NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
521786 | 2lju | 17962 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 H MET 1 1.808 -0.000 0.855 2 HA MET 1 HA MET 1 2.313 1.025 -1.496 3 HB2 MET 1 HB2 MET 1 3.972 -0.709 -1.976 4 HB3 MET 1 HB3 MET 1 3.975 -0.289 -0.269 5 HG2 MET 1 HG2 MET 1 2.454 -2.299 0.064 6 HG3 MET 1 HG3 MET 1 2.896 -2.760 -1.578 7 HE1 MET 1 HE1 MET 1 3.496 -5.026 -0.079 8 HE2 MET 1 HE2 MET 1 4.409 -4.810 -1.572 9 HE3 MET 1 HE3 MET 1 5.236 -5.314 -0.098 10 H GLN 2 H GLN 2 -0.402 0.162 -1.652 11 HA GLN 2 HA GLN 2 -0.372 -1.718 -3.905 12 HB2 GLN 2 HB2 GLN 2 -2.806 -1.894 -3.539 13 HB3 GLN 2 HB3 GLN 2 -1.884 -2.325 -2.105 14 HG2 GLN 2 HG2 GLN 2 -2.350 -0.168 -1.116 15 HG3 GLN 2 HG3 GLN 2 -3.200 0.340 -2.575 16 HE21 GLN 2 HE21 GLN 2 -3.277 -2.687 -0.738 17 HE22 GLN 2 HE22 GLN 2 -4.975 -2.657 -0.425 18 H GLU 3 H GLU 3 -2.490 -1.133 -5.359 19 HA GLU 3 HA GLU 3 -2.252 1.704 -6.099 20 HB2 GLU 3 HB2 GLU 3 -0.993 -0.098 -7.560 21 HB3 GLU 3 HB3 GLU 3 -2.597 -0.363 -8.229 22 HG2 GLU 3 HG2 GLU 3 -1.525 1.184 -9.644 23 HG3 GLU 3 HG3 GLU 3 -2.695 2.102 -8.698 24 H GLN 4 H GLN 4 -4.121 2.720 -6.565 25 HA GLN 4 HA GLN 4 -6.584 1.253 -6.140 26 HB2 GLN 4 HB2 GLN 4 -6.012 3.579 -5.196 27 HB3 GLN 4 HB3 GLN 4 -6.378 4.179 -6.808 28 HG2 GLN 4 HG2 GLN 4 -8.632 3.269 -6.644 29 HG3 GLN 4 HG3 GLN 4 -8.267 2.646 -5.036 30 HE21 GLN 4 HE21 GLN 4 -10.217 4.673 -6.095 31 HE22 GLN 4 HE22 GLN 4 -9.974 6.065 -5.101 32 H VAL 5 H VAL 5 -8.025 0.684 -7.658 33 HA VAL 5 HA VAL 5 -7.629 1.699 -10.395 34 HB VAL 5 HB VAL 5 -8.372 -1.135 -9.656 35 HG11 VAL 5 HG11 VAL 5 -8.502 0.402 -12.138 36 HG12 VAL 5 HG12 VAL 5 -7.637 -1.129 -12.290 37 HG13 VAL 5 HG13 VAL 5 -9.297 -1.108 -11.695 38 HG21 VAL 5 HG21 VAL 5 -6.174 -1.718 -10.620 39 HG22 VAL 5 HG22 VAL 5 -5.805 0.000 -10.765 40 HG23 VAL 5 HG23 VAL 5 -6.038 -0.720 -9.172 41 H SER 6 H SER 6 -9.435 2.229 -11.528 42 HA SER 6 HA SER 6 -11.975 2.084 -10.059 43 HB2 SER 6 HB2 SER 6 -10.899 4.308 -10.931 44 HB3 SER 6 HB3 SER 6 -11.566 3.803 -12.483 45 HG SER 6 HG SER 6 -12.823 4.901 -10.374 46 H ASN 7 H ASN 7 -12.006 -0.224 -10.817 47 HA ASN 7 HA ASN 7 -13.605 -0.374 -13.238 48 HB2 ASN 7 HB2 ASN 7 -11.152 -0.762 -13.849 49 HB3 ASN 7 HB3 ASN 7 -11.269 -2.256 -12.924 50 HD21 ASN 7 HD21 ASN 7 -11.907 -0.703 -15.875 51 HD22 ASN 7 HD22 ASN 7 -12.708 -2.014 -16.664 52 H VAL 8 H VAL 8 -14.770 -2.395 -13.434 53 HA VAL 8 HA VAL 8 -15.366 -3.527 -10.808 54 HB VAL 8 HB VAL 8 -17.352 -4.504 -11.898 55 HG11 VAL 8 HG11 VAL 8 -17.133 -2.066 -10.994 56 HG12 VAL 8 HG12 VAL 8 -17.328 -1.626 -12.692 57 HG13 VAL 8 HG13 VAL 8 -18.582 -2.556 -11.871 58 HG21 VAL 8 HG21 VAL 8 -17.246 -4.862 -14.096 59 HG22 VAL 8 HG22 VAL 8 -17.564 -3.140 -14.298 60 HG23 VAL 8 HG23 VAL 8 -15.904 -3.735 -14.290 61 H ARG 9 H ARG 9 -15.942 -5.908 -10.783 62 HA ARG 9 HA ARG 9 -14.242 -7.487 -12.576 63 HB2 ARG 9 HB2 ARG 9 -14.266 -7.783 -9.567 64 HB3 ARG 9 HB3 ARG 9 -13.361 -8.780 -10.698 65 HG2 ARG 9 HG2 ARG 9 -11.926 -6.985 -11.272 66 HG3 ARG 9 HG3 ARG 9 -12.952 -5.815 -10.440 67 HD2 ARG 9 HD2 ARG 9 -12.467 -7.138 -8.321 68 HD3 ARG 9 HD3 ARG 9 -11.204 -7.949 -9.246 69 HE ARG 9 HE ARG 9 -10.755 -5.256 -9.580 70 HH11 ARG 9 HH11 ARG 9 -10.942 -7.468 -6.898 71 HH12 ARG 9 HH12 ARG 9 -9.827 -6.576 -5.916 72 HH21 ARG 9 HH21 ARG 9 -9.286 -4.073 -8.297 73 HH22 ARG 9 HH22 ARG 9 -8.887 -4.645 -6.713 74 H ALA 10 H ALA 10 -14.874 -9.661 -12.830 75 HA ALA 10 HA ALA 10 -17.666 -10.160 -12.064 76 HB1 ALA 10 HB1 ALA 10 -16.709 -12.056 -13.971 77 HB2 ALA 10 HB2 ALA 10 -17.969 -10.835 -14.154 78 HB3 ALA 10 HB3 ALA 10 -16.290 -10.430 -14.511 79 H ARG 11 H ARG 11 -18.234 -11.877 -10.847 80 HA ARG 11 HA ARG 11 -16.066 -13.658 -9.952 81 HB2 ARG 11 HB2 ARG 11 -17.154 -12.141 -8.242 82 HB3 ARG 11 HB3 ARG 11 -18.629 -13.070 -8.473 83 HG2 ARG 11 HG2 ARG 11 -17.381 -15.109 -7.798 84 HG3 ARG 11 HG3 ARG 11 -15.995 -14.081 -7.430 85 HD2 ARG 11 HD2 ARG 11 -16.983 -13.174 -5.582 86 HD3 ARG 11 HD3 ARG 11 -18.612 -13.359 -6.230 87 HE ARG 11 HE ARG 11 -17.230 -15.192 -4.558 88 HH11 ARG 11 HH11 ARG 11 -19.485 -15.014 -7.204 89 HH12 ARG 11 HH12 ARG 11 -20.241 -16.528 -6.833 90 HH21 ARG 11 HH21 ARG 11 -18.217 -17.187 -4.059 91 HH22 ARG 11 HH22 ARG 11 -19.519 -17.763 -5.043 92 H ILE 12 H ILE 12 -16.194 -15.469 -11.134 93 HA ILE 12 HA ILE 12 -18.840 -16.658 -11.609 94 HB ILE 12 HB ILE 12 -16.206 -17.254 -12.962 95 HG12 ILE 12 HG12 ILE 12 -18.662 -15.928 -14.117 96 HG13 ILE 12 HG13 ILE 12 -17.299 -15.026 -13.464 97 HG21 ILE 12 HG21 ILE 12 -18.969 -18.376 -13.350 98 HG22 ILE 12 HG22 ILE 12 -17.701 -18.507 -14.567 99 HG23 ILE 12 HG23 ILE 12 -17.480 -19.246 -12.981 100 HD11 ILE 12 HD11 ILE 12 -17.077 -15.133 -15.833 101 HD12 ILE 12 HD12 ILE 12 -15.841 -16.170 -15.120 102 HD13 ILE 12 HD13 ILE 12 -17.290 -16.884 -15.827 103 H TYR 13 H TYR 13 -19.379 -18.602 -10.788 104 HA TYR 13 HA TYR 13 -17.292 -20.157 -9.416 105 HB2 TYR 13 HB2 TYR 13 -18.449 -19.003 -7.665 106 HB3 TYR 13 HB3 TYR 13 -20.018 -19.401 -8.356 107 HD1 TYR 13 HD2 TYR 13 -16.957 -21.269 -7.274 108 HD2 TYR 13 HD1 TYR 13 -21.203 -20.999 -7.205 109 HE1 TYR 13 HE2 TYR 13 -17.057 -23.286 -5.871 110 HE2 TYR 13 HE1 TYR 13 -21.314 -23.015 -5.801 111 HH TYR 13 HH TYR 13 -19.933 -24.291 -4.299 112 H LYS 14 H LYS 14 -17.341 -22.300 -9.766 113 HA LYS 14 HA LYS 14 -19.359 -23.318 -11.606 114 HB2 LYS 14 HB2 LYS 14 -17.880 -25.123 -12.029 115 HB3 LYS 14 HB3 LYS 14 -16.875 -23.683 -11.937 116 HG2 LYS 14 HG2 LYS 14 -16.423 -24.300 -9.534 117 HG3 LYS 14 HG3 LYS 14 -17.195 -25.849 -9.880 118 HD2 LYS 14 HD2 LYS 14 -15.501 -25.824 -11.915 119 HD3 LYS 14 HD3 LYS 14 -14.598 -24.757 -10.836 120 HE2 LYS 14 HE2 LYS 14 -14.597 -26.449 -9.108 121 HE3 LYS 14 HE3 LYS 14 -15.613 -27.499 -10.094 122 HZ1 LYS 14 HZ1 LYS 14 -13.889 -28.030 -11.472 123 HZ2 LYS 14 HZ2 LYS 14 -13.039 -27.817 -10.026 124 HZ3 LYS 14 HZ3 LYS 14 -13.048 -26.589 -11.189 125 HA PRO 15 HA PRO 15 -21.651 -25.591 -8.629 126 HB2 PRO 15 HB2 PRO 15 -22.416 -27.740 -10.100 127 HB3 PRO 15 HB3 PRO 15 -23.097 -26.126 -10.332 128 HG2 PRO 15 HG2 PRO 15 -20.954 -27.520 -11.890 129 HG3 PRO 15 HG3 PRO 15 -22.315 -26.549 -12.481 130 HD2 PRO 15 HD2 PRO 15 -19.800 -25.565 -12.285 131 HD3 PRO 15 HD3 PRO 15 -21.241 -24.555 -12.053 132 H ALA 16 H ALA 16 -21.965 -28.115 -8.048 133 HA ALA 16 HA ALA 16 -19.265 -29.061 -7.399 134 HB1 ALA 16 HB1 ALA 16 -21.942 -29.568 -6.125 135 HB2 ALA 16 HB2 ALA 16 -20.488 -30.473 -5.699 136 HB3 ALA 16 HB3 ALA 16 -20.549 -28.729 -5.441 137 H LYS 17 H LYS 17 -18.593 -31.136 -7.837 138 HA LYS 17 HA LYS 17 -19.663 -32.394 -10.124 139 HB2 LYS 17 HB2 LYS 17 -17.266 -32.487 -9.218 140 HB3 LYS 17 HB3 LYS 17 -17.850 -33.737 -8.129 141 HG2 LYS 17 HG2 LYS 17 -18.698 -34.896 -10.269 142 HG3 LYS 17 HG3 LYS 17 -17.592 -33.804 -11.107 143 HD2 LYS 17 HD2 LYS 17 -15.729 -34.651 -9.792 144 HD3 LYS 17 HD3 LYS 17 -16.823 -35.700 -8.888 145 HE2 LYS 17 HE2 LYS 17 -17.439 -36.547 -11.314 146 HE3 LYS 17 HE3 LYS 17 -15.827 -35.936 -11.683 147 HZ1 LYS 17 HZ1 LYS 17 -14.952 -37.741 -10.784 148 HZ2 LYS 17 HZ2 LYS 17 -16.500 -38.363 -10.506 149 HZ3 LYS 17 HZ3 LYS 17 -15.730 -37.446 -9.311 150 H SER 18 H SER 18 -21.475 -33.529 -10.239 151 HA SER 18 HA SER 18 -22.030 -35.589 -8.276 152 HB2 SER 18 HB2 SER 18 -23.169 -33.775 -7.203 153 HB3 SER 18 HB3 SER 18 -23.889 -33.247 -8.724 154 HG SER 18 HG SER 18 -24.775 -35.092 -6.966 155 H THR 19 H THR 19 -23.655 -37.092 -8.972 156 HA THR 19 HA THR 19 -23.522 -37.733 -11.692 157 HB THR 19 HB THR 19 -25.367 -39.351 -11.210 158 HG1 THR 19 HG1 THR 19 -26.603 -38.558 -9.634 159 HG21 THR 19 HG21 THR 19 -23.362 -39.498 -8.986 160 HG22 THR 19 HG22 THR 19 -22.852 -39.665 -10.666 161 HG23 THR 19 HG23 THR 19 -24.018 -40.797 -9.981 162 H MET 20 H MET 20 -24.417 -36.687 -13.337 163 HA MET 20 HA MET 20 -26.489 -34.791 -13.074 164 HB2 MET 20 HB2 MET 20 -26.428 -34.618 -15.469 165 HB3 MET 20 HB3 MET 20 -24.778 -34.812 -14.892 166 HG2 MET 20 HG2 MET 20 -25.190 -37.331 -15.366 167 HG3 MET 20 HG3 MET 20 -26.500 -36.736 -16.383 168 HE1 MET 20 HE1 MET 20 -24.217 -37.466 -19.244 169 HE2 MET 20 HE2 MET 20 -23.822 -38.407 -17.806 170 HE3 MET 20 HE3 MET 20 -25.505 -38.032 -18.180 171 H GLN 21 H GLN 21 -28.454 -34.999 -14.692 172 HA GLN 21 HA GLN 21 -30.541 -35.877 -14.940 173 HB2 GLN 21 HB2 GLN 21 -28.870 -38.367 -15.299 174 HB3 GLN 21 HB3 GLN 21 -30.596 -38.293 -15.631 175 HG2 GLN 21 HG2 GLN 21 -28.544 -36.547 -16.967 176 HG3 GLN 21 HG3 GLN 21 -29.148 -38.063 -17.634 177 HE21 GLN 21 HE21 GLN 21 -31.615 -38.165 -17.696 178 HE22 GLN 21 HE22 GLN 21 -32.413 -36.754 -18.293 179 H SER 22 H SER 22 -29.509 -35.674 -12.236 180 HA SER 22 HA SER 22 -30.670 -37.995 -10.889 181 HB2 SER 22 HB2 SER 22 -29.745 -36.935 -8.821 182 HB3 SER 22 HB3 SER 22 -28.518 -37.285 -10.039 183 HG SER 22 HG SER 22 -29.511 -34.833 -9.155 184 H GLY 23 H GLY 23 -32.519 -36.444 -12.259 185 HA2 GLY 23 HA2 GLY 23 -34.640 -35.625 -11.879 186 HA3 GLY 23 HA3 GLY 23 -34.354 -35.832 -10.158 187 H HIS 24 H HIS 24 -34.363 -33.635 -12.811 188 HA HIS 24 HA HIS 24 -34.096 -31.409 -10.946 189 HB2 HIS 24 HB2 HIS 24 -32.282 -31.924 -13.280 190 HB3 HIS 24 HB3 HIS 24 -32.621 -30.273 -12.771 191 HD1 HIS 24 HD1 HIS 24 -30.225 -32.826 -12.275 192 HD2 HIS 24 HD2 HIS 24 -32.068 -30.063 -9.779 193 HE1 HIS 24 HE1 HIS 24 -28.739 -32.649 -10.254 194 H SER 25 H SER 25 -35.245 -29.597 -11.524 195 HA SER 25 HA SER 25 -36.671 -29.686 -14.096 196 HB2 SER 25 HB2 SER 25 -38.100 -30.450 -12.143 197 HB3 SER 25 HB3 SER 25 -37.963 -28.810 -11.508 198 HG SER 25 HG SER 25 -39.747 -29.622 -13.167 199 H LYS 26 H LYS 26 -34.310 -28.186 -13.127 200 HA LYS 26 HA LYS 26 -35.276 -25.523 -13.847 201 HB2 LYS 26 HB2 LYS 26 -33.695 -26.187 -11.368 202 HB3 LYS 26 HB3 LYS 26 -33.700 -24.574 -12.069 203 HG2 LYS 26 HG2 LYS 26 -36.230 -25.995 -11.303 204 HG3 LYS 26 HG3 LYS 26 -35.312 -25.007 -10.164 205 HD2 LYS 26 HD2 LYS 26 -35.765 -23.045 -11.299 206 HD3 LYS 26 HD3 LYS 26 -36.069 -23.877 -12.826 207 HE2 LYS 26 HE2 LYS 26 -38.135 -22.998 -11.861 208 HE3 LYS 26 HE3 LYS 26 -38.162 -24.759 -11.942 209 HZ1 LYS 26 HZ1 LYS 26 -38.048 -24.960 -9.690 210 HZ2 LYS 26 HZ2 LYS 26 -38.885 -23.493 -9.785 211 HZ3 LYS 26 HZ3 LYS 26 -37.223 -23.499 -9.470 212 H LEU 27 H LEU 27 -33.328 -24.021 -14.212 213 HA LEU 27 HA LEU 27 -31.113 -25.552 -15.408 214 HB2 LEU 27 HB2 LEU 27 -32.617 -23.200 -16.525 215 HB3 LEU 27 HB3 LEU 27 -31.033 -23.687 -17.125 216 HG LEU 27 HG LEU 27 -33.545 -25.359 -17.202 217 HD11 LEU 27 HD11 LEU 27 -33.374 -25.033 -19.635 218 HD12 LEU 27 HD12 LEU 27 -32.042 -23.908 -19.375 219 HD13 LEU 27 HD13 LEU 27 -33.652 -23.521 -18.770 220 HD21 LEU 27 HD21 LEU 27 -31.882 -26.944 -17.089 221 HD22 LEU 27 HD22 LEU 27 -30.691 -25.909 -17.878 222 HD23 LEU 27 HD23 LEU 27 -31.971 -26.665 -18.828 223 H LYS 28 H LYS 28 -29.746 -25.189 -13.664 224 HA LYS 28 HA LYS 28 -28.388 -22.663 -13.689 225 HB2 LYS 28 HB2 LYS 28 -30.338 -22.243 -12.166 226 HB3 LYS 28 HB3 LYS 28 -29.711 -23.496 -11.103 227 HG2 LYS 28 HG2 LYS 28 -27.662 -22.204 -10.785 228 HG3 LYS 28 HG3 LYS 28 -28.293 -20.946 -11.850 229 HD2 LYS 28 HD2 LYS 28 -29.543 -21.841 -9.252 230 HD3 LYS 28 HD3 LYS 28 -28.592 -20.372 -9.483 231 HE2 LYS 28 HE2 LYS 28 -30.353 -19.916 -11.377 232 HE3 LYS 28 HE3 LYS 28 -31.340 -21.033 -10.437 233 HZ1 LYS 28 HZ1 LYS 28 -31.052 -18.354 -9.985 234 HZ2 LYS 28 HZ2 LYS 28 -30.089 -19.066 -8.791 235 HZ3 LYS 28 HZ3 LYS 28 -31.724 -19.480 -8.916 236 H ALA 29 H ALA 29 -26.321 -23.215 -13.623 237 HA ALA 29 HA ALA 29 -25.472 -25.329 -11.766 238 HB1 ALA 29 HB1 ALA 29 -25.470 -25.531 -14.592 239 HB2 ALA 29 HB2 ALA 29 -23.792 -25.421 -14.056 240 HB3 ALA 29 HB3 ALA 29 -24.844 -26.679 -13.408 241 H TRP 30 H TRP 30 -24.534 -22.578 -13.780 242 HA TRP 30 HA TRP 30 -22.154 -22.194 -12.101 243 HB2 TRP 30 HB2 TRP 30 -22.886 -21.232 -14.859 244 HB3 TRP 30 HB3 TRP 30 -21.578 -20.489 -13.943 245 HD1 TRP 30 HD1 TRP 30 -22.557 -23.904 -15.458 246 HE1 TRP 30 HE1 TRP 30 -20.395 -25.219 -15.931 247 HE3 TRP 30 HE3 TRP 30 -19.174 -20.674 -13.395 248 HZ2 TRP 30 HZ2 TRP 30 -17.623 -24.926 -15.487 249 HZ3 TRP 30 HZ3 TRP 30 -16.787 -21.266 -13.459 250 HH2 TRP 30 HH2 TRP 30 -16.030 -23.349 -14.484 251 H LYS 31 H LYS 31 -21.675 -20.121 -11.242 252 HA LYS 31 HA LYS 31 -24.031 -18.371 -10.963 253 HB2 LYS 31 HB2 LYS 31 -21.870 -18.714 -8.886 254 HB3 LYS 31 HB3 LYS 31 -23.424 -17.911 -8.702 255 HG2 LYS 31 HG2 LYS 31 -23.049 -20.861 -9.172 256 HG3 LYS 31 HG3 LYS 31 -23.346 -20.107 -7.604 257 HD2 LYS 31 HD2 LYS 31 -25.415 -19.079 -8.885 258 HD3 LYS 31 HD3 LYS 31 -25.188 -20.498 -9.911 259 HE2 LYS 31 HE2 LYS 31 -25.242 -20.818 -6.943 260 HE3 LYS 31 HE3 LYS 31 -26.757 -20.606 -7.819 261 HZ1 LYS 31 HZ1 LYS 31 -24.927 -22.576 -8.914 262 HZ2 LYS 31 HZ2 LYS 31 -26.608 -22.637 -8.742 263 HZ3 LYS 31 HZ3 LYS 31 -25.610 -22.969 -7.417 264 H LEU 32 H LEU 32 -23.702 -16.147 -10.969 265 HA LEU 32 HA LEU 32 -20.984 -15.207 -11.557 266 HB2 LEU 32 HB2 LEU 32 -22.260 -15.518 -13.663 267 HB3 LEU 32 HB3 LEU 32 -23.448 -14.360 -13.072 268 HG LEU 32 HG LEU 32 -21.721 -13.530 -14.755 269 HD11 LEU 32 HD11 LEU 32 -22.384 -11.541 -14.039 270 HD12 LEU 32 HD12 LEU 32 -21.344 -11.659 -12.621 271 HD13 LEU 32 HD13 LEU 32 -22.984 -12.305 -12.567 272 HD21 LEU 32 HD21 LEU 32 -19.537 -13.325 -14.213 273 HD22 LEU 32 HD22 LEU 32 -19.904 -14.690 -13.156 274 HD23 LEU 32 HD23 LEU 32 -19.873 -13.051 -12.503 275 H GLU 33 H GLU 33 -20.443 -13.299 -10.635 276 HA GLU 33 HA GLU 33 -22.513 -11.543 -9.588 277 HB2 GLU 33 HB2 GLU 33 -21.702 -13.395 -7.875 278 HB3 GLU 33 HB3 GLU 33 -20.352 -12.288 -7.671 279 HG2 GLU 33 HG2 GLU 33 -23.260 -11.618 -7.278 280 HG3 GLU 33 HG3 GLU 33 -22.076 -11.904 -6.003 281 H PHE 34 H PHE 34 -21.926 -9.719 -10.584 282 HA PHE 34 HA PHE 34 -19.092 -9.019 -10.761 283 HB2 PHE 34 HB2 PHE 34 -19.715 -7.426 -12.433 284 HB3 PHE 34 HB3 PHE 34 -20.587 -8.914 -12.788 285 HD1 PHE 34 HD2 PHE 34 -23.006 -9.083 -12.190 286 HD2 PHE 34 HD1 PHE 34 -20.852 -5.417 -11.984 287 HE1 PHE 34 HE2 PHE 34 -25.129 -7.840 -12.184 288 HE2 PHE 34 HE1 PHE 34 -22.972 -4.168 -11.977 289 HZ PHE 34 HZ PHE 34 -25.114 -5.379 -12.079 290 H GLU 35 H GLU 35 -18.214 -7.219 -9.827 291 HA GLU 35 HA GLU 35 -19.405 -6.232 -7.469 292 HB2 GLU 35 HB2 GLU 35 -16.960 -5.564 -9.046 293 HB3 GLU 