3 -3.942 -4.026 -7.979 664 HD21 LEU 3 HD21 LEU 3 -1.507 -5.959 -6.113 665 HD22 LEU 3 HD22 LEU 3 -0.441 -5.381 -7.394 666 HD23 LEU 3 HD23 LEU 3 -1.003 -7.052 -7.402 667 H SER 4 HN SER 4 -2.446 -9.550 -8.165 668 HA SER 4 HA SER 4 0.321 -9.053 -8.789 669 HB2 SER 4 HB2 SER 4 0.673 -11.346 -7.927 670 HB3 SER 4 HB1 SER 4 -0.356 -10.406 -6.854 671 HG SER 4 HG SER 4 -1.246 -12.455 -7.235 672 H ASN 5 HN ASN 5 -2.217 -10.995 -10.312 673 HA ASN 5 HA ASN 5 -0.535 -12.413 -12.143 674 HB2 ASN 5 HB2 ASN 5 -2.911 -12.991 -11.715 675 HB3 ASN 5 HB1 ASN 5 -3.407 -11.489 -12.495 676 HD21 ASN 5 HD21 ASN 5 -1.348 -14.367 -13.225 677 HD22 ASN 5 HD22 ASN 5 -1.822 -14.469 -14.852 678 H GLU 6 HN GLU 6 -2.237 -9.300 -12.371 679 HA GLU 6 HA GLU 6 -1.314 -8.703 -15.048 680 HB2 GLU 6 HB2 GLU 6 -2.690 -7.240 -12.827 681 HB3 GLU 6 HB1 GLU 6 -1.857 -6.239 -14.013 682 HG2 GLU 6 HG2 GLU 6 -3.748 -8.435 -14.877 683 HG3 GLU 6 HG1 GLU 6 -4.343 -6.828 -14.457 684 H LEU 7 HN LEU 7 -0.196 -7.843 -11.784 685 HA LEU 7 HA LEU 7 1.896 -6.085 -12.507 686 HB2 LEU 7 HB2 LEU 7 0.925 -6.798 -10.170 687 HB3 LEU 7 HB1 LEU 7 2.172 -8.039 -10.220 688 HG LEU 7 HG LEU 7 2.691 -5.068 -10.557 689 HD11 LEU 7 HD11 LEU 7 3.225 -6.822 -8.146 690 HD12 LEU 7 HD12 LEU 7 1.839 -5.741 -8.292 691 HD13 LEU 7 HD13 LEU 7 3.473 -5.080 -8.270 692 HD21 LEU 7 HD21 LEU 7 4.557 -6.037 -11.532 693 HD22 LEU 7 HD22 LEU 7 4.413 -7.532 -10.609 694 HD23 LEU 7 HD23 LEU 7 5.077 -6.084 -9.849 695 H LYS 8 HN LYS 8 1.869 -9.624 -12.217 696 HA LYS 8 HA LYS 8 4.651 -10.035 -12.703 697 HB2 LYS 8 HB2 LYS 8 3.052 -11.772 -11.872 698 HB3 LYS 8 HB1 LYS 8 2.338 -11.836 -13.482 699 HG2 LYS 8 HG2 LYS 8 4.500 -12.506 -14.433 700 HG3 LYS 8 HG1 LYS 8 5.245 -12.401 -12.838 701 HD2 LYS 8 HD2 LYS 8 3.714 -14.149 -12.005 702 HD3 LYS 8 HD1 LYS 8 2.981 -14.265 -13.606 703 HE2 LYS 8 HE2 LYS 8 4.648 -16.034 -13.343 704 HE3 LYS 8 HE1 LYS 8 5.205 -14.871 -14.548 705 HZ1 LYS 8 HZ1 LYS 8 6.879 -15.565 -12.828 706 HZ2 LYS 8 HZ2 LYS 8 5.962 -14.700 -11.689 707 HZ3 LYS 8 HZ3 LYS 8 6.665 -13.892 -13.008 708 H VAL 9 HN VAL 9 1.880 -9.725 -14.914 709 HA VAL 9 HA VAL 9 3.264 -10.367 -17.327 710 HB VAL 9 HB VAL 9 0.913 -8.518 -16.837 711 HG11 VAL 9 HG11 VAL 9 2.149 -9.596 -19.375 712 HG12 VAL 9 HG12 VAL 9 1.769 -7.922 -18.972 713 HG13 VAL 9 HG13 VAL 9 0.469 -9.065 -19.307 714 HG21 VAL 9 HG21 VAL 9 -0.459 -10.401 -17.320 715 HG22 VAL 9 HG22 VAL 9 0.775 -11.011 -16.218 716 HG23 VAL 9 HG23 VAL 9 0.902 -11.330 -17.949 717 H GLU 10 HN GLU 10 2.690 -7.198 -15.763 718 HA GLU 10 HA GLU 10 4.089 -5.689 -17.767 719 HB2 GLU 10 HB2 GLU 10 3.421 -5.110 -14.869 720 HB3 GLU 10 HB1 GLU 10 4.228 -3.941 -15.909 721 HG2 GLU 10 HG2 GLU 10 1.999 -3.315 -16.201 722 HG3 GLU 10 HG1 GLU 10 2.192 -4.437 -17.542 723 H ARG 11 HN ARG 11 5.130 -7.213 -14.741 724 HA ARG 11 HA ARG 11 7.762 -6.122 -14.634 725 HB2 ARG 11 HB2 ARG 11 6.638 -7.525 -12.847 726 HB3 ARG 11 HB1 ARG 11 6.952 -8.943 -13.848 727 HG2 ARG 11 HG2 ARG 11 9.413 -8.224 -13.833 728 HG3 ARG 11 HG1 ARG 11 8.967 -7.094 -12.555 729 HD2 ARG 11 HD2 ARG 11 9.798 -9.179 -11.568 730 HD3 ARG 11 HD1 ARG 11 8.077 -8.997 -11.217 731 HE ARG 11 HE ARG 11 8.027 -10.466 -13.522 732 HH11 ARG 11 HH21 ARG 11 9.851 -10.721 -10.599 733 HH12 ARG 11 HH22 ARG 11 9.941 -12.449 -10.657 734 HH21 ARG 11 HH11 ARG 11 8.136 -12.714 -13.603 735 HH22 ARG 11 HH12 ARG 11 8.971 -13.577 -12.356 736 H ILE 12 HN ILE 12 6.533 -9.082 -16.193 737 HA ILE 12 HA ILE 12 9.060 -9.839 -17.354 738 HB ILE 12 HB ILE 12 6.210 -10.592 -18.078 739 HG12 ILE 12 HG12 ILE 12 8.353 -12.234 -16.702 740 HG13 ILE 12 HG11 ILE 12 7.226 -11.222 -15.797 741 HG21 ILE 12 HG21 ILE 12 8.890 -11.523 -19.129 742 HG22 ILE 12 HG22 ILE 12 7.467 -11.028 -20.046 743 HG23 ILE 12 HG23 ILE 12 7.469 -12.567 -19.185 744 HD11 ILE 12 HD11 ILE 12 6.508 -13.640 -16.064 745 HD12 ILE 12 HD12 ILE 12 6.329 -13.318 -17.789 746 HD13 ILE 12 HD13 ILE 12 5.333 -12.449 -16.621 747 H ARG 13 HN ARG 13 6.276 -7.983 -18.532 748 HA ARG 13 HA ARG 13 6.993 -7.688 -21.234 749 HB2 ARG 13 HB2 ARG 13 4.874 -6.847 -20.205 750 HB3 ARG 13 HB1 ARG 13 5.793 -5.552 -19.440 751 HG2 ARG 13 HG2 ARG 13 6.505 -4.746 -21.671 752 HG3 ARG 13 HG1 ARG 13 5.556 -6.026 -22.430 753 HD2 ARG 13 HD2 ARG 13 4.418 -3.898 -20.592 754 HD3 ARG 13 HD1 ARG 13 4.346 -3.834 -22.352 755 HE ARG 13 HE ARG 13 2.805 -5.667 -20.616 756 HH11 ARG 13 HH21 ARG 13 3.798 -4.685 -23.789 757 HH12 ARG 13 HH22 ARG 13 2.516 -5.536 -24.581 758 HH21 ARG 13 HH11 ARG 13 1.150 -6.779 -21.652 759 HH22 ARG 13 HH12 ARG 13 1.025 -6.719 -23.379 760 H LEU 14 HN LEU 14 8.108 -5.823 -18.408 761 HA LEU 14 HA LEU 14 9.875 -4.181 -20.096 762 HB2 LEU 14 HB2 LEU 14 9.626 -4.421 -17.080 763 HB3 LEU 14 HB1 LEU 14 10.582 -3.205 -17.927 764 HG LEU 14 HG LEU 14 7.585 -3.578 -18.211 765 HD11 LEU 14 HD11 LEU 14 7.918 -2.690 -16.049 766 HD12 LEU 14 HD12 LEU 14 7.642 -1.268 -17.053 767 HD13 LEU 14 HD13 LEU 14 9.280 -1.696 -16.567 768 HD21 LEU 14 HD21 LEU 14 7.981 -1.148 -19.214 769 HD22 LEU 14 HD22 LEU 14 8.215 -2.573 -20.223 770 HD23 LEU 14 HD23 LEU 14 9.609 -1.761 -19.509 771 H SER 15 HN SER 15 9.949 -7.255 -18.777 772 HA SER 15 HA SER 15 11.619 -8.854 -18.509 773 HB2 SER 15 HB2 SER 15 12.333 -8.583 -20.717 774 HB3 SER 15 HB1 SER 15 12.863 -6.927 -20.458 775 HG SER 15 HG SER 15 14.096 -8.894 -18.933 776 H LEU 16 HN LEU 16 11.452 -7.693 -16.231 777 HA LEU 16 HA LEU 16 14.180 -6.688 -15.471 778 HB2 LEU 16 HB2 LEU 16 11.417 -6.109 -14.470 779 HB3 LEU 16 HB1 LEU 16 12.732 -6.052 -13.298 780 HG LEU 16 HG LEU 16 12.248 -3.845 -14.403 781 HD11 LEU 16 HD11 LEU 16 14.663 -4.843 -13.653 782 HD12 LEU 16 HD12 LEU 16 14.453 -3.219 -14.299 783 HD13 LEU 16 HD13 LEU 16 14.997 -4.518 -15.356 784 HD21 LEU 16 HD21 LEU 16 13.536 -4.962 -16.888 785 HD22 LEU 16 HD22 LEU 16 12.556 -3.507 -16.705 786 HD23 LEU 16 HD23 LEU 16 11.795 -5.095 -16.656 787 H THR 17 HN THR 17 15.377 -7.861 -14.134 788 HA THR 17 HA THR 17 14.377 -10.506 -13.300 789 HB THR 17 HB THR 17 16.700 -10.934 -12.684 790 HG1 THR 17 HG1 THR 17 17.020 -8.170 -13.232 791 HG21 THR 17 HG21 THR 17 16.198 -11.168 -15.040 792 HG22 THR 17 HG22 THR 17 17.786 -10.416 -14.889 793 HG23 THR 17 HG23 THR 17 16.378 -9.433 -15.295 794 H ALA 18 HN ALA 18 14.478 -11.222 -11.099 795 HA ALA 18 HA ALA 18 13.519 -9.313 -9.193 796 HB1 ALA 18 HB1 ALA 18 12.867 -11.610 -8.933 797 HB2 ALA 18 HB2 ALA 18 13.902 -11.230 -7.556 798 HB3 ALA 18 HB3 ALA 18 14.546 -12.146 -8.919 799 H LYS 19 HN LYS 19 16.678 -10.724 -9.839 800 HA LYS 19 HA LYS 19 18.023 -9.782 -7.503 801 HB2 LYS 19 HB2 LYS 19 18.930 -11.472 -9.110 802 HB3 LYS 19 HB1 LYS 19 19.167 -10.179 -10.285 803 HG2 LYS 19 HG2 LYS 19 20.691 -9.028 -8.747 804 HG3 LYS 19 HG1 LYS 19 20.419 -10.269 -7.525 805 HD2 LYS 19 HD2 LYS 19 21.335 -11.977 -9.065 806 HD3 LYS 19 HD1 LYS 19 21.639 -10.721 -10.265 807 HE2 LYS 19 HE2 LYS 19 22.808 -10.704 -7.469 808 HE3 LYS 19 HE1 LYS 19 23.660 -11.309 -8.889 809 HZ1 LYS 19 HZ1 LYS 19 22.763 -8.889 -9.697 810 HZ2 LYS 19 HZ2 LYS 19 24.331 -9.213 -9.132 811 HZ3 LYS 19 HZ3 LYS 19 23.152 -8.600 -8.073 812 H SER 20 HN SER 20 17.530 -8.295 -10.707 813 HA SER 20 HA SER 20 19.132 -5.986 -10.281 814 HB2 SER 20 HB2 SER 20 18.357 -6.398 -12.494 815 HB3 SER 20 HB1 SER 20 16.680 -6.501 -11.969 816 HG SER 20 HG SER 20 17.770 -4.148 -11.239 817 H VAL 21 HN VAL 21 15.608 -6.419 -9.776 818 HA VAL 21 HA VAL 21 15.166 -3.807 -8.684 819 HB VAL 21 HB VAL 21 13.642 -6.387 -8.253 820 HG11 VAL 21 HG11 VAL 21 13.001 -3.499 -7.614 821 HG12 VAL 21 HG12 VAL 21 13.031 -4.866 -6.502 822 HG13 VAL 21 HG13 VAL 21 11.764 -4.751 -7.724 823 HG21 VAL 21 HG21 VAL 21 13.892 -5.487 -10.625 824 HG22 VAL 21 HG22 VAL 21 13.019 -4.052 -10.084 825 HG23 VAL 21 HG23 VAL 21 12.232 -5.630 -10.049 826 H ALA 22 HN ALA 22 15.831 -6.938 -7.139 827 HA ALA 22 HA ALA 22 15.636 -6.062 -4.438 828 HB1 ALA 22 HB1 ALA 22 15.693 -8.412 -4.815 829 HB2 ALA 22 HB2 ALA 22 17.229 -8.046 -4.028 830 HB3 ALA 22 HB3 ALA 22 17.169 -8.300 -5.773 831 H GLU 23 HN GLU 23 18.213 -5.797 -6.807 832 HA GLU 23 HA GLU 23 20.312 -5.122 -4.958 833 HB2 GLU 23 HB2 GLU 23 20.744 -5.847 -7.283 834 HB3 GLU 23 HB1 GLU 23 19.988 -4.370 -7.879 835 HG2 GLU 23 HG2 GLU 23 21.719 -3.000 -7.080 836 HG3 GLU 23 HG1 GLU 23 22.281 -4.208 -5.925 837 H GLU 24 HN GLU 24 17.848 -3.266 -6.643 838 HA GLU 24 HA GLU 24 18.856 -0.649 -6.052 839 HB2 GLU 24 HB2 GLU 24 15.895 -1.251 -6.127 840 HB3 GLU 24 HB1 GLU 24 16.747 0.173 -6.718 841 HG2 GLU 24 HG2 GLU 24 16.898 -2.595 -7.905 842 HG3 GLU 24 HG1 GLU 24 15.993 -1.252 -8.576 843 H MET 25 HN MET 25 16.051 -2.211 -4.503 844 HA MET 25 HA MET 25 16.190 -0.513 -2.181 845 HB2 MET 25 HB2 MET 25 14.758 -3.101 -2.770 846 HB3 MET 25 HB1 MET 25 14.639 -2.319 -1.194 847 HG2 MET 25 HG2 MET 25 13.913 -0.210 -2.410 848 HG3 MET 25 HG1 MET 25 13.817 -1.179 -3.880 849 HE1 MET 25 HE1 MET 25 10.909 -3.485 -3.477 850 HE2 MET 25 HE2 MET 25 12.649 -3.763 -3.533 851 HE3 MET 25 HE3 MET 25 11.927 -2.537 -4.570 852 H GLY 26 HN GLY 26 17.392 -3.771 -2.865 853 HA2 GLY 26 HA2 GLY 26 19.330 -4.740 -1.834 854 HA3 GLY 26 HA1 GLY 26 19.238 -3.526 -0.554 855 H ILE 27 HN ILE 27 16.908 -5.923 -1.854 856 HA ILE 27 HA ILE 27 16.519 -6.930 0.954 857 HB ILE 27 HB ILE 27 14.175 -7.401 0.327 858 HG12 ILE 27 HG12 ILE 27 14.897 -5.929 -2.226 859 HG13 ILE 27 HG11 ILE 27 14.509 -7.645 -2.106 860 HG21 ILE 27 HG21 ILE 27 14.887 -5.215 1.371 861 HG22 ILE 27 HG22 ILE 27 13.378 -5.140 0.457 862 HG23 ILE 27 HG23 ILE 27 14.870 -4.513 -0.248 863 HD11 ILE 27 HD11 ILE 27 12.292 -6.808 -0.988 864 HD12 ILE 27 HD12 ILE 27 12.456 -6.711 -2.742 865 HD13 ILE 27 HD13 ILE 27 12.700 -5.272 -1.754 866 H SER 28 HN SER 28 15.739 -9.191 1.027 867 HA SER 28 HA SER 28 17.422 -10.904 -0.529 868 HB2 SER 28 HB2 SER 28 16.693 -11.522 1.718 869 HB3 SER 28 HB1 SER 28 15.012 -11.537 1.195 870 HG SER 28 HG SER 28 17.083 -13.164 0.125 871 H ARG 29 HN ARG 29 16.904 -12.332 -2.195 872 HA ARG 29 HA ARG 29 15.004 -11.484 -4.140 873 HB2 ARG 29 HB2 ARG 29 16.451 -14.117 -3.743 874 HB3 ARG 29 HB1 ARG 29 15.452 -13.771 -5.154 875 HG2 ARG 29 HG2 ARG 29 16.857 -11.847 -5.714 876 HG3 ARG 29 HG1 ARG 29 17.826 -12.106 -4.263 877 HD2 ARG 29 HD2 ARG 29 18.971 -13.056 -6.217 878 HD3 ARG 29 HD1 ARG 29 18.478 -14.346 -5.120 879 HE ARG 29 HE ARG 29 16.383 -13.988 -6.992 880 HH11 ARG 29 HH21 ARG 29 19.706 -14.922 -6.865 881 HH12 ARG 29 HH22 ARG 29 19.588 -15.996 -8.220 882 HH21 ARG 29 HH11 ARG 29 16.217 -15.387 -8.752 883 HH22 ARG 29 HH12 ARG 29 17.616 -16.259 -9.287 884 H GLN 30 HN GLN 30 14.800 -13.807 -1.494 885 HA GLN 30 HA GLN 30 12.358 -15.079 -2.279 886 HB2 GLN 30 HB2 GLN 30 13.854 -15.925 -0.476 887 HB3 GLN 30 HB1 GLN 30 13.397 -14.546 0.523 888 HG2 GLN 30 HG2 GLN 30 11.055 -15.262 0.497 889 HG3 GLN 30 HG1 GLN 30 11.458 -16.603 -0.575 890 HE21 GLN 30 HE21 GLN 30 11.252 -18.444 0.729 891 HE22 GLN 30 HE22 GLN 30 11.994 -18.638 2.243 892 H GLN 31 HN GLN 31 13.024 -12.170 -0.350 893 HA GLN 31 HA GLN 31 10.320 -11.645 0.422 894 HB2 GLN 31 HB2 GLN 31 12.313 -10.539 1.435 895 HB3 GLN 31 HB1 GLN 31 12.556 -9.652 -0.071 896 HG2 GLN 31 HG2 GLN 31 10.398 -8.564 0.158 897 HG3 GLN 31 HG1 GLN 31 10.014 -9.542 1.575 898 