35 HB3 GLU 35 -17.492 -4.435 -7.808 294 HG2 GLU 35 HG2 GLU 35 -16.907 -7.350 -7.346 295 HG3 GLU 35 HG3 GLU 35 -15.798 -6.024 -7.004 296 HA PRO 36 HA PRO 36 -21.804 -2.787 -8.738 297 HB2 PRO 36 HB2 PRO 36 -21.260 -0.955 -6.809 298 HB3 PRO 36 HB3 PRO 36 -22.242 -2.396 -6.517 299 HG2 PRO 36 HG2 PRO 36 -19.353 -1.914 -5.897 300 HG3 PRO 36 HG3 PRO 36 -20.597 -2.691 -4.900 301 HD2 PRO 36 HD2 PRO 36 -18.773 -4.105 -6.315 302 HD3 PRO 36 HD3 PRO 36 -20.419 -4.698 -6.018 303 H SER 37 H SER 37 -21.718 -0.915 -9.928 304 HA SER 37 HA SER 37 -19.025 0.165 -10.441 305 HB2 SER 37 HB2 SER 37 -20.218 0.948 -12.641 306 HB3 SER 37 HB3 SER 37 -19.677 -0.723 -12.488 307 HG SER 37 HG SER 37 -21.782 -0.737 -13.223 308 H CYS 38 H CYS 38 -22.315 1.347 -11.102 309 HA CYS 38 HA CYS 38 -22.259 3.428 -9.197 310 HB2 CYS 38 HB2 CYS 38 -20.520 4.097 -11.056 311 HB3 CYS 38 HB3 CYS 38 -21.963 4.545 -11.957 312 HG CYS 38 HG CYS 38 -20.666 6.766 -10.653 313 H THR 39 H THR 39 -24.221 4.464 -9.044 314 HA THR 39 HA THR 39 -26.475 4.707 -9.268 315 HB THR 39 HB THR 39 -26.093 4.394 -12.240 316 HG1 THR 39 HG1 THR 39 -25.067 6.260 -12.301 317 HG21 THR 39 HG21 THR 39 -28.309 4.808 -12.051 318 HG22 THR 39 HG22 THR 39 -27.774 6.478 -11.860 319 HG23 THR 39 HG23 THR 39 -28.147 5.503 -10.439 320 H GLN 40 H GLN 40 -25.763 2.152 -8.623 321 HA GLN 40 HA GLN 40 -26.604 0.082 -10.257 322 HB2 GLN 40 HB2 GLN 40 -26.645 0.393 -7.262 323 HB3 GLN 40 HB3 GLN 40 -27.140 -1.098 -8.050 324 HG2 GLN 40 HG2 GLN 40 -24.961 -1.394 -8.996 325 HG3 GLN 40 HG3 GLN 40 -24.447 0.188 -8.414 326 HE21 GLN 40 HE21 GLN 40 -23.962 0.464 -6.248 327 HE22 GLN 40 HE22 GLN 40 -23.724 -0.867 -5.174 328 H TYR 41 H TYR 41 -28.553 -1.128 -10.361 329 HA TYR 41 HA TYR 41 -30.931 0.548 -10.017 330 HB2 TYR 41 HB2 TYR 41 -30.216 -1.729 -11.812 331 HB3 TYR 41 HB3 TYR 41 -31.913 -1.466 -11.427 332 HD1 TYR 41 HD2 TYR 41 -33.068 0.539 -12.199 333 HD2 TYR 41 HD1 TYR 41 -28.987 -0.155 -13.182 334 HE1 TYR 41 HE2 TYR 41 -33.198 2.272 -13.940 335 HE2 TYR 41 HE1 TYR 41 -29.105 1.577 -14.924 336 HH TYR 41 HH TYR 41 -32.127 3.335 -15.564 337 H THR 42 H THR 42 -32.994 -0.857 -9.622 338 HA THR 42 HA THR 42 -32.557 -2.212 -7.088 339 HB THR 42 HB THR 42 -34.364 -0.508 -7.339 340 HG1 THR 42 HG1 THR 42 -35.746 -1.666 -6.053 341 HG21 THR 42 HG21 THR 42 -34.950 -1.810 -9.678 342 HG22 THR 42 HG22 THR 42 -36.008 -0.660 -8.862 343 HG23 THR 42 HG23 THR 42 -36.216 -2.391 -8.598 344 H GLU 43 H GLU 43 -33.403 -4.288 -6.597 345 HA GLU 43 HA GLU 43 -32.837 -6.296 -8.401 346 HB2 GLU 43 HB2 GLU 43 -34.344 -7.728 -6.901 347 HB3 GLU 43 HB3 GLU 43 -32.968 -6.933 -6.148 348 HG2 GLU 43 HG2 GLU 43 -34.321 -5.328 -5.109 349 HG3 GLU 43 HG3 GLU 43 -35.703 -5.708 -6.135 350 HA PRO 44 HA PRO 44 -36.204 -6.648 -11.191 351 HB2 PRO 44 HB2 PRO 44 -36.358 -9.337 -11.532 352 HB3 PRO 44 HB3 PRO 44 -35.047 -8.358 -12.199 353 HG2 PRO 44 HG2 PRO 44 -35.089 -10.027 -9.714 354 HG3 PRO 44 HG3 PRO 44 -33.818 -9.879 -10.941 355 HD2 PRO 44 HD2 PRO 44 -33.712 -8.577 -8.570 356 HD3 PRO 44 HD3 PRO 44 -33.023 -7.903 -10.061 357 H LEU 45 H LEU 45 -38.351 -7.703 -11.524 358 HA LEU 45 HA LEU 45 -39.781 -7.780 -9.003 359 HB2 LEU 45 HB2 LEU 45 -40.580 -6.499 -10.995 360 HB3 LEU 45 HB3 LEU 45 -40.873 -8.040 -11.799 361 HG LEU 45 HG LEU 45 -42.519 -8.601 -10.039 362 HD11 LEU 45 HD11 LEU 45 -41.784 -7.352 -8.176 363 HD12 LEU 45 HD12 LEU 45 -43.333 -6.655 -8.649 364 HD13 LEU 45 HD13 LEU 45 -41.831 -5.837 -9.077 365 HD21 LEU 45 HD21 LEU 45 -43.667 -7.828 -11.836 366 HD22 LEU 45 HD22 LEU 45 -42.781 -6.303 -11.888 367 HD23 LEU 45 HD23 LEU 45 -44.068 -6.536 -10.704 368 H MET 46 H MET 46 -39.883 -9.643 -7.938 369 HA MET 46 HA MET 46 -40.558 -12.071 -9.447 370 HB2 MET 46 HB2 MET 46 -38.075 -11.833 -8.656 371 HB3 MET 46 HB3 MET 46 -38.733 -12.235 -7.076 372 HG2 MET 46 HG2 MET 46 -37.948 -14.243 -8.060 373 HG3 MET 46 HG3 MET 46 -39.709 -14.292 -8.085 374 HE1 MET 46 HE1 MET 46 -37.680 -15.981 -9.355 375 HE2 MET 46 HE2 MET 46 -38.669 -16.423 -10.747 376 HE3 MET 46 HE3 MET 46 -37.117 -15.619 -10.987 377 H ASN 47 H ASN 47 -41.926 -13.508 -8.416 378 HA ASN 47 HA ASN 47 -42.682 -13.132 -5.662 379 HB2 ASN 47 HB2 ASN 47 -45.092 -12.742 -6.185 380 HB3 ASN 47 HB3 ASN 47 -44.051 -11.394 -6.633 381 HD21 ASN 47 HD21 ASN 47 -43.657 -10.976 -8.810 382 HD22 ASN 47 HD22 ASN 47 -44.658 -11.625 -10.060 383 H TRP 48 H TRP 48 -43.730 -14.905 -4.802 384 HA TRP 48 HA TRP 48 -44.533 -17.055 -6.614 385 HB2 TRP 48 HB2 TRP 48 -42.300 -17.172 -4.630 386 HB3 TRP 48 HB3 TRP 48 -43.286 -18.610 -4.880 387 HD1 TRP 48 HD1 TRP 48 -41.054 -16.192 -6.917 388 HE1 TRP 48 HE1 TRP 48 -40.060 -17.503 -8.896 389 HE3 TRP 48 HE3 TRP 48 -43.486 -20.638 -6.247 390 HZ2 TRP 48 HZ2 TRP 48 -40.278 -20.082 -10.025 391 HZ3 TRP 48 HZ3 TRP 48 -43.038 -22.476 -7.821 392 HH2 TRP 48 HH2 TRP 48 -41.467 -22.201 -9.670 393 H THR 49 H THR 49 -45.663 -18.831 -5.429 394 HA THR 49 HA THR 49 -47.175 -17.716 -3.158 395 HB THR 49 HB THR 49 -49.009 -19.270 -3.842 396 HG1 THR 49 HG1 THR 49 -48.842 -20.399 -5.714 397 HG21 THR 49 HG21 THR 49 -48.464 -17.621 -6.252 398 HG22 THR 49 HG22 THR 49 -48.546 -16.790 -4.698 399 HG23 THR 49 HG23 THR 49 -49.921 -17.737 -5.266 400 H GLY 50 H GLY 50 -46.129 -20.833 -4.549 401 HA2 GLY 50 HA2 GLY 50 -46.630 -22.435 -2.335 402 HA3 GLY 50 HA3 GLY 50 -45.393 -22.760 -3.541 403 H SER 51 H SER 51 -43.704 -20.589 -3.117 404 HA SER 51 HA SER 51 -42.899 -20.844 -0.304 405 HB2 SER 51 HB2 SER 51 -40.586 -21.238 -0.923 406 HB3 SER 51 HB3 SER 51 -41.599 -22.462 -1.688 407 HG SER 51 HG SER 51 -39.883 -21.088 -2.927 408 H HIS 52 H HIS 52 -42.322 -18.973 0.608 409 HA HIS 52 HA HIS 52 -42.741 -16.513 -0.572 410 HB2 HIS 52 HB2 HIS 52 -41.516 -15.548 1.328 411 HB3 HIS 52 HB3 HIS 52 -42.611 -16.824 1.853 412 HD1 HIS 52 HD1 HIS 52 -41.532 -19.036 2.699 413 HD2 HIS 52 HD2 HIS 52 -38.810 -16.044 1.748 414 HE1 HIS 52 HE1 HIS 52 -39.343 -19.777 3.691 415 H ASP 53 H ASP 53 -41.576 -15.132 -1.784 416 HA ASP 53 HA ASP 53 -39.232 -16.080 -3.098 417 HB2 ASP 53 HB2 ASP 53 -40.979 -14.558 -4.105 418 HB3 ASP 53 HB3 ASP 53 -40.309 -13.257 -3.125 419 H THR 54 H THR 54 -37.116 -15.411 -2.922 420 HA THR 54 HA THR 54 -36.416 -14.186 -0.364 421 HB THR 54 HB THR 54 -35.281 -16.269 -0.884 422 HG1 THR 54 HG1 THR 54 -33.400 -15.524 -0.177 423 HG21 THR 54 HG21 THR 54 -35.334 -16.286 -3.279 424 HG22 THR 54 HG22 THR 54 -33.642 -16.323 -2.782 425 HG23 THR 54 HG23 THR 54 -34.357 -14.820 -3.364 426 H LYS 55 H LYS 55 -34.708 -12.571 -0.266 427 HA LYS 55 HA LYS 55 -35.065 -10.562 -2.326 428 HB2 LYS 55 HB2 LYS 55 -33.851 -10.600 0.413 429 HB3 LYS 55 HB3 LYS 55 -33.465 -9.286 -0.691 430 HG2 LYS 55 HG2 LYS 55 -35.246 -8.351 0.339 431 HG3 LYS 55 HG3 LYS 55 -36.112 -9.227 -0.925 432 HD2 LYS 55 HD2 LYS 55 -37.296 -9.847 0.952 433 HD3 LYS 55 HD3 LYS 55 -36.125 -11.163 0.832 434 HE2 LYS 55 HE2 LYS 55 -34.682 -9.966 2.448 435 HE3 LYS 55 HE3 LYS 55 -35.933 -8.735 2.613 436 HZ1 LYS 55 HZ1 LYS 55 -37.397 -10.276 3.588 437 HZ2 LYS 55 HZ2 LYS 55 -35.910 -10.528 4.353 438 HZ3 LYS 55 HZ3 LYS 55 -36.438 -11.602 3.158 439 H GLN 56 H GLN 56 -33.867 -10.822 -4.107 440 HA GLN 56 HA GLN 56 -31.402 -12.159 -4.241 441 HB2 GLN 56 HB2 GLN 56 -32.818 -10.252 -6.081 442 HB3 GLN 56 HB3 GLN 56 -31.211 -10.854 -6.468 443 HG2 GLN 56 HG2 GLN 56 -31.943 -12.975 -6.859 444 HG3 GLN 56 HG3 GLN 56 -33.307 -12.828 -5.752 445 HE21 GLN 56 HE21 GLN 56 -35.153 -12.980 -6.784 446 HE22 GLN 56 HE22 GLN 56 -35.515 -12.318 -8.338 447 H GLN 57 H GLN 57 -29.303 -11.252 -4.806 448 HA GLN 57 HA GLN 57 -28.862 -8.604 -3.591 449 HB2 GLN 57 HB2 GLN 57 -26.709 -9.407 -2.760 450 HB3 GLN 57 HB3 GLN 57 -28.026 -10.389 -2.134 451 HG2 GLN 57 HG2 GLN 57 -27.506 -12.181 -3.578 452 HG3 GLN 57 HG3 GLN 57 -26.414 -11.184 -4.538 453 HE21 GLN 57 HE21 GLN 57 -26.873 -12.709 -1.409 454 HE22 GLN 57 HE22 GLN 57 -25.197 -12.808 -1.002 455 H VAL 58 H VAL 58 -29.372 -8.911 -6.309 456 HA VAL 58 HA VAL 58 -28.584 -8.206 -8.326 457 HB VAL 58 HB VAL 58 -25.972 -7.476 -7.029 458 HG11 VAL 58 HG11 VAL 58 -27.416 -6.810 -9.510 459 HG12 VAL 58 HG12 VAL 58 -26.602 -5.466 -8.707 460 HG13 VAL 58 HG13 VAL 58 -25.684 -6.893 -9.190 461 HG21 VAL 58 HG21 VAL 58 -27.321 -5.181 -6.819 462 HG22 VAL 58 HG22 VAL 58 -28.655 -6.307 -6.576 463 HG23 VAL 58 HG23 VAL 58 -27.248 -6.365 -5.514 464 H CYS 59 H CYS 59 -27.763 -10.872 -6.944 465 HA CYS 59 HA CYS 59 -25.375 -11.587 -8.415 466 HB2 CYS 59 HB2 CYS 59 -26.003 -12.435 -6.080 467 HB3 CYS 59 HB3 CYS 59 -27.162 -13.478 -6.895 468 HG CYS 59 HG CYS 59 -25.484 -15.379 -7.231 469 H LEU 60 H LEU 60 -25.251 -12.959 -10.157 470 HA LEU 60 HA LEU 60 -27.799 -13.481 -11.533 471 HB2 LEU 60 HB2 LEU 60 -25.135 -12.627 -12.416 472 HB3 LEU 60 HB3 LEU 60 -25.871 -13.877 -13.417 473 HG LEU 60 HG LEU 60 -27.152 -11.223 -12.774 474 HD11 LEU 60 HD11 LEU 60 -25.335 -10.668 -14.128 475 HD12 LEU 60 HD12 LEU 60 -26.674 -10.851 -15.261 476 HD13 LEU 60 HD13 LEU 60 -25.482 -12.140 -15.090 477 HD21 LEU 60 HD21 LEU 60 -27.927 -13.565 -14.478 478 HD22 LEU 60 HD22 LEU 60 -28.533 -11.943 -14.816 479 HD23 LEU 60 HD23 LEU 60 -28.880 -12.710 -13.265 480 H SER 61 H SER 61 -28.056 -15.472 -12.682 481 HA SER 61 HA SER 61 -26.304 -17.647 -11.753 482 HB2 SER 61 HB2 SER 61 -29.234 -18.140 -12.123 483 HB3 SER 61 HB3 SER 61 -28.080 -18.982 -11.089 484 HG SER 61 HG SER 61 -29.658 -16.841 -10.535 485 H PHE 62 H PHE 62 -25.406 -18.653 -13.411 486 HA PHE 62 HA PHE 62 -26.834 -18.685 -15.986 487 HB2 PHE 62 HB2 PHE 62 -23.884 -18.701 -15.352 488 HB3 PHE 62 HB3 PHE 62 -24.513 -19.095 -16.949 489 HD1 PHE 62 HD1 PHE 62 -25.654 -17.380 -18.289 490 HD2 PHE 62 HD2 PHE 62 -23.808 -16.457 -14.566 491 HE1 PHE 62 HE1 PHE 62 -25.703 -14.987 -18.862 492 HE2 PHE 62 HE2 PHE 62 -23.855 -14.063 -15.132 493 HZ PHE 62 HZ PHE 62 -24.804 -13.325 -17.282 494 H THR 63 H THR 63 -26.361 -20.595 -17.373 495 HA THR 63 HA THR 63 -26.456 -23.025 -15.734 496 HB THR 63 HB THR 63 -27.129 -22.840 -18.668 497 HG1 THR 63 HG1 THR 63 -28.752 -21.641 -18.011 498 HG21 THR 63 HG21 THR 63 -28.684 -24.759 -17.849 499 HG22 THR 63 HG22 THR 63 -27.582 -24.828 -16.474 500 HG23 THR 63 HG23 THR 63 -26.971 -25.087 -18.108 501 H THR 64 H THR 64 -24.874 -21.688 -18.611 502 HA THR 64 HA THR 64 -22.812 -23.780 -18.347 503 HB THR 64 HB THR 64 -22.426 -22.999 -20.881 504 HG1 THR 64 HG1 THR 64 -24.286 -22.392 -21.854 505 HG21 THR 64 HG21 THR 64 -22.864 -25.303 -19.980 506 HG22 THR 64 HG22 THR 64 -23.547 -24.993 -21.576 507 HG23 THR 64 HG23 THR 64 -24.587 -24.972 -20.153 508 H ARG 65 H ARG 65 -20.694 -23.172 -18.334 509 HA ARG 65 HA ARG 65 -19.950 -20.681 -17.417 510 HB2 ARG 65 HB2 ARG 65 -17.626 -21.332 -18.285 511 HB3 ARG 65 HB3 ARG 65 -18.389 -22.407 -17.122 512 HG2 ARG 65 HG2 ARG 65 -18.323 -24.111 -18.538 513 HG3 ARG 65 HG3 ARG 65 -19.067 -23.156 -19.822 514 HD2 ARG 65 HD2 ARG 65 -17.078 -22.623 -20.764 515 HD3 ARG 65 HD3 ARG 65 -16.243 -22.550 -19.212 516 HE ARG 65 HE ARG 65 -16.992 -25.208 -20.037 517 HH11 ARG 65 HH11 ARG 65 -14.554 -22.726 -20.165 518 HH12 ARG 65 HH12 ARG 65 -13.262 -23.830 -20.500 519 HH21 ARG 65 HH21 ARG 65 -15.299 -26.672 -20.479 520 HH22 ARG 65 HH22 ARG 65 -13.687 -26.074 -20.680 521 H GLU 66 H GLU 66 -20.156 -21.841 -20.739 522 HA GLU 66 HA GLU 66 -18.857 -19.805 -22.081 523 HB2 GLU 66 HB2 GLU 66 -21.197 -21.539 -22.809 524 HB3 GLU 66 HB3 GLU 66 -20.633 -20.294 -23.914 525 HG2 GLU 66 HG2 GLU 66 -18.442 -21.317 -23.998 526 HG3 GLU 66 HG3 GLU 66 -18.941 -22.530 -22.820 527 H LEU 67 H LEU 67 -22.029 -19.819 -20.610 528 HA LEU 67 HA LEU 67 -22.841 -17.327 -21.801 529 HB2 LEU 67 HB2 LEU 67 -24.189 -19.401 -20.691 530 HB3 LEU 67 HB3 LEU 67 -24.207 -18.243 -19.362 531 HG LEU 67 HG LEU 67 -25.299 -16.599 -20.808 532 HD11 LEU 67 HD11 LEU 67 -24.477 -17.138 -22.961 533 HD12 LEU 67 HD12 LEU 67 -26.215 -17.431 -23.002 534 HD13 LEU 67 HD13 LEU 67 -25.095 -18.786 -22.863 535 HD21 LEU 67 HD21 LEU 67 -27.352 -18.288 -21.337 536 HD22 LEU 67 HD22 LEU 67 -27.016 -17.590 -19.752 537 HD23 LEU 67 HD23 LEU 67 -26.450 -19.216 -20.138 538 H ALA 68 H ALA 68 -21.494 -18.394 -18.729 539 HA ALA 68 HA ALA 68 -21.793 -15.949 -17.342 540 HB1 ALA 68 HB1 ALA 68 -20.881 -18.495 -16.728 541 HB2 ALA 68 HB2 ALA 68 -19.471 -17.459 -16.505 542 HB3 ALA 68 HB3 ALA 68 -20.966 -17.113 -15.635 543 H ILE 69 H ILE 69 -18.754 -17.383 -18.546 544 HA ILE 69 HA ILE 69 -17.167 -15.140 -18.311 545 HB ILE 69 HB ILE 69 -17.000 -17.329 -20.383 546 HG12 ILE 69 HG12 ILE 69 -14.952 -17.713 -18.625 547 HG13 ILE 69 HG13 ILE 69 -16.189 -17.053 -17.560 548 HG21 ILE 69 HG21 ILE 69 -14.488 -16.521 -20.230 549 HG22 ILE 69 HG22 ILE 69 -15.630 -15.786 -21.353 550 HG23 ILE 69 HG23 ILE 69 -15.260 -14.988 -19.825 551 HD11 ILE 69 HD11 ILE 69 -16.910 -19.264 -19.415 552 HD12 ILE 69 HD12 ILE 69 -15.993 -19.622 -17.951 553 HD13 ILE 69 HD13 ILE 69 -17.575 -18.851 -17.835 554 H ALA 70 H ALA 70 -19.406 -16.000 -20.872 555 HA ALA 70 HA ALA 70 -18.633 -14.242 -22.869 556 HB1 ALA 70 HB1 ALA 70 -20.281 -15.652 -23.582 557 HB2 ALA 70 HB2 ALA 70 -21.216 -15.494 -22.094 558 HB3 ALA 70 HB3 ALA 70 -21.238 -14.199 -23.291 559 H TYR 71 H TYR 71 -20.514 -13.637 -19.957 560 HA TYR 71 HA TYR 71 -21.412 -11.050 -20.609 561 HB2 TYR 71 HB2 TYR 71 -21.469 -12.790 -18.327 562 HB3 TYR 71 HB3 TYR 71 -21.004 -11.173 -17.810 563 HD1 TYR 71 HD1 TYR 71 -23.350 -12.274 -20.495 564 HD2 TYR 71 HD2 TYR 71 -22.870 -10.249 -16.784 565 HE1 TYR 71 HE1 TYR 71 -25.707 -11.576 -20.578 566 HE2 TYR 71 HE2 TYR 71 -25.226 -9.547 -16.856 567 HH TYR 71 HH TYR 71 -26.996 -9.208 -18.493 568 H ALA 72 H ALA 72 -18.658 -12.066 -18.583 569 HA ALA 72 HA ALA 72 -17.618 -9.507 -18.136 570 HB1 ALA 72 HB1 ALA 72 -16.871 -12.189 -17.558 571 HB2 ALA 72 HB2 ALA 72 -15.465 -11.345 -18.209 572 HB3 ALA 72 HB3 ALA 72 -16.308 -10.698 -16.802 573 H VAL 73 H VAL 73 -16.606 -11.953 -20.527 574 HA VAL 73 HA VAL 73 -14.621 -10.528 -21.805 575 HB VAL 73 HB VAL 73 -16.604 -12.416 -23.084 576 HG11 VAL 73 HG11 VAL 73 -14.719 -12.785 -24.711 577 HG12 VAL 73 HG12 VAL 73 -15.516 -11.214 -24.821 578 HG13 VAL 73 HG13 VAL 73 -13.948 -11.356 -24.025 579 HG21 VAL 73 HG21 VAL 73 -15.144 -14.175 -22.563 580 HG22 VAL 73 HG22 VAL 73 -13.826 -13.078 -22.152 581 HG23 VAL 73 HG23 VAL 73 -15.224 -13.215 -21.085 582 H ALA 74 H ALA 74 -18.086 -10.187 -22.069 583 HA ALA 74 HA ALA 74 -18.362 -8.815 -24.447 584 HB1 ALA 74 HB1 ALA 74 -19.897 -7.994 -22.007 585 HB2 ALA 74 HB2 ALA 74 -20.441 -8.097 -23.682 586 HB3 ALA 74 HB3 ALA 74 -20.149 -9.570 -22.758 587 H HIS 75 H HIS 75 -17.195 -7.653 -21.346 588 HA HIS 75 HA HIS 75 -16.523 -5.092 -22.634 589 HB2 HIS 75 HB2 HIS 75 -17.764 -5.617 -19.960 590 HB3 HIS 75 HB3 HIS 75 -16.719 -4.215 -20.164 591 HD1 HIS 75 HD1 HIS 75 -17.669 -3.456 -23.055 592 HD2 HIS 75 HD2 HIS 75 -20.165 -4.294 -19.841 593 HE1 HIS 75 HE1 HIS 75 -19.847 -2.314 -23.580 594 H LYS 76 H LYS 76 -15.013 -7.632 -22.179 595 HA LYS 76 HA LYS 76 -12.956 -8.335 -21.496 596 HB2 LYS 76 HB2 LYS 76 -12.541 -6.164 -22.894 597 HB3 LYS 76 HB3 LYS 76 -12.098 -5.467 -21.341 598 HG2 LYS 76 HG2 LYS 76 -10.214 -6.753 -21.141 599 HG3 LYS 76 HG3 LYS 76 -10.855 -8.044 -22.160 600 HD2 LYS 76 HD2 LYS 76 -10.094 -5.315 -23.192 601 HD3 LYS 76 HD3 LYS 76 -9.003 -6.703 -23.192 602 HE2 LYS 76 HE2 LYS 76 -11.070 -7.847 -24.397 603 HE3 LYS 76 HE3 LYS 76 -11.423 -6.176 -24.836 604 HZ1 LYS 76 HZ1 LYS 76 -9.964 -6.415 -26.468 605 HZ2 LYS 76 HZ2 LYS 76 -9.462 -7.927 -25.901 606 HZ3 LYS 76 HZ3 LYS 76 -8.733 -6.518 -25.312 607 H ILE 77 H ILE 77 -14.796 -8.036 -19.406 608 HA ILE 77 HA ILE 77 -13.483 -6.691 -17.210 609 HB ILE 77 HB ILE 77 -15.899 -8.503 -17.191 610 HG12 ILE 77 HG12 ILE 77 -15.841 -5.492 -17.001 611 HG13 ILE 77 HG13 ILE 77 -16.044 -6.341 -18.530 612 HG21 ILE 77 HG21 ILE 77 -16.262 -7.102 -15.010 613 HG22 ILE 77 HG22 ILE 77 -15.225 -8.528 -14.997 614 HG23 ILE 77 HG23 ILE 77 -14.510 -6.918 -15.084 615 HD11 ILE 77 HD11 ILE 77 -17.892 -7.367 -16.604 616 HD12 ILE 77 HD12 ILE 77 -18.021 -5.610 -16.692 617 HD13 ILE 77 HD13 ILE 77 -18.205 -6.582 -18.152 618 H ASP 78 H ASP 78 -12.402 -7.621 -15.523 619 HA ASP 78 HA ASP 78 -11.149 -10.135 -15.996 620 HB2 ASP 78 HB2 ASP 78 -11.127 -8.677 -13.361 621 HB3 ASP 78 HB3 ASP 78 -9.876 -9.704 -14.055 622 H TYR 79 H TYR 79 -12.403 -11.908 -15.908 623 HA TYR 79 HA TYR 79 -14.263 -12.221 -13.664 624 HB2 TYR 79 HB2 TYR 79 -15.231 -14.066 -14.961 625 HB3 TYR 79 HB3 TYR 79 -15.191 -12.580 -15.904 626 HD1 TYR 79 HD1 TYR 79 -13.646 -12.344 -17.789 627 HD2 TYR 79 HD2 TYR 79 -13.885 -15.971 -15.578 628 HE1 TYR 79 HE1 TYR 79 -12.447 -13.513 -19.590 629 HE2 TYR 79 HE2 TYR 79 -12.686 -17.150 -17.372 630 HH TYR 79 HH TYR 79 -10.956 -16.325 -19.282 631 H THR 80 H THR 80 -13.990 -13.719 -12.111 632 HA THR 80 HA THR 80 -11.582 -15.406 -12.284 633 HB THR 80 HB THR 80 -11.427 -13.842 -10.451 634 HG1 THR 80 HG1 THR 80 -10.565 -15.785 -9.868 635 HG21 THR 80 HG21 THR 80 -13.387 -14.643 -8.626 636 HG22 THR 80 HG22 THR 80 -14.236 -14.440 -10.158 637 HG23 THR 80 HG23 THR 80 -13.299 -13.107 -9.485 638 H VAL 81 H VAL 81 -11.724 -17.572 -12.007 639 HA VAL 81 HA VAL 81 -14.425 -18.699 -11.796 640 HB VAL 81 HB VAL 81 -13.368 -20.802 -12.628 641 HG11 VAL 81 HG11 VAL 81 -12.642 -18.755 -14.640 642 HG12 VAL 81 HG12 VAL 81 -13.664 -20.185 -14.793 643 HG13 VAL 81 HG13 VAL 81 -14.295 -18.727 -14.027 644 HG21 VAL 81 HG21 VAL 81 -11.160 -21.029 -12.631 645 HG22 VAL 81 HG22 VAL 81 -11.018 -19.698 -13.778 646 HG23 VAL 81 HG23 VAL 81 -10.983 -19.375 -12.045 647 H LEU 82 H LEU 82 -15.057 -19.610 -9.962 648 HA LEU 82 HA LEU 82 -13.010 -20.422 -8.013 649 HB2 LEU 82 HB2 LEU 82 -15.886 -19.610 -7.648 650 HB3 LEU 82 HB3 LEU 82 -14.881 -20.264 -6.357 651 HG LEU 82 HG LEU 82 -14.156 -17.756 -7.852 652 HD11 LEU 82 HD11 LEU 82 -16.450 -17.912 -6.470 653 HD12 LEU 82 HD12 LEU 82 -15.452 -16.460 -6.536 654 HD13 LEU 82 HD13 LEU 82 -15.332 -17.550 -5.155 655 HD21 LEU 82 HD21 LEU 82 -12.677 -17.355 -6.054 656 HD22 LEU 82 HD22 LEU 82 -12.442 -19.042 -6.514 657 HD23 LEU 82 HD23 LEU 82 -13.391 -18.641 -5.081 658 H GLN 83 H GLN 83 -12.938 -22.467 -7.243 659 HA GLN 83 HA GLN 83 -14.674 -24.422 -8.546 660 HB2 GLN 83 HB2 GLN 83 -12.205 -24.880 -6.864 661 HB3 GLN 83 HB3 GLN 83 -13.054 -26.087 -7.823 662 HG2 GLN 83 HG2 GLN 83 -12.533 -24.633 -9.837 663 HG3 GLN 83 HG3 GLN 83 -11.424 -23.759 -8.781 664 HE21 GLN 83 HE21 GLN 83 -10.448 -24.958 -10.992 665 HE22 GLN 83 HE22 GLN 83 -9.507 -26.342 -10.565 666 H ASP 84 H ASP 84 -15.820 -26.005 -7.403 667 HA ASP 84 HA ASP 84 -16.967 -25.120 -4.955 668 HB2 ASP 84 HB2 ASP 84 -18.315 -27.118 -5.059 669 HB3 ASP 84 HB3 ASP 84 -18.183 -26.448 -6.683 670 H ASN 85 H ASN 85 -14.460 -27.411 -5.796 671 HA ASN 85 HA ASN 85 -13.937 -27.798 -2.928 672 HB2 ASN 85 HB2 ASN 85 -14.373 -29.840 -5.027 673 HB3 ASN 85 HB3 ASN 85 -13.021 -30.136 -3.938 674 HD21 ASN 85 HD21 ASN 85 -13.923 -31.848 -2.888 675 HD22 ASN 85 HD22 ASN 85 -15.299 -31.712 -1.851 676 HA PRO 86 HA PRO 86 -9.749 -26.781 -3.747 677 HB2 PRO 86 HB2 PRO 86 -8.401 -28.474 -2.107 678 HB3 PRO 86 HB3 PRO 86 -9.332 -27.095 -1.510 679 HG2 PRO 86 HG2 PRO 86 -10.099 -29.986 -1.639 680 HG3 PRO 86 HG3 PRO 86 -10.355 -28.818 -0.329 681 HD2 PRO 86 HD2 PRO 86 -12.311 -29.506 -2.071 682 HD3 PRO 86 HD3 PRO 86 -12.199 -27.887 -1.351 683 H ARG 87 H ARG 87 -7.720 -27.531 -4.633 684 HA ARG 87 HA ARG 87 -8.077 -29.916 -6.305 685 HB2 ARG 87 HB2 ARG 87 -6.789 -27.307 -6.679 686 HB3 ARG 87 HB3 ARG 87 -5.822 -28.663 -7.244 687 HG2 ARG 87 HG2 ARG 87 -8.276 -29.266 -8.265 688 HG3 ARG 87 HG3 ARG 87 -8.261 -27.503 -8.351 689 HD2 ARG 87 HD2 ARG 87 -7.230 -27.906 -10.323 690 HD3 ARG 87 HD3 ARG 87 -5.805 -28.009 -9.290 691 HE ARG 87 HE ARG 87 -6.783 -30.552 -9.344 692 HH11 ARG 87 HH11 ARG 87 -5.820 -28.242 -11.764 693 HH12 ARG 87 HH12 ARG 87 -5.311 -29.447 -12.900 694 HH21 ARG 87 HH21 ARG 87 -6.118 -32.149 -10.831 695 HH22 ARG 87 HH22 ARG 87 -5.482 -31.669 -12.369 696 H THR 88 H THR 88 -7.292 -31.663 -5.295 697 HA THR 88 HA THR 88 -4.913 -31.488 -3.641 698 HB THR 88 HB THR 88 -6.306 -34.061 -4.321 699 HG1 THR 88 HG1 THR 88 -7.119 -32.364 -2.194 700 HG21 THR 88 HG21 THR 88 -4.388 -33.092 -2.328 701 HG22 THR 88 HG22 THR 88 -4.686 -34.730 -2.913 702 HG23 THR 88 HG23 THR 88 -5.709 -34.044 -1.651 703 H ILE 89 H ILE 89 -3.014 -32.705 -3.986 704 HA ILE 89 HA ILE 89 -2.460 -33.197 -6.820 705 HB ILE 89 HB ILE 89 -0.515 -32.989 -4.519 706 HG12 ILE 89 HG12 ILE 89 -0.018 -30.801 -5.983 707 HG13 ILE 89 HG13 ILE 89 -1.733 -30.975 -6.338 708 HG21 ILE 89 HG21 ILE 89 0.997 -32.497 -6.624 709 HG22 ILE 89 HG22 ILE 89 0.684 -34.145 -6.082 710 HG23 ILE 89 HG23 ILE 89 -0.225 -33.475 -7.437 711 HD11 ILE 89 HD11 ILE 89 -2.315 -30.201 -4.342 712 HD12 ILE 89 HD12 ILE 89 -1.158 -31.240 -3.509 713 HD13 ILE 89 HD13 ILE 89 -0.636 -29.691 -4.171 714 H VAL 90 H VAL 90 -1.599 -35.120 -7.572 715 HA VAL 90 HA VAL 90 -2.496 -37.496 -6.480 716 HB VAL 90 HB VAL 90 -0.697 -38.588 -7.925 717 HG11 VAL 90 HG11 VAL 90 -2.846 -36.759 -8.897 718 HG12 VAL 90 HG12 VAL 90 -1.808 -37.580 -10.064 719 HG13 VAL 90 HG13 VAL 90 -2.771 -38.520 -8.924 720 HG21 VAL 90 HG21 VAL 90 -0.287 -35.778 -8.924 721 HG22 VAL 90 HG22 VAL 90 0.814 -36.571 -7.797 722 HG23 VAL 90 HG23 VAL 90 0.571 -37.241 -9.410 723 HA PRO 91 HA PRO 91 0.250 -38.624 -3.247 724 HB2 PRO 91 HB2 PRO 91 0.340 -41.322 -3.535 725 HB3 PRO 91 HB3 PRO 91 -1.079 -40.469 -2.918 726 HG2 PRO 91 HG2 PRO 91 -0.544 -41.508 -5.674 727 HG3 PRO 91 HG3 PRO 91 -2.033 -41.596 -4.714 728 HD2 PRO 91 HD2 PRO 91 -1.672 -39.769 -6.681 729 HD3 PRO 91 HD3 PRO 91 -2.643 -39.434 -5.233 730 H LYS 92 H LYS 92 2.333 -38.048 -3.407 731 HA LYS 92 HA LYS 92 4.033 -38.741 -5.562 732 HB2 LYS 92 HB2 LYS 92 4.163 -36.807 -3.767 733 HB3 LYS 92 HB3 LYS 92 5.146 -37.977 -2.896 734 HG2 LYS 92 HG2 LYS 92 5.745 -37.313 -5.750 735 HG3 LYS 92 HG3 LYS 92 6.300 -36.268 -4.440 736 HD2 LYS 92 HD2 LYS 92 7.383 -38.253 -3.399 737 HD3 LYS 92 HD3 LYS 92 6.932 -39.194 -4.822 738 HE2 LYS 92 HE2 LYS 92 8.607 -36.690 -4.914 739 HE3 LYS 92 HE3 LYS 92 9.276 -38.320 -4.844 740 HZ1 LYS 92 HZ1 LYS 92 9.079 -38.430 -7.031 741 HZ2 LYS 92 HZ2 LYS 92 8.369 -36.896 -7.090 742 HZ3 LYS 92 HZ3 LYS 92 7.400 -38.270 -6.902 743 H SER 93 H SER 93 4.586 -40.789 -5.954 744 HA SER 93 HA SER 93 5.440 -42.459 -3.680 745 HB2 SER 93 HB2 SER 93 4.362 -43.373 -6.359 746 HB3 SER 93 HB3 SER 93 4.808 -44.414 -5.007 747 HG SER 93 HG SER 93 2.832 -44.143 -4.372 748 H TYR 94 H TYR 94 6.865 -44.384 -4.705 749 HA TYR 94 HA TYR 94 8.650 -43.666 -6.793 750 HB2 TYR 94 HB2 TYR 94 10.690 -43.507 -5.268 751 HB3 TYR 94 HB3 TYR 94 9.634 -42.101 -5.319 752 HD1 TYR 94 HD1 TYR 94 8.212 -41.542 -3.404 753 HD2 TYR 94 HD2 TYR 94 10.902 -44.836 -3.266 754 HE1 TYR 94 HE1 TYR 94 7.984 -41.618 -0.956 755 HE2 TYR 94 HE2 TYR 94 10.680 -44.922 -0.818 756 HH TYR 94 HH TYR 94 8.325 -42.996 0.883 757 H ALA 95 H ALA 95 9.655 -45.442 -7.539 758 HA ALA 95 HA ALA 95 9.230 -47.937 -6.097 759 HB1 ALA 95 HB1 ALA 95 9.870 -49.030 -8.173 760 HB2 ALA 95 HB2 ALA 95 8.627 -47.814 -8.469 761 HB3 ALA 95 HB3 ALA 95 10.309 -47.472 -8.875 762 H ASP 96 H ASP 96 11.110 -49.593 -6.456 763 HA ASP 96 HA ASP 96 13.772 -48.559 -6.404 764 HB2 ASP 96 HB2 ASP 96 13.304 -47.874 -4.178 765 HB3 ASP 96 HB3 ASP 96 12.464 -49.379 -3.813 766 H ASN 97 H ASN 97 15.137 -50.105 -7.052 767 HA ASN 97 HA ASN 97 14.481 -52.912 -6.545 768 HB2 ASN 97 HB2 ASN 97 14.821 -53.547 -8.857 769 HB3 ASN 97 HB3 ASN 97 13.565 -52.314 -8.783 770 HD21 ASN 97 HD21 ASN 97 15.859 -53.268 -10.694 771 HD22 ASN 97 HD22 ASN 97 16.482 -51.770 -11.288 772 H PHE 98 H PHE 98 16.262 -54.325 -6.605 773 HA PHE 98 HA PHE 98 18.903 -53.076 -6.892 774 HB2 PHE 98 HB2 PHE 98 19.694 -54.154 -4.850 775 HB3 PHE 98 HB3 PHE 98 18.329 -53.102 -4.492 776 HD1 PHE 98 HD1 PHE 98 19.396 -56.604 -4.875 777 HD2 PHE 98 HD2 PHE 98 16.299 -53.966 -3.621 778 HE1 PHE 98 HE1 PHE 98 18.240 -58.484 -3.786 779 HE2 PHE 98 HE2 PHE 98 15.139 -55.842 -2.530 780 HZ PHE 98 HZ PHE 98 16.110 -58.104 -2.611 781 H THR 99 H THR 99 20.663 -54.673 -7.087 782 HA THR 99 HA THR 99 19.871 -57.362 -7.871 783 HB THR 99 HB THR 99 21.386 -55.601 -9.805 784 HG1 THR 99 HG1 THR 99 19.362 -54.904 -10.082 785 HG21 THR 99 HG21 THR 99 22.068 -57.694 -10.403 786 HG22 THR 99 HG22 THR 99 20.536 -57.658 -11.275 787 HG23 THR 99 HG23 THR 99 20.644 -58.473 -9.716 788 H LYS 100 H LYS 100 21.434 -58.849 -7.505 789 HA LYS 100 HA LYS 100 24.092 -57.841 -6.723 790 HB2 LYS 100 HB2 LYS 100 22.212 -59.596 -5.331 791 HB3 LYS 100 HB3 LYS 100 23.827 -60.281 -5.458 792 HG2 LYS 100 HG2 LYS 100 24.654 -58.885 -3.933 793 HG3 LYS 100 HG3 LYS 100 23.846 -57.487 -4.648 794 HD2 LYS 100 HD2 LYS 100 23.054 -57.877 -2.376 795 HD3 LYS 100 HD3 LYS 100 21.756 -58.139 -3.543 796 HE2 LYS 100 HE2 LYS 100 23.336 -60.528 -2.905 797 HE3 LYS 100 HE3 LYS 100 22.432 -59.862 -1.546 798 HZ1 LYS 100 HZ1 LYS 100 21.436 -61.011 -4.055 799 HZ2 LYS 100 HZ2 LYS 100 20.517 -59.813 -3.294 800 HZ3 LYS 100 HZ3 LYS 100 20.886 -61.244 -2.472 801 HA PRO 101 HA PRO 101 25.973 -60.567 -9.601 802 HB2 PRO 101 HB2 PRO 101 28.153 -61.446 -8.243 803 HB3 PRO 101 HB3 PRO 101 28.007 -59.796 -8.862 804 HG2 PRO 101 HG2 PRO 101 27.539 -60.828 -6.091 805 HG3 PRO 101 HG3 PRO 101 28.376 -59.353 -6.609 806 HD2 PRO 101 HD2 PRO 101 25.827 -59.338 -5.694 807 HD3 PRO 101 HD3 PRO 101 26.407 -58.197 -6.924 808 H ARG 102 H ARG 102 26.749 -62.816 -9.954 809 HA ARG 102 HA ARG 102 25.360 -64.707 -8.170 810 HB2 ARG 102 HB2 ARG 102 24.471 -64.298 -10.579 811 HB3 ARG 102 HB3 ARG 102 25.856 -65.261 -11.077 812 HG2 ARG 102 HG2 ARG 102 24.032 -66.743 -10.938 813 HG3 ARG 102 HG3 ARG 102 25.027 -67.053 -9.513 814 HD2 ARG 102 HD2 ARG 102 22.790 -67.014 -8.754 815 HD3 ARG 102 HD3 ARG 102 23.499 -65.476 -8.262 816 HE ARG 102 HE ARG 102 22.025 -64.396 -9.641 817 HH11 ARG 102 HH11 ARG 102 22.095 -67.777 -10.467 818 HH12 ARG 102 HH12 ARG 102 20.760 -67.670 -11.566 819 HH21 ARG 102 HH21 ARG 102 20.266 -64.242 -11.085 820 HH22 ARG 102 HH22 ARG 102 19.721 -65.658 -11.917 821 H ASP 103 H ASP 103 27.089 -65.321 -6.927 822 HA ASP 103 HA ASP 103 29.647 -65.958 -8.020 823 HB2 ASP 103 HB2 ASP 103 30.240 -66.653 -5.792 824 HB3 ASP 103 HB3 ASP 103 29.262 -65.192 -5.668 825 H MET 104 H MET 104 30.642 -68.013 -8.159 826 HA MET 104 HA MET 104 29.055 -70.021 -9.314 827 HB2 MET 104 HB2 MET 104 31.063 -71.368 -9.357 828 HB3 MET 104 HB3 MET 104 31.473 -69.708 -9.766 829 HG2 MET 104 HG2 MET 104 31.998 -69.515 -7.219 830 HG3 MET 104 HG3 MET 104 32.115 -71.270 -7.314 831 HE1 MET 104 HE1 MET 104 34.353 -68.567 -6.861 832 HE2 MET 104 HE2 MET 104 34.557 -70.205 -6.242 833 HE3 MET 104 HE3 MET 104 35.785 -69.501 -7.295 Start of MODEL 2 1 H1 MET 1 H MET 1 -1.271 -5.939 0.744 2 HA MET 1 HA MET 1 -3.827 -6.631 -0.463 3 HB2 MET 1 HB2 MET 1 -3.051 -5.194 2.068 4 HB3 MET 1 HB3 MET 1 -4.714 -5.248 1.498 5 HG2 MET 1 HG2 MET 1 -4.644 -7.701 1.577 6 HG3 MET 1 HG3 MET 1 -2.998 -7.616 2.202 7 HE1 MET 1 HE1 MET 1 -5.954 -8.830 4.454 8 HE2 MET 1 HE2 MET 1 -6.928 -7.446 3.956 9 HE3 MET 1 HE3 MET 1 -6.117 -8.437 2.743 10 H GLN 2 H GLN 2 -3.380 -5.442 -2.448 11 HA GLN 2 HA GLN 2 -3.927 -2.566 -2.130 12 HB2 GLN 2 HB2 GLN 2 -1.935 -3.968 -3.848 13 HB3 GLN 2 HB3 GLN 2 -2.706 -2.521 -4.485 14 HG2 GLN 2 HG2 GLN 2 -1.717 -1.144 -2.945 15 HG3 GLN 2 HG3 GLN 2 -1.522 -2.432 -1.758 16 HE21 GLN 2 HE21 GLN 2 0.486 -3.037 -1.449 17 HE22 GLN 2 HE22 GLN 2 1.763 -2.983 -2.610 18 H GLU 3 H GLU 3 -6.125 -2.719 -2.447 19 HA GLU 3 HA GLU 3 -7.200 -4.172 -4.698 20 HB2 GLU 3 HB2 GLU 3 -8.348 -2.565 -2.452 21 HB3 GLU 3 HB3 GLU 3 -9.341 -2.879 -3.869 22 HG2 GLU 3 HG2 GLU 3 -9.926 -4.641 -2.550 23 HG3 GLU 3 HG3 GLU 3 -8.599 -5.355 -3.465 24 H GLN 4 H GLN 4 -7.942 -3.357 -6.597 25 HA GLN 4 HA GLN 4 -7.302 -0.542 -7.136 26 HB2 GLN 4 HB2 GLN 4 -6.215 -2.342 -8.516 27 HB3 GLN 4 HB3 GLN 4 -7.809 -2.741 -9.143 28 HG2 GLN 4 HG2 GLN 4 -7.945 -0.844 -10.406 29 HG3 GLN 4 HG3 GLN 4 -6.879 0.072 -9.343 30 HE21 GLN 4 HE21 GLN 4 -5.541 0.789 -10.955 31 HE22 GLN 4 HE22 GLN 4 -4.476 -0.250 -11.832 32 H VAL 5 H VAL 5 -8.757 0.763 -8.334 33 HA VAL 5 HA VAL 5 -11.521 -0.222 -8.491 34 HB VAL 5 HB VAL 5 -12.264 2.079 -7.716 35 HG11 VAL 5 HG11 VAL 5 -12.407 1.393 -5.499 36 HG12 VAL 5 HG12 VAL 5 -12.186 -0.124 -6.373 37 HG13 VAL 5 HG13 VAL 5 -10.824 0.617 -5.534 38 HG21 VAL 5 HG21 VAL 5 -10.822 3.563 -6.746 39 HG22 VAL 5 HG22 VAL 5 -9.672 2.313 -6.275 40 HG23 VAL 5 HG23 VAL 5 -9.748 2.854 -7.952 41 H SER 6 H SER 6 -10.678 -0.378 -10.772 42 HA SER 6 HA SER 6 -10.957 2.220 -12.137 43 HB2 SER 6 HB2 SER 6 -9.581 1.259 -13.962 44 HB3 SER 6 HB3 