HE21 GLN 31 HE21 GLN 31 11.972 -9.368 3.324 899 HE22 GLN 31 HE22 GLN 31 12.471 -7.776 3.637 900 H LEU 32 HN LEU 32 12.244 -10.484 -2.350 901 HA LEU 32 HA LEU 32 10.178 -8.849 -3.462 902 HB2 LEU 32 HB2 LEU 32 12.654 -8.860 -4.090 903 HB3 LEU 32 HB1 LEU 32 12.309 -10.313 -5.028 904 HG LEU 32 HG LEU 32 10.339 -8.785 -6.024 905 HD11 LEU 32 HD11 LEU 32 10.904 -6.883 -4.503 906 HD12 LEU 32 HD12 LEU 32 11.010 -6.448 -6.209 907 HD13 LEU 32 HD13 LEU 32 12.478 -6.768 -5.285 908 HD21 LEU 32 HD21 LEU 32 12.040 -9.754 -7.427 909 HD22 LEU 32 HD22 LEU 32 13.267 -8.658 -6.791 910 HD23 LEU 32 HD23 LEU 32 11.965 -8.032 -7.804 911 H CYS 33 HN CYS 33 11.078 -12.237 -3.988 912 HA CYS 33 HA CYS 33 9.214 -12.788 -6.067 913 HB2 CYS 33 HB2 CYS 33 11.173 -14.218 -4.911 914 HB3 CYS 33 HB1 CYS 33 9.811 -14.919 -4.040 915 HG CYS 33 HG CYS 33 9.146 -14.890 -6.966 916 H ASN 34 HN ASN 34 8.887 -12.682 -2.575 917 HA ASN 34 HA ASN 34 6.295 -13.891 -2.421 918 HB2 ASN 34 HB2 ASN 34 8.069 -13.289 -0.561 919 HB3 ASN 34 HB1 ASN 34 7.198 -11.759 -0.488 920 HD21 ASN 34 HD21 ASN 34 5.709 -11.846 1.195 921 HD22 ASN 34 HD22 ASN 34 4.757 -13.194 1.589 922 H ILE 35 HN ILE 35 7.360 -10.570 -3.031 923 HA ILE 35 HA ILE 35 4.860 -9.257 -2.646 924 HB ILE 35 HB ILE 35 7.150 -8.647 -4.535 925 HG12 ILE 35 HG12 ILE 35 6.417 -7.388 -1.871 926 HG13 ILE 35 HG11 ILE 35 7.605 -8.678 -2.044 927 HG21 ILE 35 HG21 ILE 35 6.113 -6.266 -4.339 928 HG22 ILE 35 HG22 ILE 35 4.646 -7.112 -3.847 929 HG23 ILE 35 HG23 ILE 35 5.352 -7.420 -5.432 930 HD11 ILE 35 HD11 ILE 35 8.941 -6.747 -2.118 931 HD12 ILE 35 HD12 ILE 35 7.747 -5.841 -3.044 932 HD13 ILE 35 HD13 ILE 35 8.696 -7.100 -3.825 933 H GLU 36 HN GLU 36 6.304 -10.653 -5.590 934 HA GLU 36 HA GLU 36 4.051 -10.005 -7.270 935 HB2 GLU 36 HB2 GLU 36 5.283 -11.003 -8.975 936 HB3 GLU 36 HB1 GLU 36 6.569 -10.658 -7.824 937 HG2 GLU 36 HG2 GLU 36 5.969 -13.080 -6.909 938 HG3 GLU 36 HG1 GLU 36 5.307 -13.295 -8.524 939 H GLN 37 HN GLN 37 4.733 -12.569 -5.050 940 HA GLN 37 HA GLN 37 2.399 -14.161 -6.056 941 HB2 GLN 37 HB2 GLN 37 4.531 -15.379 -5.914 942 HB3 GLN 37 HB1 GLN 37 4.694 -14.928 -4.217 943 HG2 GLN 37 HG2 GLN 37 2.892 -16.293 -3.556 944 HG3 GLN 37 HG1 GLN 37 2.250 -16.408 -5.194 945 HE21 GLN 37 HE21 GLN 37 2.703 -18.777 -3.751 946 HE22 GLN 37 HE22 GLN 37 4.027 -19.605 -4.415 947 H SER 38 HN SER 38 3.010 -11.780 -3.897 948 HA SER 38 HA SER 38 1.894 -12.735 -1.450 949 HB2 SER 38 HB2 SER 38 1.404 -10.288 -1.041 950 HB3 SER 38 HB1 SER 38 3.080 -10.651 -1.443 951 HG SER 38 HG SER 38 1.054 -9.747 -3.222 952 H GLU 39 HN GLU 39 -0.229 -11.798 -0.580 953 HA GLU 39 HA GLU 39 -2.401 -12.804 -2.197 954 HB2 GLU 39 HB2 GLU 39 -2.491 -11.142 0.338 955 HB3 GLU 39 HB1 GLU 39 -3.818 -12.093 -0.327 956 HG2 GLU 39 HG2 GLU 39 -2.522 -14.153 -0.037 957 HG3 GLU 39 HG1 GLU 39 -1.153 -13.221 0.576 958 H THR 40 HN THR 40 -3.750 -10.193 -0.761 959 HA THR 40 HA THR 40 -4.005 -8.757 -3.336 960 HB THR 40 HB THR 40 -6.037 -9.276 -2.046 961 HG1 THR 40 HG1 THR 40 -6.649 -6.932 -1.789 962 HG21 THR 40 HG21 THR 40 -4.988 -7.352 0.039 963 HG22 THR 40 HG22 THR 40 -4.833 -9.102 0.193 964 HG23 THR 40 HG23 THR 40 -6.431 -8.361 0.128 965 H ALA 41 HN ALA 41 -4.407 -6.208 -2.739 966 HA ALA 41 HA ALA 41 -1.738 -5.288 -1.985 967 HB1 ALA 41 HB1 ALA 41 -2.617 -4.147 -3.845 968 HB2 ALA 41 HB2 ALA 41 -2.848 -2.999 -2.525 969 HB3 ALA 41 HB3 ALA 41 -4.205 -3.972 -3.100 970 HA PRO 42 HA PRO 42 -2.804 -4.205 2.201 971 HB2 PRO 42 HB2 PRO 42 -1.076 -2.102 2.650 972 HB3 PRO 42 HB1 PRO 42 -0.579 -3.804 2.623 973 HG2 PRO 42 HG2 PRO 42 -0.288 -1.717 0.521 974 HG3 PRO 42 HG1 PRO 42 0.798 -3.046 0.949 975 HD2 PRO 42 HD2 PRO 42 -0.881 -3.104 -1.235 976 HD3 PRO 42 HD1 PRO 42 -0.284 -4.554 -0.398 977 H VAL 43 HN VAL 43 -3.821 -2.584 3.528 978 HA VAL 43 HA VAL 43 -5.763 -0.969 2.187 979 HB VAL 43 HB VAL 43 -6.005 -1.905 4.498 980 HG11 VAL 43 HG11 VAL 43 -4.252 0.400 5.360 981 HG12 VAL 43 HG12 VAL 43 -3.618 -1.229 5.126 982 HG13 VAL 43 HG13 VAL 43 -4.858 -0.933 6.344 983 HG21 VAL 43 HG21 VAL 43 -7.390 0.007 3.634 984 HG22 VAL 43 HG22 VAL 43 -6.247 1.115 4.394 985 HG23 VAL 43 HG23 VAL 43 -7.198 0.010 5.387 986 H VAL 44 HN VAL 44 -2.497 -0.319 3.177 987 HA VAL 44 HA VAL 44 -2.598 2.508 3.446 988 HB VAL 44 HB VAL 44 -0.385 0.697 2.436 989 HG11 VAL 44 HG11 VAL 44 1.076 2.666 3.133 990 HG12 VAL 44 HG12 VAL 44 -0.397 3.634 3.164 991 HG13 VAL 44 HG13 VAL 44 0.143 2.898 1.655 992 HG21 VAL 44 HG21 VAL 44 -1.123 0.269 4.747 993 HG22 VAL 44 HG22 VAL 44 -0.935 1.980 5.132 994 HG23 VAL 44 HG23 VAL 44 0.480 1.003 4.739 995 H VAL 45 HN VAL 45 -2.117 0.481 0.549 996 HA VAL 45 HA VAL 45 -1.716 2.624 -1.297 997 HB VAL 45 HB VAL 45 -2.927 -0.127 -1.705 998 HG11 VAL 45 HG11 VAL 45 -2.028 2.001 -3.657 999 HG12 VAL 45 HG12 VAL 45 -3.605 1.216 -3.566 1000 HG13 VAL 45 HG13 VAL 45 -2.195 0.304 -4.106 1001 HG21 VAL 45 HG21 VAL 45 -0.734 -0.821 -2.307 1002 HG22 VAL 45 HG22 VAL 45 -0.512 0.145 -0.849 1003 HG23 VAL 45 HG23 VAL 45 -0.155 0.841 -2.429 1004 H LYS 46 HN LYS 46 -4.684 0.962 -0.227 1005 HA LYS 46 HA LYS 46 -6.493 2.381 -1.922 1006 HB2 LYS 46 HB2 LYS 46 -6.873 1.151 0.827 1007 HB3 LYS 46 HB1 LYS 46 -8.198 1.765 -0.164 1008 HG2 LYS 46 HG2 LYS 46 -7.588 0.195 -1.964 1009 HG3 LYS 46 HG1 LYS 46 -6.253 -0.414 -0.986 1010 HD2 LYS 46 HD2 LYS 46 -7.831 -1.175 0.733 1011 HD3 LYS 46 HD1 LYS 46 -9.180 -0.527 -0.200 1012 HE2 LYS 46 HE2 LYS 46 -8.975 -2.935 -0.606 1013 HE3 LYS 46 HE1 LYS 46 -8.583 -2.043 -2.076 1014 HZ1 LYS 46 HZ1 LYS 46 -6.943 -3.785 -0.547 1015 HZ2 LYS 46 HZ2 LYS 46 -6.218 -2.254 -0.686 1016 HZ3 LYS 46 HZ3 LYS 46 -6.660 -3.117 -2.081 1017 H TYR 47 HN TYR 47 -5.208 3.086 1.312 1018 HA TYR 47 HA TYR 47 -6.749 5.435 1.829 1019 HB2 TYR 47 HB2 TYR 47 -5.174 4.094 3.397 1020 HB3 TYR 47 HB1 TYR 47 -3.872 5.047 2.693 1021 HD1 TYR 47 HD1 TYR 47 -4.332 7.687 2.614 1022 HD2 TYR 47 HD2 TYR 47 -6.269 4.927 5.282 1023 HE1 TYR 47 HE1 TYR 47 -4.909 9.550 4.127 1024 HE2 TYR 47 HE2 TYR 47 -6.828 6.804 6.796 1025 HH TYR 47 HH TYR 47 -5.414 9.793 6.633 1026 H ILE 48 HN ILE 48 -3.560 4.971 0.329 1027 HA ILE 48 HA ILE 48 -3.008 7.715 -0.221 1028 HB ILE 48 HB ILE 48 -2.129 5.176 -1.633 1029 HG12 ILE 48 HG12 ILE 48 -0.591 6.978 0.260 1030 HG13 ILE 48 HG11 ILE 48 -1.480 5.552 0.800 1031 HG21 ILE 48 HG21 ILE 48 -1.809 6.924 -3.217 1032 HG22 ILE 48 HG22 ILE 48 -0.241 6.716 -2.436 1033 HG23 ILE 48 HG23 ILE 48 -1.288 8.058 -1.970 1034 HD11 ILE 48 HD11 ILE 48 0.575 5.399 -1.413 1035 HD12 ILE 48 HD12 ILE 48 -0.096 4.082 -0.453 1036 HD13 ILE 48 HD13 ILE 48 1.021 5.228 0.284 1037 H ALA 49 HN ALA 49 -4.628 5.193 -2.109 1038 HA ALA 49 HA ALA 49 -5.006 6.568 -4.527 1039 HB1 ALA 49 HB1 ALA 49 -6.857 5.061 -4.915 1040 HB2 ALA 49 HB2 ALA 49 -7.039 4.772 -3.185 1041 HB3 ALA 49 HB3 ALA 49 -5.614 4.175 -4.032 1042 H PHE 50 HN PHE 50 -6.936 6.734 -1.537 1043 HA PHE 50 HA PHE 50 -9.022 8.375 -2.586 1044 HB2 PHE 50 HB2 PHE 50 -8.738 7.132 -0.262 1045 HB3 PHE 50 HB1 PHE 50 -8.056 8.672 0.257 1046 HD1 PHE 50 HD2 PHE 50 -10.974 7.383 -1.715 1047 HD2 PHE 50 HD1 PHE 50 -9.554 10.243 1.159 1048 HE1 PHE 50 HE2 PHE 50 -13.273 8.267 -1.461 1049 HE2 PHE 50 HE1 PHE 50 -11.858 11.125 1.415 1050 HZ PHE 50 HZ PHE 50 -13.719 10.136 0.105 1051 H LEU 51 HN LEU 51 -6.006 9.227 -0.874 1052 HA LEU 51 HA LEU 51 -6.358 12.077 -1.121 1053 HB2 LEU 51 HB2 LEU 51 -3.869 10.384 -0.750 1054 HB3 LEU 51 HB1 LEU 51 -3.888 12.143 -0.636 1055 HG LEU 51 HG LEU 51 -5.577 10.290 1.073 1056 HD11 LEU 51 HD11 LEU 51 -3.933 11.251 2.875 1057 HD12 LEU 51 HD12 LEU 51 -2.877 11.563 1.497 1058 HD13 LEU 51 HD13 LEU 51 -3.400 9.916 1.853 1059 HD21 LEU 51 HD21 LEU 51 -5.287 13.279 0.858 1060 HD22 LEU 51 HD22 LEU 51 -5.591 12.576 2.447 1061 HD23 LEU 51 HD23 LEU 51 -6.736 12.312 1.136 1062 H ARG 52 HN ARG 52 -4.721 9.658 -3.122 1063 HA ARG 52 HA ARG 52 -3.501 11.444 -4.979 1064 HB2 ARG 52 HB2 ARG 52 -2.978 9.014 -4.797 1065 HB3 ARG 52 HB1 ARG 52 -4.559 8.645 -5.480 1066 HG2 ARG 52 HG2 ARG 52 -3.974 9.858 -7.537 1067 HG3 ARG 52 HG1 ARG 52 -2.401 10.270 -6.856 1068 HD2 ARG 52 HD2 ARG 52 -1.897 7.825 -6.660 1069 HD3 ARG 52 HD1 ARG 52 -3.423 7.482 -7.480 1070 HE ARG 52 HE ARG 52 -1.958 9.311 -9.089 1071 HH11 ARG 52 HH21 ARG 52 -1.825 6.062 -7.918 1072 HH12 ARG 52 HH22 ARG 52 -0.955 5.471 -9.293 1073 HH21 ARG 52 HH11 ARG 52 -0.833 8.550 -10.880 1074 HH22 ARG 52 HH12 ARG 52 -0.394 6.877 -10.968 1075 H SER 53 HN SER 53 -6.712 9.909 -4.965 1076 HA SER 53 HA SER 53 -7.554 10.776 -7.532 1077 HB2 SER 53 HB2 SER 53 -8.796 9.138 -6.144 1078 HB3 SER 53 HB1 SER 53 -9.238 10.429 -5.031 1079 HG SER 53 HG SER 53 -10.869 10.655 -6.345 1080 H LYS 54 HN LYS 54 -6.985 12.568 -4.657 1081 HA LYS 54 HA LYS 54 -8.673 14.846 -5.549 1082 HB2 LYS 54 HB2 LYS 54 -6.963 14.403 -3.086 1083 HB3 LYS 54 HB1 LYS 54 -7.904 15.863 -3.392 1084 HG2 LYS 54 HG2 LYS 54 -9.966 14.518 -3.483 1085 HG3 LYS 54 HG1 LYS 54 -9.028 13.052 -3.198 1086 HD2 LYS 54 HD2 LYS 54 -8.248 14.015 -1.034 1087 HD3 LYS 54 HD1 LYS 54 -9.298 15.406 -1.307 1088 HE2 LYS 54 HE2 LYS 54 -10.196 12.519 -1.077 1089 HE3 LYS 54 HE1 LYS 54 -10.424 13.775 0.137 1090 HZ1 LYS 54 HZ1 LYS 54 -12.319 14.246 -0.885 1091 HZ2 LYS 54 HZ2 LYS 54 -11.956 13.227 -2.195 1092 HZ3 LYS 54 HZ3 LYS 54 -11.411 14.836 -2.192 1093 H GLY 55 HN GLY 55 -5.672 13.640 -6.239 1094 HA2 GLY 55 HA2 GLY 55 -3.950 14.625 -7.517 1095 HA3 GLY 55 HA1 GLY 55 -4.793 16.170 -7.396 1096 H VAL 56 HN VAL 56 -4.075 14.354 -4.493 1097 HA VAL 56 HA VAL 56 -2.648 16.580 -3.351 1098 HB VAL 56 HB VAL 56 -2.909 13.686 -2.494 1099 HG11 VAL 56 HG11 VAL 56 -2.134 14.677 -0.238 1100 HG12 VAL 56 HG12 VAL 56 -1.518 16.031 -1.186 1101 HG13 VAL 56 HG13 VAL 56 -0.890 14.408 -1.460 1102 HG21 VAL 56 HG21 VAL 56 -4.082 16.176 -1.241 1103 HG22 VAL 56 HG22 VAL 56 -4.583 14.500 -1.011 1104 HG23 VAL 56 HG23 VAL 56 -4.906 15.316 -2.539 1105 H ASP 57 HN ASP 57 -0.470 16.997 -3.260 1106 HA ASP 57 HA ASP 57 1.314 16.007 -5.184 1107 HB2 ASP 57 HB2 ASP 57 1.984 17.093 -2.430 1108 HB3 ASP 57 HB1 ASP 57 3.099 16.997 -3.793 1109 H LEU 58 HN LEU 58 0.940 13.686 -5.135 1110 HA LEU 58 HA LEU 58 1.938 12.172 -2.810 1111 HB2 LEU 58 HB2 LEU 58 -0.128 11.472 -4.009 1112 HB3 LEU 58 HB1 LEU 58 0.826 11.225 -5.470 1113 HG LEU 58 HG LEU 58 2.205 9.542 -4.243 1114 HD11 LEU 58 HD11 LEU 58 0.949 8.690 -2.079 1115 HD12 LEU 58 HD12 LEU 58 0.349 10.345 -2.014 1116 HD13 LEU 58 HD13 LEU 58 2.083 10.029 -1.966 1117 HD21 LEU 58 HD21 LEU 58 0.563 7.786 -4.364 1118 HD22 LEU 58 HD22 LEU 58 0.142 8.974 -5.599 1119 HD23 LEU 58 HD23 LEU 58 -0.755 8.924 -4.081 1120 H ASN 59 HN ASN 59 2.647 12.388 -6.315 1121 HA ASN 59 HA ASN 59 4.915 10.675 -6.256 1122 HB2 ASN 59 HB2 ASN 59 5.566 12.134 -8.361 1123 HB3 ASN 59 HB1 ASN 59 4.135 11.104 -8.418 1124 HD21 ASN 59 HD21 ASN 59 2.169 12.125 -8.879 1125 HD22 ASN 59 HD22 ASN 59 1.932 13.806 -8.863 1126 H ALA 60 HN ALA 60 4.666 14.194 -5.806 1127 HA ALA 60 HA ALA 60 7.495 14.656 -5.628 1128 HB1 ALA 60 HB1 ALA 60 6.857 16.789 -4.584 1129 HB2 ALA 60 HB2 ALA 60 5.218 16.188 -4.338 1130 HB3 ALA 60 HB3 ALA 60 5.822 16.454 -5.972 1131 H LEU 61 HN LEU 61 5.014 13.881 -3.218 1132 HA LEU 61 HA LEU 61 6.599 14.176 -0.881 1133 HB2 