SER 6 -8.709 1.323 -12.430 45 HG SER 6 HG SER 6 -8.735 -0.724 -13.804 46 H ASN 7 H ASN 7 -11.622 -1.254 -12.350 47 HA ASN 7 HA ASN 7 -14.038 -0.631 -13.884 48 HB2 ASN 7 HB2 ASN 7 -12.213 -2.916 -14.642 49 HB3 ASN 7 HB3 ASN 7 -13.628 -2.335 -15.516 50 HD21 ASN 7 HD21 ASN 7 -13.477 -0.493 -16.764 51 HD22 ASN 7 HD22 ASN 7 -11.962 0.221 -17.188 52 H VAL 8 H VAL 8 -15.549 -2.512 -13.966 53 HA VAL 8 HA VAL 8 -15.955 -3.542 -11.353 54 HB VAL 8 HB VAL 8 -17.865 -4.726 -12.281 55 HG11 VAL 8 HG11 VAL 8 -19.119 -2.866 -12.614 56 HG12 VAL 8 HG12 VAL 8 -17.636 -2.071 -12.080 57 HG13 VAL 8 HG13 VAL 8 -18.004 -2.193 -13.801 58 HG21 VAL 8 HG21 VAL 8 -17.782 -3.844 -14.996 59 HG22 VAL 8 HG22 VAL 8 -16.316 -4.754 -14.638 60 HG23 VAL 8 HG23 VAL 8 -17.897 -5.488 -14.367 61 H ARG 9 H ARG 9 -16.517 -5.981 -11.123 62 HA ARG 9 HA ARG 9 -14.612 -7.678 -12.550 63 HB2 ARG 9 HB2 ARG 9 -14.639 -7.180 -9.587 64 HB3 ARG 9 HB3 ARG 9 -14.052 -8.705 -10.237 65 HG2 ARG 9 HG2 ARG 9 -12.258 -7.681 -11.331 66 HG3 ARG 9 HG3 ARG 9 -12.977 -6.075 -11.191 67 HD2 ARG 9 HD2 ARG 9 -12.684 -6.186 -8.747 68 HD3 ARG 9 HD3 ARG 9 -11.911 -7.761 -8.928 69 HE ARG 9 HE ARG 9 -10.551 -5.925 -10.539 70 HH11 ARG 9 HH11 ARG 9 -11.122 -6.578 -7.168 71 HH12 ARG 9 HH12 ARG 9 -9.617 -5.895 -6.647 72 HH21 ARG 9 HH21 ARG 9 -8.568 -5.022 -9.866 73 HH22 ARG 9 HH22 ARG 9 -8.165 -5.010 -8.181 74 H ALA 10 H ALA 10 -15.314 -9.732 -12.864 75 HA ALA 10 HA ALA 10 -17.979 -10.377 -11.805 76 HB1 ALA 10 HB1 ALA 10 -16.712 -10.712 -14.389 77 HB2 ALA 10 HB2 ALA 10 -17.408 -12.220 -13.793 78 HB3 ALA 10 HB3 ALA 10 -18.419 -10.784 -13.949 79 H ARG 11 H ARG 11 -18.248 -12.018 -10.431 80 HA ARG 11 HA ARG 11 -15.949 -13.786 -9.932 81 HB2 ARG 11 HB2 ARG 11 -16.437 -12.576 -7.955 82 HB3 ARG 11 HB3 ARG 11 -18.169 -12.817 -8.144 83 HG2 ARG 11 HG2 ARG 11 -18.097 -14.968 -7.346 84 HG3 ARG 11 HG3 ARG 11 -16.403 -15.188 -7.787 85 HD2 ARG 11 HD2 ARG 11 -17.181 -13.193 -5.696 86 HD3 ARG 11 HD3 ARG 11 -17.049 -14.904 -5.289 87 HE ARG 11 HE ARG 11 -14.716 -14.192 -6.620 88 HH11 ARG 11 HH11 ARG 11 -16.370 -13.392 -3.662 89 HH12 ARG 11 HH12 ARG 11 -14.915 -13.021 -2.797 90 HH21 ARG 11 HH21 ARG 11 -12.795 -13.706 -5.491 91 HH22 ARG 11 HH22 ARG 11 -12.883 -13.199 -3.838 92 H ILE 12 H ILE 12 -16.247 -15.562 -11.152 93 HA ILE 12 HA ILE 12 -18.903 -16.754 -11.357 94 HB ILE 12 HB ILE 12 -16.314 -17.518 -12.712 95 HG12 ILE 12 HG12 ILE 12 -18.737 -16.332 -14.039 96 HG13 ILE 12 HG13 ILE 12 -17.531 -15.294 -13.283 97 HG21 ILE 12 HG21 ILE 12 -17.824 -18.873 -14.183 98 HG22 ILE 12 HG22 ILE 12 -17.665 -19.469 -12.532 99 HG23 ILE 12 HG23 ILE 12 -19.113 -18.586 -13.014 100 HD11 ILE 12 HD11 ILE 12 -17.129 -17.201 -15.571 101 HD12 ILE 12 HD12 ILE 12 -17.031 -15.440 -15.598 102 HD13 ILE 12 HD13 ILE 12 -15.814 -16.377 -14.732 103 H TYR 13 H TYR 13 -19.461 -18.718 -10.530 104 HA TYR 13 HA TYR 13 -17.429 -20.297 -9.140 105 HB2 TYR 13 HB2 TYR 13 -18.267 -18.928 -7.366 106 HB3 TYR 13 HB3 TYR 13 -19.933 -19.188 -7.869 107 HD1 TYR 13 HD1 TYR 13 -16.990 -21.324 -6.976 108 HD2 TYR 13 HD2 TYR 13 -21.149 -20.571 -6.493 109 HE1 TYR 13 HE1 TYR 13 -17.150 -23.232 -5.431 110 HE2 TYR 13 HE2 TYR 13 -21.321 -22.476 -4.946 111 HH TYR 13 HH TYR 13 -20.259 -24.180 -4.001 112 H LYS 14 H LYS 14 -17.788 -22.464 -9.177 113 HA LYS 14 HA LYS 14 -19.853 -23.420 -10.946 114 HB2 LYS 14 HB2 LYS 14 -18.748 -25.516 -10.865 115 HB3 LYS 14 HB3 LYS 14 -17.478 -24.299 -10.864 116 HG2 LYS 14 HG2 LYS 14 -17.191 -24.561 -8.471 117 HG3 LYS 14 HG3 LYS 14 -18.514 -25.728 -8.423 118 HD2 LYS 14 HD2 LYS 14 -15.991 -26.085 -10.038 119 HD3 LYS 14 HD3 LYS 14 -16.240 -26.758 -8.425 120 HE2 LYS 14 HE2 LYS 14 -17.901 -27.345 -10.875 121 HE3 LYS 14 HE3 LYS 14 -16.700 -28.416 -10.157 122 HZ1 LYS 14 HZ1 LYS 14 -18.709 -29.181 -9.323 123 HZ2 LYS 14 HZ2 LYS 14 -19.335 -27.628 -9.089 124 HZ3 LYS 14 HZ3 LYS 14 -18.125 -28.214 -8.063 125 HA PRO 15 HA PRO 15 -22.863 -24.624 -7.984 126 HB2 PRO 15 HB2 PRO 15 -23.905 -26.828 -9.177 127 HB3 PRO 15 HB3 PRO 15 -24.206 -25.186 -9.760 128 HG2 PRO 15 HG2 PRO 15 -22.255 -27.225 -10.760 129 HG3 PRO 15 HG3 PRO 15 -23.314 -26.143 -11.683 130 HD2 PRO 15 HD2 PRO 15 -20.683 -25.631 -11.305 131 HD3 PRO 15 HD3 PRO 15 -21.897 -24.342 -11.441 132 H ALA 16 H ALA 16 -23.712 -26.731 -6.876 133 HA ALA 16 HA ALA 16 -21.440 -27.937 -5.577 134 HB1 ALA 16 HB1 ALA 16 -24.247 -28.801 -5.050 135 HB2 ALA 16 HB2 ALA 16 -22.896 -28.618 -3.931 136 HB3 ALA 16 HB3 ALA 16 -23.724 -27.192 -4.552 137 H LYS 17 H LYS 17 -21.475 -30.339 -5.137 138 HA LYS 17 HA LYS 17 -21.148 -31.765 -7.505 139 HB2 LYS 17 HB2 LYS 17 -21.111 -33.789 -6.052 140 HB3 LYS 17 HB3 LYS 17 -20.069 -32.493 -5.480 141 HG2 LYS 17 HG2 LYS 17 -21.639 -31.896 -3.776 142 HG3 LYS 17 HG3 LYS 17 -22.835 -33.022 -4.420 143 HD2 LYS 17 HD2 LYS 17 -21.887 -34.135 -2.581 144 HD3 LYS 17 HD3 LYS 17 -21.101 -34.846 -3.993 145 HE2 LYS 17 HE2 LYS 17 -19.851 -32.507 -2.618 146 HE3 LYS 17 HE3 LYS 17 -19.686 -34.117 -1.920 147 HZ1 LYS 17 HZ1 LYS 17 -18.043 -34.484 -3.334 148 HZ2 LYS 17 HZ2 LYS 17 -18.278 -32.985 -4.081 149 HZ3 LYS 17 HZ3 LYS 17 -19.123 -34.344 -4.629 150 H SER 18 H SER 18 -23.967 -31.350 -5.476 151 HA SER 18 HA SER 18 -25.505 -33.427 -6.705 152 HB2 SER 18 HB2 SER 18 -26.467 -31.053 -5.090 153 HB3 SER 18 HB3 SER 18 -27.383 -32.519 -5.442 154 HG SER 18 HG SER 18 -26.104 -32.238 -3.332 155 H THR 19 H THR 19 -27.765 -32.730 -7.607 156 HA THR 19 HA THR 19 -27.612 -30.379 -9.319 157 HB THR 19 HB THR 19 -28.340 -32.944 -10.675 158 HG1 THR 19 HG1 THR 19 -26.209 -33.350 -11.154 159 HG21 THR 19 HG21 THR 19 -28.683 -31.389 -12.259 160 HG22 THR 19 HG22 THR 19 -26.927 -31.362 -12.413 161 HG23 THR 19 HG23 THR 19 -27.742 -30.173 -11.397 162 H MET 20 H MET 20 -29.677 -30.020 -10.508 163 HA MET 20 HA MET 20 -31.965 -31.180 -9.060 164 HB2 MET 20 HB2 MET 20 -31.794 -28.338 -10.067 165 HB3 MET 20 HB3 MET 20 -33.077 -29.044 -9.093 166 HG2 MET 20 HG2 MET 20 -31.256 -29.453 -7.340 167 HG3 MET 20 HG3 MET 20 -30.288 -28.322 -8.282 168 HE1 MET 20 HE1 MET 20 -34.231 -28.158 -6.638 169 HE2 MET 20 HE2 MET 20 -32.906 -29.106 -5.961 170 HE3 MET 20 HE3 MET 20 -33.372 -27.578 -5.211 171 H GLN 21 H GLN 21 -34.061 -30.273 -10.405 172 HA GLN 21 HA GLN 21 -33.996 -31.767 -12.823 173 HB2 GLN 21 HB2 GLN 21 -36.065 -29.996 -11.541 174 HB3 GLN 21 HB3 GLN 21 -36.332 -30.747 -13.109 175 HG2 GLN 21 HG2 GLN 21 -37.341 -32.214 -11.638 176 HG3 GLN 21 HG3 GLN 21 -35.763 -32.949 -11.920 177 HE21 GLN 21 HE21 GLN 21 -34.251 -32.983 -10.277 178 HE22 GLN 21 HE22 GLN 21 -34.654 -32.630 -8.634 179 H SER 22 H SER 22 -35.296 -30.538 -14.752 180 HA SER 22 HA SER 22 -34.332 -27.877 -15.260 181 HB2 SER 22 HB2 SER 22 -32.924 -28.401 -17.163 182 HB3 SER 22 HB3 SER 22 -32.326 -29.276 -15.755 183 HG SER 22 HG SER 22 -32.977 -30.289 -18.073 184 H GLY 23 H GLY 23 -35.821 -26.869 -16.437 185 HA2 GLY 23 HA2 GLY 23 -37.644 -28.526 -18.065 186 HA3 GLY 23 HA3 GLY 23 -38.105 -27.026 -17.276 187 H HIS 24 H HIS 24 -38.554 -25.583 -18.804 188 HA HIS 24 HA HIS 24 -36.834 -25.467 -21.184 189 HB2 HIS 24 HB2 HIS 24 -38.722 -24.053 -22.118 190 HB3 HIS 24 HB3 HIS 24 -39.110 -25.745 -21.817 191 HD1 HIS 24 HD1 HIS 24 -40.670 -26.246 -19.765 192 HD2 HIS 24 HD2 HIS 24 -40.188 -22.217 -20.658 193 HE1 HIS 24 HE1 HIS 24 -42.494 -25.056 -18.508 194 H SER 25 H SER 25 -38.098 -23.577 -18.513 195 HA SER 25 HA SER 25 -36.266 -21.396 -19.271 196 HB2 SER 25 HB2 SER 25 -37.852 -19.842 -18.130 197 HB3 SER 25 HB3 SER 25 -38.548 -20.627 -19.548 198 HG SER 25 HG SER 25 -39.985 -20.677 -17.782 199 H LYS 26 H LYS 26 -35.812 -19.954 -17.272 200 HA LYS 26 HA LYS 26 -34.764 -19.744 -15.266 201 HB2 LYS 26 HB2 LYS 26 -37.151 -20.605 -14.616 202 HB3 LYS 26 HB3 LYS 26 -36.299 -22.087 -14.201 203 HG2 LYS 26 HG2 LYS 26 -35.044 -21.020 -12.525 204 HG3 LYS 26 HG3 LYS 26 -35.478 -19.413 -13.112 205 HD2 LYS 26 HD2 LYS 26 -37.530 -21.353 -12.078 206 HD3 LYS 26 HD3 LYS 26 -36.663 -20.242 -11.014 207 HE2 LYS 26 HE2 LYS 26 -37.631 -18.364 -11.985 208 HE3 LYS 26 HE3 LYS 26 -38.061 -19.229 -13.460 209 HZ1 LYS 26 HZ1 LYS 26 -39.403 -20.518 -11.437 210 HZ2 LYS 26 HZ2 LYS 26 -40.069 -19.473 -12.588 211 HZ3 LYS 26 HZ3 LYS 26 -39.577 -18.873 -11.084 212 H LEU 27 H LEU 27 -33.579 -21.437 -17.254 213 HA LEU 27 HA LEU 27 -32.463 -23.712 -15.857 214 HB2 LEU 27 HB2 LEU 27 -32.199 -22.572 -18.608 215 HB3 LEU 27 HB3 LEU 27 -31.026 -23.753 -18.027 216 HG LEU 27 HG LEU 27 -33.977 -24.319 -18.011 217 HD11 LEU 27 HD11 LEU 27 -32.758 -25.647 -20.173 218 HD12 LEU 27 HD12 LEU 27 -32.322 -23.944 -20.309 219 HD13 LEU 27 HD13 LEU 27 -34.019 -24.416 -20.224 220 HD21 LEU 27 HD21 LEU 27 -31.465 -25.827 -17.570 221 HD22 LEU 27 HD22 LEU 27 -32.770 -26.663 -18.414 222 HD23 LEU 27 HD23 LEU 27 -33.044 -25.998 -16.802 223 H LYS 28 H LYS 28 -30.982 -23.321 -14.344 224 HA LYS 28 HA LYS 28 -28.700 -21.620 -15.054 225 HB2 LYS 28 HB2 LYS 28 -30.138 -21.543 -12.394 226 HB3 LYS 28 HB3 LYS 28 -28.666 -20.665 -12.788 227 HG2 LYS 28 HG2 LYS 28 -29.758 -19.136 -14.090 228 HG3 LYS 28 HG3 LYS 28 -31.066 -20.250 -14.495 229 HD2 LYS 28 HD2 LYS 28 -30.724 -19.318 -11.675 230 HD3 LYS 28 HD3 LYS 28 -31.502 -18.266 -12.859 231 HE2 LYS 28 HE2 LYS 28 -33.200 -19.889 -13.289 232 HE3 LYS 28 HE3 LYS 28 -32.351 -21.110 -12.342 233 HZ1 LYS 28 HZ1 LYS 28 -32.720 -18.979 -10.641 234 HZ2 LYS 28 HZ2 LYS 28 -33.560 -20.447 -10.623 235 HZ3 LYS 28 HZ3 LYS 28 -34.187 -19.125 -11.473 236 H ALA 29 H ALA 29 -26.762 -22.455 -14.524 237 HA ALA 29 HA ALA 29 -26.711 -24.783 -12.718 238 HB1 ALA 29 HB1 ALA 29 -26.396 -25.020 -15.390 239 HB2 ALA 29 HB2 ALA 29 -24.723 -24.769 -14.887 240 HB3 ALA 29 HB3 ALA 29 -25.658 -26.102 -14.208 241 H TRP 30 H TRP 30 -24.808 -22.202 -14.236 242 HA TRP 30 HA TRP 30 -22.850 -22.404 -12.059 243 HB2 TRP 30 HB2 TRP 30 -22.761 -21.213 -14.816 244 HB3 TRP 30 HB3 TRP 30 -21.603 -20.709 -13.587 245 HD1 TRP 30 HD1 TRP 30 -22.759 -23.967 -15.344 246 HE1 TRP 30 HE1 TRP 30 -20.742 -25.562 -15.459 247 HE3 TRP 30 HE3 TRP 30 -19.364 -21.175 -12.732 248 HZ2 TRP 30 HZ2 TRP 30 -18.067 -25.629 -14.562 249 HZ3 TRP 30 HZ3 TRP 30 -17.098 -22.077 -12.404 250 HH2 TRP 30 HH2 TRP 30 -16.466 -24.258 -13.301 251 H LYS 31 H LYS 31 -22.067 -20.418 -11.070 252 HA LYS 31 HA LYS 31 -24.186 -18.377 -10.899 253 HB2 LYS 31 HB2 LYS 31 -23.854 -19.705 -8.832 254 HB3 LYS 31 HB3 LYS 31 -22.181 -19.166 -8.777 255 HG2 LYS 31 HG2 LYS 31 -23.256 -17.763 -7.278 256 HG3 LYS 31 HG3 LYS 31 -23.161 -16.792 -8.750 257 HD2 LYS 31 HD2 LYS 31 -25.436 -17.129 -9.245 258 HD3 LYS 31 HD3 LYS 31 -25.571 -18.468 -8.102 259 HE2 LYS 31 HE2 LYS 31 -25.077 -16.798 -6.276 260 HE3 LYS 31 HE3 LYS 31 -25.268 -15.534 -7.491 261 HZ1 LYS 31 HZ1 LYS 31 -27.260 -16.704 -5.997 262 HZ2 LYS 31 HZ2 LYS 31 -27.456 -17.346 -7.550 263 HZ3 LYS 31 HZ3 LYS 31 -27.462 -15.670 -7.321 264 H LEU 32 H LEU 32 -23.680 -16.312 -11.322 265 HA LEU 32 HA LEU 32 -20.855 -15.525 -11.379 266 HB2 LEU 32 HB2 LEU 32 -21.448 -16.074 -13.661 267 HB3 LEU 32 HB3 LEU 32 -22.868 -15.034 -13.569 268 HG LEU 32 HG LEU 32 -20.757 -14.208 -14.821 269 HD11 LEU 32 HD11 LEU 32 -21.338 -11.971 -13.184 270 HD12 LEU 32 HD12 LEU 32 -22.817 -12.914 -13.358 271 HD13 LEU 32 HD13 LEU 32 -21.959 -12.350 -14.791 272 HD21 LEU 32 HD21 LEU 32 -18.957 -13.472 -13.650 273 HD22 LEU 32 HD22 LEU 32 -19.456 -14.768 -12.564 274 HD23 LEU 32 HD23 LEU 32 -19.905 -13.099 -12.210 275 H GLU 33 H GLU 33 -20.539 -13.743 -10.232 276 HA GLU 33 HA GLU 33 -22.753 -11.814 -9.986 277 HB2 GLU 33 HB2 GLU 33 -21.509 -11.388 -7.666 278 HB3 GLU 33 HB3 GLU 33 -22.791 -12.578 -7.839 279 HG2 GLU 33 HG2 GLU 33 -21.381 -14.340 -7.626 280 HG3 GLU 33 HG3 GLU 33 -20.023 -13.486 -8.355 281 H PHE 34 H PHE 34 -22.194 -10.010 -10.998 282 HA PHE 34 HA PHE 34 -19.372 -9.196 -11.005 283 HB2 PHE 34 HB2 PHE 34 -19.812 -7.962 -12.996 284 HB3 PHE 34 HB3 PHE 34 -20.582 -9.532 -13.201 285 HD1 PHE 34 HD1 PHE 34 -23.061 -9.721 -12.859 286 HD2 PHE 34 HD2 PHE 34 -21.053 -5.976 -13.099 287 HE1 PHE 34 HE1 PHE 34 -25.201 -8.609 -13.345 288 HE2 PHE 34 HE2 PHE 34 -23.189 -4.857 -13.585 289 HZ PHE 34 HZ PHE 34 -25.267 -6.174 -13.707 290 H GLU 35 H GLU 35 -18.736 -7.221 -10.255 291 HA GLU 35 HA GLU 35 -20.219 -5.983 -8.243 292 HB2 GLU 35 HB2 GLU 35 -17.748 -5.319 -9.755 293 HB3 GLU 35 HB3 GLU 35 -18.514 -4.015 -8.858 294 HG2 GLU 35 HG2 GLU 35 -17.890 -4.840 -6.874 295 HG3 GLU 35 HG3 GLU 35 -18.205 -6.507 -7.351 296 HA PRO 36 HA PRO 36 -22.929 -3.138 -10.191 297 HB2 PRO 36 HB2 PRO 36 -22.747 -0.960 -8.580 298 HB3 PRO 36 HB3 PRO 36 -23.563 -2.450 -8.092 299 HG2 PRO 36 HG2 PRO 36 -20.804 -1.496 -7.428 300 HG3 PRO 36 HG3 PRO 36 -22.008 -2.256 -6.373 301 HD2 PRO 36 HD2 PRO 36 -19.931 -3.629 -7.438 302 HD3 PRO 36 HD3 PRO 36 -21.509 -4.379 -7.122 303 H SER 37 H SER 37 -23.027 -0.624 -10.742 304 HA SER 37 HA SER 37 -20.482 0.029 -12.079 305 HB2 SER 37 HB2 SER 37 -22.099 1.385 -13.622 306 HB3 SER 37 HB3 SER 37 -21.962 -0.360 -13.837 307 HG SER 37 HG SER 37 -24.152 0.455 -13.752 308 H CYS 38 H CYS 38 -23.077 1.183 -10.076 309 HA CYS 38 HA CYS 38 -23.349 3.070 -8.838 310 HB2 CYS 38 HB2 CYS 38 -20.778 2.424 -8.487 311 HB3 CYS 38 HB3 CYS 38 -20.550 3.970 -9.295 312 HG CYS 38 HG CYS 38 -22.307 5.262 -7.364 313 H THR 39 H THR 39 -24.130 3.268 -11.460 314 HA THR 39 HA THR 39 -23.460 6.066 -12.091 315 HB THR 39 HB THR 39 -23.959 5.458 -14.508 316 HG1 THR 39 HG1 THR 39 -24.848 3.461 -14.415 317 HG21 THR 39 HG21 THR 39 -21.720 5.884 -14.151 318 HG22 THR 39 HG22 THR 39 -21.659 4.209 -14.697 319 HG23 THR 39 HG23 THR 39 -21.550 4.580 -12.977 320 H GLN 40 H GLN 40 -25.164 7.184 -13.354 321 HA GLN 40 HA GLN 40 -27.636 7.072 -12.075 322 HB2 GLN 40 HB2 GLN 40 -26.765 9.048 -13.285 323 HB3 GLN 40 HB3 GLN 40 -27.040 8.215 -14.809 324 HG2 GLN 40 HG2 GLN 40 -29.294 8.489 -14.721 325 HG3 GLN 40 HG3 GLN 40 -29.336 8.491 -12.958 326 HE21 GLN 40 HE21 GLN 40 -30.396 10.333 -15.101 327 HE22 GLN 40 HE22 GLN 40 -29.863 11.901 -14.614 328 H TYR 41 H TYR 41 -29.110 5.521 -12.162 329 HA TYR 41 HA TYR 41 -29.231 3.703 -14.408 330 HB2 TYR 41 HB2 TYR 41 -29.518 3.133 -11.888 331 HB3 TYR 41 HB3 TYR 41 -31.168 3.701 -12.112 332 HD1 TYR 41 HD1 TYR 41 -28.712 1.143 -13.126 333 HD2 TYR 41 HD2 TYR 41 -32.779 2.383 -13.287 334 HE1 TYR 41 HE1 TYR 41 -29.347 -1.069 -13.996 335 HE2 TYR 