LEU 61 HB2 LEU 61 4.190 13.872 -0.770 1134 HB3 LEU 61 HB1 LEU 61 4.314 12.286 -1.526 1135 HG LEU 61 HG LEU 61 5.958 12.610 0.945 1136 HD11 LEU 61 HD11 LEU 61 3.876 12.161 2.365 1137 HD12 LEU 61 HD12 LEU 61 2.937 12.754 0.996 1138 HD13 LEU 61 HD13 LEU 61 4.091 13.818 1.800 1139 HD21 LEU 61 HD21 LEU 61 5.482 10.463 -0.439 1140 HD22 LEU 61 HD22 LEU 61 3.890 10.488 0.317 1141 HD23 LEU 61 HD23 LEU 61 5.338 10.347 1.313 1142 H PHE 62 HN PHE 62 6.012 11.320 -2.924 1143 HA PHE 62 HA PHE 62 7.816 9.624 -1.452 1144 HB2 PHE 62 HB2 PHE 62 6.346 9.475 -4.052 1145 HB3 PHE 62 HB1 PHE 62 7.709 8.378 -3.842 1146 HD1 PHE 62 HD1 PHE 62 7.797 6.986 -1.687 1147 HD2 PHE 62 HD2 PHE 62 4.250 8.956 -3.091 1148 HE1 PHE 62 HE1 PHE 62 6.411 5.470 -0.301 1149 HE2 PHE 62 HE2 PHE 62 2.865 7.439 -1.704 1150 HZ PHE 62 HZ PHE 62 3.940 5.699 -0.311 1151 H ASP 63 HN ASP 63 8.129 11.565 -4.400 1152 HA ASP 63 HA ASP 63 10.558 10.836 -5.428 1153 HB2 ASP 63 HB2 ASP 63 9.161 12.786 -6.178 1154 HB3 ASP 63 HB1 ASP 63 9.821 13.716 -4.831 1155 H ARG 64 HN ARG 64 10.109 12.900 -2.568 1156 HA ARG 64 HA ARG 64 12.944 13.192 -2.045 1157 HB2 ARG 64 HB2 ARG 64 10.714 13.342 -0.003 1158 HB3 ARG 64 HB1 ARG 64 12.252 14.202 0.014 1159 HG2 ARG 64 HG2 ARG 64 10.069 14.629 -2.057 1160 HG3 ARG 64 HG1 ARG 64 10.317 15.649 -0.648 1161 HD2 ARG 64 HD2 ARG 64 12.396 15.193 -2.812 1162 HD3 ARG 64 HD1 ARG 64 11.339 16.598 -2.702 1163 HE ARG 64 HE ARG 64 12.707 16.235 -0.214 1164 HH11 ARG 64 HH21 ARG 64 13.121 17.197 -3.498 1165 HH12 ARG 64 HH22 ARG 64 14.424 18.281 -3.151 1166 HH21 ARG 64 HH11 ARG 64 14.396 17.631 0.259 1167 HH22 ARG 64 HH12 ARG 64 15.149 18.528 -1.017 1168 H ILE 65 HN ILE 65 10.438 10.991 -0.806 1169 HA ILE 65 HA ILE 65 12.142 9.637 1.066 1170 HB ILE 65 HB ILE 65 9.628 8.730 -0.356 1171 HG12 ILE 65 HG12 ILE 65 10.047 9.621 2.508 1172 HG13 ILE 65 HG11 ILE 65 9.534 10.717 1.226 1173 HG21 ILE 65 HG21 ILE 65 9.559 7.074 1.596 1174 HG22 ILE 65 HG22 ILE 65 11.261 7.459 1.844 1175 HG23 ILE 65 HG23 ILE 65 10.734 6.732 0.326 1176 HD11 ILE 65 HD11 ILE 65 7.662 9.672 2.622 1177 HD12 ILE 65 HD12 ILE 65 8.063 8.146 1.834 1178 HD13 ILE 65 HD13 ILE 65 7.504 9.515 0.872 1179 H ILE 66 HN ILE 66 11.285 8.968 -2.318 1180 HA ILE 66 HA ILE 66 12.282 6.491 -2.819 1181 HB ILE 66 HB ILE 66 12.774 9.001 -4.442 1182 HG12 ILE 66 HG12 ILE 66 10.383 8.014 -3.917 1183 HG13 ILE 66 HG11 ILE 66 10.774 8.515 -5.557 1184 HG21 ILE 66 HG21 ILE 66 13.360 6.108 -5.058 1185 HG22 ILE 66 HG22 ILE 66 14.399 7.515 -5.282 1186 HG23 ILE 66 HG23 ILE 66 13.018 7.260 -6.348 1187 HD11 ILE 66 HD11 ILE 66 9.642 6.204 -5.217 1188 HD12 ILE 66 HD12 ILE 66 11.232 5.664 -4.681 1189 HD13 ILE 66 HD13 ILE 66 11.020 6.302 -6.311 1190 H VAL 67 HN VAL 67 14.076 5.468 -2.235 1191 HA VAL 67 HA VAL 67 16.533 7.024 -1.621 1192 HB VAL 67 HB VAL 67 15.719 4.150 -1.100 1193 HG11 VAL 67 HG11 VAL 67 17.845 4.178 0.320 1194 HG12 VAL 67 HG12 VAL 67 18.305 5.627 -0.574 1195 HG13 VAL 67 HG13 VAL 67 18.084 4.099 -1.425 1196 HG21 VAL 67 HG21 VAL 67 16.264 6.464 0.785 1197 HG22 VAL 67 HG22 VAL 67 15.668 4.864 1.229 1198 HG23 VAL 67 HG23 VAL 67 14.654 5.952 0.280 1199 H ASN 68 HN ASN 68 18.173 7.079 -3.035 1200 HA ASN 68 HA ASN 68 18.289 5.025 -5.226 1201 HB2 ASN 68 HB2 ASN 68 19.740 7.458 -5.902 1202 HB3 ASN 68 HB1 ASN 68 18.363 6.740 -6.735 1203 HD21 ASN 68 HD21 ASN 68 19.197 8.929 -4.022 1204 HD22 ASN 68 HD22 ASN 68 17.727 9.777 -4.049 1205 H LYS 69 HN LYS 69 19.870 6.525 -2.570 1206 HA LYS 69 HA LYS 69 22.492 5.276 -3.346 1207 HB2 LYS 69 HB2 LYS 69 21.892 7.657 -1.569 1208 HB3 LYS 69 HB1 LYS 69 23.488 6.928 -1.747 1209 HG2 LYS 69 HG2 LYS 69 23.418 7.368 -4.176 1210 HG3 LYS 69 HG1 LYS 69 21.830 8.114 -3.990 1211 HD2 LYS 69 HD2 LYS 69 22.781 9.819 -2.502 1212 HD3 LYS 69 HD1 LYS 69 24.368 9.060 -2.626 1213 HE2 LYS 69 HE2 LYS 69 24.427 10.834 -4.201 1214 HE3 LYS 69 HE1 LYS 69 24.135 9.389 -5.171 1215 HZ1 LYS 69 HZ1 LYS 69 22.504 10.753 -5.951 1216 HZ2 LYS 69 HZ2 LYS 69 22.303 11.568 -4.472 1217 HZ3 LYS 69 HZ3 LYS 69 21.657 10.011 -4.682 1218 H LEU 70 HN LEU 70 22.732 6.278 -0.249 1219 HA LEU 70 HA LEU 70 22.671 3.567 0.787 1220 HB2 LEU 70 HB2 LEU 70 23.004 6.187 2.269 1221 HB3 LEU 70 HB1 LEU 70 23.430 4.585 2.870 1222 HG LEU 70 HG LEU 70 24.649 5.914 0.430 1223 HD11 LEU 70 HD11 LEU 70 26.649 6.167 1.811 1224 HD12 LEU 70 HD12 LEU 70 25.838 5.391 3.171 1225 HD13 LEU 70 HD13 LEU 70 25.286 6.965 2.598 1226 HD21 LEU 70 HD21 LEU 70 24.849 3.604 0.035 1227 HD22 LEU 70 HD22 LEU 70 24.998 3.220 1.750 1228 HD23 LEU 70 HD23 LEU 70 26.348 3.960 0.889 1229 H GLU 71 HN GLU 71 21.729 3.835 3.337 1230 HA GLU 71 HA GLU 71 19.792 3.943 4.653 1231 HB2 GLU 71 HB2 GLU 71 19.409 6.104 3.035 1232 HB3 GLU 71 HB1 GLU 71 18.073 5.095 2.487 1233 HG2 GLU 71 HG2 GLU 71 17.080 6.264 4.259 1234 HG3 GLU 71 HG1 GLU 71 17.608 4.790 5.068 1235 H HIS 72 HN HIS 72 20.549 1.697 3.219 1236 HA HIS 72 HA HIS 72 18.408 0.592 1.629 1237 HB2 HIS 72 HB2 HIS 72 20.719 -0.704 3.108 1238 HB3 HIS 72 HB1 HIS 72 19.618 -1.585 2.046 1239 HD2 HIS 72 HD2 HIS 72 22.983 -0.188 1.606 1240 HE1 HIS 72 HE1 HIS 72 21.084 0.784 -2.040 1241 HE2 HIS 72 HE2 HIS 72 23.321 0.593 -0.861 1242 H HIS 73 HN HIS 73 17.388 1.701 4.043 1243 HA HIS 73 HA HIS 73 16.044 1.196 5.891 1244 HB2 HIS 73 HB2 HIS 73 14.815 0.234 3.850 1245 HB3 HIS 73 HB1 HIS 73 15.401 -1.344 4.382 1246 HD2 HIS 73 HD2 HIS 73 12.132 -0.497 4.647 1247 HE1 HIS 73 HE1 HIS 73 12.981 -0.475 8.785 1248 HE2 HIS 73 HE2 HIS 73 11.128 -0.555 7.055 1249 H HIS 74 HN HIS 74 17.395 0.789 7.606 1250 HA HIS 74 HA HIS 74 18.927 -1.647 7.875 1251 HB2 HIS 74 HB2 HIS 74 18.169 0.517 9.849 1252 HB3 HIS 74 HB1 HIS 74 19.239 -0.826 10.244 1253 HD2 HIS 74 HD2 HIS 74 20.939 -0.730 7.300 1254 HE1 HIS 74 HE1 HIS 74 21.945 3.159 8.590 1255 HE2 HIS 74 HE2 HIS 74 22.542 1.292 6.982 1256 H HIS 75 HN HIS 75 18.284 -3.552 8.590 1257 HA HIS 75 HA HIS 75 15.799 -3.773 10.249 1258 HB2 HIS 75 HB2 HIS 75 15.097 -4.503 8.092 1259 HB3 HIS 75 HB1 HIS 75 16.622 -5.328 7.783 1260 HD2 HIS 75 HD2 HIS 75 13.153 -6.352 8.747 1261 HE1 HIS 75 HE1 HIS 75 15.640 -9.215 10.609 1262 HE2 HIS 75 HE2 HIS 75 13.253 -8.668 9.947 1263 H HIS 76 HN HIS 76 18.910 -5.166 9.252 1264 HA HIS 76 HA HIS 76 18.860 -7.112 11.460 1265 HB2 HIS 76 HB2 HIS 76 21.009 -6.402 9.441 1266 HB3 HIS 76 HB1 HIS 76 21.126 -7.714 10.615 1267 HD2 HIS 76 HD2 HIS 76 19.616 -7.083 7.122 1268 HE1 HIS 76 HE1 HIS 76 18.007 -10.742 8.487 1269 HE2 HIS 76 HE2 HIS 76 18.258 -9.214 6.477 1270 H HIS 77 HN HIS 77 19.490 -6.583 13.468 1271 HA HIS 77 HA HIS 77 20.719 -4.020 14.060 1272 HB2 HIS 77 HB2 HIS 77 19.101 -5.335 15.544 1273 HB3 HIS 77 HB1 HIS 77 20.467 -6.381 15.935 1274 HD2 HIS 77 HD2 HIS 77 19.545 -2.534 16.327 1275 HE1 HIS 77 HE1 HIS 77 22.557 -3.519 19.119 1276 HE2 HIS 77 HE2 HIS 77 21.006 -1.681 18.312 Start of MODEL 20 1 H1 MET 1 HT1 MET 1 10.058 14.489 8.475 2 H2 MET 1 HT2 MET 1 10.082 16.183 8.353 3 H3 MET 1 HT3 MET 1 10.924 15.236 7.222 4 HA MET 1 HA MET 1 7.984 15.431 7.553 5 HB2 MET 1 HB2 MET 1 9.901 16.186 5.322 6 HB3 MET 1 HB1 MET 1 8.143 16.243 5.184 7 HG2 MET 1 HG2 MET 1 9.770 17.773 7.240 8 HG3 MET 1 HG1 MET 1 9.124 18.468 5.757 9 HE1 MET 1 HE1 MET 1 5.989 17.037 5.663 10 HE2 MET 1 HE2 MET 1 6.903 18.406 5.035 11 HE3 MET 1 HE3 MET 1 5.493 18.691 6.051 12 H GLU 2 HN GLU 2 8.215 13.062 8.052 13 HA GLU 2 HA GLU 2 9.131 11.262 5.967 14 HB2 GLU 2 HB2 GLU 2 7.483 10.830 8.469 15 HB3 GLU 2 HB1 GLU 2 8.021 9.522 7.416 16 HG2 GLU 2 HG2 GLU 2 10.365 10.184 7.776 17 HG3 GLU 2 HG1 GLU 2 9.837 11.513 8.809 18 H LEU 3 HN LEU 3 7.396 9.420 5.412 19 HA LEU 3 HA LEU 3 5.498 10.586 3.620 20 HB2 LEU 3 HB2 LEU 3 5.763 7.793 4.766 21 HB3 LEU 3 HB1 LEU 3 4.608 8.207 3.503 22 HG LEU 3 HG LEU 3 7.575 8.761 3.235 23 HD11 LEU 3 HD11 LEU 3 7.628 6.675 1.842 24 HD12 LEU 3 HD12 LEU 3 5.998 6.307 2.406 25 HD13 LEU 3 HD13 LEU 3 7.336 6.366 3.553 26 HD21 LEU 3 HD21 LEU 3 6.378 10.006 1.605 27 HD22 LEU 3 HD22 LEU 3 5.207 8.716 1.345 28 HD23 LEU 3 HD23 LEU 3 6.855 8.545 0.745 29 H SER 4 HN SER 4 5.141 9.166 6.854 30 HA SER 4 HA SER 4 2.312 9.276 7.018 31 HB2 SER 4 HB2 SER 4 4.042 8.257 8.662 32 HB3 SER 4 HB1 SER 4 4.123 9.869 9.364 33 HG SER 4 HG SER 4 1.757 8.344 8.965 34 H ASN 5 HN ASN 5 4.773 11.752 7.565 35 HA ASN 5 HA ASN 5 3.059 13.748 8.670 36 HB2 ASN 5 HB2 ASN 5 5.655 13.664 8.471 37 HB3 ASN 5 HB1 ASN 5 5.407 14.380 6.879 38 HD21 ASN 5 HD21 ASN 5 2.867 15.726 8.179 39 HD22 ASN 5 HD22 ASN 5 3.527 17.074 8.969 40 H GLU 6 HN GLU 6 3.911 12.944 5.316 41 HA GLU 6 HA GLU 6 2.569 15.130 4.063 42 HB2 GLU 6 HB2 GLU 6 3.352 12.353 3.183 43 HB3 GLU 6 HB1 GLU 6 2.425 13.394 2.106 44 HG2 GLU 6 HG2 GLU 6 5.006 14.289 3.415 45 HG3 GLU 6 HG1 GLU 6 4.960 13.503 1.838 46 H LEU 7 HN LEU 7 1.408 11.850 4.908 47 HA LEU 7 HA LEU 7 -1.220 12.187 3.817 48 HB2 LEU 7 HB2 LEU 7 0.019 10.372 5.872 49 HB3 LEU 7 HB1 LEU 7 -1.737 10.407 5.737 50 HG LEU 7 HG LEU 7 -1.530 9.902 3.307 51 HD11 LEU 7 HD11 LEU 7 0.685 9.131 2.473 52 HD12 LEU 7 HD12 LEU 7 1.412 9.645 3.995 53 HD13 LEU 7 HD13 LEU 7 0.699 10.838 2.911 54 HD21 LEU 7 HD21 LEU 7 -0.901 7.556 3.604 55 HD22 LEU 7 HD22 LEU 7 -1.798 8.105 5.019 56 HD23 LEU 7 HD23 LEU 7 -0.043 7.952 5.093 57 H LYS 8 HN LYS 8 0.114 12.823 7.049 58 HA LYS 8 HA LYS 8 -2.349 13.605 8.267 59 HB2 LYS 8 HB2 LYS 8 -0.239 13.064 9.491 60 HB3 LYS 8 HB1 LYS 8 0.446 14.581 8.910 61 HG2 LYS 8 HG2 LYS 8 -1.285 15.855 10.054 62 HG3 LYS 8 HG1 LYS 8 -2.100 14.367 10.536 63 HD2 LYS 8 HD2 LYS 8 -0.795 15.157 12.421 64 HD3 LYS 8 HD1 LYS 8 -0.036 13.697 11.789 65 HE2 LYS 8 HE2 LYS 8 0.874 16.374 10.752 66 HE3 LYS 8 HE1 LYS 8 1.441 15.817 12.327 67 HZ1 LYS 8 HZ1 LYS 8 1.720 13.626 10.762 68 HZ2 LYS 8 HZ2 LYS 8 2.965 14.707 11.175 69 HZ3 LYS 8 HZ3 LYS 8 2.134 14.885 9.704 70 H VAL 9 HN VAL 9 0.181 15.511 6.628 71 HA VAL 9 HA VAL 9 -1.060 18.060 7.031 72 HB VAL 9 HB VAL 9 0.834 17.059 4.885 73 HG11 VAL 9 HG11 VAL 9 -0.251 19.819 5.468 74 HG12 VAL 9 HG12 VAL 9 -0.229 18.961 3.927 75 HG13 VAL 9 HG13 VAL 9 1.274 19.573 4.617 76 HG21 VAL 9 HG21 VAL 9 1.531 17.160 7.362 77 HG22 VAL 9 HG22 VAL 9 1.394 18.912 7.211 78 HG23 VAL 9 HG23 VAL 9 2.554 18.029 6.217 79 H GLU 10 HN GLU 10 -1.241 15.731 4.325 80 HA GLU 10 HA GLU 10 -3.011 17.310 2.715 81 HB2 GLU 10 HB2 GLU 10 -2.523 14.320 2.863 82 HB3 GLU 10 HB1 GLU 10 -3.515 15.087 1.621 83 HG2 GLU 10 HG2 GLU 10 -1.637 16.377 0.819 84 HG3 GLU 10 HG1 GLU 10 -0.632 15.852 2.169 85 H ARG 11 HN ARG 11 -3.532 15.000 5.339 86 HA ARG 11 HA ARG 11 -6.362 14.682 5.063 87 HB2 ARG 11 HB2 ARG 11 -4.802 13.397 6.624 88 HB3 ARG 11 HB1 ARG 11 -4.810 14.816 7.670 89 HG2 ARG 11 HG2 ARG 11 -7.339 14.652 7.709 90 HG3 ARG 11 HG1 ARG 11 -7.176 13.101 6.885 91 HD2 ARG 11 HD2 ARG 11 -7.323 12.612 9.233 92 HD3 ARG 11 HD1 ARG 11 -5.634 12.382 8.772 93 HE ARG 11 HE ARG 11 -5.948 15.077 9.626 94 HH11 ARG 11 HH21 ARG 11 -6.086 11.842 10.826 95 HH12 ARG 11 HH22 ARG 11 -5.597 12.279 12.429 96 HH21 ARG 11 HH11 ARG 11 -5.320 15.659 11.713 97 HH22 ARG 11 HH12 ARG 11 -5.161 14.437 12.930 98 H ILE 12 HN ILE 12 -4.395 16.972 6.928 99 HA ILE 12 HA ILE 12 -6.584 18.519 7.957 100 HB ILE 12 HB ILE 12 -3.655 19.189 7.528 101 HG12 ILE 12 HG12 ILE 12 -5.143 18.574 10.096 102 HG13 ILE 12 HG11 ILE 12 -4.337 17.326 9.145 103 HG21 ILE 12 HG21 ILE 12 -4.807 21.282 7.644 104 HG22 ILE 12 HG22 ILE 12 -4.183 20.986 9.267 105 HG23 ILE 12 HG23 ILE 12 -5.885 20.696 8.911 106 HD11 ILE 12 HD11 ILE 12 -2.922 18.282 11.005 107 HD12 ILE 12 HD12 ILE 12 -2.946 19.823 10.146 108 HD13 ILE 12 HD13 ILE 12 -2.196 18.410 9.402 109 H ARG 13 HN ARG 13 -4.483 18.871 5.106 110 HA ARG 13 HA ARG 13 -5.353 21.391 4.207 111 HB2 ARG 13 HB2 ARG 13 -3.499 19.978 3.218 112 HB3 ARG 13 HB1 ARG 13 -4.746 19.017 2.422 113 HG2 ARG 13 HG2 ARG 13 -5.598 21.087 1.325 114 HG3 ARG 13 HG1 ARG 13 -4.272 21.989 2.057 115 HD2 ARG 13 HD2 ARG 13 -3.918 19.611 0.208 116 HD3 ARG 13 HD1 ARG 13 -3.767 21.297 -0.285 117 HE ARG 13 HE ARG 13 -2.042 20.825 1.945 118 HH11 ARG 13 HH21 ARG 13 -2.473 20.086 -1.402 119 HH12 ARG 13 HH22 ARG 13 -0.782 19.860 -1.702 120 HH21 ARG 13 HH11 ARG 13 0.161 20.525 1.567 121 HH22 ARG 13 HH12 ARG 13 0.708 20.109 -0.023 122 H LEU 14 HN LEU 14 -6.773 18.180 3.547 123 HA LEU 14 HA LEU 14 -9.152 19.521 2.326 124 HB2 LEU 14 HB2 LEU 14 -8.348 16.591 2.402 125 HB3 LEU 14 HB1 LEU 14 -9.741 17.250 1.543 126 HG LEU 14 HG LEU 14 -6.840 17.979 1.015 127 HD11 LEU 14 HD11 LEU 14 -8.792 16.130 -0.355 128 HD12 LEU 14 HD12 LEU 14 -7.131 15.807 0.144 129 HD13 LEU 14 HD13 LEU 14 -7.449 16.854 -1.238 130 HD21 LEU 14 HD21 LEU 14 -7.998 19.895 0.349 131 HD22 LEU 14 HD22 LEU 14 -9.464 19.004 -0.054 132 HD23 LEU 14 HD23 LEU 14 -8.069 18.945 -1.133 133 H SER 15 HN SER 15 -8.086 18.581 5.285 134 HA SER 15 HA SER 15 -9.124 17.895 7.283 135 HB2 SER 15 HB2 SER 15 -10.086 20.029 7.361 136 HB3 SER 15 HB1 SER 15 -11.057 19.753 5.917 137 HG SER 15 HG SER 15 -11.686 17.942 7.786 138 H LEU 16 HN LEU 16 -9.182 15.622 6.555 139 HA LEU 16 HA LEU 16 -11.883 14.660 5.692 140 HB2 LEU 16 HB2 LEU 16 -9.224 13.207 5.774 141 HB3 LEU 16 HB1 LEU 16 -10.725 12.590 5.083 142 HG LEU 16 HG LEU 16 -9.302 15.099 4.154 143 HD11 LEU 16 HD11 LEU 16 -9.334 12.270 3.080 144 HD12 LEU 16 HD12 LEU 16 -7.932 13.227 3.554 145 HD13 LEU 16 HD13 LEU 16 -8.844 13.656 2.107 146 HD21 LEU 16 HD21 LEU 16 -11.554 15.386 3.547 147 HD22 LEU 16 HD22 LEU 16 -11.817 13.657 3.308 148 HD23 LEU 16 HD23 LEU 16 -10.895 14.586 2.125 149 H THR 17 HN THR 17 -13.116 13.524 7.087 150 HA THR 17 HA THR 17 -12.240 13.271 9.862 151 HB THR 17 HB THR 17 -14.556 12.208 10.101 152 HG1 THR 17 HG1 THR 17 -15.887 12.510 8.274 153 HG21 THR 17 HG21 THR 17 -14.415 14.945 8.808 154 HG22 THR 17 HG22 THR 17 -14.048 14.618 10.502 155 HG23 THR 17 HG23 THR 17 -15.680 14.360 9.887 156 H ALA 18 HN ALA 18 -11.544 11.448 10.868 157 HA ALA 18 HA ALA 18 -10.681 9.180 9.343 158 HB1 ALA 18 HB1 ALA 18 -9.478 9.675 11.333 159 HB2 ALA 18 HB2 ALA 18 -10.350 8.183 11.689 160 HB3 ALA 18 HB3 ALA 18 -10.951 9.724 12.300 161 H LYS 19 HN LYS 19 -13.516 9.786 11.378 162 HA LYS 19 HA LYS 19 -14.517 7.116 11.451 163 HB2 LYS 19 HB2 LYS 19 -15.354 9.005 12.860 164 HB3 LYS 19 HB1 LYS 19 -16.113 9.696 11.426 165 HG2 LYS 19 HG2 LYS 19 -17.483 7.676 11.152 166 HG3 LYS 19 HG1 LYS 19 -16.701 6.942 12.554 167 HD2 LYS 19 HD2 LYS 19 -17.547 8.769 13.984 168 HD3 LYS 19 HD1 LYS 19 -18.336 9.498 12.584 169 HE2 LYS 19 HE2 LYS 19 -19.958 8.176 13.859 170 HE3 LYS 19 HE1 LYS 19 -19.675 7.426 12.288 171 HZ1 LYS 19 HZ1 LYS 19 -17.768 6.357 13.939 172 HZ2 LYS 19 HZ2 LYS 19 -19.185 5.589 13.403 173 HZ3 LYS 19 HZ3 LYS 19 -19.168 6.399 14.897 174 H SER 20 HN SER 20 -15.152 9.783 9.167 175 HA SER 20 HA SER 20 -17.031 8.390 7.543 176 HB2 SER 20 HB2 SER 20 -15.033 10.535 6.763 177 HB3 SER 20 HB1 SER 20 -16.431 10.051 5.806 178 HG SER 20 HG SER 20 -17.572 11.320 7.018 179 H VAL 21 HN VAL 21 -13.485 8.691 7.229 180 HA VAL 21 HA VAL 21 -13.303 7.078 4.857 181 HB VAL 21 HB VAL 21 -11.261 7.710 7.004 182 HG11 VAL 21 HG11 VAL 21 -11.026 6.317 4.333 183 HG12 VAL 21 HG12 VAL 21 -10.453 5.762 5.906 184 HG13 VAL 21 HG13 VAL 21 -9.647 7.108 5.098 185 HG21 VAL 21 HG21 VAL 21 -10.525 9.445 5.528 186 HG22 VAL 21 HG22 VAL 21 -12.280 9.596 5.619 187 HG23 VAL 21 HG23 VAL 21 -11.531 8.843 4.211 188 H ALA 22 HN ALA 22 -12.833 6.308 8.308 189 HA ALA 22 HA ALA 22 -12.144 3.570 7.938 190 HB1 ALA 22 HB1 ALA 22 -11.771 4.624 10.076 191 HB2 ALA 22 HB2 ALA 22 -12.946 3.333 10.327 192 HB3 ALA 22 HB3 ALA 22 -13.484 5.011 10.242 193 H GLU 23 HN GLU 23 -15.297 5.156 8.325 194 HA GLU 23 HA GLU 23 -16.804 2.700 8.437 195 HB2 GLU 23 HB2 GLU 23 -17.522 5.057 9.169 196 HB3 GLU 23 HB1 GLU 23 -17.847 5.365 7.464 197 HG2 GLU 23 HG2 GLU 23 -19.917 4.623 8.392 198 HG3 GLU 23 HG1 GLU 23 -19.273 3.241 7.502 199 H GLU 24 HN GLU 24 -16.144 5.008 5.785 200 HA GLU 24 HA GLU 24 -17.601 3.471 3.824 201 HB2 GLU 24 HB2 GLU 24 -17.073 5.928 3.654 202 HB3 GLU 24 HB1 GLU 24 -15.398 5.487 3.321 203 HG2 GLU 24 HG2 GLU 24 -16.007 4.342 1.305 204 HG3 GLU 24 HG1 GLU 24 -17.725 4.435 1.695 205 H MET 25 HN MET 25 -14.221 3.561 4.839 206 HA MET 25 HA MET 25 -13.154 1.976 2.714 207 HB2 MET 25 HB2 MET 25 -12.319 2.509 5.564 208 HB3 MET 25 HB1 MET 25 -11.413 1.380 4.562 209 HG2 MET 25 HG2 MET 25 -12.051 4.207 3.691 210 HG3 MET 25 HG1 MET 25 -10.560 3.778 4.525 211 HE1 MET 25 HE1 MET 25 -9.478 1.032 3.337 212 HE2 MET 25 HE2 MET 25 -8.741 2.574 3.760 213 HE3 MET 25 HE3 MET 25 -8.452 1.875 2.173 214 H GLY 26 HN GLY 26 -14.671 1.108 5.802 215 HA2 GLY 26 HA2 GLY 26 -15.972 -0.937 6.038 216 HA3 GLY 26 HA1 GLY 26 -14.975 -1.688 4.789 217 H ILE 27 HN ILE 27 -13.443 0.236 7.255 218 HA ILE 27 HA ILE 27 -12.523 -2.261 8.649 219 HB ILE 27 HB ILE 27 -10.305 -1.182 8.902 220 HG12 ILE 27 HG12 ILE 27 -11.358 0.852 6.911 221 HG13 ILE 27 HG11 ILE 27 -11.167 1.177 8.633 222 HG21 ILE 27 HG21 ILE 27 -9.581 -1.562 6.599 223 HG22 ILE 27 HG22 ILE 27 -11.240 -1.391 6.026 224 HG23 ILE 27 HG23 ILE 27 -10.796 -2.760 7.045 225 HD11 ILE 27 HD11 ILE 27 -9.223 1.913 7.183 226 HD12 ILE 27 HD12 ILE 27 -8.894 0.210 6.882 227 HD13 ILE 27 HD13 ILE 27 -8.793 0.851 8.521 228 H SER 28 HN SER 28 -11.739 -1.853 10.854 229 HA SER 28 HA SER 28 -13.618 -0.325 12.369 230 HB2 SER 28 HB2 SER 28 -12.504 -2.280 13.313 231 HB3 SER 28 HB1 SER 28 -10.935 -1.499 13.147 232 HG SER 28 HG SER 28 -12.278 0.224 14.455 233 H ARG 29 HN ARG 29 -13.225 1.539 13.677 234 HA ARG 29 HA ARG 29 -11.806 3.650 12.376 235 HB2 ARG 29 HB2 ARG 29 -13.757 3.982 13.892 236 HB3 ARG 29 HB1 ARG 29 -12.752 3.509 15.260 237 HG2 ARG 29 HG2 ARG 29 -11.458 5.449 15.167 238 HG3 ARG 29 HG1 ARG 29 -11.784 5.720 13.458 239 HD2 ARG 29 HD2 ARG 29 -12.988 7.395 14.664 240 HD3 ARG 29 HD1 ARG 29 -14.188 6.233 14.106 241 HE ARG 29 HE ARG 29 -13.711 5.254 16.572 242 HH11 ARG 29 HH21 ARG 29 -14.079 8.509 15.448 243 HH12 ARG 29 HH22 ARG 29 -14.715 9.088 16.949 244 HH21 ARG 29 HH11 ARG 29 -14.556 6.010 18.529 245 HH22 ARG 29 HH12 ARG 29 -14.987 7.680 18.684 246 H GLN 30 HN GLN 30 -10.979 1.538 15.101 247 HA GLN 30 HA GLN 30 -8.547 2.843 15.854 248 HB2 GLN 30 HB2 GLN 30 -9.342 -0.084 16.018 249 HB3 GLN 30 HB1 GLN 30 -7.957 0.626 16.847 250 HG2 GLN 30 HG2 GLN 30 -10.830 1.524 17.224 251 HG3 GLN 30 HG1 GLN 30 -9.968 0.442 18.316 252 HE21 GLN 30 HE21 GLN 30 -10.868 3.586 18.128 253 HE22 GLN 30 HE22 GLN 30 -9.567 4.323 18.931 254 H GLN 31 HN GLN 31 -9.256 0.302 13.470 255 HA GLN 31 HA GLN 31 -6.557 -0.269 12.729 256 HB2 GLN 31 HB2 GLN 31 -8.492 -1.671 12.064 257 HB3 GLN 31 HB1 GLN 31 -9.064 -0.370 11.019 258 HG2 GLN 31 HG2 GLN 31 -7.070 -0.513 9.648 259 HG3 GLN 31 HG1 GLN 31 -6.346 -1.684 10.752 260 HE21 GLN 31 HE21 GLN 31 -6.770 -2.313 7.990 261 HE22 GLN 31 HE22 GLN 31 -7.956 -3.523 7.892 262 H LEU 32 HN LEU 32 -8.870 2.153 11.550 263 HA LEU 32 HA LEU 32 -7.228 3.141 9.431 264 HB2 LEU 32 HB2 LEU 32 -9.647 3.676 9.668 265 HB3 LEU 32 HB1 LEU 32 -9.274 4.645 11.093 266 HG LEU 32 HG LEU 32 -7.818 6.102 9.711 267 HD11 LEU 32 HD11 LEU 32 -7.014 4.882 7.903 268 HD12 LEU 32 HD12 LEU 32 -8.316 5.772 7.120 269 HD13 LEU 32 HD13 LEU 32 -8.563 4.097 7.602 270 HD21 LEU 32 HD21 LEU 32 -10.288 6.534 10.039 271 HD22 LEU 32 HD22 LEU 32 -10.559 5.798 8.461 272 HD23 LEU 32 HD23 LEU 32 -9.599 7.269 8.594 273 H CYS 33 HN CYS 33 -7.483 3.991 12.862 274 HA CYS 33 HA CYS 33 -5.823 6.275 12.879 275 HB2 CYS 33 HB2 CYS 33 -6.071 4.091 14.971 276 HB3 CYS 33 HB1 CYS 33 -5.384 5.691 15.252 277 HG CYS 33 HG CYS 33 -7.786 6.692 14.640 278 H ASN 34 HN ASN 34 -4.967 2.824 12.955 279 HA ASN 34 HA ASN 34 -2.164 3.170 13.405 280 HB2 ASN 34 HB2 ASN 34 -3.848 1.016 12.142 281 HB3 ASN 34 HB1 ASN 34 -2.089 0.901 12.072 282 HD21 ASN 34 HD21 ASN 34 -4.747 1.398 14.466 283 HD22 ASN 34 HD22 ASN 34 -3.942 0.612 15.737 284 H ILE 35 HN ILE 35 -4.087 3.089 10.412 285 HA ILE 35 HA ILE 35 -1.873 3.243 8.606 286 HB ILE 35 HB ILE 35 -4.743 4.178 8.314 287 HG12 ILE 35 HG12 ILE 35 -3.341 1.741 7.173 288 HG13 ILE 35 HG11 ILE 35 -4.259 1.710 8.678 289 HG21 ILE 35 HG21 ILE 35 -3.497 5.391 6.677 290 HG22 ILE 35 HG22 ILE 35 -4.149 3.995 5.821 291 HG23 ILE 35 HG23 ILE 35 -2.462 4.006 6.332 292 HD11 ILE 35 HD11 ILE 35 -6.230 2.633 7.380 293 HD12 ILE 35 HD12 ILE 35 -5.752 0.998 6.927 294 HD13 ILE 35 HD13 ILE 35 -5.297 2.364 5.909 295 H GLU 36 HN GLU 36 -3.856 5.779 10.136 296 HA GLU 36 HA GLU 36 -2.663 7.981 8.776 297 HB2 GLU 36 HB2 GLU 36 -3.877 7.926 11.552 298 HB3 GLU 36 HB1 GLU 36 -3.613 9.362 10.562 299 HG2 GLU 36 HG2 GLU 36 -5.052 7.979 8.778 300 HG3 GLU 36 HG1 GLU 36 -5.642 7.168 10.228 301 H GLN 37 HN GLN 37 -1.742 6.369 11.823 302 HA GLN 37 HA GLN 37 0.552 8.251 12.103 303 HB2 GLN 37 HB2 GLN 37 0.849 7.285 14.303 304 HB3 GLN 37 HB1 GLN 37 -0.868 7.623 14.091 305 HG2 GLN 37 HG2 GLN 37 -1.146 5.228 13.339 306 HG3 GLN 37 HG1 GLN 37 0.515 4.941 13.848 307 HE21 GLN 37 HE21 GLN 37 -1.136 3.409 15.274 308 HE22 GLN 37 HE22 GLN 37 -1.477 4.055 16.806 309 H SER 38 HN SER 38 -0.014 5.643 10.286 310 HA SER 38 HA SER 38 2.093 3.823 10.903 311 HB2 SER 38 HB2 SER 38 0.337 3.219 9.335 312 HB3 SER 38 HB1 SER 38 0.805 4.523 8.250 313 HG SER 38 HG SER 38 1.916 2.039 8.640 314 H GLU 39 HN GLU 39 4.233 4.151 10.830 315 HA GLU 39 HA GLU 39 5.330 6.346 9.102 316 HB2 GLU 39 HB2 GLU 39 6.382 5.063 11.640 317 HB3 GLU 39 HB1 GLU 39 7.314 6.191 10.653 318 HG2 GLU 39 HG2 GLU 39 5.567 7.906 10.950 319 HG3 GLU 39 HG1 GLU 39 4.626 6.779 11.929 320 H THR 40 HN THR 40 5.001 3.017 9.358 321 HA THR 40 HA THR 40 7.484 2.510 7.742 322 HB THR 40 HB THR 40 5.840 0.606 9.442 323 HG1 THR 40 HG1 THR 40 8.451 0.861 10.039 324 HG21 THR 40 HG21 THR 40 8.273 0.226 7.688 325 HG22 THR 40 HG22 THR 40 6.723 -0.607 7.576 326 HG23 THR 40 HG23 THR 40 7.801 -0.930 8.934 327 H ALA 41 HN ALA 41 7.086 2.122 5.634 328 HA ALA 41 HA ALA 41 4.320 1.429 4.791 329 HB1 ALA 41 HB1 ALA 41 5.058 3.260 3.535 330 HB2 ALA 41 HB2 ALA 41 5.449 1.917 2.461 331 HB3 ALA 41 HB3 ALA 41 6.711 2.658 3.447 332 HA PRO 42 HA PRO 42 5.532 -2.742 3.816 333 HB2 PRO 42 HB2 PRO 42 3.812 -3.345 1.780 334 HB3 PRO 42 HB1 PRO 42 3.278 -3.152 3.463 335 HG2 PRO 42 HG2 PRO 42 3.152 -1.189 1.208 336 HG3 PRO 42 HG1 PRO 42 1.920 -1.590 2.420 337 HD2 PRO 42 HD2 PRO 42 3.500 0.623 2.636 338 HD3 PRO 42 HD1 PRO 42 2.901 -0.262 4.057 339 H VAL 43 HN VAL 43 6.547 -4.092 2.164 340 HA VAL 43 HA VAL 43 8.451 -2.737 0.531 