41 HE2 TYR 41 -33.425 0.175 -14.157 336 HH TYR 41 HH TYR 41 -32.340 -1.705 -15.390 337 H THR 42 H THR 42 -30.477 3.988 -16.124 338 HA THR 42 HA THR 42 -32.183 6.165 -16.496 339 HB THR 42 HB THR 42 -32.477 3.577 -18.011 340 HG1 THR 42 HG1 THR 42 -30.361 3.841 -18.286 341 HG21 THR 42 HG21 THR 42 -33.335 6.344 -18.352 342 HG22 THR 42 HG22 THR 42 -33.928 4.874 -19.125 343 HG23 THR 42 HG23 THR 42 -32.508 5.698 -19.769 344 H GLU 43 H GLU 43 -34.452 6.325 -16.640 345 HA GLU 43 HA GLU 43 -35.866 4.969 -14.591 346 HB2 GLU 43 HB2 GLU 43 -36.488 7.026 -16.630 347 HB3 GLU 43 HB3 GLU 43 -37.853 6.100 -16.021 348 HG2 GLU 43 HG2 GLU 43 -37.810 7.103 -14.024 349 HG3 GLU 43 HG3 GLU 43 -36.049 7.094 -13.943 350 HA PRO 44 HA PRO 44 -37.582 1.462 -16.589 351 HB2 PRO 44 HB2 PRO 44 -40.117 1.409 -15.619 352 HB3 PRO 44 HB3 PRO 44 -38.703 1.011 -14.634 353 HG2 PRO 44 HG2 PRO 44 -40.251 3.569 -14.780 354 HG3 PRO 44 HG3 PRO 44 -39.619 2.724 -13.356 355 HD2 PRO 44 HD2 PRO 44 -38.375 4.866 -14.450 356 HD3 PRO 44 HD3 PRO 44 -37.488 3.549 -13.656 357 H LEU 45 H LEU 45 -39.642 0.710 -17.813 358 HA LEU 45 HA LEU 45 -40.186 2.728 -19.851 359 HB2 LEU 45 HB2 LEU 45 -39.697 -0.041 -19.896 360 HB3 LEU 45 HB3 LEU 45 -41.373 0.174 -20.398 361 HG LEU 45 HG LEU 45 -39.826 0.071 -22.302 362 HD11 LEU 45 HD11 LEU 45 -40.914 1.673 -23.514 363 HD12 LEU 45 HD12 LEU 45 -40.761 2.894 -22.251 364 HD13 LEU 45 HD13 LEU 45 -41.955 1.606 -22.091 365 HD21 LEU 45 HD21 LEU 45 -38.734 2.755 -21.649 366 HD22 LEU 45 HD22 LEU 45 -38.030 1.443 -22.596 367 HD23 LEU 45 HD23 LEU 45 -38.034 1.356 -20.834 368 H MET 46 H MET 46 -42.331 3.070 -20.667 369 HA MET 46 HA MET 46 -44.249 3.506 -18.671 370 HB2 MET 46 HB2 MET 46 -45.762 4.102 -20.477 371 HB3 MET 46 HB3 MET 46 -44.162 4.760 -20.793 372 HG2 MET 46 HG2 MET 46 -43.727 2.854 -22.310 373 HG3 MET 46 HG3 MET 46 -45.387 2.319 -22.054 374 HE1 MET 46 HE1 MET 46 -43.309 3.404 -24.401 375 HE2 MET 46 HE2 MET 46 -44.089 4.598 -25.438 376 HE3 MET 46 HE3 MET 46 -43.154 5.122 -24.037 377 H ASN 47 H ASN 47 -46.564 2.650 -18.872 378 HA ASN 47 HA ASN 47 -46.479 -0.177 -18.464 379 HB2 ASN 47 HB2 ASN 47 -49.024 1.399 -18.730 380 HB3 ASN 47 HB3 ASN 47 -48.688 0.007 -17.704 381 HD21 ASN 47 HD21 ASN 47 -49.546 2.968 -17.374 382 HD22 ASN 47 HD22 ASN 47 -48.592 3.491 -16.031 383 H TRP 48 H TRP 48 -45.890 -1.118 -20.422 384 HA TRP 48 HA TRP 48 -47.996 -1.071 -22.480 385 HB2 TRP 48 HB2 TRP 48 -45.951 0.171 -23.202 386 HB3 TRP 48 HB3 TRP 48 -45.030 -1.319 -23.020 387 HD1 TRP 48 HD1 TRP 48 -46.116 -3.452 -24.607 388 HE1 TRP 48 HE1 TRP 48 -46.839 -3.304 -27.073 389 HE3 TRP 48 HE3 TRP 48 -46.769 1.607 -24.960 390 HZ2 TRP 48 HZ2 TRP 48 -47.586 -1.307 -28.923 391 HZ3 TRP 48 HZ3 TRP 48 -47.489 2.555 -27.113 392 HH2 TRP 48 HH2 TRP 48 -47.888 1.127 -29.053 393 H THR 49 H THR 49 -45.194 -2.905 -21.269 394 HA THR 49 HA THR 49 -46.247 -5.376 -22.351 395 HB THR 49 HB THR 49 -44.245 -6.420 -21.311 396 HG1 THR 49 HG1 THR 49 -43.496 -5.299 -19.667 397 HG21 THR 49 HG21 THR 49 -43.939 -4.046 -23.124 398 HG22 THR 49 HG22 THR 49 -43.896 -5.762 -23.529 399 HG23 THR 49 HG23 THR 49 -42.550 -5.026 -22.659 400 H GLY 50 H GLY 50 -45.731 -3.919 -19.160 401 HA2 GLY 50 HA2 GLY 50 -47.937 -5.312 -18.029 402 HA3 GLY 50 HA3 GLY 50 -46.422 -6.055 -17.539 403 H SER 51 H SER 51 -45.135 -5.057 -16.042 404 HA SER 51 HA SER 51 -46.263 -2.626 -14.820 405 HB2 SER 51 HB2 SER 51 -45.311 -3.376 -12.701 406 HB3 SER 51 HB3 SER 51 -46.338 -4.641 -13.377 407 HG SER 51 HG SER 51 -44.528 -5.701 -12.836 408 H HIS 52 H HIS 52 -44.406 -1.577 -13.363 409 HA HIS 52 HA HIS 52 -42.096 -1.185 -15.152 410 HB2 HIS 52 HB2 HIS 52 -41.968 1.114 -14.129 411 HB3 HIS 52 HB3 HIS 52 -43.391 0.826 -15.125 412 HD1 HIS 52 HD1 HIS 52 -45.680 0.652 -13.897 413 HD2 HIS 52 HD2 HIS 52 -42.469 1.595 -11.434 414 HE1 HIS 52 HE1 HIS 52 -46.698 1.448 -11.740 415 H ASP 53 H ASP 53 -43.185 -1.658 -11.867 416 HA ASP 53 HA ASP 53 -40.891 -1.102 -10.427 417 HB2 ASP 53 HB2 ASP 53 -42.970 -3.252 -9.994 418 HB3 ASP 53 HB3 ASP 53 -41.720 -2.857 -8.818 419 H THR 54 H THR 54 -39.035 -2.192 -9.915 420 HA THR 54 HA THR 54 -38.593 -4.865 -10.986 421 HB THR 54 HB THR 54 -36.275 -3.912 -11.826 422 HG1 THR 54 HG1 THR 54 -36.640 -1.752 -11.280 423 HG21 THR 54 HG21 THR 54 -37.118 -3.913 -14.051 424 HG22 THR 54 HG22 THR 54 -38.737 -3.472 -13.507 425 HG23 THR 54 HG23 THR 54 -38.090 -5.072 -13.144 426 H LYS 55 H LYS 55 -36.329 -5.642 -10.359 427 HA LYS 55 HA LYS 55 -35.518 -4.488 -7.776 428 HB2 LYS 55 HB2 LYS 55 -36.953 -6.657 -7.702 429 HB3 LYS 55 HB3 LYS 55 -35.482 -7.455 -8.244 430 HG2 LYS 55 HG2 LYS 55 -34.323 -6.426 -6.265 431 HG3 LYS 55 HG3 LYS 55 -35.917 -5.929 -5.692 432 HD2 LYS 55 HD2 LYS 55 -35.329 -8.785 -6.406 433 HD3 LYS 55 HD3 LYS 55 -34.948 -8.138 -4.808 434 HE2 LYS 55 HE2 LYS 55 -37.680 -7.921 -6.050 435 HE3 LYS 55 HE3 LYS 55 -37.190 -9.293 -5.056 436 HZ1 LYS 55 HZ1 LYS 55 -37.180 -8.047 -3.174 437 HZ2 LYS 55 HZ2 LYS 55 -38.370 -7.201 -4.026 438 HZ3 LYS 55 HZ3 LYS 55 -36.787 -6.607 -3.971 439 H GLN 56 H GLN 56 -33.480 -3.842 -7.908 440 HA GLN 56 HA GLN 56 -31.715 -4.831 -9.953 441 HB2 GLN 56 HB2 GLN 56 -31.603 -2.696 -7.878 442 HB3 GLN 56 HB3 GLN 56 -30.083 -3.291 -8.532 443 HG2 GLN 56 HG2 GLN 56 -30.872 -1.307 -9.711 444 HG3 GLN 56 HG3 GLN 56 -30.784 -2.712 -10.774 445 HE21 GLN 56 HE21 GLN 56 -32.382 -2.691 -12.169 446 HE22 GLN 56 HE22 GLN 56 -34.019 -2.244 -11.846 447 H GLN 57 H GLN 57 -29.965 -6.146 -9.733 448 HA GLN 57 HA GLN 57 -29.286 -7.130 -7.057 449 HB2 GLN 57 HB2 GLN 57 -29.387 -9.420 -7.702 450 HB3 GLN 57 HB3 GLN 57 -30.916 -8.691 -8.176 451 HG2 GLN 57 HG2 GLN 57 -29.711 -8.366 -10.471 452 HG3 GLN 57 HG3 GLN 57 -28.670 -9.657 -9.873 453 HE21 GLN 57 HE21 GLN 57 -32.091 -8.831 -10.273 454 HE22 GLN 57 HE22 GLN 57 -32.609 -10.428 -10.679 455 H VAL 58 H VAL 58 -27.221 -8.350 -7.037 456 HA VAL 58 HA VAL 58 -25.375 -7.268 -9.064 457 HB VAL 58 HB VAL 58 -23.605 -7.620 -7.284 458 HG11 VAL 58 HG11 VAL 58 -24.265 -5.404 -7.761 459 HG12 VAL 58 HG12 VAL 58 -25.814 -5.608 -6.939 460 HG13 VAL 58 HG13 VAL 58 -24.319 -5.555 -6.005 461 HG21 VAL 58 HG21 VAL 58 -24.109 -8.445 -5.275 462 HG22 VAL 58 HG22 VAL 58 -25.496 -7.369 -5.099 463 HG23 VAL 58 HG23 VAL 58 -25.671 -8.902 -5.955 464 H CYS 59 H CYS 59 -26.453 -10.115 -7.381 465 HA CYS 59 HA CYS 59 -24.449 -11.734 -8.798 466 HB2 CYS 59 HB2 CYS 59 -25.040 -13.524 -7.176 467 HB3 CYS 59 HB3 CYS 59 -24.400 -12.077 -6.404 468 HG CYS 59 HG CYS 59 -26.704 -13.511 -5.141 469 H LEU 60 H LEU 60 -25.051 -13.164 -10.317 470 HA LEU 60 HA LEU 60 -27.897 -13.823 -10.590 471 HB2 LEU 60 HB2 LEU 60 -28.005 -13.262 -12.836 472 HB3 LEU 60 HB3 LEU 60 -27.101 -11.928 -12.121 473 HG LEU 60 HG LEU 60 -25.074 -13.548 -12.902 474 HD11 LEU 60 HD11 LEU 60 -26.344 -13.775 -15.422 475 HD12 LEU 60 HD12 LEU 60 -27.374 -14.560 -14.225 476 HD13 LEU 60 HD13 LEU 60 -25.691 -15.056 -14.401 477 HD21 LEU 60 HD21 LEU 60 -25.771 -11.052 -13.385 478 HD22 LEU 60 HD22 LEU 60 -26.235 -11.726 -14.948 479 HD23 LEU 60 HD23 LEU 60 -24.571 -11.878 -14.379 480 H SER 61 H SER 61 -28.247 -15.670 -12.109 481 HA SER 61 HA SER 61 -25.995 -17.564 -11.946 482 HB2 SER 61 HB2 SER 61 -28.938 -18.263 -11.921 483 HB3 SER 61 HB3 SER 61 -27.583 -19.358 -11.649 484 HG SER 61 HG SER 61 -28.883 -18.135 -9.814 485 H PHE 62 H PHE 62 -25.377 -18.610 -13.753 486 HA PHE 62 HA PHE 62 -26.905 -18.052 -16.208 487 HB2 PHE 62 HB2 PHE 62 -23.993 -18.172 -15.617 488 HB3 PHE 62 HB3 PHE 62 -24.518 -18.753 -17.193 489 HD1 PHE 62 HD2 PHE 62 -26.275 -17.109 -18.373 490 HD2 PHE 62 HD1 PHE 62 -23.376 -15.975 -15.470 491 HE1 PHE 62 HE2 PHE 62 -26.357 -14.793 -19.201 492 HE2 PHE 62 HE1 PHE 62 -23.454 -13.658 -16.292 493 HZ PHE 62 HZ PHE 62 -24.944 -13.064 -18.161 494 H THR 63 H THR 63 -26.894 -19.713 -17.866 495 HA THR 63 HA THR 63 -27.563 -22.261 -16.827 496 HB THR 63 HB THR 63 -26.905 -21.988 -19.719 497 HG1 THR 63 HG1 THR 63 -28.193 -20.341 -19.984 498 HG21 THR 63 HG21 THR 63 -27.932 -24.002 -19.355 499 HG22 THR 63 HG22 THR 63 -29.354 -23.001 -19.656 500 HG23 THR 63 HG23 THR 63 -28.885 -23.396 -18.001 501 H THR 64 H THR 64 -24.805 -21.138 -18.776 502 HA THR 64 HA THR 64 -23.282 -23.457 -17.792 503 HB THR 64 HB THR 64 -22.078 -23.139 -20.154 504 HG1 THR 64 HG1 THR 64 -23.930 -22.879 -21.687 505 HG21 THR 64 HG21 THR 64 -23.134 -25.202 -19.184 506 HG22 THR 64 HG22 THR 64 -23.266 -25.062 -20.937 507 HG23 THR 64 HG23 THR 64 -24.654 -24.690 -19.916 508 H ARG 65 H ARG 65 -20.920 -23.153 -17.921 509 HA ARG 65 HA ARG 65 -20.094 -20.796 -16.691 510 HB2 ARG 65 HB2 ARG 65 -17.780 -21.576 -17.197 511 HB3 ARG 65 HB3 ARG 65 -18.797 -22.806 -16.456 512 HG2 ARG 65 HG2 ARG 65 -19.234 -23.367 -19.040 513 HG3 ARG 65 HG3 ARG 65 -17.604 -22.698 -19.150 514 HD2 ARG 65 HD2 ARG 65 -16.677 -24.403 -17.956 515 HD3 ARG 65 HD3 ARG 65 -18.131 -24.663 -16.994 516 HE ARG 65 HE ARG 65 -18.704 -25.418 -19.613 517 HH11 ARG 65 HH11 ARG 65 -16.630 -26.405 -16.997 518 HH12 ARG 65 HH12 ARG 65 -16.605 -28.071 -17.473 519 HH21 ARG 65 HH21 ARG 65 -18.679 -27.608 -20.250 520 HH22 ARG 65 HH22 ARG 65 -17.770 -28.754 -19.324 521 H GLU 66 H GLU 66 -19.753 -21.810 -20.080 522 HA GLU 66 HA GLU 66 -18.303 -19.676 -21.060 523 HB2 GLU 66 HB2 GLU 66 -19.153 -21.813 -22.250 524 HB3 GLU 66 HB3 GLU 66 -20.581 -20.857 -22.624 525 HG2 GLU 66 HG2 GLU 66 -19.322 -20.525 -24.501 526 HG3 GLU 66 HG3 GLU 66 -18.847 -19.135 -23.528 527 H LEU 67 H LEU 67 -21.696 -19.845 -20.232 528 HA LEU 67 HA LEU 67 -22.574 -17.512 -21.531 529 HB2 LEU 67 HB2 LEU 67 -23.677 -19.463 -19.862 530 HB3 LEU 67 HB3 LEU 67 -23.915 -17.938 -19.012 531 HG LEU 67 HG LEU 67 -25.879 -18.374 -20.281 532 HD11 LEU 67 HD11 LEU 67 -24.784 -16.476 -22.205 533 HD12 LEU 67 HD12 LEU 67 -24.411 -16.072 -20.529 534 HD13 LEU 67 HD13 LEU 67 -26.089 -16.283 -21.033 535 HD21 LEU 67 HD21 LEU 67 -24.020 -19.473 -22.170 536 HD22 LEU 67 HD22 LEU 67 -25.067 -18.301 -22.968 537 HD23 LEU 67 HD23 LEU 67 -25.772 -19.657 -22.089 538 H ALA 68 H ALA 68 -21.125 -18.039 -18.358 539 HA ALA 68 HA ALA 68 -21.480 -15.369 -17.436 540 HB1 ALA 68 HB1 ALA 68 -20.229 -15.988 -15.561 541 HB2 ALA 68 HB2 ALA 68 -21.049 -17.472 -16.048 542 HB3 ALA 68 HB3 ALA 68 -19.349 -17.233 -16.448 543 H ILE 69 H ILE 69 -18.548 -17.107 -18.501 544 HA ILE 69 HA ILE 69 -16.821 -14.934 -18.512 545 HB ILE 69 HB ILE 69 -16.772 -17.321 -20.362 546 HG12 ILE 69 HG12 ILE 69 -14.818 -17.610 -18.403 547 HG13 ILE 69 HG13 ILE 69 -16.207 -16.978 -17.525 548 HG21 ILE 69 HG21 ILE 69 -15.231 -15.980 -21.365 549 HG22 ILE 69 HG22 ILE 69 -14.891 -15.078 -19.889 550 HG23 ILE 69 HG23 ILE 69 -14.207 -16.687 -20.116 551 HD11 ILE 69 HD11 ILE 69 -17.163 -18.999 -19.239 552 HD12 ILE 69 HD12 ILE 69 -15.720 -19.623 -18.440 553 HD13 ILE 69 HD13 ILE 69 -17.065 -19.009 -17.478 554 H ALA 70 H ALA 70 -19.142 -15.984 -20.924 555 HA ALA 70 HA ALA 70 -18.241 -14.345 -23.046 556 HB1 ALA 70 HB1 ALA 70 -19.644 -16.097 -23.680 557 HB2 ALA 70 HB2 ALA 70 -20.845 -15.706 -22.448 558 HB3 ALA 70 HB3 ALA 70 -20.655 -14.662 -23.857 559 H TYR 71 H TYR 71 -20.184 -13.730 -20.235 560 HA TYR 71 HA TYR 71 -21.320 -11.279 -21.211 561 HB2 TYR 71 HB2 TYR 71 -22.451 -12.654 -19.499 562 HB3 TYR 71 HB3 TYR 71 -21.133 -12.327 -18.379 563 HD1 TYR 71 HD1 TYR 71 -22.850 -9.987 -20.712 564 HD2 TYR 71 HD2 TYR 71 -22.130 -11.094 -16.667 565 HE1 TYR 71 HE1 TYR 71 -24.005 -7.952 -19.955 566 HE2 TYR 71 HE2 TYR 71 -23.283 -9.062 -15.899 567 HH TYR 71 HH TYR 71 -24.671 -7.373 -16.555 568 H ALA 72 H ALA 72 -18.746 -12.128 -18.915 569 HA ALA 72 HA ALA 72 -18.016 -9.462 -18.308 570 HB1 ALA 72 HB1 ALA 72 -16.874 -10.540 -16.745 571 HB2 ALA 72 HB2 ALA 72 -17.186 -12.079 -17.548 572 HB3 ALA 72 HB3 ALA 72 -15.761 -11.133 -17.978 573 H VAL 73 H VAL 73 -16.396 -11.885 -20.370 574 HA VAL 73 HA VAL 73 -14.382 -10.296 -21.385 575 HB VAL 73 HB VAL 73 -15.891 -12.469 -22.844 576 HG11 VAL 73 HG11 VAL 73 -14.625 -11.110 -24.399 577 HG12 VAL 73 HG12 VAL 73 -13.183 -11.258 -23.391 578 HG13 VAL 73 HG13 VAL 73 -13.846 -12.679 -24.198 579 HG21 VAL 73 HG21 VAL 73 -13.239 -12.779 -21.486 580 HG22 VAL 73 HG22 VAL 73 -14.741 -12.943 -20.576 581 HG23 VAL 73 HG23 VAL 73 -14.413 -14.016 -21.937 582 H ALA 74 H ALA 74 -17.755 -10.457 -22.328 583 HA ALA 74 HA ALA 74 -17.634 -9.109 -24.769 584 HB1 ALA 74 HB1 ALA 74 -19.790 -9.324 -22.691 585 HB2 ALA 74 HB2 ALA 74 -20.023 -8.429 -24.193 586 HB3 ALA 74 HB3 ALA 74 -19.665 -10.155 -24.241 587 H HIS 75 H HIS 75 -17.542 -7.912 -21.484 588 HA HIS 75 HA HIS 75 -17.346 -5.164 -22.530 589 HB2 HIS 75 HB2 HIS 75 -19.242 -5.951 -20.835 590 HB3 HIS 75 HB3 HIS 75 -17.968 -5.652 -19.656 591 HD1 HIS 75 HD1 HIS 75 -20.220 -3.905 -22.073 592 HD2 HIS 75 HD2 HIS 75 -17.296 -2.962 -19.277 593 HE1 HIS 75 HE1 HIS 75 -20.370 -1.414 -21.759 594 H LYS 76 H LYS 76 -15.264 -7.296 -22.106 595 HA LYS 76 HA LYS 76 -13.147 -7.513 -21.293 596 HB2 LYS 76 HB2 LYS 76 -13.426 -4.506 -21.352 597 HB3 LYS 76 HB3 LYS 76 -11.905 -5.328 -21.026 598 HG2 LYS 76 HG2 LYS 76 -11.996 -6.389 -23.219 599 HG3 LYS 76 HG3 LYS 76 -13.534 -5.586 -23.547 600 HD2 LYS 76 HD2 LYS 76 -11.008 -4.084 -22.889 601 HD3 LYS 76 HD3 LYS 76 -11.475 -4.500 -24.540 602 HE2 LYS 76 HE2 LYS 76 -13.701 -3.355 -23.991 603 HE3 LYS 76 HE3 LYS 76 -12.863 -2.682 -22.595 604 HZ1 LYS 76 HZ1 LYS 76 -12.662 -1.095 -24.287 605 HZ2 LYS 76 HZ2 LYS 76 -12.271 -2.247 -25.461 606 HZ3 LYS 76 HZ3 LYS 76 -11.157 -1.866 -24.246 607 H ILE 77 H ILE 77 -14.889 -8.078 -19.343 608 HA ILE 77 HA ILE 77 -14.015 -6.586 -16.970 609 HB ILE 77 HB ILE 77 -16.276 -8.571 -17.244 610 HG12 ILE 77 HG12 ILE 77 -16.476 -5.587 -16.839 611 HG13 ILE 77 HG13 ILE 77 -16.509 -6.329 -18.434 612 HG21 ILE 77 HG21 ILE 77 -14.979 -7.326 -14.949 613 HG22 ILE 77 HG22 ILE 77 -16.725 -7.077 -14.986 614 HG23 ILE 77 HG23 ILE 77 -16.067 -8.713 -15.024 615 HD11 ILE 77 HD11 ILE 77 -18.404 -7.327 -16.380 616 HD12 ILE 77 HD12 ILE 77 -18.717 -5.764 -17.136 617 HD13 ILE 77 HD13 ILE 77 -18.584 -7.214 -18.131 618 H ASP 78 H ASP 78 -12.939 -7.550 -15.309 619 HA ASP 78 HA ASP 78 -11.489 -9.936 -15.879 620 HB2 ASP 78 HB2 ASP 78 -10.609 -8.031 -14.515 621 HB3 ASP 78 HB3 ASP 78 -11.725 -8.492 -13.232 622 H TYR 79 H TYR 79 -12.640 -11.781 -15.983 623 HA TYR 79 HA TYR 79 -14.565 -12.376 -13.855 624 HB2 TYR 79 