341 HB VAL 43 HB VAL 43 8.803 -5.024 -0.491 342 HG11 VAL 43 HG11 VAL 43 8.563 -5.078 2.530 343 HG12 VAL 43 HG12 VAL 43 9.859 -4.240 1.676 344 HG13 VAL 43 HG13 VAL 43 9.696 -5.990 1.532 345 HG21 VAL 43 HG21 VAL 43 7.513 -6.892 0.458 346 HG22 VAL 43 HG22 VAL 43 6.435 -5.751 -0.347 347 HG23 VAL 43 HG23 VAL 43 6.556 -5.758 1.413 348 H VAL 44 HN VAL 44 5.138 -3.459 0.014 349 HA VAL 44 HA VAL 44 5.051 -3.747 -2.817 350 HB VAL 44 HB VAL 44 3.057 -2.508 -0.898 351 HG11 VAL 44 HG11 VAL 44 2.860 -3.240 -3.823 352 HG12 VAL 44 HG12 VAL 44 2.448 -1.710 -3.050 353 HG13 VAL 44 HG13 VAL 44 1.434 -3.128 -2.789 354 HG21 VAL 44 HG21 VAL 44 1.947 -4.721 -1.118 355 HG22 VAL 44 HG22 VAL 44 3.567 -4.864 -0.438 356 HG23 VAL 44 HG23 VAL 44 3.282 -5.273 -2.128 357 H VAL 45 HN VAL 45 4.904 -0.814 -0.780 358 HA VAL 45 HA VAL 45 4.564 1.044 -2.921 359 HB VAL 45 HB VAL 45 5.921 1.389 -0.230 360 HG11 VAL 45 HG11 VAL 45 5.308 3.830 -0.658 361 HG12 VAL 45 HG12 VAL 45 5.044 3.370 -2.340 362 HG13 VAL 45 HG13 VAL 45 6.643 3.193 -1.617 363 HG21 VAL 45 HG21 VAL 45 3.793 2.195 0.535 364 HG22 VAL 45 HG22 VAL 45 3.475 0.675 -0.301 365 HG23 VAL 45 HG23 VAL 45 3.138 2.210 -1.102 366 H LYS 46 HN LYS 46 7.499 -0.214 -1.343 367 HA LYS 46 HA LYS 46 9.373 1.332 -2.839 368 HB2 LYS 46 HB2 LYS 46 9.610 -1.410 -1.568 369 HB3 LYS 46 HB1 LYS 46 10.977 -0.516 -2.234 370 HG2 LYS 46 HG2 LYS 46 10.552 1.335 -0.681 371 HG3 LYS 46 HG1 LYS 46 9.142 0.493 -0.039 372 HD2 LYS 46 HD2 LYS 46 10.612 -1.384 0.663 373 HD3 LYS 46 HD1 LYS 46 12.011 -0.475 0.091 374 HE2 LYS 46 HE2 LYS 46 10.071 0.567 2.168 375 HE3 LYS 46 HE1 LYS 46 11.583 -0.249 2.566 376 HZ1 LYS 46 HZ1 LYS 46 11.388 2.373 2.248 377 HZ2 LYS 46 HZ2 LYS 46 11.757 1.932 0.650 378 HZ3 LYS 46 HZ3 LYS 46 12.808 1.508 1.917 379 H TYR 47 HN TYR 47 7.875 -1.837 -3.470 380 HA TYR 47 HA TYR 47 9.367 -2.471 -5.817 381 HB2 TYR 47 HB2 TYR 47 7.773 -4.000 -4.538 382 HB3 TYR 47 HB1 TYR 47 6.453 -3.154 -5.344 383 HD1 TYR 47 HD1 TYR 47 9.592 -5.056 -5.993 384 HD2 TYR 47 HD2 TYR 47 5.816 -3.738 -7.558 385 HE1 TYR 47 HE1 TYR 47 9.929 -6.473 -8.000 386 HE2 TYR 47 HE2 TYR 47 6.153 -5.161 -9.563 387 HH TYR 47 HH TYR 47 7.779 -7.522 -9.892 388 H ILE 48 HN ILE 48 6.325 -0.695 -5.352 389 HA ILE 48 HA ILE 48 5.837 -0.151 -8.122 390 HB ILE 48 HB ILE 48 5.014 1.342 -5.611 391 HG12 ILE 48 HG12 ILE 48 3.401 -0.471 -7.432 392 HG13 ILE 48 HG11 ILE 48 4.210 -1.043 -5.973 393 HG21 ILE 48 HG21 ILE 48 4.830 2.929 -7.372 394 HG22 ILE 48 HG22 ILE 48 3.212 2.247 -7.210 395 HG23 ILE 48 HG23 ILE 48 4.269 1.709 -8.517 396 HD11 ILE 48 HD11 ILE 48 1.932 -0.530 -5.370 397 HD12 ILE 48 HD12 ILE 48 2.025 1.047 -6.153 398 HD13 ILE 48 HD13 ILE 48 2.953 0.735 -4.686 399 H ALA 49 HN ALA 49 7.561 1.687 -5.592 400 HA ALA 49 HA ALA 49 8.111 4.022 -7.090 401 HB1 ALA 49 HB1 ALA 49 9.944 2.658 -5.092 402 HB2 ALA 49 HB2 ALA 49 8.620 3.740 -4.664 403 HB3 ALA 49 HB3 ALA 49 10.002 4.356 -5.570 404 H PHE 50 HN PHE 50 9.852 0.932 -6.952 405 HA PHE 50 HA PHE 50 12.048 1.691 -8.603 406 HB2 PHE 50 HB2 PHE 50 11.801 -0.434 -7.213 407 HB3 PHE 50 HB1 PHE 50 10.780 -1.058 -8.511 408 HD1 PHE 50 HD1 PHE 50 14.098 0.591 -7.979 409 HD2 PHE 50 HD2 PHE 50 11.805 -2.213 -10.288 410 HE1 PHE 50 HE1 PHE 50 16.136 -0.030 -9.244 411 HE2 PHE 50 HE2 PHE 50 13.846 -2.832 -11.556 412 HZ PHE 50 HZ PHE 50 16.010 -1.742 -11.033 413 H LEU 51 HN LEU 51 8.882 0.259 -9.403 414 HA LEU 51 HA LEU 51 9.311 0.079 -12.231 415 HB2 LEU 51 HB2 LEU 51 6.749 0.445 -10.644 416 HB3 LEU 51 HB1 LEU 51 6.811 0.020 -12.351 417 HG LEU 51 HG LEU 51 8.026 -1.610 -10.100 418 HD11 LEU 51 HD11 LEU 51 6.172 -3.235 -10.897 419 HD12 LEU 51 HD12 LEU 51 5.435 -1.813 -11.635 420 HD13 LEU 51 HD13 LEU 51 5.693 -1.868 -9.891 421 HD21 LEU 51 HD21 LEU 51 7.974 -3.342 -12.124 422 HD22 LEU 51 HD22 LEU 51 9.316 -2.216 -11.948 423 HD23 LEU 51 HD23 LEU 51 8.027 -1.873 -13.100 424 H ARG 52 HN ARG 52 8.017 2.637 -10.159 425 HA ARG 52 HA ARG 52 7.229 4.443 -12.215 426 HB2 ARG 52 HB2 ARG 52 6.529 4.773 -9.907 427 HB3 ARG 52 HB1 ARG 52 8.203 4.966 -9.390 428 HG2 ARG 52 HG2 ARG 52 8.430 7.016 -10.648 429 HG3 ARG 52 HG1 ARG 52 6.861 6.781 -11.412 430 HD2 ARG 52 HD2 ARG 52 6.944 6.875 -8.414 431 HD3 ARG 52 HD1 ARG 52 7.141 8.391 -9.294 432 HE ARG 52 HE ARG 52 4.677 6.849 -9.088 433 HH11 ARG 52 HH21 ARG 52 6.585 9.031 -10.960 434 HH12 ARG 52 HH22 ARG 52 5.228 9.722 -11.784 435 HH21 ARG 52 HH11 ARG 52 2.890 7.748 -10.154 436 HH22 ARG 52 HH12 ARG 52 3.138 8.998 -11.327 437 H SER 53 HN SER 53 10.352 3.974 -10.568 438 HA SER 53 HA SER 53 11.690 6.208 -11.714 439 HB2 SER 53 HB2 SER 53 13.760 5.015 -11.174 440 HB3 SER 53 HB1 SER 53 12.604 4.842 -9.857 441 HG SER 53 HG SER 53 13.040 2.978 -11.955 442 H LYS 54 HN LYS 54 10.678 3.201 -13.124 443 HA LYS 54 HA LYS 54 12.480 3.552 -15.462 444 HB2 LYS 54 HB2 LYS 54 10.469 1.416 -14.707 445 HB3 LYS 54 HB1 LYS 54 11.329 1.435 -16.247 446 HG2 LYS 54 HG2 LYS 54 13.484 1.375 -15.058 447 HG3 LYS 54 HG1 LYS 54 12.637 1.380 -13.510 448 HD2 LYS 54 HD2 LYS 54 11.544 -0.746 -14.086 449 HD3 LYS 54 HD1 LYS 54 12.368 -0.756 -15.646 450 HE2 LYS 54 HE2 LYS 54 13.813 -0.696 -12.983 451 HE3 LYS 54 HE1 LYS 54 13.493 -2.173 -13.892 452 HZ1 LYS 54 HZ1 LYS 54 15.399 -1.737 -14.924 453 HZ2 LYS 54 HZ2 LYS 54 15.466 -0.142 -14.343 454 HZ3 LYS 54 HZ3 LYS 54 14.570 -0.503 -15.741 455 H GLY 55 HN GLY 55 9.599 4.796 -14.407 456 HA2 GLY 55 HA2 GLY 55 8.025 6.119 -15.544 457 HA3 GLY 55 HA1 GLY 55 8.940 5.843 -17.026 458 H VAL 56 HN VAL 56 7.461 3.375 -14.914 459 HA VAL 56 HA VAL 56 6.309 2.014 -17.185 460 HB VAL 56 HB VAL 56 5.864 1.775 -14.200 461 HG11 VAL 56 HG11 VAL 56 3.800 1.035 -15.118 462 HG12 VAL 56 HG12 VAL 56 4.743 -0.438 -14.878 463 HG13 VAL 56 HG13 VAL 56 4.595 0.264 -16.490 464 HG21 VAL 56 HG21 VAL 56 8.029 1.013 -14.956 465 HG22 VAL 56 HG22 VAL 56 7.301 0.118 -16.288 466 HG23 VAL 56 HG23 VAL 56 7.041 -0.409 -14.628 467 H ASP 57 HN ASP 57 5.314 4.677 -15.296 468 HA ASP 57 HA ASP 57 3.417 6.031 -15.359 469 HB2 ASP 57 HB2 ASP 57 2.646 4.448 -17.834 470 HB3 ASP 57 HB1 ASP 57 2.072 6.043 -17.363 471 H LEU 58 HN LEU 58 3.194 4.208 -13.491 472 HA LEU 58 HA LEU 58 1.055 2.306 -13.722 473 HB2 LEU 58 HB2 LEU 58 1.025 2.716 -11.098 474 HB3 LEU 58 HB1 LEU 58 2.390 1.895 -11.850 475 HG LEU 58 HG LEU 58 2.563 4.887 -11.743 476 HD11 LEU 58 HD11 LEU 58 1.775 4.667 -9.538 477 HD12 LEU 58 HD12 LEU 58 3.529 4.636 -9.364 478 HD13 LEU 58 HD13 LEU 58 2.607 3.134 -9.294 479 HD21 LEU 58 HD21 LEU 58 4.653 2.881 -10.886 480 HD22 LEU 58 HD22 LEU 58 4.876 4.475 -11.603 481 HD23 LEU 58 HD23 LEU 58 4.313 3.133 -12.598 482 H ASN 59 HN ASN 59 1.168 5.704 -12.698 483 HA ASN 59 HA ASN 59 -1.287 6.179 -11.585 484 HB2 ASN 59 HB2 ASN 59 -1.291 8.364 -13.003 485 HB3 ASN 59 HB1 ASN 59 0.056 8.081 -11.903 486 HD21 ASN 59 HD21 ASN 59 0.510 9.793 -14.054 487 HD22 ASN 59 HD22 ASN 59 1.512 9.038 -15.197 488 H ALA 60 HN ALA 60 -0.717 5.588 -15.038 489 HA ALA 60 HA ALA 60 -3.412 6.074 -15.886 490 HB1 ALA 60 HB1 ALA 60 -1.445 4.108 -17.091 491 HB2 ALA 60 HB2 ALA 60 -1.381 5.847 -17.378 492 HB3 ALA 60 HB3 ALA 60 -2.782 4.917 -17.911 493 H LEU 61 HN LEU 61 -1.739 3.161 -14.712 494 HA LEU 61 HA LEU 61 -3.898 1.335 -15.173 495 HB2 LEU 61 HB2 LEU 61 -1.677 1.308 -13.110 496 HB3 LEU 61 HB1 LEU 61 -2.739 -0.061 -13.441 497 HG LEU 61 HG LEU 61 -0.984 1.288 -15.515 498 HD11 LEU 61 HD11 LEU 61 0.181 0.004 -13.598 499 HD12 LEU 61 HD12 LEU 61 0.582 -0.460 -15.250 500 HD13 LEU 61 HD13 LEU 61 -0.537 -1.444 -14.307 501 HD21 LEU 61 HD21 LEU 61 -2.932 -1.006 -15.567 502 HD22 LEU 61 HD22 LEU 61 -1.510 -1.087 -16.607 503 HD23 LEU 61 HD23 LEU 61 -2.646 0.246 -16.775 504 H PHE 62 HN PHE 62 -3.007 3.307 -12.352 505 HA PHE 62 HA PHE 62 -5.096 2.371 -10.636 506 HB2 PHE 62 HB2 PHE 62 -3.490 4.927 -10.738 507 HB3 PHE 62 HB1 PHE 62 -4.726 4.648 -9.514 508 HD1 PHE 62 HD2 PHE 62 -4.575 2.254 -8.330 509 HD2 PHE 62 HD1 PHE 62 -1.291 4.267 -10.234 510 HE1 PHE 62 HE2 PHE 62 -2.976 0.918 -6.986 511 HE2 PHE 62 HE1 PHE 62 0.306 2.932 -8.885 512 HZ PHE 62 HZ PHE 62 -0.536 1.259 -7.263 513 H ASP 63 HN ASP 63 -4.930 5.037 -12.967 514 HA ASP 63 HA ASP 63 -7.463 6.216 -12.397 515 HB2 ASP 63 HB2 ASP 63 -5.589 7.125 -13.883 516 HB3 ASP 63 HB1 ASP 63 -6.181 6.034 -15.134 517 H ARG 64 HN ARG 64 -6.517 3.480 -14.395 518 HA ARG 64 HA ARG 64 -9.049 3.113 -15.694 519 HB2 ARG 64 HB2 ARG 64 -6.698 1.306 -15.131 520 HB3 ARG 64 HB1 ARG 64 -8.133 0.727 -15.976 521 HG2 ARG 64 HG2 ARG 64 -7.858 2.439 -17.703 522 HG3 ARG 64 HG1 ARG 64 -6.487 3.129 -16.834 523 HD2 ARG 64 HD2 ARG 64 -5.056 1.408 -17.448 524 HD3 ARG 64 HD1 ARG 64 -6.352 0.215 -17.529 525 HE ARG 64 HE ARG 64 -6.943 1.042 -19.725 526 HH11 ARG 64 HH21 ARG 64 -4.148 2.597 -18.351 527 HH12 ARG 64 HH22 ARG 64 -3.593 3.175 -19.885 528 HH21 ARG 64 HH11 ARG 64 -6.218 1.801 -21.675 529 HH22 ARG 64 HH12 ARG 64 -4.758 2.730 -21.758 530 H ILE 65 HN ILE 65 -7.918 2.379 -12.493 531 HA ILE 65 HA ILE 65 -9.840 0.282 -11.933 532 HB ILE 65 HB ILE 65 -8.437 2.155 -10.007 533 HG12 ILE 65 HG12 ILE 65 -6.811 1.018 -11.408 534 HG13 ILE 65 HG11 ILE 65 -6.784 0.298 -9.803 535 HG21 ILE 65 HG21 ILE 65 -8.755 0.212 -8.435 536 HG22 ILE 65 HG22 ILE 65 -9.800 -0.523 -9.652 537 HG23 ILE 65 HG23 ILE 65 -10.251 1.014 -8.913 538 HD11 ILE 65 HD11 ILE 65 -6.811 -1.598 -11.156 539 HD12 ILE 65 HD12 ILE 65 -7.821 -0.840 -12.382 540 HD13 ILE 65 HD13 ILE 65 -8.534 -1.386 -10.866 541 H ILE 66 HN ILE 66 -9.754 3.781 -11.398 542 HA ILE 66 HA ILE 66 -12.548 3.726 -10.394 543 HB ILE 66 HB ILE 66 -12.121 6.167 -9.968 544 HG12 ILE 66 HG12 ILE 66 -9.326 5.433 -10.905 545 HG13 ILE 66 HG11 ILE 66 -10.422 6.557 -11.704 546 HG21 ILE 66 HG21 ILE 66 -11.683 4.324 -8.297 547 HG22 ILE 66 HG22 ILE 66 -10.717 5.778 -8.045 548 HG23 ILE 66 HG23 ILE 66 -9.992 4.357 -8.799 549 HD11 ILE 66 HD11 ILE 66 -8.955 7.919 -10.431 550 HD12 ILE 66 HD12 ILE 66 -9.083 6.869 -9.020 551 HD13 ILE 66 HD13 ILE 66 -10.457 7.862 -9.508 552 H VAL 67 HN VAL 67 -10.627 5.117 -13.043 553 HA VAL 67 HA VAL 67 -11.280 6.048 -15.084 554 HB VAL 67 HB VAL 67 -13.651 4.216 -14.595 555 HG11 VAL 67 HG11 VAL 67 -14.456 5.716 -16.216 556 HG12 VAL 67 HG12 VAL 67 -13.757 4.426 -17.193 557 HG13 VAL 67 HG13 VAL 67 -12.866 5.929 -16.950 558 HG21 VAL 67 HG21 VAL 67 -11.342 3.819 -16.500 559 HG22 VAL 67 HG22 VAL 67 -12.457 2.611 -15.858 560 HG23 VAL 67 HG23 VAL 67 -11.230 3.324 -14.814 561 H ASN 68 HN ASN 68 -12.860 6.711 -12.229 562 HA ASN 68 HA ASN 68 -14.934 8.453 -13.341 563 HB2 ASN 68 HB2 ASN 68 -15.503 8.932 -11.055 564 HB3 ASN 68 HB1 ASN 68 -15.224 7.200 -11.201 565 HD21 ASN 68 HD21 ASN 68 -14.851 7.492 -8.761 566 HD22 ASN 68 HD22 ASN 68 -13.284 7.893 -8.270 567 H LYS 69 HN LYS 69 -14.788 10.686 -11.747 568 HA LYS 69 HA LYS 69 -13.803 12.806 -11.696 569 HB2 LYS 69 HB2 LYS 69 -12.200 11.583 -10.225 570 HB3 LYS 69 HB1 LYS 69 -11.217 11.224 -11.645 571 HG2 LYS 69 HG2 LYS 69 -10.864 13.592 -12.064 572 HG3 LYS 69 HG1 LYS 69 -11.968 14.021 -10.760 573 HD2 LYS 69 HD2 LYS 69 -9.783 14.240 -9.833 574 HD3 LYS 69 HD1 LYS 69 -10.420 12.727 -9.195 575 HE2 LYS 69 HE2 LYS 69 -9.100 11.421 -10.689 576 HE3 LYS 69 HE1 LYS 69 -8.712 12.818 -11.692 577 HZ1 LYS 69 HZ1 LYS 69 -7.974 13.097 -8.918 578 HZ2 LYS 69 HZ2 LYS 69 -7.084 13.450 -10.322 579 HZ3 LYS 69 HZ3 LYS 69 -7.147 11.859 -9.730 580 H LEU 70 HN LEU 70 -14.429 13.438 -13.793 581 HA LEU 70 HA LEU 70 -12.209 13.881 -15.631 582 HB2 LEU 70 HB2 LEU 70 -13.771 12.808 -17.534 583 HB3 LEU 70 HB1 LEU 70 -12.587 11.843 -16.658 584 HG LEU 70 HG LEU 70 -14.324 11.094 -15.086 585 HD11 LEU 70 HD11 LEU 70 -16.726 11.644 -15.681 586 HD12 LEU 70 HD12 LEU 70 -16.104 12.872 -16.781 587 HD13 LEU 70 HD13 LEU 70 -15.805 13.008 -15.049 588 HD21 LEU 70 HD21 LEU 70 -15.411 9.601 -16.582 589 HD22 LEU 70 HD22 LEU 70 -13.882 9.998 -17.366 590 HD23 LEU 70 HD23 LEU 70 -15.373 10.772 -17.900 591 H GLU 71 HN GLU 71 -13.521 14.681 -17.852 592 HA GLU 71 HA GLU 71 -14.909 16.314 -18.782 593 HB2 GLU 71 HB2 GLU 71 -16.656 15.139 -17.204 594 HB3 GLU 71 HB1 GLU 71 -16.446 16.571 -16.197 595 HG2 GLU 71 HG2 GLU 71 -16.858 17.924 -18.366 596 HG3 GLU 71 HG1 GLU 71 -17.469 16.411 -19.033 597 H HIS 72 HN HIS 72 -12.480 16.859 -17.144 598 HA HIS 72 HA HIS 72 -12.912 19.770 -16.897 599 HB2 HIS 72 HB2 HIS 72 -11.909 19.862 -14.633 600 HB3 HIS 72 HB1 HIS 72 -13.434 18.979 -14.633 601 HD2 HIS 72 HD2 HIS 72 -11.986 17.795 -12.234 602 HE1 HIS 72 HE1 HIS 72 -9.946 15.055 -14.716 603 HE2 HIS 72 HE2 HIS 72 -10.578 15.603 -12.321 604 H HIS 73 HN HIS 73 -10.787 20.908 -16.655 605 HA HIS 73 HA HIS 73 -8.390 19.284 -17.271 606 HB2 HIS 73 HB2 HIS 73 -7.886 20.795 -19.251 607 HB3 HIS 73 HB1 HIS 73 -9.186 19.631 -19.500 608 HD2 HIS 73 HD2 HIS 73 -9.398 23.308 -17.926 609 HE1 HIS 73 HE1 HIS 73 -12.270 22.913 -20.997 610 HE2 HIS 73 HE2 HIS 73 -11.346 24.466 -19.216 611 H HIS 74 HN HIS 74 -6.421 20.776 -17.419 612 HA HIS 74 HA HIS 74 -6.589 22.695 -15.186 613 HB2 HIS 74 HB2 HIS 74 -4.154 22.036 -16.854 614 HB3 HIS 74 HB1 HIS 74 -4.206 22.655 -15.203 615 HD2 HIS 74 HD2 HIS 74 -6.717 20.194 -14.618 616 HE1 HIS 74 HE1 HIS 74 -3.275 17.751 -14.783 617 HE2 HIS 74 HE2 HIS 74 -5.706 17.853 -14.066 618 H HIS 75 HN HIS 75 -6.643 24.885 -15.448 619 HA HIS 75 HA HIS 75 -7.098 26.052 -18.036 620 HB2 HIS 75 HB2 HIS 75 -6.259 27.510 -15.521 621 HB3 HIS 75 HB1 HIS 75 -7.230 28.136 -16.854 622 HD2 HIS 75 HD2 HIS 75 -7.703 26.118 -13.577 623 HE1 HIS 75 HE1 HIS 75 -11.438 26.150 -15.545 624 HE2 HIS 75 HE2 HIS 75 -10.243 25.564 -13.386 625 H HIS 76 HN HIS 76 -4.290 26.005 -15.858 626 HA HIS 76 HA HIS 76 -2.519 26.583 -18.164 627 HB2 HIS 76 HB2 HIS 76 -1.326 28.356 -16.883 628 HB3 HIS 76 HB1 HIS 76 -2.988 28.811 -17.253 629 HD2 HIS 76 HD2 HIS 76 -4.202 29.834 -15.009 630 HE1 HIS 76 HE1 HIS 76 -2.081 27.636 -12.092 631 HE2 HIS 76 HE2 HIS 76 -3.867 29.400 -12.459 632 H HIS 77 HN HIS 77 -3.026 24.235 -16.566 633 HA HIS 77 HA HIS 77 -1.870 22.581 -15.385 634 HB2 HIS 77 HB2 HIS 77 -0.293 22.648 -17.189 635 HB3 HIS 77 HB1 HIS 77 0.415 24.152 -16.609 636 HD2 HIS 77 HD2 HIS 77 2.814 23.560 -15.396 637 HE1 HIS 77 HE1 HIS 77 1.729 19.877 -13.636 638 HE2 HIS 77 HE2 HIS 77 3.596 21.575 -13.896 639 H1 MET 1 HT1 MET 1 -8.106 -11.742 -14.431 640 H2 MET 1 HT2 MET 1 -8.842 -10.671 -15.527 641 H3 MET 1 HT3 MET 1 -8.896 -10.355 -13.858 642 HA MET 1 HA MET 1 -6.209 -10.642 -14.601 643 HB2 MET 1 HB2 MET 1 -7.121 -10.071 -16.878 644 HB3 MET 1 HB1 MET 1 -7.729 -8.561 -16.204 645 HG2 MET 1 HG2 MET 1 -5.587 -8.099 -17.221 646 HG3 MET 1 HG1 MET 1 -5.373 -8.034 -15.472 647 HE1 MET 1 HE1 MET 1 -5.368 -10.285 -18.555 648 HE2 MET 1 HE2 MET 1 -3.781 -11.048 -18.489 649 HE3 MET 1 HE3 MET 1 -3.904 -9.300 -18.676 650 H GLU 2 HN GLU 2 -6.834 -10.274 -12.228 651 HA GLU 2 HA GLU 2 -7.813 -7.776 -11.287 652 HB2 GLU 2 HB2 GLU 2 -6.584 -8.424 -9.149 653 HB3 GLU 2 HB1 GLU 2 -7.737 -9.612 -9.756 654 HG2 GLU 2 HG2 GLU 2 -5.867 -10.831 -10.856 655 HG3 GLU 2 HG1 GLU 2 -4.734 -9.667 -10.176 656 H LEU 3 HN LEU 3 -6.330 -6.309 -9.849 657 HA LEU 3 HA LEU 3 -4.489 -4.955 -11.560 658 HB2 LEU 3 HB2 LEU 3 -5.687 -3.816 -9.748 659 HB3 LEU 3 HB1 LEU 3 -4.866 -4.807 -8.550 660 HG LEU 3 HG LEU 3 -2.677 -3.831 -9.337 661 HD11 LEU 3 HD11 LEU 3 -2.991 -1.602 -10.602 662 HD12 LEU 3 HD12 LEU 3 -4.581 -2.218 -11.042 663 HD13 LEU 3 HD13 LEU 3 -3.131 -3.080 -11.548 664 HD21 LEU 3 HD21 LEU 3 -3.976 -2.958 -7.380 665 HD22 LEU 3 HD22 LEU 3 -4.734 -1.786 -8.459 666 HD23 LEU 3 HD23 LEU 3 -2.995 -1.723 -8.170 667 H SER 4 HN SER 4 -3.985 -7.265 -8.890 668 HA SER 4 HA SER 4 -1.138 -7.105 -8.805 669 HB2 SER 4 HB2 SER 4 -1.242 -9.341 -7.773 670 HB3 SER 4 HB1 SER 4 -2.501 -8.304 -7.111 671 HG SER 4 HG SER 4 -2.700 -10.401 -8.988 672 H ASN 5 HN ASN 5 -3.341 -8.867 -10.914 673 HA ASN 5 HA ASN 5 -1.396 -10.544 -12.185 674 HB2 ASN 5 HB2 ASN 5 -4.007 -10.616 -12.253 675 HB3 ASN 5 HB1 ASN 5 -3.851 -9.478 -13.587 676 HD21 ASN 5 HD21 ASN 5 -1.072 -11.161 -13.881 677 HD22 ASN 5 HD22 ASN 5 -1.583 -12.436 -14.878 678 H GLU 6 HN GLU 6 -2.627 -7.290 -12.912 679 HA GLU 6 HA GLU 6 -1.186 -6.968 -15.374 680 HB2 GLU 6 HB2 GLU 6 -2.227 -4.937 -13.379 681 HB3 GLU 6 HB1 GLU 6 -1.548 -4.510 -14.950 682 HG2 GLU 6 HG2 GLU 6 -3.262 -6.023 -16.014 683 HG3 GLU 6 HG1 GLU 6 -4.003 -6.209 -14.424 684 H LEU 7 HN LEU 7 -0.371 -6.366 -11.987 685 HA LEU 7 HA LEU 7 2.058 -4.944 -12.443 686 HB2 LEU 7 HB2 LEU 7 0.943 -5.092 -10.234 687 HB3 LEU 7 HB1 LEU 7 1.329 -6.809 -10.160 688 HG LEU 7 HG LEU 7 3.737 -6.283 -10.218 689 HD11 LEU 7 HD11 LEU 7 4.208 -3.715 -9.744 690 HD12 LEU 7 HD12 LEU 7 2.685 -3.489 -10.605 691 HD13 LEU 7 HD13 LEU 7 4.038 -4.297 -11.400 692 HD21 LEU 7 HD21 LEU 7 2.647 -6.449 -8.040 693 HD22 LEU 7 HD22 LEU 7 2.147 -4.759 -8.131 694 HD23 LEU 7 HD23 LEU 7 3.856 -5.167 -7.985 695 H LYS 8 HN LYS 8 1.389 -8.426 -12.107 696 HA LYS 8 HA LYS 8 4.103 -9.303 -12.246 697 HB2 LYS 8 HB2 LYS 8 2.164 -10.728 -11.563 698 HB3 LYS 8 HB1 LYS 8 1.633 -10.751 -13.245 699 HG2 LYS 8 HG2 LYS 8 3.730 -11.808 -13.928 700 HG3 LYS 8 HG1 LYS 8 4.337 -11.716 -12.275 701 HD2 LYS 8 HD2 LYS 8 2.480 -13.162 -11.515 702 HD3 LYS 8 HD1 LYS 8 1.900 -13.278 -13.177 703 HE2 LYS 8 HE2 LYS 8 4.673 -14.120 -12.289 704 HE3 LYS 8 HE1 LYS 8 3.315 -15.231 -12.469 705 HZ1 LYS 8 HZ1 LYS 8 4.991 -14.742 -14.430 706 HZ2 LYS 8 HZ2 LYS 8 3.912 -13.461 -14.714 707 HZ3 LYS 8 HZ3 LYS 8 3.350 -15.065 -14.714 708 H VAL 9 HN VAL 9 1.711 -8.589 -14.761 709 HA VAL 9 HA VAL 9 3.234 -9.552 -16.980 710 HB VAL 9 HB VAL 9 1.167 -7.338 -16.793 711 HG11 VAL 9 HG11 VAL 9 2.395 -6.904 -18.791 712 HG12 VAL 9 HG12 VAL 9 0.976 -7.815 -19.305 713 HG13 VAL 9 HG13 VAL 9 2.537 -8.623 -19.165 714 HG21 VAL 9 HG21 VAL 9 0.980 -10.207 -17.773 715 HG22 VAL 9 HG22 VAL 9 -0.347 -9.048 -17.686 716 HG23 VAL 9 HG23 VAL 9 0.405 -9.638 -16.205 717 H GLU 10 HN GLU 10 3.097 -6.359 -15.392 718 HA GLU 10 HA GLU 10 4.785 -4.930 -17.148 719 HB2 GLU 10 HB2 GLU 10 4.491 -4.760 -14.133 720 HB3 GLU 10 HB1 GLU 10 5.343 -3.561 -15.109 721 HG2 GLU 10 HG2 GLU 10 3.323 -3.043 -16.344 722 HG3 GLU 10 HG1 GLU 10 2.452 -4.356 -15.552 723 H ARG 11 HN ARG 11 5.613 -7.045 -14.403 724 HA ARG 11 HA ARG 11 8.431 -6.610 -14.434 725 HB2 ARG 11 HB2 ARG 11 6.954 -7.908 -12.737 726 HB3 ARG 11 HB1 ARG 11 7.145 -9.279 -13.828 727 HG2 ARG 11 HG2 ARG 11 9.734 -8.600 -13.646 728 HG3 ARG 11 HG1 ARG 11 9.195 -7.908 -12.118 729 HD2 ARG 11 HD2 ARG 11 9.654 -10.046 -11.366 730 HD3 ARG 11 HD1 ARG 11 8.009 -10.345 -11.934 731 HE ARG 11 HE ARG 11 9.810 -10.710 -14.120 732 HH11 ARG 11 HH21 ARG 11 8.927 -12.078 -11.074 733 HH12 ARG 11 HH22 ARG 11 9.331 -13.696 -11.542 734 HH21 ARG 11 HH11 ARG 11 10.348 -12.805 -14.735 735 HH22 ARG 11 HH12 ARG 11 10.133 -14.109 -13.615 736 H ILE 12 HN ILE 12 6.427 -9.047 -16.102 737 HA ILE 12 HA ILE 12 8.593 -10.305 -17.517 738 HB ILE 12 HB ILE 12 5.619 -10.157 -18.119 739 HG12 ILE 12 HG12 ILE 12 7.253 -12.462 -17.027 740 HG13 ILE 12 HG11 ILE 12 6.444 -11.294 -15.982 741 HG21 ILE 12 HG21 ILE 12 6.157 -12.227 -19.514 742 HG22 ILE 12 HG22 ILE 12 7.853 -11.762 -19.386 743 HG23 ILE 12 HG23 ILE 12 6.705 -10.692 -20.188 744 HD11 ILE 12 HD11 ILE 12 4.282 -11.867 -16.898 745 HD12 ILE 12 HD12 ILE 12 5.087 -13.371 -16.443 746 HD13 ILE 12 HD13 ILE 12 5.024 -12.882 -18.136 747 H ARG 13 HN ARG 13 6.321 -7.711 -18.372 748 HA ARG 13 HA ARG 13 7.036 -7.365 -21.079 749 HB2 ARG 13 HB2 ARG 13 5.176 -6.212 -19.710 750 HB3 ARG 13 HB1 ARG 13 6.418 -5.063 -19.213 751 HG2 ARG 13 HG2 ARG 13 6.910 -4.640 -21.636 752 HG3 ARG 13 HG1 ARG 13 5.537 -5.667 -22.050 753 HD2 ARG 13 HD2 ARG 13 4.143 -4.139 -20.520 754 HD3 ARG 13 HD1 ARG 13 5.512 -3.030 -20.573 755 HE ARG 13 HE ARG 13 3.587 -3.404 -22.673 756 HH11 ARG 13 HH21 ARG 13 6.955 -2.923 -22.055 757 HH12 ARG 13 HH22 ARG 13 7.252 -2.168 -23.584 758 HH21 ARG 13 HH11 ARG 13 3.963 -2.409 -24.648 759 HH22 ARG 13 HH12 ARG 13 5.560 -1.870 -25.047 760 H LEU 14 HN LEU 14 8.444 -5.876 -18.163 761 HA LEU 14 HA LEU 14 10.674 -4.778 -19.810 762 HB2 LEU 14 HB2 LEU 14 9.856 -4.323 -16.921 763 HB3 LEU 14 HB1 LEU 14 11.244 -3.556 -17.695 764 HG LEU 14 HG LEU 14 8.388 -3.328 -18.698 765 HD11 LEU 14 HD11 LEU 14 10.035 -1.550 -16.897 766 HD12 LEU 14 HD12 LEU 14 8.404 -2.169 -16.633 767 HD13 LEU 14 HD13 LEU 14 8.689 -0.920 -17.846 768 HD21 LEU 14 HD21 LEU 14 9.594 -1.237 -19.819 769 HD22 LEU 14 HD22 LEU 14 9.704 -2.828 -20.561 770 HD23 LEU 14 HD23 LEU 14 11.043 -2.218 -19.591 771 H SER 15 HN SER 15 9.931 -7.585 -18.322 772 HA SER 15 HA SER 15 11.150 -9.263 -17.182 773 HB2 SER 15 HB2 SER 15 13.178 -8.433 -19.274 774 HB3 SER 15 HB1 SER 15 13.015 -10.022 -18.528 775 HG SER 15 HG SER 15 10.672 -9.127 -19.573 776 H LEU 16 HN LEU 16 11.406 -7.883 -15.229 777 HA LEU 16 HA LEU 16 14.001 -6.548 -14.863 778 HB2 LEU 16 HB2 LEU 16 11.488 -6.865 -13.266 779 HB3 LEU 16 HB1 LEU 16 12.969 -6.514 -12.376 780 HG LEU 16 HG LEU 16 13.354 -4.552 -13.857 781 HD11 LEU 16 HD11 LEU 16 10.630 -5.325 -14.941 782 HD12 LEU 16 HD12 LEU 16 12.152 -5.330 -15.832 783 HD13 LEU 16 HD13 LEU 16 11.456 -3.804 -15.286 784 HD21 LEU 16 HD21 LEU 16 12.126 -4.411 -11.678 785 HD22 LEU 16 HD22 LEU 16 10.610 -4.556 -12.570 786 HD23 LEU 16 HD23 LEU 16 11.654 -3.157 -12.826 787 H THR 17 HN THR 17 15.443 -7.137 -13.096 788 HA THR 17 HA THR 17 15.719 -10.098 -12.892 789 HB THR 17 HB THR 17 18.010 -9.376 -11.909 790 HG1 THR 17 HG1 THR 17 16.819 -7.033 -12.176 791 HG21 THR 17 HG21 THR 17 18.899 -8.941 -14.198 792 HG22 THR 17 HG22 THR 17 17.244 -8.734 -14.770 793 HG23 THR 17 HG23 THR 17 17.774 -10.298 -14.154 794 H ALA 18 HN ALA 18 15.180 -11.100 -11.052 795 HA ALA 18 HA ALA 18 14.057 -9.764 -8.806 796 HB1 ALA 18 HB1 ALA 18 13.442 -12.034 -9.147 797 HB2 ALA 18 HB2 ALA 18 14.437 -12.056 -7.690 798 HB3 ALA 18 HB3 ALA 18 15.124 -12.557 -9.235 799 H LYS 19 HN LYS 19 17.331 -10.943 -9.457 800 HA LYS 19 HA LYS 19 18.371 -10.564 -6.829 801 HB2 LYS 19 HB2 LYS 19 19.683 -10.480 -9.556 802 HB3 LYS 19 HB1 LYS 19 20.575 -10.442 -8.040 803 HG2 LYS 19 HG2 LYS 19 19.524 -12.600 -7.390 804 HG3 LYS 19 HG1 LYS 19 18.712 -12.650 -8.956 805 HD2 LYS 19 HD2 LYS 19 21.719 -12.516 -8.576 806 HD3 LYS 19 HD1 LYS 19 20.820 -13.991 -8.923 807 HE2 LYS 19 HE2 LYS 19 21.428 -13.387 -11.081 808 HE3 LYS 19 HE1 LYS 19 19.898 -12.518 -10.965 809 HZ1 LYS 19 HZ1 LYS 19 21.836 -10.884 -9.841 810 HZ2 LYS 19 HZ2 LYS 19 21.028 -10.662 -11.320 811 HZ3 