HB2 TYR 79 -15.370 -14.161 -15.314 625 HB3 TYR 79 HB3 TYR 79 -15.341 -12.628 -16.179 626 HD1 TYR 79 HD2 TYR 79 -13.731 -12.240 -17.971 627 HD2 TYR 79 HD1 TYR 79 -13.872 -15.964 -15.919 628 HE1 TYR 79 HE2 TYR 79 -12.377 -13.265 -19.750 629 HE2 TYR 79 HE1 TYR 79 -12.518 -16.999 -17.692 630 HH TYR 79 HH TYR 79 -11.359 -16.660 -19.560 631 H THR 80 H THR 80 -14.193 -13.872 -12.342 632 HA THR 80 HA THR 80 -11.754 -15.506 -12.600 633 HB THR 80 HB THR 80 -11.521 -13.937 -10.778 634 HG1 THR 80 HG1 THR 80 -10.682 -15.987 -10.342 635 HG21 THR 80 HG21 THR 80 -14.022 -15.129 -9.579 636 HG22 THR 80 HG22 THR 80 -13.970 -13.584 -10.427 637 HG23 THR 80 HG23 THR 80 -13.056 -13.802 -8.935 638 H VAL 81 H VAL 81 -12.015 -17.635 -12.705 639 HA VAL 81 HA VAL 81 -14.649 -18.776 -12.238 640 HB VAL 81 HB VAL 81 -12.128 -20.050 -13.311 641 HG11 VAL 81 HG11 VAL 81 -13.353 -21.827 -12.432 642 HG12 VAL 81 HG12 VAL 81 -14.901 -21.104 -12.874 643 HG13 VAL 81 HG13 VAL 81 -13.853 -21.777 -14.121 644 HG21 VAL 81 HG21 VAL 81 -12.945 -18.391 -14.838 645 HG22 VAL 81 HG22 VAL 81 -13.367 -19.981 -15.472 646 HG23 VAL 81 HG23 VAL 81 -14.596 -18.992 -14.683 647 H LEU 82 H LEU 82 -15.205 -19.712 -10.392 648 HA LEU 82 HA LEU 82 -13.076 -20.584 -8.558 649 HB2 LEU 82 HB2 LEU 82 -15.876 -19.608 -8.086 650 HB3 LEU 82 HB3 LEU 82 -14.969 -20.471 -6.846 651 HG LEU 82 HG LEU 82 -13.914 -17.962 -8.120 652 HD11 LEU 82 HD11 LEU 82 -14.803 -16.781 -6.113 653 HD12 LEU 82 HD12 LEU 82 -15.759 -18.219 -5.753 654 HD13 LEU 82 HD13 LEU 82 -16.043 -17.323 -7.245 655 HD21 LEU 82 HD21 LEU 82 -13.111 -18.116 -5.492 656 HD22 LEU 82 HD22 LEU 82 -12.152 -18.583 -6.897 657 HD23 LEU 82 HD23 LEU 82 -13.083 -19.799 -6.020 658 H GLN 83 H GLN 83 -12.728 -22.698 -8.905 659 HA GLN 83 HA GLN 83 -15.075 -24.477 -8.984 660 HB2 GLN 83 HB2 GLN 83 -14.002 -24.722 -11.064 661 HB3 GLN 83 HB3 GLN 83 -12.400 -24.669 -10.341 662 HG2 GLN 83 HG2 GLN 83 -12.430 -26.860 -9.765 663 HG3 GLN 83 HG3 GLN 83 -14.177 -26.889 -9.527 664 HE21 GLN 83 HE21 GLN 83 -15.222 -26.126 -11.830 665 HE22 GLN 83 HE22 GLN 83 -14.757 -27.174 -13.122 666 H ASP 84 H ASP 84 -15.354 -25.505 -7.127 667 HA ASP 84 HA ASP 84 -13.434 -25.679 -5.083 668 HB2 ASP 84 HB2 ASP 84 -15.942 -25.839 -4.818 669 HB3 ASP 84 HB3 ASP 84 -15.828 -27.492 -5.417 670 H ASN 85 H ASN 85 -12.487 -27.625 -4.161 671 HA ASN 85 HA ASN 85 -11.054 -29.387 -4.339 672 HB2 ASN 85 HB2 ASN 85 -13.436 -30.393 -4.713 673 HB3 ASN 85 HB3 ASN 85 -12.893 -30.602 -6.376 674 HD21 ASN 85 HD21 ASN 85 -11.611 -31.105 -3.102 675 HD22 ASN 85 HD22 ASN 85 -10.970 -32.679 -3.415 676 HA PRO 86 HA PRO 86 -9.303 -27.776 -8.333 677 HB2 PRO 86 HB2 PRO 86 -6.935 -27.002 -7.254 678 HB3 PRO 86 HB3 PRO 86 -8.365 -25.962 -7.281 679 HG2 PRO 86 HG2 PRO 86 -7.288 -27.645 -5.052 680 HG3 PRO 86 HG3 PRO 86 -7.928 -25.992 -4.998 681 HD2 PRO 86 HD2 PRO 86 -9.391 -28.145 -4.252 682 HD3 PRO 86 HD3 PRO 86 -10.120 -26.706 -4.992 683 H ARG 87 H ARG 87 -8.455 -29.278 -9.619 684 HA ARG 87 HA ARG 87 -6.839 -31.421 -8.436 685 HB2 ARG 87 HB2 ARG 87 -8.900 -31.924 -9.840 686 HB3 ARG 87 HB3 ARG 87 -7.984 -31.346 -11.224 687 HG2 ARG 87 HG2 ARG 87 -6.468 -33.118 -11.111 688 HG3 ARG 87 HG3 ARG 87 -6.934 -33.526 -9.459 689 HD2 ARG 87 HD2 ARG 87 -9.082 -34.322 -10.215 690 HD3 ARG 87 HD3 ARG 87 -8.739 -33.787 -11.859 691 HE ARG 87 HE ARG 87 -6.764 -35.611 -10.975 692 HH11 ARG 87 HH11 ARG 87 -10.068 -35.454 -12.062 693 HH12 ARG 87 HH12 ARG 87 -10.075 -37.067 -12.694 694 HH21 ARG 87 HH21 ARG 87 -6.760 -37.737 -11.802 695 HH22 ARG 87 HH22 ARG 87 -8.192 -38.366 -12.544 696 H THR 88 H THR 88 -4.739 -31.678 -8.902 697 HA THR 88 HA THR 88 -3.582 -30.308 -11.209 698 HB THR 88 HB THR 88 -1.667 -29.513 -9.741 699 HG1 THR 88 HG1 THR 88 -3.558 -29.673 -7.634 700 HG21 THR 88 HG21 THR 88 -2.906 -27.493 -8.972 701 HG22 THR 88 HG22 THR 88 -4.412 -28.307 -9.391 702 HG23 THR 88 HG23 THR 88 -3.237 -27.927 -10.648 703 H ILE 89 H ILE 89 -1.581 -31.161 -11.896 704 HA ILE 89 HA ILE 89 -0.699 -33.620 -10.552 705 HB ILE 89 HB ILE 89 -0.325 -34.629 -12.830 706 HG12 ILE 89 HG12 ILE 89 -2.202 -32.417 -13.687 707 HG13 ILE 89 HG13 ILE 89 -0.497 -32.523 -14.112 708 HG21 ILE 89 HG21 ILE 89 -3.245 -34.200 -12.573 709 HG22 ILE 89 HG22 ILE 89 -2.329 -35.697 -12.735 710 HG23 ILE 89 HG23 ILE 89 -2.394 -34.866 -11.180 711 HD11 ILE 89 HD11 ILE 89 -1.490 -33.366 -15.991 712 HD12 ILE 89 HD12 ILE 89 -1.188 -34.845 -15.078 713 HD13 ILE 89 HD13 ILE 89 -2.800 -34.130 -15.091 714 H VAL 90 H VAL 90 1.451 -33.825 -10.370 715 HA VAL 90 HA VAL 90 3.203 -31.733 -10.771 716 HB VAL 90 HB VAL 90 5.026 -33.526 -10.702 717 HG11 VAL 90 HG11 VAL 90 4.879 -33.657 -8.398 718 HG12 VAL 90 HG12 VAL 90 3.862 -32.259 -8.753 719 HG13 VAL 90 HG13 VAL 90 3.123 -33.825 -8.416 720 HG21 VAL 90 HG21 VAL 90 4.474 -35.759 -10.352 721 HG22 VAL 90 HG22 VAL 90 2.799 -35.385 -9.948 722 HG23 VAL 90 HG23 VAL 90 3.350 -35.264 -11.618 723 HA PRO 91 HA PRO 91 4.300 -31.643 -15.021 724 HB2 PRO 91 HB2 PRO 91 6.919 -30.946 -14.886 725 HB3 PRO 91 HB3 PRO 91 5.606 -29.819 -14.526 726 HG2 PRO 91 HG2 PRO 91 7.322 -31.393 -12.644 727 HG3 PRO 91 HG3 PRO 91 6.799 -29.702 -12.533 728 HD2 PRO 91 HD2 PRO 91 5.605 -31.691 -11.136 729 HD3 PRO 91 HD3 PRO 91 4.718 -30.268 -11.719 730 H LYS 92 H LYS 92 4.632 -33.265 -16.394 731 HA LYS 92 HA LYS 92 6.345 -35.492 -15.601 732 HB2 LYS 92 HB2 LYS 92 4.124 -35.121 -17.556 733 HB3 LYS 92 HB3 LYS 92 5.315 -36.374 -17.885 734 HG2 LYS 92 HG2 LYS 92 4.854 -37.219 -15.536 735 HG3 LYS 92 HG3 LYS 92 3.454 -36.144 -15.542 736 HD2 LYS 92 HD2 LYS 92 2.580 -38.182 -16.257 737 HD3 LYS 92 HD3 LYS 92 2.847 -37.300 -17.762 738 HE2 LYS 92 HE2 LYS 92 3.636 -39.545 -18.050 739 HE3 LYS 92 HE3 LYS 92 5.030 -38.469 -17.988 740 HZ1 LYS 92 HZ1 LYS 92 4.446 -39.323 -15.384 741 HZ2 LYS 92 HZ2 LYS 92 5.823 -39.646 -16.309 742 HZ3 LYS 92 HZ3 LYS 92 4.493 -40.689 -16.380 743 H SER 93 H SER 93 8.099 -36.199 -16.778 744 HA SER 93 HA SER 93 9.195 -34.240 -18.666 745 HB2 SER 93 HB2 SER 93 10.543 -36.466 -17.119 746 HB3 SER 93 HB3 SER 93 11.366 -35.382 -18.241 747 HG SER 93 HG SER 93 11.516 -34.701 -16.040 748 H TYR 94 H TYR 94 10.518 -35.140 -20.477 749 HA TYR 94 HA TYR 94 9.810 -37.778 -21.422 750 HB2 TYR 94 HB2 TYR 94 8.701 -35.278 -22.652 751 HB3 TYR 94 HB3 TYR 94 9.034 -36.682 -23.660 752 HD1 TYR 94 HD1 TYR 94 8.101 -38.971 -22.518 753 HD2 TYR 94 HD2 TYR 94 6.529 -35.061 -21.932 754 HE1 TYR 94 HE1 TYR 94 5.933 -39.944 -21.886 755 HE2 TYR 94 HE2 TYR 94 4.356 -36.023 -21.297 756 HH TYR 94 HH TYR 94 3.098 -37.959 -21.408 757 H ALA 95 H ALA 95 11.644 -38.574 -22.180 758 HA ALA 95 HA ALA 95 13.728 -36.781 -23.141 759 HB1 ALA 95 HB1 ALA 95 14.364 -39.609 -23.240 760 HB2 ALA 95 HB2 ALA 95 15.164 -38.300 -22.369 761 HB3 ALA 95 HB3 ALA 95 13.772 -39.113 -21.653 762 H ASP 96 H ASP 96 15.102 -37.987 -24.989 763 HA ASP 96 HA ASP 96 13.329 -39.009 -27.071 764 HB2 ASP 96 HB2 ASP 96 14.594 -37.346 -28.663 765 HB3 ASP 96 HB3 ASP 96 13.180 -36.807 -27.761 766 H ASN 97 H ASN 97 14.285 -40.479 -28.370 767 HA ASN 97 HA ASN 97 17.185 -40.878 -28.032 768 HB2 ASN 97 HB2 ASN 97 15.572 -42.655 -27.117 769 HB3 ASN 97 HB3 ASN 97 15.240 -43.047 -28.801 770 HD21 ASN 97 HD21 ASN 97 16.088 -45.116 -28.538 771 HD22 ASN 97 HD22 ASN 97 17.789 -45.399 -28.428 772 H PHE 98 H PHE 98 17.347 -39.313 -29.833 773 HA PHE 98 HA PHE 98 16.726 -40.514 -32.443 774 HB2 PHE 98 HB2 PHE 98 17.090 -37.680 -31.528 775 HB3 PHE 98 HB3 PHE 98 17.331 -38.097 -33.221 776 HD1 PHE 98 HD1 PHE 98 15.365 -39.588 -34.231 777 HD2 PHE 98 HD2 PHE 98 15.010 -36.964 -30.899 778 HE1 PHE 98 HE1 PHE 98 12.939 -39.434 -34.614 779 HE2 PHE 98 HE2 PHE 98 12.583 -36.806 -31.277 780 HZ PHE 98 HZ PHE 98 11.545 -38.044 -33.136 781 H THR 99 H THR 99 18.313 -41.178 -33.746 782 HA THR 99 HA THR 99 21.082 -40.490 -33.004 783 HB THR 99 HB THR 99 20.716 -42.839 -32.613 784 HG1 THR 99 HG1 THR 99 22.471 -43.479 -33.700 785 HG21 THR 99 HG21 THR 99 19.403 -42.719 -35.285 786 HG22 THR 99 HG22 THR 99 18.908 -43.570 -33.822 787 HG23 THR 99 HG23 THR 99 20.215 -44.211 -34.815 788 H LYS 100 H LYS 100 22.617 -40.276 -34.716 789 HA LYS 100 HA LYS 100 21.689 -38.782 -36.912 790 HB2 LYS 100 HB2 LYS 100 24.294 -39.843 -35.992 791 HB3 LYS 100 HB3 LYS 100 24.174 -39.493 -37.712 792 HG2 LYS 100 HG2 LYS 100 24.967 -37.507 -36.866 793 HG3 LYS 100 HG3 LYS 100 23.227 -37.211 -36.923 794 HD2 LYS 100 HD2 LYS 100 24.332 -38.388 -34.433 795 HD3 LYS 100 HD3 LYS 100 24.697 -36.692 -34.762 796 HE2 LYS 100 HE2 LYS 100 21.888 -37.567 -35.110 797 HE3 LYS 100 HE3 LYS 100 22.502 -37.477 -33.460 798 HZ1 LYS 100 HZ1 LYS 100 21.441 -35.408 -34.696 799 HZ2 LYS 100 HZ2 LYS 100 23.044 -35.198 -35.195 800 HZ3 LYS 100 HZ3 LYS 100 22.670 -35.238 -33.546 801 HA PRO 101 HA PRO 101 20.777 -41.712 -40.047 802 HB2 PRO 101 HB2 PRO 101 21.817 -40.543 -42.266 803 HB3 PRO 101 HB3 PRO 101 20.366 -39.942 -41.453 804 HG2 PRO 101 HG2 PRO 101 23.189 -38.964 -41.260 805 HG3 PRO 101 HG3 PRO 101 21.688 -38.030 -41.392 806 HD2 PRO 101 HD2 PRO 101 22.970 -38.401 -39.036 807 HD3 PRO 101 HD3 PRO 101 21.205 -38.250 -39.149 808 H ARG 102 H ARG 102 21.648 -43.288 -41.495 809 HA ARG 102 HA ARG 102 24.509 -43.805 -41.040 810 HB2 ARG 102 HB2 ARG 102 22.453 -45.431 -40.408 811 HB3 ARG 102 HB3 ARG 102 22.763 -45.974 -42.052 812 HG2 ARG 102 HG2 ARG 102 24.756 -45.897 -39.797 813 HG3 ARG 102 HG3 ARG 102 23.975 -47.332 -40.460 814 HD2 ARG 102 HD2 ARG 102 24.996 -46.578 -42.703 815 HD3 ARG 102 HD3 ARG 102 26.038 -45.556 -41.713 816 HE ARG 102 HE ARG 102 27.221 -47.417 -41.127 817 HH11 ARG 102 HH11 ARG 102 24.119 -48.405 -42.358 818 HH12 ARG 102 HH12 ARG 102 24.499 -50.096 -42.326 819 HH21 ARG 102 HH21 ARG 102 27.734 -49.639 -41.080 820 HH22 ARG 102 HH22 ARG 102 26.555 -50.796 -41.598 821 H ASP 103 H ASP 103 25.757 -43.345 -42.718 822 HA ASP 103 HA ASP 103 24.658 -43.679 -45.430 823 HB2 ASP 103 HB2 ASP 103 25.447 -41.359 -44.572 824 HB3 ASP 103 HB3 ASP 103 27.071 -42.003 -44.797 825 H MET 104 H MET 104 27.764 -43.821 -43.679 826 HA MET 104 HA MET 104 29.194 -45.238 -45.598 827 HB2 MET 104 HB2 MET 104 30.722 -45.848 -43.790 828 HB3 MET 104 HB3 MET 104 30.242 -44.162 -43.661 829 HG2 MET 104 HG2 MET 104 28.413 -45.138 -42.055 830 HG3 MET 104 HG3 MET 104 29.560 -46.469 -41.917 831 HE1 MET 104 HE1 MET 104 29.877 -44.738 -38.649 832 HE2 MET 104 HE2 MET 104 29.309 -46.099 -39.617 833 HE3 MET 104 HE3 MET 104 31.019 -45.963 -39.203 Start of MODEL 3 1 H1 MET 1 H MET 1 -2.367 -0.554 -2.914 2 HA MET 1 HA MET 1 -1.020 1.394 -4.666 3 HB2 MET 1 HB2 MET 1 0.479 -0.317 -3.670 4 HB3 MET 1 HB3 MET 1 -0.481 -1.572 -4.442 5 HG2 MET 1 HG2 MET 1 0.128 -0.751 -6.626 6 HG3 MET 1 HG3 MET 1 0.998 0.601 -5.905 7 HE1 MET 1 HE1 MET 1 4.320 -0.613 -6.416 8 HE2 MET 1 HE2 MET 1 3.224 -0.873 -7.773 9 HE3 MET 1 HE3 MET 1 3.024 0.540 -6.736 10 H GLN 2 H GLN 2 -3.312 1.710 -5.424 11 HA GLN 2 HA GLN 2 -3.714 0.112 -7.802 12 HB2 GLN 2 HB2 GLN 2 -6.100 -0.339 -7.287 13 HB3 GLN 2 HB3 GLN 2 -4.990 -1.190 -6.220 14 HG2 GLN 2 HG2 GLN 2 -5.421 0.316 -4.435 15 HG3 GLN 2 HG3 GLN 2 -6.317 1.405 -5.493 16 HE21 GLN 2 HE21 GLN 2 -6.731 -0.670 -3.091 17 HE22 GLN 2 HE22 GLN 2 -8.296 -1.298 -3.463 18 H GLU 3 H GLU 3 -5.205 1.077 -9.302 19 HA GLU 3 HA GLU 3 -5.916 3.864 -8.691 20 HB2 GLU 3 HB2 GLU 3 -3.773 3.455 -10.149 21 HB3 GLU 3 HB3 GLU 3 -4.938 3.129 -11.424 22 HG2 GLU 3 HG2 GLU 3 -5.045 5.646 -9.802 23 HG3 GLU 3 HG3 GLU 3 -4.013 5.496 -11.224 24 H GLN 4 H GLN 4 -8.057 3.968 -8.793 25 HA GLN 4 HA GLN 4 -9.725 2.123 -10.068 26 HB2 GLN 4 HB2 GLN 4 -10.146 4.904 -9.019 27 HB3 GLN 4 HB3 GLN 4 -11.442 4.063 -9.861 28 HG2 GLN 4 HG2 GLN 4 -10.889 2.153 -8.158 29 HG3 GLN 4 HG3 GLN 4 -10.200 3.478 -7.222 30 HE21 GLN 4 HE21 GLN 4 -11.585 3.974 -5.680 31 HE22 GLN 4 HE22 GLN 4 -13.285 4.205 -5.878 32 H VAL 5 H VAL 5 -9.875 1.751 -12.173 33 HA VAL 5 HA VAL 5 -9.669 4.036 -14.026 34 HB VAL 5 HB VAL 5 -9.101 2.280 -15.758 35 HG11 VAL 5 HG11 VAL 5 -6.738 2.036 -14.932 36 HG12 VAL 5 HG12 VAL 5 -7.365 3.685 -14.944 37 HG13 VAL 5 HG13 VAL 5 -7.263 2.789 -13.427 38 HG21 VAL 5 HG21 VAL 5 -9.947 0.458 -14.040 39 HG22 VAL 5 HG22 VAL 5 -8.676 0.101 -15.209 40 HG23 VAL 5 HG23 VAL 5 -8.256 0.487 -13.540 41 H SER 6 H SER 6 -12.074 3.066 -12.625 42 HA SER 6 HA SER 6 -14.272 2.650 -13.041 43 HB2 SER 6 HB2 SER 6 -14.038 4.580 -14.539 44 HB3 SER 6 HB3 SER 6 -13.508 3.515 -15.841 45 HG SER 6 HG SER 6 -16.004 3.216 -14.542 46 H ASN 7 H ASN 7 -12.676 0.404 -13.035 47 HA ASN 7 HA ASN 7 -13.836 -1.240 -15.188 48 HB2 ASN 7 HB2 ASN 7 -11.374 -1.141 -15.258 49 HB3 ASN 7 HB3 ASN 7 -11.305 -1.739 -13.603 50 HD21 ASN 7 HD21 ASN 7 -10.087 -3.520 -14.274 51 HD22 ASN 7 HD22 ASN 7 -10.810 -4.853 -15.102 52 H VAL 8 H VAL 8 -14.744 -3.234 -14.664 53 HA VAL 8 HA VAL 8 -15.367 -3.583 -11.805 54 HB VAL 8 HB VAL 8 -17.370 -4.873 -12.627 55 HG11 VAL 8 HG11 VAL 8 -16.916 -2.010 -12.638 56 HG12 VAL 8 HG12 VAL 8 -18.248 -2.476 -13.697 57 HG13 VAL 8 HG13 VAL 8 -18.271 -2.937 -11.994 58 HG21 VAL 8 HG21 VAL 8 -17.960 -4.980 -14.830 59 HG22 VAL 8 HG22 VAL 8 -17.120 -3.486 -15.244 60 HG23 VAL 8 HG23 VAL 8 -16.205 -4.974 -15.002 61 H ARG 9 H ARG 9 -16.204 -6.024 -11.524 62 HA ARG 9 HA ARG 9 -14.392 -7.871 -12.883 63 HB2 ARG 9 HB2 ARG 9 -14.545 -7.587 -9.876 64 HB3 ARG 9 HB3 ARG 9 -13.684 -8.860 -10.731 65 HG2 ARG 9 HG2 ARG 9 -11.921 -7.502 -10.462 66 HG3 ARG 9 HG3 ARG 9 -12.586 -6.673 -11.871 67 HD2 ARG 9 HD2 ARG 9 -13.443 -4.942 -10.615 68 HD3 ARG 9 HD3 ARG 9 -13.542 -5.917 -9.150 69 HE ARG 9 HE ARG 9 -10.849 -5.650 -9.790 70 HH11 ARG 9 HH11 ARG 9 -13.519 -3.622 -8.851 71 HH12 ARG 9 HH12 ARG 9 -12.519 -2.449 -8.060 72 HH21 ARG 9 HH21 ARG 9 -9.523 -4.113 -8.752 73 HH22 ARG 9 HH22 ARG 9 -10.246 -2.729 -8.005 74 H ALA 10 H ALA 10 -15.161 -9.940 -13.056 75 HA ALA 10 HA ALA 10 -17.895 -10.371 -12.053 76 HB1 ALA 10 HB1 ALA 10 -18.194 -10.598 -14.288 77 HB2 ALA 10 HB2 ALA 10 -16.524 -11.088 -14.575 78 HB3 ALA 10 HB3 ALA 10 -17.686 -12.251 -13.936 79 H ARG 11 H ARG 11 -18.199 -11.864 -10.540 80 HA ARG 11 HA ARG 11 -16.018 -13.731 -9.951 81 HB2 ARG 11 HB2 ARG 11 -18.395 -12.816 -8.328 82 HB3 ARG 11 HB3 ARG 11 -17.308 -14.097 -7.810 83 HG2 ARG 11 HG2 ARG 11 -16.109 -11.494 -8.572 84 HG3 ARG 11 HG3 ARG 11 -16.991 -11.588 -7.046 85 HD2 ARG 11 HD2 ARG 11 -15.579 -13.653 -6.553 86 HD3 ARG 11 HD3 ARG 11 -14.571 -13.147 -7.908 87 HE ARG 11 HE ARG 11 -14.915 -10.991 -6.130 88 HH11 ARG 11 HH11 ARG 11 -13.296 -14.063 -6.376 89 HH12 ARG 11 HH12 ARG 11 -12.001 -13.613 -5.315 90 HH21 ARG 11 HH21 ARG 11 -13.216 -10.387 -4.732 91 HH22 ARG 11 HH22 ARG 11 -11.958 -11.521 -4.381 92 H ILE 12 H ILE 12 -16.242 -15.515 -11.175 93 HA ILE 12 HA ILE 12 -18.891 -16.702 -11.526 94 HB ILE 12 HB ILE 12 -16.249 -17.465 -12.776 95 HG12 ILE 12 HG12 ILE 12 -18.601 -16.181 -14.150 96 HG13 ILE 12 HG13 ILE 12 -17.345 -15.216 -13.385 97 HG21 ILE 12 HG21 ILE 12 -17.786 -18.723 -14.361 98 HG22 ILE 12 HG22 ILE 12 -17.569 -19.409 -12.753 99 HG23 ILE 12 HG23 ILE 12 -19.040 -18.515 -13.138 100 HD11 ILE 12 HD11 ILE 12 -16.943 -17.200 -15.610 101 HD12 ILE 12 HD12 ILE 12 -16.945 -15.443 -15.762 102 HD13 ILE 12 HD13 ILE 12 -15.676 -16.247 -14.838 103 H TYR 13 H TYR 13 -19.480 -18.661 -10.722 104 HA TYR 13 HA TYR 13 -17.494 -20.237 -9.255 105 HB2 TYR 13 HB2 TYR 13 -18.454 -18.889 -7.522 106 HB3 TYR 13 HB3 TYR 13 -20.085 -19.187 -8.112 107 HD1 TYR 13 HD2 TYR 13 -17.132 -21.219 -7.030 108 HD2 TYR 13 HD1 TYR 13 -21.344 -20.640 -6.851 109 HE1 TYR 13 HE2 TYR 13 -17.325 -23.139 -5.505 110 HE2 TYR 13 HE1 TYR 13 -21.549 -22.558 -5.325 111 HH TYR 13 HH TYR 13 -19.806 -24.820 -4.968 112 H LYS 14 H LYS 14 -17.776 -22.394 -9.412 113 HA LYS 14 HA LYS 14 -19.821 -23.347 -11.222 114 HB2 LYS 14 HB2 LYS 14 -18.618 -25.388 -11.281 115 HB3 LYS 14 HB3 LYS 14 -17.404 -24.115 -11.235 116 HG2 LYS 14 HG2 LYS 14 -17.129 -24.486 -8.822 117 HG3 LYS 14 HG3 LYS 14 -18.308 -25.797 -8.905 118 HD2 LYS 14 HD2 LYS 14 -15.875 -25.795 -10.658 119 HD3 LYS 14 HD3 LYS 14 -15.794 -26.379 -8.994 120 HE2 LYS 14 HE2 LYS 14 -17.573 -27.989 -9.477 121 HE3 LYS 14 HE3 LYS 14 -17.657 -27.402 -11.138 122 HZ1 LYS 14 HZ1 LYS 14 -15.197 -28.019 -11.229 123 HZ2 LYS 14 HZ2 LYS 14 -16.324 -29.280 -11.266 124 HZ3 LYS 14 HZ3 LYS 14 -15.493 -28.930 -9.834 125 HA PRO 15 HA PRO 15 -22.699 -24.847 -8.265 126 HB2 PRO 15 HB2 PRO 15 -23.667 -27.035 -9.550 127 HB3 PRO 15 HB3 PRO 15 -24.057 -25.381 -10.039 128 HG2 PRO 15 HG2 PRO 15 -22.037 -27.268 -11.187 129 HG3 PRO 15 HG3 PRO 15 -23.167 -26.192 -12.029 130 HD2 PRO 15 HD2 PRO 15 -20.554 -25.575 -11.681 131 HD3 PRO 15 HD3 PRO 15 -21.830 -24.340 -11.723 132 H ALA 16 H ALA 16 -23.331 -26.840 -7.032 133 HA ALA 16 HA ALA 16 -20.943 -28.157 -6.079 134 HB1 ALA 16 HB1 ALA 16 -22.104 -27.917 -4.195 135 HB2 ALA 16 HB2 ALA 16 -23.609 -27.630 -5.069 136 HB3 ALA 16 HB3 ALA 16 -23.084 -29.280 -4.737 137 H LYS 17 H LYS 17 -20.644 -30.419 -5.951 138 HA LYS 17 HA LYS 17 -21.339 -31.839 -8.288 139 HB2 LYS 17 HB2 LYS 17 -19.347 -32.146 -6.614 140 HB3 LYS 17 HB3 LYS 17 -20.455 -33.237 -5.791 141 HG2 LYS 17 HG2 LYS 17 -20.056 -33.586 -8.713 142 HG3 LYS 17 HG3 LYS 17 -18.769 -34.097 -7.618 143 HD2 LYS 17 HD2 LYS 17 -21.596 -34.928 -7.103 144 HD3 LYS 17 HD3 LYS 17 -20.627 -35.786 -8.302 145 HE2 LYS 17 HE2 LYS 17 -19.723 -35.319 -5.468 146 HE3 LYS 17 HE3 LYS 17 -20.605 -36.758 -5.977 147 HZ1 LYS 17 HZ1 LYS 17 -18.599 -37.588 -6.416 148 HZ2 LYS 17 HZ2 LYS 17 -17.842 -36.076 -6.362 149 HZ3 LYS 17 HZ3 LYS 17 -18.597 -36.593 -7.786 150 H SER 18 H SER 18 -22.687 -31.780 -5.045 151 HA SER 18 HA SER 18 -24.674 -33.794 -5.836 152 HB2 SER 18 HB2 SER 18 -25.201 -33.588 -3.262 153 HB3 SER 18 HB3 SER 18 -23.818 -34.533 -3.813 154 HG SER 18 HG SER 18 -23.890 -32.223 -2.348 155 H THR 19 H THR 19 -26.192 -32.658 -6.948 156 HA THR 19 HA THR 19 -27.529 -30.472 -5.489 157 HB THR 19 HB THR 19 -28.273 -29.871 -7.969 158 HG1 THR 19 HG1 THR 19 -27.132 -31.490 -9.026 159 HG21 THR 19 HG21 THR 19 -26.834 -28.074 -7.857 160 HG22 THR 19 HG22 THR 19 -25.494 -29.049 -7.252 161 HG23 THR 19 HG23 THR 19 -26.822 -28.613 -6.178 162 H MET 20 H MET 20 -29.770 -30.411 -5.521 163 HA MET 20 HA MET 20 -31.083 -32.816 -6.608 164 HB2 MET 20 HB2 MET 20 -30.878 -32.432 -4.019 165 HB3 MET 20 HB3 MET 20 -32.209 -31.313 -4.277 166 HG2 MET 20 HG2 MET 20 -33.295 -33.265 -3.725 167 HG3 MET 20 HG3 MET 20 -33.337 -33.293 -5.486 168 HE1 MET 20 HE1 MET 20 -33.593 -35.452 -3.038 169 HE2 MET 20 HE2 MET 20 -32.386 -36.736 -3.113 170 HE3 MET 20 HE3 MET 20 -32.029 -35.239 -2.251 171 H GLN 21 H GLN 21 -30.698 -30.283 -7.963 172 HA GLN 21 HA GLN 21 -33.523 -29.585 -8.370 173 HB2 GLN 21 HB2 GLN 21 -31.194 -27.717 -8.015 174 HB3 GLN 21 HB3 GLN 21 -32.637 -27.221 -8.888 175 HG2 GLN 21 HG2 GLN 21 -32.944 -28.395 -6.174 176 HG3 GLN 21 HG3 GLN 21 -32.358 -26.739 -6.328 177 HE21 GLN 21 HE21 GLN 21 -33.839 -25.215 -6.377 178 HE22 GLN 21 HE22 GLN 21 -35.499 -25.421 -6.809 179 H SER 22 H SER 22 -34.158 -29.328 -10.463 180 HA SER 22 HA SER 22 -32.088 -29.765 -12.515 181 HB2 SER 22 HB2 SER 22 -34.910 -30.777 -12.287 182 HB3 SER 22 HB3 SER 22 -34.123 -30.662 -13.861 183 HG SER 22 HG SER 22 -33.866 -32.571 -12.042 184 H GLY 23 H GLY 23 -35.021 -28.017 -11.663 185 HA2 GLY 23 HA2 GLY 23 -35.695 -25.909 -12.334 186 HA3 GLY 23 HA3 GLY 23 -34.253 -25.808 -13.334 187 H HIS 24 H HIS 24 -37.615 -26.385 -13.265 188 HA HIS 24 HA HIS 24 -37.701 -27.533 -15.933 189 HB2 HIS 24 HB2 HIS 24 -39.278 -28.128 -13.980 190 HB3 HIS 24 HB3 HIS 24 -40.089 -26.610 -14.350 191 HD1 HIS 24 HD1 HIS 24 -39.508 -27.179 -17.554 192 HD2 HIS 24 HD2 HIS 24 -41.616 -29.497 -14.827 193 HE1 HIS 24 HE1 HIS 24 -41.067 -28.587 -18.934 194 H SER 25 H SER 25 -38.853 -24.579 -14.313 195 HA SER 25 HA SER 25 -39.181 -23.329 -16.951 196 HB2 SER 25 HB2 SER 25 -40.396 -22.801 -14.255 197 HB3 SER 25 HB3 SER 25 -40.363 -21.528 -15.475 198 HG SER 25 HG SER 25 -41.463 -22.980 -16.881 199 H LYS 26 H LYS 26 -36.578 -23.652 -16.064 200 HA LYS 26 HA LYS 26 -35.583 -21.018 -16.251 201 HB2 LYS 26 HB2 LYS 26 -34.483 -20.853 -14.046 202 HB3 LYS 26 HB3 LYS 26 -36.238 -20.832 -13.921 203 HG2 LYS 26 HG2 LYS 26 -36.124 -23.288 -13.399 204 HG3 LYS 26 HG3 LYS 26 -34.372 -23.100 -13.279 205 HD2 LYS 26 HD2 LYS 26 -34.519 -21.759 -11.390 206 HD3 LYS 26 HD3 LYS 26 -36.193 -21.307 -11.720 207 HE2 LYS 26 HE2 LYS 26 -35.383 -24.121 -11.039 208 HE3 LYS 26 HE3 LYS 26 -35.790 -22.930 -9.802 209 HZ1 LYS 26 HZ1 LYS 26 -37.699 -23.239 -11.975 210 HZ2 LYS 26 HZ2 LYS 26 -37.968 -23.000 -10.324 211 HZ3 LYS 26 HZ3 LYS 26 -37.578 -24.540 -10.902 212 H LEU 27 H LEU 27 -33.366 -20.965 -16.647 213 HA LEU 27 HA LEU 27 -32.007 -23.578 -16.665 214 HB2 LEU 27 HB2 LEU 27 -32.317 -21.555 -18.825 215 HB3 LEU 27 HB3 LEU 27 -30.806 -22.458 -18.733 216 HG LEU 27 HG LEU 27 -33.499 -23.796 -18.896 217 HD11 LEU 27 HD11 LEU 27 -33.367 -23.889 -21.212 218 HD12 LEU 27 HD12 LEU 27 -31.665 -23.432 -21.234 219 HD13 LEU 27 HD13 LEU 27 -32.895 -22.229 -20.848 220 HD21 LEU 27 HD21 LEU 27 -31.591 -25.399 -20.048 221 HD22 LEU 27 HD22 LEU 27 -32.215 -25.557 -18.406 222 HD23 LEU 27 HD23 LEU 27 -30.723 -24.665 -18.700 223 H LYS 28 H LYS 28 -30.697 -23.287 -14.928 224 HA LYS 28 HA LYS 28 -28.496 -21.437 -15.249 225 HB2 LYS 28 HB2 LYS 28 -28.804 -20.607 -12.856 226 HB3 LYS 28 HB3 LYS 28 -29.883 -19.939 -14.073 227 HG2 LYS 28 HG2 LYS 28 -31.721 -20.981 -13.219 228 HG3 LYS 28 HG3 LYS 28 -30.790 -22.334 -12.570 229 HD2 LYS 28 HD2 LYS 28 -30.293 -19.656 -11.399 230 HD3 LYS 28 HD3 LYS 28 -31.834 -20.429 -11.020 231 HE2 LYS 28 HE2 LYS 28 -29.109 -21.664 -10.624 232 HE3 LYS 28 HE3 LYS 28 -30.094 -20.936 -9.356 233 HZ1 LYS 28 HZ1 LYS 28 -31.168 -22.840 -9.118 234 HZ2 LYS 28 HZ2 LYS 28 -30.173 -23.558 -10.282 235 HZ3 LYS 28 HZ3 LYS 28 -31.631 -22.837 -10.746 236 H ALA 29 H ALA 29 -26.736 -22.587 -14.848 237 HA ALA 29 HA ALA 29 -26.866 -24.687 -12.781 238 HB1 ALA 29 HB1 ALA 29 -24.782 -25.011 -14.807 239 HB2 ALA 29 HB2 ALA 29 -25.921 -26.187 -14.150 240 HB3 ALA 29 HB3 ALA 29 -26.424 -25.100 -15.444 241 H TRP 30 H TRP 30 -24.961 -22.135 -14.260 242 HA TRP 30 HA TRP 30 -22.941 -22.412 -12.146 243 HB2 TRP 30 HB2 TRP 30 -22.915 -21.177 -14.878 244 HB3 TRP 30 HB3 TRP 30 -21.759 -20.636 -13.663 245 HD1 TRP 30 HD1 TRP 30 -22.861 -23.995 -15.278 246 HE1 TRP 30 HE1 TRP 30 -20.778 -25.493 -15.477 247 HE3 TRP 30 HE3 TRP 30 -19.442 -20.933 -13.026 248 HZ2 TRP 30 HZ2 TRP 30 -18.047 -25.391 -14.770 249 HZ3 TRP 30 HZ3 TRP 30 -17.116 -21.709 -12.826 250 HH2 TRP 30 HH2 TRP 30 -16.435 -23.892 -13.681 251 H LYS 31 H LYS 31 -22.043 -20.320 -11.301 252 HA LYS 31 HA LYS 31 -24.216 -18.365 -10.920 253 HB2 LYS 31 HB2 LYS 31 -23.766 -19.662 -8.884 254 HB3 LYS 31 HB3 LYS 31 -22.073 -19.189 -8.951 255 HG2 LYS 31 HG2 LYS 31 -22.527 -16.999 -8.342 256 HG3 LYS 31 HG3 LYS 31 -24.224 -17.116 -8.813 257 HD2 LYS 31 HD2 LYS 31 -24.821 -18.219 -6.881 258 HD3 LYS 31 HD3 LYS 31 -23.199 -18.866 -6.625 259 HE2 LYS 31 HE2 LYS 31 -23.570 -15.920 -6.500 260 HE3 LYS 31 HE3 LYS 31 -24.169 -16.888 -5.155 261 HZ1 LYS 31 HZ1 LYS 31 -22.082 -17.510 -4.547 262 HZ2 LYS 31 HZ2 LYS 31 -21.723 -15.991 -5.199 263 HZ3 LYS 31 HZ3 LYS 31 -21.449 -17.389 -6.112 264 H LEU 32 H LEU 32 -23.650 -16.166 -10.761 265 HA LEU 32 HA LEU 32 -20.891 -15.403 -11.276 266 HB2 LEU 32 HB2 LEU 32 -21.927 -15.789 -13.496 267 HB3 LEU 32 HB3 LEU 32 -23.131 -14.561 -13.111 268 HG LEU 32 HG LEU 32 -21.183 -13.893 -14.624 269 HD11 LEU 32 HD11 LEU 32 -21.794 -11.822 -14.112 270 HD12 LEU 32 HD12 LEU 32 -21.041 -11.924 -12.521 271 HD13 LEU 32 HD13 LEU 32 -22.694 -12.493 -12.752 272 HD21 LEU 32 HD21 LEU 32 -19.076 -13.694 -13.822 273 HD22 LEU 32 HD22 LEU 32 -19.610 -14.999 -12.761 274 HD23 LEU 32 HD23 LEU 32 -19.615 -13.332 -12.181 275 H GLU 33 H GLU 33 -20.376 -13.589 -10.223 276 HA GLU 33 HA GLU 33 -22.541 -11.764 -9.427 277 HB2 GLU 33 HB2 GLU 33 -20.657 -13.250 -7.720 278 HB3 GLU 33 HB3 GLU 33 -20.789 -11.537 -7.347 279 HG2 GLU 33 HG2 GLU 33 -23.333 -12.972 -7.727 280 HG3 GLU 33 HG3 GLU 33 -22.389 -13.426 -6.310 281 H PHE 34 H PHE 34 -22.131 -9.993 -10.594 282 HA PHE 34 HA PHE 34 -19.388 -9.140 -11.064 283 HB2 PHE 34 HB2 PHE 34 -20.296 -7.591 -12.650 284 HB3 PHE 34 HB3 PHE 34 -21.132 -9.123 -12.880 285 HD1 PHE 34 HD2 PHE 34 -23.441 -9.400 -11.964 286 HD2 PHE 34 HD1 PHE 34 -21.464 -5.633 -12.082 287 HE1 PHE 34 HE2 PHE 34 -25.605 -8.260 -11.693 288 HE2 PHE 34 HE1 PHE 34 -23.625 -4.487 -11.810 289 HZ PHE 34 HZ PHE 34 -25.698 -5.801 -11.616 290 H GLU 35 H GLU 35 -18.484 -7.260 -10.308 291 HA GLU 35 HA GLU 35 -19.242 -6.328 -7.794 292 HB2 GLU 35 HB2 GLU 35 -17.270 -5.563 -9.840 293 HB3 GLU 35 HB3 GLU 35 -17.759 -4.255 -8.773 294 HG2 GLU 35 HG2 GLU 35 -15.727 -5.599 -8.090 295 HG3 GLU 35 HG3 GLU 35 -16.974 -5.358 -6.868 296 HA PRO 36 HA PRO 36 -22.322 -3.268 -8.414 297 HB2 PRO 36 HB2 PRO 36 -21.592 -1.339 -6.647 298 HB3 PRO 36 HB3 PRO 36 -22.271 -2.893 -6.148 299 HG2 PRO 36 HG2 PRO 36 -19.411 -2.012 -6.226 300 HG3 PRO 36 HG3 PRO 36 -20.265 -2.929 -4.971 301 HD2 PRO 36 HD2 PRO 36 -18.652 -4.111 -6.797 302 HD3 PRO 36 HD3 PRO 36 -20.084 -4.917 -6.125 303 H SER 37 H SER 37 -19.080 -2.630 -9.172 304 HA SER 37 HA SER 37 -18.052 -1.149 -10.558 305 HB2 SER 37 HB2 SER 37 -20.106 -1.812 -11.965 306 HB3 SER 37 HB3 SER 37 -20.768 -0.246 -11.499 307 HG SER 37 HG SER 37 -19.619 0.520 -13.072 308 H CYS 38 H CYS 38 -19.050 -0.342 -7.867 309 HA CYS 38 HA CYS 38 -19.015 1.504 -6.541 310 HB2 CYS 38 HB2 CYS 38 -17.017 1.939 -8.209 311 HB3 CYS 38 HB3 CYS 38 -18.070 3.218 -8.801 312 HG CYS 38 HG CYS 38 -18.117 3.575 -5.611 313 H THR 39 H THR 39 -21.369 0.865 -8.114 314 HA THR 39 HA THR 39 -22.813 3.316 -7.696 315 HB THR 39 HB THR 39 -23.806 3.012 -10.140 316 HG1 THR 39 HG1 THR 39 -21.073 2.384 -10.581 317 HG21 THR 39 HG21 THR 39 -22.612 4.919 -10.790 318 HG22 THR 39 HG22 THR 39 -21.175 4.439 -9.887 319 HG23 THR 39 HG23 THR 39 -22.610 5.002 -9.030 320 H GLN 40 H GLN 40 -25.164 3.032 -8.084 321 HA GLN 40 HA GLN 40 -25.942 0.211 -7.736 322 HB2 GLN 40 HB2 GLN 40 -27.316 2.656 -6.609 323 HB3 GLN 40 HB3 GLN 40 -27.787 0.983 -6.340 324 HG2 GLN 40 HG2 GLN 40 -25.614 0.595 -5.228 325 HG3 GLN 40 HG3 GLN 40 -25.252 2.310 -5.414 326 HE21 GLN 40 HE21 GLN 40 -25.755 0.453 -3.065 327 HE22 GLN 40 HE22 GLN 40 -26.905 1.308 -2.101 328 H TYR 41 H TYR 41 -25.731 1.176 -10.288 329 HA TYR 41 HA TYR 41 -28.377 2.026 -11.154 330 HB2 TYR 41 HB2 TYR 41 -26.100 2.863 -12.090 331 HB3 TYR 41 HB3 TYR 41 -26.107 1.362 -13.007 332 HD1 TYR 41 HD2 TYR 41 -28.663 3.970 -12.181 333 HD2 TYR 41 HD1 TYR 41 -26.740 1.666 -15.196 334 HE1 TYR 41 HE2 TYR 41 -30.087 5.025 -13.886 335 HE2 TYR 41 HE1 TYR 41 -28.158 2.715 -16.910 336 HH TYR 41 HH TYR 41 -30.589 3.862 -16.837 337 H THR 42 H THR 42 -29.421 0.042 -10.453 338 HA THR 42 HA THR 42 -29.174 -2.071 -12.485 339 HB THR 42 HB THR 42 -29.844 -3.697 -10.623 340 HG1 THR 42 HG1 THR 42 -29.208 -2.999 -8.520 341 HG21 THR 42 HG21 THR 42 -27.188 -2.461 -11.088 342 HG22 THR 42 HG22 THR 42 -27.715 -4.130 -11.305 343 HG23 THR 42 HG23 THR 42 -27.345 -3.525 -9.691 344 H GLU 43 H GLU 43 -31.022 -2.386 -13.527 345 HA GLU 43 HA GLU 43 -33.554 -2.247 -12.105 346 HB2 GLU 43 HB2 GLU 43 -32.692 -0.300 -14.187 347 HB3 GLU 43 HB3 GLU 43 -34.362 -0.849 -14.225 348 HG2 GLU 43 HG2 GLU 43 -34.712 -0.070 -11.970 349 HG3 GLU 43 HG3 GLU 43 -33.015 0.383 -11.833 350 HA PRO 44 HA PRO 44 -33.198 -5.600 -15.319 351 HB2 PRO 44 HB2 PRO 44 -33.941 -7.613 -13.655 352 HB3 PRO 44 HB3 PRO 44 -32.266 -7.072 -13.822 353 HG2 PRO 44 HG2 PRO 44 -34.273 -6.395 -11.707 354 HG3 PRO 44 HG3 PRO 44 -32.555 -6.797 -11.531 355 HD2 PRO 44 HD2 PRO 44 -33.470 -4.249 -11.460 356 HD3 PRO 44 HD3 PRO 44 -31.869 -4.672 -12.102 357 H LEU 45 H LEU 45 -34.977 -7.407 -15.641 358 HA LEU 45 HA LEU 45 -37.622 -6.251 -15.079 359 HB2 LEU 45 HB2 LEU 45 -36.604 -5.940 -17.469 360 HB3 LEU 45 HB3 LEU 45 -37.082 -7.623 -17.674 361 HG LEU 45 HG LEU 45 -39.097 -5.624 -16.739 362 HD11 LEU 45 HD11 LEU 45 -39.669 -5.068 -19.018 363 HD12 LEU 45 HD12 LEU 45 -38.351 -6.071 -19.625 364 HD13 LEU 45 HD13 LEU 45 -37.996 -4.614 -18.698 365 HD21 LEU 45 HD21 LEU 45 -39.033 -8.346 -17.836 366 HD22 LEU 45 HD22 LEU 45 -40.288 -7.304 -18.508 367 HD23 LEU 45 HD23 LEU 45 -40.207 -7.577 -16.767 368 H MET 46 H MET 46 -39.339 -7.725 -14.906 369 HA MET 46 HA MET 46 -38.836 -10.558 -15.177 370 HB2 MET 46 HB2 MET 46 -38.041 -9.664 -12.831 371 HB3 MET 46 HB3 MET 46 -39.761 -9.698 -12.466 372 HG2 MET 46 HG2 MET 46 -39.890 -12.022 -12.772 373 HG3 MET 46 HG3 MET 46 -38.320 -12.085 -13.568 374 HE1 MET 46 HE1 MET 46 -36.520 -13.098 -12.555 375 HE2 