LYS 19 HZ3 LYS 19 22.512 -11.489 -11.275 812 H SER 20 HN SER 20 18.209 -8.388 -9.657 813 HA SER 20 HA SER 20 19.659 -6.223 -8.499 814 HB2 SER 20 HB2 SER 20 19.079 -6.370 -10.906 815 HB3 SER 20 HB1 SER 20 17.379 -6.127 -10.505 816 HG SER 20 HG SER 20 18.514 -4.194 -9.303 817 H VAL 21 HN VAL 21 16.136 -6.801 -8.647 818 HA VAL 21 HA VAL 21 15.476 -4.492 -7.064 819 HB VAL 21 HB VAL 21 13.931 -7.036 -7.637 820 HG11 VAL 21 HG11 VAL 21 13.154 -4.447 -6.288 821 HG12 VAL 21 HG12 VAL 21 12.944 -6.093 -5.688 822 HG13 VAL 21 HG13 VAL 21 11.961 -5.511 -7.032 823 HG21 VAL 21 HG21 VAL 21 12.712 -5.457 -9.203 824 HG22 VAL 21 HG22 VAL 21 14.380 -5.801 -9.660 825 HG23 VAL 21 HG23 VAL 21 13.978 -4.272 -8.881 826 H ALA 22 HN ALA 22 15.822 -7.949 -6.255 827 HA ALA 22 HA ALA 22 15.135 -7.688 -3.492 828 HB1 ALA 22 HB1 ALA 22 15.260 -9.841 -4.774 829 HB2 ALA 22 HB2 ALA 22 16.115 -9.892 -3.233 830 HB3 ALA 22 HB3 ALA 22 17.018 -9.708 -4.737 831 H GLU 23 HN GLU 23 18.322 -7.691 -5.109 832 HA GLU 23 HA GLU 23 19.855 -7.377 -2.707 833 HB2 GLU 23 HB2 GLU 23 20.432 -6.623 -5.586 834 HB3 GLU 23 HB1 GLU 23 21.629 -6.537 -4.295 835 HG2 GLU 23 HG2 GLU 23 20.102 -9.085 -4.847 836 HG3 GLU 23 HG1 GLU 23 21.578 -8.692 -5.728 837 H GLU 24 HN GLU 24 18.633 -4.995 -5.068 838 HA GLU 24 HA GLU 24 19.741 -2.722 -3.695 839 HB2 GLU 24 HB2 GLU 24 17.516 -3.002 -5.729 840 HB3 GLU 24 HB1 GLU 24 18.092 -1.442 -5.138 841 HG2 GLU 24 HG2 GLU 24 19.909 -3.532 -6.372 842 HG3 GLU 24 HG1 GLU 24 19.183 -2.212 -7.288 843 H MET 25 HN MET 25 16.482 -4.201 -3.646 844 HA MET 25 HA MET 25 15.364 -2.241 -1.867 845 HB2 MET 25 HB2 MET 25 14.601 -5.086 -2.531 846 HB3 MET 25 HB1 MET 25 13.688 -4.124 -1.369 847 HG2 MET 25 HG2 MET 25 13.296 -2.403 -3.083 848 HG3 MET 25 HG1 MET 25 14.237 -3.336 -4.246 849 HE1 MET 25 HE1 MET 25 10.152 -4.127 -2.453 850 HE2 MET 25 HE2 MET 25 11.491 -3.172 -1.821 851 HE3 MET 25 HE3 MET 25 11.466 -4.915 -1.569 852 H GLY 26 HN GLY 26 17.007 -5.341 -1.309 853 HA2 GLY 26 HA2 GLY 26 18.401 -5.668 0.674 854 HA3 GLY 26 HA1 GLY 26 17.358 -4.553 1.559 855 H ILE 27 HN ILE 27 16.175 -7.127 -0.558 856 HA ILE 27 HA ILE 27 15.242 -8.654 1.851 857 HB ILE 27 HB ILE 27 13.107 -9.078 0.682 858 HG12 ILE 27 HG12 ILE 27 14.054 -6.975 -1.286 859 HG13 ILE 27 HG11 ILE 27 14.023 -8.700 -1.639 860 HG21 ILE 27 HG21 ILE 27 13.804 -6.148 1.015 861 HG22 ILE 27 HG22 ILE 27 13.284 -7.239 2.300 862 HG23 ILE 27 HG23 ILE 27 12.171 -6.815 0.999 863 HD11 ILE 27 HD11 ILE 27 11.584 -7.126 -0.769 864 HD12 ILE 27 HD12 ILE 27 11.627 -8.789 -1.355 865 HD13 ILE 27 HD13 ILE 27 11.991 -7.457 -2.451 866 H SER 28 HN SER 28 14.602 -10.917 1.265 867 HA SER 28 HA SER 28 16.706 -12.109 -0.362 868 HB2 SER 28 HB2 SER 28 16.000 -13.189 1.710 869 HB3 SER 28 HB1 SER 28 14.351 -13.324 1.103 870 HG SER 28 HG SER 28 15.072 -14.734 -0.465 871 H ARG 29 HN ARG 29 16.114 -13.858 -1.965 872 HA ARG 29 HA ARG 29 14.531 -12.773 -4.095 873 HB2 ARG 29 HB2 ARG 29 15.584 -15.579 -3.620 874 HB3 ARG 29 HB1 ARG 29 14.865 -15.034 -5.135 875 HG2 ARG 29 HG2 ARG 29 16.598 -13.214 -5.226 876 HG3 ARG 29 HG1 ARG 29 17.369 -13.946 -3.817 877 HD2 ARG 29 HD2 ARG 29 16.831 -15.403 -6.419 878 HD3 ARG 29 HD1 ARG 29 18.379 -14.684 -5.992 879 HE ARG 29 HE ARG 29 17.105 -16.930 -4.466 880 HH11 ARG 29 HH21 ARG 29 19.932 -15.229 -5.605 881 HH12 ARG 29 HH22 ARG 29 21.025 -16.355 -4.880 882 HH21 ARG 29 HH11 ARG 29 18.553 -18.367 -3.549 883 HH22 ARG 29 HH12 ARG 29 20.257 -18.110 -3.730 884 H GLN 30 HN GLN 30 13.883 -15.183 -1.585 885 HA GLN 30 HA GLN 30 11.382 -16.130 -2.602 886 HB2 GLN 30 HB2 GLN 30 12.388 -15.901 0.246 887 HB3 GLN 30 HB1 GLN 30 10.968 -16.823 -0.241 888 HG2 GLN 30 HG2 GLN 30 13.763 -17.297 -1.318 889 HG3 GLN 30 HG1 GLN 30 13.026 -18.231 -0.017 890 HE21 GLN 30 HE21 GLN 30 11.410 -19.794 -0.575 891 HE22 GLN 30 HE22 GLN 30 11.003 -20.158 -2.182 892 H GLN 31 HN GLN 31 12.103 -13.570 -0.219 893 HA GLN 31 HA GLN 31 9.424 -12.785 0.313 894 HB2 GLN 31 HB2 GLN 31 11.476 -12.053 1.569 895 HB3 GLN 31 HB1 GLN 31 11.870 -10.999 0.212 896 HG2 GLN 31 HG2 GLN 31 9.668 -9.869 0.493 897 HG3 GLN 31 HG1 GLN 31 9.379 -10.842 1.929 898 HE21 GLN 31 HE21 GLN 31 9.685 -7.922 1.889 899 HE22 GLN 31 HE22 GLN 31 11.049 -7.550 2.825 900 H LEU 32 HN LEU 32 11.711 -11.727 -2.194 901 HA LEU 32 HA LEU 32 10.018 -9.716 -3.311 902 HB2 LEU 32 HB2 LEU 32 12.417 -9.835 -3.829 903 HB3 LEU 32 HB1 LEU 32 12.181 -11.388 -4.627 904 HG LEU 32 HG LEU 32 10.765 -10.347 -6.323 905 HD11 LEU 32 HD11 LEU 32 9.597 -8.590 -5.324 906 HD12 LEU 32 HD12 LEU 32 10.804 -7.705 -6.248 907 HD13 LEU 32 HD13 LEU 32 11.028 -7.951 -4.518 908 HD21 LEU 32 HD21 LEU 32 12.477 -8.862 -7.355 909 HD22 LEU 32 HD22 LEU 32 13.176 -10.349 -6.716 910 HD23 LEU 32 HD23 LEU 32 13.348 -8.840 -5.823 911 H CYS 33 HN CYS 33 10.368 -13.185 -3.954 912 HA CYS 33 HA CYS 33 8.678 -13.340 -6.230 913 HB2 CYS 33 HB2 CYS 33 10.158 -15.164 -5.115 914 HB3 CYS 33 HB1 CYS 33 8.745 -15.488 -4.111 915 HG CYS 33 HG CYS 33 7.429 -15.797 -6.490 916 H ASN 34 HN ASN 34 7.959 -13.129 -2.796 917 HA ASN 34 HA ASN 34 5.183 -13.824 -2.963 918 HB2 ASN 34 HB2 ASN 34 6.727 -13.575 -0.877 919 HB3 ASN 34 HB1 ASN 34 6.270 -11.873 -0.936 920 HD21 ASN 34 HD21 ASN 34 5.320 -14.892 0.287 921 HD22 ASN 34 HD22 ASN 34 3.699 -14.524 0.632 922 H ILE 35 HN ILE 35 6.922 -10.749 -3.257 923 HA ILE 35 HA ILE 35 4.639 -9.036 -3.309 924 HB ILE 35 HB ILE 35 7.375 -8.737 -4.580 925 HG12 ILE 35 HG12 ILE 35 6.204 -7.488 -2.073 926 HG13 ILE 35 HG11 ILE 35 7.192 -8.949 -2.062 927 HG21 ILE 35 HG21 ILE 35 5.929 -7.223 -5.748 928 HG22 ILE 35 HG22 ILE 35 6.743 -6.260 -4.517 929 HG23 ILE 35 HG23 ILE 35 5.080 -6.787 -4.265 930 HD11 ILE 35 HD11 ILE 35 8.015 -6.178 -2.957 931 HD12 ILE 35 HD12 ILE 35 8.975 -7.617 -3.291 932 HD13 ILE 35 HD13 ILE 35 8.683 -7.121 -1.626 933 H GLU 36 HN GLU 36 6.392 -10.627 -6.006 934 HA GLU 36 HA GLU 36 4.546 -9.507 -7.978 935 HB2 GLU 36 HB2 GLU 36 5.787 -10.809 -9.604 936 HB3 GLU 36 HB1 GLU 36 6.948 -10.111 -8.476 937 HG2 GLU 36 HG2 GLU 36 6.867 -12.260 -7.183 938 HG3 GLU 36 HG1 GLU 36 5.890 -12.942 -8.476 939 H GLN 37 HN GLN 37 4.508 -12.132 -5.817 940 HA GLN 37 HA GLN 37 2.490 -13.653 -7.406 941 HB2 GLN 37 HB2 GLN 37 4.053 -14.254 -4.889 942 HB3 GLN 37 HB1 GLN 37 2.704 -15.256 -5.405 943 HG2 GLN 37 HG2 GLN 37 5.104 -14.633 -7.142 944 HG3 GLN 37 HG1 GLN 37 4.951 -16.092 -6.167 945 HE21 GLN 37 HE21 GLN 37 4.695 -15.284 -9.283 946 HE22 GLN 37 HE22 GLN 37 3.374 -16.236 -9.761 947 H SER 38 HN SER 38 2.358 -10.996 -5.676 948 HA SER 38 HA SER 38 0.607 -11.463 -3.499 949 HB2 SER 38 HB2 SER 38 1.691 -9.301 -3.834 950 HB3 SER 38 HB1 SER 38 0.805 -9.061 -5.337 951 HG SER 38 HG SER 38 0.037 -8.284 -3.023 952 H GLU 39 HN GLU 39 -1.598 -11.575 -3.327 953 HA GLU 39 HA GLU 39 -3.138 -12.024 -5.855 954 HB2 GLU 39 HB2 GLU 39 -3.560 -12.896 -2.984 955 HB3 GLU 39 HB1 GLU 39 -4.789 -13.092 -4.235 956 HG2 GLU 39 HG2 GLU 39 -3.331 -14.509 -5.540 957 HG3 GLU 39 HG1 GLU 39 -1.970 -14.180 -4.465 958 H THR 40 HN THR 40 -3.114 -10.262 -2.778 959 HA THR 40 HA THR 40 -5.177 -8.399 -3.895 960 HB THR 40 HB THR 40 -6.121 -8.206 -1.626 961 HG1 THR 40 HG1 THR 40 -5.434 -9.966 -0.175 962 HG21 THR 40 HG21 THR 40 -5.983 -11.086 -2.541 963 HG22 THR 40 HG22 THR 40 -7.004 -9.856 -3.287 964 HG23 THR 40 HG23 THR 40 -7.280 -10.334 -1.612 965 H ALA 41 HN ALA 41 -5.007 -6.225 -3.051 966 HA ALA 41 HA ALA 41 -2.209 -5.527 -2.362 967 HB1 ALA 41 HB1 ALA 41 -3.203 -3.144 -2.770 968 HB2 ALA 41 HB2 ALA 41 -4.579 -4.017 -3.447 969 HB3 ALA 41 HB3 ALA 41 -2.977 -4.214 -4.154 970 HA PRO 42 HA PRO 42 -3.247 -4.633 1.875 971 HB2 PRO 42 HB2 PRO 42 -1.453 -2.631 2.449 972 HB3 PRO 42 HB1 PRO 42 -0.989 -4.334 2.271 973 HG2 PRO 42 HG2 PRO 42 -0.773 -2.101 0.298 974 HG3 PRO 42 HG1 PRO 42 0.386 -3.391 0.670 975 HD2 PRO 42 HD2 PRO 42 -1.246 -3.486 -1.518 976 HD3 PRO 42 HD1 PRO 42 -0.713 -4.949 -0.659 977 H VAL 43 HN VAL 43 -4.154 -2.963 3.302 978 HA VAL 43 HA VAL 43 -6.073 -1.280 2.037 979 HB VAL 43 HB VAL 43 -6.438 -0.335 4.287 980 HG11 VAL 43 HG11 VAL 43 -7.171 -2.711 3.627 981 HG12 VAL 43 HG12 VAL 43 -7.106 -2.359 5.353 982 HG13 VAL 43 HG13 VAL 43 -5.809 -3.280 4.592 983 HG21 VAL 43 HG21 VAL 43 -4.934 -1.221 6.138 984 HG22 VAL 43 HG22 VAL 43 -4.182 -0.043 5.063 985 HG23 VAL 43 HG23 VAL 43 -3.830 -1.761 4.873 986 H VAL 44 HN VAL 44 -2.719 -0.823 2.693 987 HA VAL 44 HA VAL 44 -2.598 2.021 2.895 988 HB VAL 44 HB VAL 44 -0.637 0.031 1.711 989 HG11 VAL 44 HG11 VAL 44 -0.396 2.981 2.320 990 HG12 VAL 44 HG12 VAL 44 -0.022 2.145 0.812 991 HG13 VAL 44 HG13 VAL 44 1.014 1.927 2.224 992 HG21 VAL 44 HG21 VAL 44 -1.124 -0.318 4.093 993 HG22 VAL 44 HG22 VAL 44 -0.810 1.386 4.421 994 HG23 VAL 44 HG23 VAL 44 0.503 0.332 3.898 995 H VAL 45 HN VAL 45 -2.499 -0.138 0.055 996 HA VAL 45 HA VAL 45 -2.193 1.915 -1.909 997 HB VAL 45 HB VAL 45 -3.509 -0.812 -2.079 998 HG11 VAL 45 HG11 VAL 45 -4.348 0.436 -3.926 999 HG12 VAL 45 HG12 VAL 45 -2.990 -0.488 -4.567 1000 HG13 VAL 45 HG13 VAL 45 -2.794 1.225 -4.193 1001 HG21 VAL 45 HG21 VAL 45 -1.023 -0.597 -1.481 1002 HG22 VAL 45 HG22 VAL 45 -0.799 0.061 -3.102 1003 HG23 VAL 45 HG23 VAL 45 -1.404 -1.582 -2.893 1004 H LYS 46 HN LYS 46 -5.083 0.374 -0.519 1005 HA LYS 46 HA LYS 46 -7.011 1.775 -2.087 1006 HB2 LYS 46 HB2 LYS 46 -7.144 0.627 0.714 1007 HB3 LYS 46 HB1 LYS 46 -8.550 1.247 -0.152 1008 HG2 LYS 46 HG2 LYS 46 -8.162 -0.389 -1.958 1009 HG3 LYS 46 HG1 LYS 46 -6.747 -1.002 -1.101 1010 HD2 LYS 46 HD2 LYS 46 -8.168 -1.642 0.808 1011 HD3 LYS 46 HD1 LYS 46 -9.587 -1.020 -0.033 1012 HE2 LYS 46 HE2 LYS 46 -9.231 -2.648 -1.851 1013 HE3 LYS 46 HE1 LYS 46 -7.807 -3.270 -1.017 1014 HZ1 LYS 46 HZ1 LYS 46 -10.529 -3.228 0.163 1015 HZ2 LYS 46 HZ2 LYS 46 -9.148 -3.990 0.795 1016 HZ3 LYS 46 HZ3 LYS 46 -9.865 -4.573 -0.630 1017 H TYR 47 HN TYR 47 -5.450 2.564 1.012 1018 HA TYR 47 HA TYR 47 -6.941 4.934 1.571 1019 HB2 TYR 47 HB2 TYR 47 -5.377 3.715 3.148 1020 HB3 TYR 47 HB1 TYR 47 -4.032 4.428 2.258 1021 HD1 TYR 47 HD2 TYR 47 -6.953 5.143 4.405 1022 HD2 TYR 47 HD1 TYR 47 -3.487 6.777 2.466 1023 HE1 TYR 47 HE2 TYR 47 -7.193 7.228 5.726 1024 HE2 TYR 47 HE1 TYR 47 -3.728 8.860 3.792 1025 HH TYR 47 HH TYR 47 -4.762 9.544 5.968 1026 H ILE 48 HN ILE 48 -3.900 4.419 -0.206 1027 HA ILE 48 HA ILE 48 -3.379 7.168 -0.809 1028 HB ILE 48 HB ILE 48 -2.656 4.624 -2.308 1029 HG12 ILE 48 HG12 ILE 48 -0.917 6.370 -0.548 1030 HG13 ILE 48 HG11 ILE 48 -1.812 4.986 0.083 1031 HG21 ILE 48 HG21 ILE 48 -1.673 7.471 -2.612 1032 HG22 ILE 48 HG22 ILE 48 -2.472 6.493 -3.844 1033 HG23 ILE 48 HG23 ILE 48 -0.849 6.075 -3.298 1034 HD11 ILE 48 HD11 ILE 48 -0.024 4.675 -2.325 1035 HD12 ILE 48 HD12 ILE 48 -0.576 3.444 -1.191 1036 HD13 ILE 48 HD13 ILE 48 0.647 4.613 -0.695 1037 H ALA 49 HN ALA 49 -5.149 4.626 -2.554 1038 HA ALA 49 HA ALA 49 -5.789 6.158 -4.864 1039 HB1 ALA 49 HB1 ALA 49 -6.085 3.636 -4.478 1040 HB2 ALA 49 HB2 ALA 49 -7.371 4.455 -5.366 1041 HB3 ALA 49 HB3 ALA 49 -7.592 4.051 -3.663 1042 H PHE 50 HN PHE 50 -7.314 5.924 -1.691 1043 HA PHE 50 HA PHE 50 -9.756 7.247 -2.297 1044 HB2 PHE 50 HB2 PHE 50 -8.922 6.067 -0.107 1045 HB3 PHE 50 HB1 PHE 50 -8.287 7.656 0.314 1046 HD1 PHE 50 HD1 PHE 50 -11.407 6.033 -0.965 1047 HD2 PHE 50 HD2 PHE 50 -9.707 9.174 1.421 1048 HE1 PHE 50 HE1 PHE 50 -13.678 6.706 -0.238 1049 HE2 PHE 50 HE2 PHE 50 -11.982 9.850 2.147 1050 HZ PHE 50 HZ PHE 50 -13.966 8.614 1.320 1051 H LEU 51 HN LEU 51 -6.650 8.552 -1.131 1052 HA LEU 51 HA LEU 51 -7.461 11.310 -1.250 1053 HB2 LEU 51 HB2 LEU 51 -4.716 10.020 -1.347 1054 HB3 LEU 51 HB1 LEU 51 -4.992 11.750 -1.149 1055 HG LEU 51 HG LEU 51 -6.080 9.619 0.719 1056 HD11 LEU 51 HD11 LEU 51 -3.703 9.612 0.963 1057 HD12 LEU 51 HD12 LEU 51 -4.324 10.599 2.286 1058 HD13 LEU 51 HD13 LEU 51 -3.619 11.371 0.866 1059 HD21 LEU 51 HD21 LEU 51 -6.204 11.801 2.206 1060 HD22 LEU 51 HD22 LEU 51 -7.475 11.480 1.033 1061 HD23 LEU 51 HD23 LEU 51 -6.197 12.633 0.651 1062 H ARG 52 HN ARG 52 -5.872 9.133 -3.553 1063 HA ARG 52 HA ARG 52 -5.264 11.081 -5.548 1064 HB2 ARG 52 HB2 ARG 52 -4.401 8.737 -5.545 1065 HB3 ARG 52 HB1 ARG 52 -6.018 8.177 -5.961 1066 HG2 ARG 52 HG2 ARG 52 -5.978 9.425 -8.044 1067 HG3 ARG 52 HG1 ARG 52 -4.425 10.147 -7.616 1068 HD2 ARG 52 HD2 ARG 52 -4.359 8.134 -9.210 1069 HD3 ARG 52 HD1 ARG 52 -3.285 8.079 -7.819 1070 HE ARG 52 HE ARG 52 -5.955 6.741 -7.703 1071 HH11 ARG 52 HH21 ARG 52 -2.478 6.619 -7.517 1072 HH12 ARG 52 HH22 ARG 52 -2.459 5.000 -6.910 1073 HH21 ARG 52 HH11 ARG 52 -5.895 4.628 -6.943 1074 HH22 ARG 52 HH12 ARG 52 -4.373 3.881 -6.593 1075 H SER 53 HN SER 53 -8.174 9.120 -4.976 1076 HA SER 53 HA SER 53 -9.588 9.937 -7.319 1077 HB2 SER 53 HB2 SER 53 -10.526 9.003 -4.597 1078 HB3 SER 53 HB1 SER 53 -11.638 9.343 -5.920 1079 HG SER 53 HG SER 53 -9.615 7.382 -5.730 1080 H LYS 54 HN LYS 54 -8.780 11.607 -4.425 1081 HA LYS 54 HA LYS 54 -10.920 13.626 -4.760 1082 HB2 LYS 54 HB2 LYS 54 -8.632 13.367 -2.783 1083 HB3 LYS 54 HB1 LYS 54 -9.823 14.670 -2.757 1084 HG2 LYS 54 HG2 LYS 54 -11.635 13.018 -2.494 1085 HG3 LYS 54 HG1 LYS 54 -10.453 11.710 -2.530 1086 HD2 LYS 54 HD2 LYS 54 -9.373 12.619 -0.510 1087 HD3 LYS 54 HD1 LYS 54 -10.547 13.936 -0.472 1088 HE2 LYS 54 HE2 LYS 54 -12.379 12.304 -0.220 1089 HE3 LYS 54 HE1 LYS 54 -11.211 10.984 -0.262 1090 HZ1 LYS 54 HZ1 LYS 54 -10.795 11.273 1.878 1091 HZ2 LYS 54 HZ2 LYS 54 -12.026 12.442 1.945 1092 HZ3 LYS 54 HZ3 LYS 54 -10.422 12.910 1.642 1093 H GLY 55 HN GLY 55 -8.153 12.966 -6.339 1094 HA2 GLY 55 HA2 GLY 55 -6.966 14.292 -7.889 1095 HA3 GLY 55 HA1 GLY 55 -7.882 15.693 -7.336 1096 H VAL 56 HN VAL 56 -6.381 13.850 -4.848 1097 HA VAL 56 HA VAL 56 -4.791 16.074 -3.991 1098 HB VAL 56 HB VAL 56 -4.756 13.139 -3.248 1099 HG11 VAL 56 HG11 VAL 56 -2.533 13.860 -2.757 1100 HG12 VAL 56 HG12 VAL 56 -3.410 14.011 -1.234 1101 HG13 VAL 56 HG13 VAL 56 -3.088 15.443 -2.211 1102 HG21 VAL 56 HG21 VAL 56 -5.969 13.855 -1.327 1103 HG22 VAL 56 HG22 VAL 56 -6.704 14.722 -2.673 1104 HG23 VAL 56 HG23 VAL 56 -5.564 15.546 -1.609 1105 H ASP 57 HN ASP 57 -2.566 16.448 -4.185 1106 HA ASP 57 HA ASP 57 -1.287 15.752 -6.623 1107 HB2 ASP 57 HB2 ASP 57 -0.241 16.772 -3.973 1108 HB3 ASP 57 HB1 ASP 57 0.795 16.572 -5.384 1109 H LEU 58 HN LEU 58 -1.800 13.366 -6.444 1110 HA LEU 58 HA LEU 58 -0.403 11.683 -4.595 1111 HB2 LEU 58 HB2 LEU 58 -2.473 11.323 -6.282 1112 HB3 LEU 58 HB1 LEU 58 -1.200 10.673 -7.308 1113 HG LEU 58 HG LEU 58 -2.135 8.862 -6.018 1114 HD11 LEU 58 HD11 LEU 58 0.442 9.481 -4.606 1115 HD12 LEU 58 HD12 LEU 58 0.422 9.157 -6.341 1116 HD13 LEU 58 HD13 LEU 58 -0.156 7.936 -5.210 1117 HD21 LEU 58 HD21 LEU 58 -2.612 10.766 -4.038 1118 HD22 LEU 58 HD22 LEU 58 -1.319 9.795 -3.337 1119 HD23 LEU 58 HD23 LEU 58 -2.818 9.029 -3.856 1120 H ASN 59 HN ASN 59 0.289 12.675 -7.938 1121 HA ASN 59 HA ASN 59 2.590 11.044 -8.316 1122 HB2 ASN 59 HB2 ASN 59 2.060 13.804 -9.461 1123 HB3 ASN 59 HB1 ASN 59 3.153 12.590 -10.125 1124 HD21 ASN 59 HD21 ASN 59 0.422 13.874 -11.038 1125 HD22 ASN 59 HD22 ASN 59 -0.473 12.524 -11.546 1126 H ALA 60 HN ALA 60 2.204 14.307 -6.988 1127 HA ALA 60 HA ALA 60 4.982 14.863 -6.664 1128 HB1 ALA 60 HB1 ALA 60 2.880 16.410 -6.421 1129 HB2 ALA 60 HB2 ALA 60 4.293 16.725 -5.419 1130 HB3 ALA 60 HB3 ALA 60 2.903 15.884 -4.738 1131 H LEU 61 HN LEU 61 2.652 13.157 -4.599 1132 HA LEU 61 HA LEU 61 4.237 13.050 -2.247 1133 HB2 LEU 61 HB2 LEU 61 1.847 12.356 -2.385 1134 HB3 LEU 61 HB1 LEU 61 2.335 10.938 -3.309 1135 HG LEU 61 HG LEU 61 3.741 10.196 -1.393 1136 HD11 LEU 61 HD11 LEU 61 2.744 12.795 -0.250 1137 HD12 LEU 61 HD12 LEU 61 4.347 12.068 -0.148 1138 HD13 LEU 61 HD13 LEU 61 3.035 11.440 0.844 1139 HD21 LEU 61 HD21 LEU 61 1.842 9.576 0.084 1140 HD22 LEU 61 HD22 LEU 61 1.444 9.364 -1.621 1141 HD23 LEU 61 HD23 LEU 61 0.831 10.764 -0.741 1142 H PHE 62 HN PHE 62 3.998 10.668 -4.909 1143 HA PHE 62 HA PHE 62 6.113 8.998 -3.836 1144 HB2 PHE 62 HB2 PHE 62 4.675 9.176 -6.484 1145 HB3 PHE 62 HB1 PHE 62 6.043 8.085 -6.283 1146 HD1 PHE 62 HD2 PHE 62 2.806 9.037 -4.632 1147 HD2 PHE 62 HD1 PHE 62 5.681 5.943 -5.417 1148 HE1 PHE 62 HE2 PHE 62 1.325 7.375 -3.537 1149 HE2 PHE 62 HE1 PHE 62 4.197 4.286 -4.330 1150 HZ PHE 62 HZ PHE 62 2.019 5.001 -3.395 1151 H ASP 63 HN ASP 63 5.990 11.511 -6.322 1152 HA ASP 63 HA ASP 63 8.627 11.168 -7.315 1153 HB2 ASP 63 HB2 ASP 63 6.654 12.590 -8.212 1154 HB3 ASP 63 HB1 ASP 63 7.249 13.840 -7.127 1155 H ARG 64 HN ARG 64 7.415 13.102 -4.581 1156 HA ARG 64 HA ARG 64 9.823 14.512 -4.063 1157 HB2 ARG 64 HB2 ARG 64 7.290 14.276 -2.843 1158 HB3 ARG 64 HB1 ARG 64 8.398 13.717 -1.602 1159 HG2 ARG 64 HG2 ARG 64 8.404 15.995 -1.148 1160 HG3 ARG 64 HG1 ARG 64 9.747 15.926 -2.287 1161 HD2 ARG 64 HD2 ARG 64 6.920 16.872 -2.745 1162 HD3 ARG 64 HD1 ARG 64 8.433 17.697 -3.118 1163 HE ARG 64 HE ARG 64 8.441 15.397 -4.709 1164 HH11 ARG 64 HH21 ARG 64 6.448 18.163 -4.188 1165 HH12 ARG 64 HH22 ARG 64 5.840 18.191 -5.810 1166 HH21 ARG 64 HH11 ARG 64 7.683 15.449 -6.834 1167 HH22 ARG 64 HH12 ARG 64 6.524 16.645 -7.301 1168 H ILE 65 HN ILE 65 9.091 11.186 -3.805 1169 HA ILE 65 HA ILE 65 11.235 10.651 -1.826 1170 HB ILE 65 HB ILE 65 9.653 8.602 -3.394 1171 HG12 ILE 65 HG12 ILE 65 7.974 10.027 -2.419 1172 HG13 ILE 65 HG11 ILE 65 8.104 8.602 -1.391 1173 HG21 ILE 65 HG21 ILE 65 10.140 7.192 -1.480 1174 HG22 ILE 65 HG22 ILE 65 10.853 8.552 -0.613 1175 HG23 ILE 65 HG23 ILE 65 11.647 7.909 -2.050 1176 HD11 ILE 65 HD11 ILE 65 8.076 10.450 0.101 1177 HD12 ILE 65 HD12 ILE 65 9.207 11.368 -0.886 1178 HD13 ILE 65 HD13 ILE 65 9.765 9.959 0.015 1179 H ILE 66 HN ILE 66 10.426 9.499 -5.120 1180 HA ILE 66 HA ILE 66 13.049 8.464 -5.630 1181 HB ILE 66 HB ILE 66 10.839 9.311 -7.524 1182 HG12 ILE 66 HG12 ILE 66 11.777 6.549 -6.707 1183 HG13 ILE 66 HG11 ILE 66 10.458 7.395 -5.895 1184 HG21 ILE 66 HG21 ILE 66 12.140 7.776 -9.120 1185 HG22 ILE 66 HG22 ILE 66 13.492 7.936 -8.000 1186 HG23 ILE 66 HG23 ILE 66 12.849 9.361 -8.815 1187 HD11 ILE 66 HD11 ILE 66 9.265 7.587 -8.059 1188 HD12 ILE 66 HD12 ILE 66 9.564 5.904 -7.627 1189 HD13 ILE 66 HD13 ILE 66 10.569 6.694 -8.843 1190 H VAL 67 HN VAL 67 11.488 11.550 -6.467 1191 HA VAL 67 HA VAL 67 12.411 13.619 -7.038 1192 HB VAL 67 HB VAL 67 15.080 12.449 -6.205 1193 HG11 VAL 67 HG11 VAL 67 15.682 14.766 -5.796 1194 HG12 VAL 67 HG12 VAL 67 14.062 15.295 -6.253 1195 HG13 VAL 67 HG13 VAL 67 15.133 14.584 -7.462 1196 HG21 VAL 67 HG21 VAL 67 13.280 12.207 -4.454 1197 HG22 VAL 67 HG22 VAL 67 13.082 13.959 -4.499 1198 HG23 VAL 67 HG23 VAL 67 14.611 13.258 -3.972 1199 H ASN 68 HN ASN 68 14.359 10.851 -8.078 1200 HA ASN 68 HA ASN 68 15.477 12.149 -10.380 1201 HB2 ASN 68 HB2 ASN 68 15.007 9.198 -9.866 1202 HB3 ASN 68 HB1 ASN 68 16.097 9.875 -11.076 1203 HD21 ASN 68 HD21 ASN 68 17.477 11.842 -9.772 1204 HD22 ASN 68 HD22 ASN 68 18.285 11.232 -8.411 1205 H LYS 69 HN LYS 69 14.428 12.709 -12.204 1206 HA LYS 69 HA LYS 69 12.596 10.950 -13.566 1207 HB2 LYS 69 HB2 LYS 69 11.068 11.788 -11.783 1208 HB3 LYS 69 HB1 LYS 69 11.380 13.440 -12.320 1209 HG2 LYS 69 HG2 LYS 69 10.469 12.926 -14.531 1210 HG3 LYS 69 HG1 LYS 69 10.229 11.243 -14.064 1211 HD2 LYS 69 HD2 LYS 69 8.668 11.965 -12.287 1212 HD3 LYS 69 HD1 LYS 69 8.888 13.643 -12.786 1213 HE2 LYS 69 HE2 LYS 69 7.882 11.451 -14.621 1214 HE3 LYS 69 HE1 LYS 69 6.830 12.569 -13.751 1215 HZ1 LYS 69 HZ1 LYS 69 8.976 13.828 -15.217 1216 HZ2 LYS 69 HZ2 LYS 69 7.330 14.240 -15.127 1217 HZ3 LYS 69 HZ3 LYS 69 7.846 13.023 -16.193 1218 H LEU 70 HN LEU 70 14.050 11.419 -15.266 1219 HA LEU 70 HA LEU 70 14.632 14.150 -16.068 1220 HB2 LEU 70 HB2 LEU 70 15.025 11.538 -17.554 1221 HB3 LEU 70 HB1 LEU 70 15.748 13.086 -17.993 1222 HG LEU 70 HG LEU 70 16.194 11.626 -15.369 1223 HD11 LEU 70 HD11 LEU 70 17.879 11.910 -17.868 1224 HD12 LEU 70 HD12 LEU 70 17.309 10.420 -17.116 1225 HD13 LEU 70 HD13 LEU 70 18.540 11.397 -16.316 1226 HD21 LEU 70 HD21 LEU 70 18.155 13.398 -15.360 1227 HD22 LEU 70 HD22 LEU 70 16.547 13.882 -14.837 1228 HD23 LEU 70 HD23 LEU 70 17.102 14.287 -16.461 1229 H GLU 71 HN GLU 71 13.872 15.240 -17.906 1230 HA GLU 71 HA GLU 71 11.140 14.449 -18.741 1231 HB2 GLU 71 HB2 GLU 71 11.471 16.791 -20.004 1232 HB3 GLU 71 HB1 GLU 71 11.092 16.731 -18.285 1233 HG2 GLU 71 HG2 GLU 71 13.946 16.768 -19.283 1234 HG3 GLU 71 HG1 GLU 71 13.042 18.251 -18.983 1235 H HIS 72 HN HIS 72 10.982 13.172 -20.509 1236 HA HIS 72 HA HIS 72 12.748 13.724 -22.857 1237 HB2 HIS 72 HB2 HIS 72 13.109 11.330 -23.194 1238 HB3 HIS 72 HB1 HIS 72 13.668 11.780 -21.586 1239 HD2 HIS 72 HD2 HIS 72 12.022 8.819 -22.779 1240 HE1 HIS 72 HE1 HIS 72 9.730 9.724 -19.349 1241 HE2 HIS 72 HE2 HIS 72 10.299 7.921 -21.039 1242 H HIS 73 HN HIS 73 10.513 14.842 -23.146 1243 HA HIS 73 HA HIS 73 8.080 13.612 -23.546 1244 HB2 HIS 73 HB2 HIS 73 7.885 15.266 -25.585 1245 HB3 HIS 73 HB1 HIS 73 8.071 15.914 -23.956 1246 HD2 HIS 73 HD2 HIS 73 10.778 14.831 -26.708 1247 HE1 HIS 73 HE1 HIS 73 11.935 18.486 -24.934 1248 HE2 HIS 73 HE2 HIS 73 12.566 16.731 -26.652 1249 H HIS 74 HN HIS 74 7.024 12.638 -25.377 1250 HA HIS 74 HA HIS 74 8.848 10.932 -26.976 1251 HB2 HIS 74 HB2 HIS 74 5.817 10.911 -26.763 1252 HB3 HIS 74 HB1 HIS 74 6.821 9.665 -27.506 1253 HD2 HIS 74 HD2 HIS 74 8.239 8.007 -25.645 1254 HE1 HIS 74 HE1 HIS 74 6.421 9.609 -22.185 1255 HE2 HIS 74 HE2 HIS 74 7.900 7.750 -23.070 1256 H HIS 75 HN HIS 75 8.254 13.902 -27.401 1257 HA HIS 75 HA HIS 75 7.907 15.364 -29.189 1258 HB2 HIS 75 HB2 HIS 75 8.341 13.351 -31.315 1259 HB3 HIS 75 HB1 HIS 75 9.259 14.811 -30.949 1260 HD2 HIS 75 HD2 HIS 75 11.490 14.409 -29.230 1261 HE1 HIS 75 HE1 HIS 75 11.084 10.214 -28.951 1262 HE2 HIS 75 HE2 HIS 75 12.582 12.187 -28.408 1263 H HIS 76 HN HIS 76 6.680 15.542 -31.406 1264 HA HIS 76 HA HIS 76 4.494 15.699 -32.271 1265 HB2 HIS 76 HB2 HIS 76 5.060 12.739 -32.054 1266 HB3 HIS 76 HB1 HIS 76 3.567 13.337 -32.777 1267 HD2 HIS 76 HD2 HIS 76 4.661 12.355 -35.316 1268 HE1 HIS 76 HE1 HIS 76 7.423 15.531 -35.658 1269 HE2 HIS 76 HE2 HIS 76 6.307 13.618 -36.896 1270 H HIS 77 HN HIS 77 3.489 12.758 -30.758 1271 HA HIS 77 HA HIS 77 1.120 13.674 -29.683 1272 HB2 HIS 77 HB2 HIS 77 2.229 11.278 -29.698 1273 HB3 HIS 77 HB1 HIS 77 2.745 11.707 -28.070 1274 HD2 HIS 77 HD2 HIS 77 -0.319 10.241 -29.768 1275 HE1 HIS 77 HE1 HIS 77 -1.719 11.808 -26.106 1276 HE2 HIS 77 HE2 HIS 77 -2.309 10.336 -28.087
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