MET 46 HE2 MET 46 -36.330 -13.495 -10.848 376 HE3 MET 46 HE3 MET 46 -37.647 -14.211 -11.778 377 H ASN 47 H ASN 47 -40.817 -11.842 -14.576 378 HA ASN 47 HA ASN 47 -43.236 -10.259 -15.152 379 HB2 ASN 47 HB2 ASN 47 -44.101 -12.472 -16.120 380 HB3 ASN 47 HB3 ASN 47 -42.879 -11.610 -17.052 381 HD21 ASN 47 HD21 ASN 47 -40.844 -12.473 -17.267 382 HD22 ASN 47 HD22 ASN 47 -40.459 -14.092 -16.801 383 H TRP 48 H TRP 48 -42.066 -13.217 -13.563 384 HA TRP 48 HA TRP 48 -44.440 -13.758 -12.144 385 HB2 TRP 48 HB2 TRP 48 -42.312 -15.230 -12.564 386 HB3 TRP 48 HB3 TRP 48 -41.752 -14.515 -11.055 387 HD1 TRP 48 HD1 TRP 48 -42.434 -15.778 -8.936 388 HE1 TRP 48 HE1 TRP 48 -44.202 -17.551 -8.336 389 HE3 TRP 48 HE3 TRP 48 -44.926 -15.983 -13.396 390 HZ2 TRP 48 HZ2 TRP 48 -46.366 -18.863 -9.588 391 HZ3 TRP 48 HZ3 TRP 48 -46.834 -17.523 -13.612 392 HH2 TRP 48 HH2 TRP 48 -47.536 -18.932 -11.746 393 H THR 49 H THR 49 -45.348 -12.374 -10.770 394 HA THR 49 HA THR 49 -44.096 -10.264 -9.455 395 HB THR 49 HB THR 49 -46.093 -10.237 -7.954 396 HG1 THR 49 HG1 THR 49 -47.557 -11.844 -8.051 397 HG21 THR 49 HG21 THR 49 -47.764 -9.922 -9.812 398 HG22 THR 49 HG22 THR 49 -46.527 -10.505 -10.926 399 HG23 THR 49 HG23 THR 49 -46.257 -9.026 -10.003 400 H GLY 50 H GLY 50 -43.038 -10.034 -7.560 401 HA2 GLY 50 HA2 GLY 50 -41.824 -12.232 -6.323 402 HA3 GLY 50 HA3 GLY 50 -41.902 -10.610 -5.651 403 H SER 51 H SER 51 -42.054 -13.102 -4.216 404 HA SER 51 HA SER 51 -44.725 -13.724 -3.520 405 HB2 SER 51 HB2 SER 51 -43.127 -15.377 -2.997 406 HB3 SER 51 HB3 SER 51 -42.067 -14.221 -2.190 407 HG SER 51 HG SER 51 -43.929 -15.739 -1.100 408 H HIS 52 H HIS 52 -42.294 -11.614 -2.031 409 HA HIS 52 HA HIS 52 -44.438 -10.444 -0.381 410 HB2 HIS 52 HB2 HIS 52 -41.539 -10.951 0.194 411 HB3 HIS 52 HB3 HIS 52 -42.383 -9.650 1.027 412 HD1 HIS 52 HD1 HIS 52 -43.911 -10.289 2.931 413 HD2 HIS 52 HD2 HIS 52 -42.545 -13.572 0.783 414 HE1 HIS 52 HE1 HIS 52 -44.608 -12.303 4.265 415 H ASP 53 H ASP 53 -43.596 -9.759 -3.139 416 HA ASP 53 HA ASP 53 -43.141 -7.934 -4.426 417 HB2 ASP 53 HB2 ASP 53 -44.231 -6.592 -1.947 418 HB3 ASP 53 HB3 ASP 53 -43.920 -5.743 -3.458 419 H THR 54 H THR 54 -40.964 -8.978 -2.826 420 HA THR 54 HA THR 54 -39.356 -6.524 -2.538 421 HB THR 54 HB THR 54 -37.954 -7.785 -0.901 422 HG1 THR 54 HG1 THR 54 -38.387 -9.820 -0.512 423 HG21 THR 54 HG21 THR 54 -39.165 -6.840 0.722 424 HG22 THR 54 HG22 THR 54 -40.503 -7.960 0.465 425 HG23 THR 54 HG23 THR 54 -40.384 -6.491 -0.504 426 H LYS 55 H LYS 55 -37.986 -6.363 -4.181 427 HA LYS 55 HA LYS 55 -36.731 -8.823 -5.211 428 HB2 LYS 55 HB2 LYS 55 -38.297 -7.458 -6.741 429 HB3 LYS 55 HB3 LYS 55 -36.997 -6.274 -6.787 430 HG2 LYS 55 HG2 LYS 55 -35.487 -8.095 -7.604 431 HG3 LYS 55 HG3 LYS 55 -36.913 -9.125 -7.742 432 HD2 LYS 55 HD2 LYS 55 -36.963 -6.439 -9.028 433 HD3 LYS 55 HD3 LYS 55 -36.029 -7.725 -9.795 434 HE2 LYS 55 HE2 LYS 55 -38.084 -7.995 -10.796 435 HE3 LYS 55 HE3 LYS 55 -38.205 -9.121 -9.446 436 HZ1 LYS 55 HZ1 LYS 55 -39.102 -6.374 -9.011 437 HZ2 LYS 55 HZ2 LYS 55 -39.703 -7.819 -8.371 438 HZ3 LYS 55 HZ3 LYS 55 -40.083 -7.375 -9.958 439 H GLN 56 H GLN 56 -35.050 -8.647 -3.644 440 HA GLN 56 HA GLN 56 -33.135 -6.481 -4.218 441 HB2 GLN 56 HB2 GLN 56 -32.285 -6.897 -1.878 442 HB3 GLN 56 HB3 GLN 56 -33.883 -6.171 -1.984 443 HG2 GLN 56 HG2 GLN 56 -34.949 -8.079 -1.258 444 HG3 GLN 56 HG3 GLN 56 -33.618 -9.131 -1.740 445 HE21 GLN 56 HE21 GLN 56 -31.603 -8.905 -0.496 446 HE22 GLN 56 HE22 GLN 56 -31.718 -8.571 1.194 447 H GLN 57 H GLN 57 -32.829 -8.378 -5.934 448 HA GLN 57 HA GLN 57 -31.007 -10.413 -4.896 449 HB2 GLN 57 HB2 GLN 57 -32.532 -11.390 -6.371 450 HB3 GLN 57 HB3 GLN 57 -32.465 -10.036 -7.491 451 HG2 GLN 57 HG2 GLN 57 -30.683 -10.853 -8.582 452 HG3 GLN 57 HG3 GLN 57 -29.933 -11.472 -7.112 453 HE21 GLN 57 HE21 GLN 57 -31.324 -12.329 -9.963 454 HE22 GLN 57 HE22 GLN 57 -31.775 -13.953 -9.588 455 H VAL 58 H VAL 58 -28.861 -10.368 -5.181 456 HA VAL 58 HA VAL 58 -27.754 -8.211 -6.859 457 HB VAL 58 HB VAL 58 -25.714 -8.423 -5.364 458 HG11 VAL 58 HG11 VAL 58 -27.431 -6.605 -5.248 459 HG12 VAL 58 HG12 VAL 58 -28.221 -7.516 -3.961 460 HG13 VAL 58 HG13 VAL 58 -26.580 -6.911 -3.735 461 HG21 VAL 58 HG21 VAL 58 -27.102 -10.608 -4.364 462 HG22 VAL 58 HG22 VAL 58 -25.651 -9.878 -3.675 463 HG23 VAL 58 HG23 VAL 58 -27.244 -9.384 -3.100 464 H CYS 59 H CYS 59 -27.697 -11.595 -6.096 465 HA CYS 59 HA CYS 59 -25.315 -12.126 -7.649 466 HB2 CYS 59 HB2 CYS 59 -27.295 -14.122 -6.544 467 HB3 CYS 59 HB3 CYS 59 -25.638 -14.433 -7.050 468 HG CYS 59 HG CYS 59 -25.694 -14.593 -4.284 469 H LEU 60 H LEU 60 -25.219 -13.121 -9.642 470 HA LEU 60 HA LEU 60 -27.768 -13.264 -11.113 471 HB2 LEU 60 HB2 LEU 60 -26.593 -11.503 -12.082 472 HB3 LEU 60 HB3 LEU 60 -25.044 -12.329 -11.929 473 HG LEU 60 HG LEU 60 -25.652 -13.836 -13.746 474 HD11 LEU 60 HD11 LEU 60 -28.279 -12.482 -13.453 475 HD12 LEU 60 HD12 LEU 60 -27.905 -14.172 -13.791 476 HD13 LEU 60 HD13 LEU 60 -27.766 -12.967 -15.070 477 HD21 LEU 60 HD21 LEU 60 -25.938 -10.892 -14.305 478 HD22 LEU 60 HD22 LEU 60 -25.800 -12.109 -15.574 479 HD23 LEU 60 HD23 LEU 60 -24.485 -11.884 -14.419 480 H SER 61 H SER 61 -28.328 -15.199 -11.850 481 HA SER 61 HA SER 61 -26.372 -17.364 -11.765 482 HB2 SER 61 HB2 SER 61 -28.297 -18.861 -11.949 483 HB3 SER 61 HB3 SER 61 -28.562 -17.689 -10.659 484 HG SER 61 HG SER 61 -29.622 -17.591 -13.291 485 H PHE 62 H PHE 62 -25.980 -18.748 -13.519 486 HA PHE 62 HA PHE 62 -26.948 -17.847 -16.138 487 HB2 PHE 62 HB2 PHE 62 -24.144 -17.959 -15.178 488 HB3 PHE 62 HB3 PHE 62 -24.440 -18.556 -16.808 489 HD1 PHE 62 HD1 PHE 62 -25.867 -16.976 -18.332 490 HD2 PHE 62 HD2 PHE 62 -23.743 -15.717 -14.865 491 HE1 PHE 62 HE1 PHE 62 -25.858 -14.667 -19.181 492 HE2 PHE 62 HE2 PHE 62 -23.731 -13.405 -15.707 493 HZ PHE 62 HZ PHE 62 -24.791 -12.878 -17.868 494 H THR 63 H THR 63 -26.801 -19.454 -17.816 495 HA THR 63 HA THR 63 -27.614 -22.011 -16.987 496 HB THR 63 HB THR 63 -26.452 -21.699 -19.710 497 HG1 THR 63 HG1 THR 63 -28.437 -20.543 -20.285 498 HG21 THR 63 HG21 THR 63 -27.576 -23.687 -19.600 499 HG22 THR 63 HG22 THR 63 -28.910 -22.642 -20.087 500 HG23 THR 63 HG23 THR 63 -28.719 -23.098 -18.394 501 H THR 64 H THR 64 -24.555 -20.963 -18.486 502 HA THR 64 HA THR 64 -23.177 -23.122 -17.082 503 HB THR 64 HB THR 64 -21.939 -23.782 -19.118 504 HG1 THR 64 HG1 THR 64 -22.786 -23.085 -21.145 505 HG21 THR 64 HG21 THR 64 -24.090 -24.908 -18.305 506 HG22 THR 64 HG22 THR 64 -23.582 -25.236 -19.961 507 HG23 THR 64 HG23 THR 64 -24.882 -24.087 -19.649 508 H ARG 65 H ARG 65 -20.706 -22.930 -17.650 509 HA ARG 65 HA ARG 65 -19.862 -20.398 -16.725 510 HB2 ARG 65 HB2 ARG 65 -17.568 -21.261 -17.141 511 HB3 ARG 65 HB3 ARG 65 -18.569 -22.369 -16.211 512 HG2 ARG 65 HG2 ARG 65 -17.804 -23.903 -17.646 513 HG3 ARG 65 HG3 ARG 65 -19.031 -23.248 -18.732 514 HD2 ARG 65 HD2 ARG 65 -17.504 -22.149 -20.019 515 HD3 ARG 65 HD3 ARG 65 -16.389 -21.902 -18.675 516 HE ARG 65 HE ARG 65 -16.626 -24.649 -19.475 517 HH11 ARG 65 HH11 ARG 65 -15.016 -21.625 -20.089 518 HH12 ARG 65 HH12 ARG 65 -13.622 -22.362 -20.808 519 HH21 ARG 65 HH21 ARG 65 -14.797 -25.633 -20.418 520 HH22 ARG 65 HH22 ARG 65 -13.499 -24.643 -20.995 521 H GLU 66 H GLU 66 -20.080 -21.832 -19.917 522 HA GLU 66 HA GLU 66 -18.471 -20.184 -21.415 523 HB2 GLU 66 HB2 GLU 66 -19.749 -22.130 -22.287 524 HB3 GLU 66 HB3 GLU 66 -21.216 -21.163 -22.218 525 HG2 GLU 66 HG2 GLU 66 -19.926 -19.521 -23.736 526 HG3 GLU 66 HG3 GLU 66 -18.864 -20.893 -24.041 527 H LEU 67 H LEU 67 -21.855 -19.604 -20.490 528 HA LEU 67 HA LEU 67 -22.058 -17.078 -21.741 529 HB2 LEU 67 HB2 LEU 67 -23.692 -18.776 -20.095 530 HB3 LEU 67 HB3 LEU 67 -23.810 -17.104 -19.550 531 HG LEU 67 HG LEU 67 -24.295 -16.571 -22.032 532 HD11 LEU 67 HD11 LEU 67 -25.371 -18.388 -23.256 533 HD12 LEU 67 HD12 LEU 67 -24.947 -19.514 -21.966 534 HD13 LEU 67 HD13 LEU 67 -23.677 -18.753 -22.924 535 HD21 LEU 67 HD21 LEU 67 -26.728 -17.337 -21.655 536 HD22 LEU 67 HD22 LEU 67 -26.019 -16.187 -20.520 537 HD23 LEU 67 HD23 LEU 67 -26.148 -17.892 -20.084 538 H ALA 68 H ALA 68 -21.251 -18.058 -18.436 539 HA ALA 68 HA ALA 68 -21.178 -15.571 -17.213 540 HB1 ALA 68 HB1 ALA 68 -20.375 -16.693 -15.453 541 HB2 ALA 68 HB2 ALA 68 -20.590 -18.132 -16.452 542 HB3 ALA 68 HB3 ALA 68 -19.014 -17.342 -16.369 543 H ILE 69 H ILE 69 -18.532 -17.278 -18.877 544 HA ILE 69 HA ILE 69 -16.709 -15.090 -18.584 545 HB ILE 69 HB ILE 69 -16.575 -17.549 -20.331 546 HG12 ILE 69 HG12 ILE 69 -14.587 -17.553 -18.338 547 HG13 ILE 69 HG13 ILE 69 -16.069 -17.051 -17.533 548 HG21 ILE 69 HG21 ILE 69 -14.813 -15.194 -20.099 549 HG22 ILE 69 HG22 ILE 69 -14.016 -16.767 -20.102 550 HG23 ILE 69 HG23 ILE 69 -15.057 -16.301 -21.448 551 HD11 ILE 69 HD11 ILE 69 -16.955 -19.092 -17.656 552 HD12 ILE 69 HD12 ILE 69 -16.409 -19.336 -19.316 553 HD13 ILE 69 HD13 ILE 69 -15.303 -19.623 -17.972 554 H ALA 70 H ALA 70 -18.895 -16.223 -21.087 555 HA ALA 70 HA ALA 70 -17.933 -14.592 -23.185 556 HB1 ALA 70 HB1 ALA 70 -20.478 -16.071 -22.680 557 HB2 ALA 70 HB2 ALA 70 -20.363 -14.954 -24.041 558 HB3 ALA 70 HB3 ALA 70 -19.260 -16.326 -23.929 559 H TYR 71 H TYR 71 -19.984 -13.970 -20.463 560 HA TYR 71 HA TYR 71 -21.099 -11.538 -21.541 561 HB2 TYR 71 HB2 TYR 71 -22.319 -12.975 -19.905 562 HB3 TYR 71 HB3 TYR 71 -21.129 -12.535 -18.686 563 HD1 TYR 71 HD2 TYR 71 -22.663 -10.326 -21.247 564 HD2 TYR 71 HD1 TYR 71 -22.427 -11.356 -17.126 565 HE1 TYR 71 HE2 TYR 71 -23.986 -8.332 -20.680 566 HE2 TYR 71 HE1 TYR 71 -23.752 -9.366 -16.547 567 HH TYR 71 HH TYR 71 -24.672 -6.997 -18.992 568 H ALA 72 H ALA 72 -18.836 -12.321 -18.901 569 HA ALA 72 HA ALA 72 -18.151 -9.717 -18.200 570 HB1 ALA 72 HB1 ALA 72 -17.525 -12.065 -17.170 571 HB2 ALA 72 HB2 ALA 72 -16.048 -11.817 -18.103 572 HB3 ALA 72 HB3 ALA 72 -16.529 -10.637 -16.883 573 H VAL 73 H VAL 73 -16.595 -11.887 -20.549 574 HA VAL 73 HA VAL 73 -14.545 -10.123 -21.320 575 HB VAL 73 HB VAL 73 -15.846 -12.327 -22.925 576 HG11 VAL 73 HG11 VAL 73 -13.653 -12.318 -24.148 577 HG12 VAL 73 HG12 VAL 73 -14.679 -10.912 -24.439 578 HG13 VAL 73 HG13 VAL 73 -13.295 -10.785 -23.352 579 HG21 VAL 73 HG21 VAL 73 -14.237 -13.792 -22.071 580 HG22 VAL 73 HG22 VAL 73 -13.227 -12.479 -21.468 581 HG23 VAL 73 HG23 VAL 73 -14.751 -12.859 -20.666 582 H ALA 74 H ALA 74 -17.882 -10.422 -22.314 583 HA ALA 74 HA ALA 74 -17.900 -9.085 -24.726 584 HB1 ALA 74 HB1 ALA 74 -19.813 -10.059 -23.043 585 HB2 ALA 74 HB2 ALA 74 -20.110 -8.322 -22.967 586 HB3 ALA 74 HB3 ALA 74 -20.129 -9.154 -24.522 587 H HIS 75 H HIS 75 -17.488 -7.800 -21.508 588 HA HIS 75 HA HIS 75 -17.255 -5.098 -22.664 589 HB2 HIS 75 HB2 HIS 75 -18.506 -6.039 -20.121 590 HB3 HIS 75 HB3 HIS 75 -17.731 -4.457 -20.140 591 HD1 HIS 75 HD1 HIS 75 -19.367 -5.442 -23.292 592 HD2 HIS 75 HD2 HIS 75 -20.369 -3.376 -19.830 593 HE1 HIS 75 HE1 HIS 75 -21.494 -4.215 -23.833 594 H LYS 76 H LYS 76 -15.246 -7.269 -22.247 595 HA LYS 76 HA LYS 76 -13.115 -7.547 -21.489 596 HB2 LYS 76 HB2 LYS 76 -13.379 -4.566 -21.728 597 HB3 LYS 76 HB3 LYS 76 -11.883 -5.283 -21.145 598 HG2 LYS 76 HG2 LYS 76 -11.410 -5.129 -23.365 599 HG3 LYS 76 HG3 LYS 76 -12.125 -6.743 -23.322 600 HD2 LYS 76 HD2 LYS 76 -13.196 -5.734 -25.123 601 HD3 LYS 76 HD3 LYS 76 -14.349 -5.525 -23.803 602 HE2 LYS 76 HE2 LYS 76 -14.281 -3.429 -24.826 603 HE3 LYS 76 HE3 LYS 76 -13.215 -3.255 -23.433 604 HZ1 LYS 76 HZ1 LYS 76 -12.614 -2.863 -26.141 605 HZ2 LYS 76 HZ2 LYS 76 -11.685 -4.163 -25.587 606 HZ3 LYS 76 HZ3 LYS 76 -11.597 -2.667 -24.803 607 H ILE 77 H ILE 77 -14.791 -8.076 -19.494 608 HA ILE 77 HA ILE 77 -13.832 -6.585 -17.151 609 HB ILE 77 HB ILE 77 -16.140 -8.523 -17.355 610 HG12 ILE 77 HG12 ILE 77 -16.237 -5.526 -16.996 611 HG13 ILE 77 HG13 ILE 77 -16.392 -6.313 -18.562 612 HG21 ILE 77 HG21 ILE 77 -15.941 -8.645 -15.140 613 HG22 ILE 77 HG22 ILE 77 -14.738 -7.357 -15.104 614 HG23 ILE 77 HG23 ILE 77 -16.456 -6.959 -15.093 615 HD11 ILE 77 HD11 ILE 77 -18.242 -6.533 -16.207 616 HD12 ILE 77 HD12 ILE 77 -18.574 -5.822 -17.787 617 HD13 ILE 77 HD13 ILE 77 -18.348 -7.564 -17.633 618 H ASP 78 H ASP 78 -12.702 -7.554 -15.538 619 HA ASP 78 HA ASP 78 -11.347 -9.991 -16.127 620 HB2 ASP 78 HB2 ASP 78 -11.356 -8.066 -13.834 621 HB3 ASP 78 HB3 ASP 78 -10.601 -9.645 -13.630 622 H TYR 79 H TYR 79 -12.464 -11.843 -16.100 623 HA TYR 79 HA TYR 79 -14.378 -12.324 -13.934 624 HB2 TYR 79 HB2 TYR 79 -15.214 -14.161 -15.299 625 HB3 TYR 79 HB3 TYR 79 -15.159 -12.680 -16.249 626 HD1 TYR 79 HD1 TYR 79 -13.480 -15.920 -15.658 627 HD2 TYR 79 HD2 TYR 79 -13.812 -12.524 -18.201 628 HE1 TYR 79 HE1 TYR 79 -12.143 -17.077 -17.369 629 HE2 TYR 79 HE2 TYR 79 -12.477 -13.671 -19.918 630 HH TYR 79 HH TYR 79 -11.203 -15.455 -20.372 631 H THR 80 H THR 80 -14.176 -13.994 -12.503 632 HA THR 80 HA THR 80 -11.694 -15.576 -12.653 633 HB THR 80 HB THR 80 -11.422 -13.942 -10.894 634 HG1 THR 80 HG1 THR 80 -10.515 -15.794 -10.210 635 HG21 THR 80 HG21 THR 80 -14.177 -14.232 -10.545 636 HG22 THR 80 HG22 THR 80 -13.088 -13.222 -9.595 637 HG23 THR 80 HG23 THR 80 -13.459 -14.861 -9.064 638 H VAL 81 H VAL 81 -12.025 -17.693 -12.739 639 HA VAL 81 HA VAL 81 -14.664 -18.769 -12.188 640 HB VAL 81 HB VAL 81 -13.706 -20.907 -13.042 641 HG11 VAL 81 HG11 VAL 81 -14.855 -19.377 -14.543 642 HG12 VAL 81 HG12 VAL 81 -13.350 -18.500 -14.825 643 HG13 VAL 81 HG13 VAL 81 -13.516 -20.169 -15.373 644 HG21 VAL 81 HG21 VAL 81 -11.252 -19.492 -12.632 645 HG22 VAL 81 HG22 VAL 81 -11.502 -21.184 -13.065 646 HG23 VAL 81 HG23 VAL 81 -11.388 -19.959 -14.328 647 H LEU 82 H LEU 82 -15.230 -19.681 -10.332 648 HA LEU 82 HA LEU 82 -13.105 -20.498 -8.466 649 HB2 LEU 82 HB2 LEU 82 -15.842 -19.368 -8.080 650 HB3 LEU 82 HB3 LEU 82 -15.128 -20.369 -6.816 651 HG LEU 82 HG LEU 82 -14.807 -18.020 -6.323 652 HD11 LEU 82 HD11 LEU 82 -12.659 -18.224 -5.613 653 HD12 LEU 82 HD12 LEU 82 -12.082 -18.825 -7.166 654 HD13 LEU 82 HD13 LEU 82 -12.951 -19.901 -6.074 655 HD21 LEU 82 HD21 LEU 82 -13.431 -16.602 -7.771 656 HD22 LEU 82 HD22 LEU 82 -14.901 -17.134 -8.587 657 HD23 LEU 82 HD23 LEU 82 -13.356 -17.897 -8.966 658 H GLN 83 H GLN 83 -12.838 -22.601 -8.175 659 HA GLN 83 HA GLN 83 -15.167 -24.377 -8.455 660 HB2 GLN 83 HB2 GLN 83 -12.377 -25.091 -9.355 661 HB3 GLN 83 HB3 GLN 83 -13.849 -26.021 -9.601 662 HG2 GLN 83 HG2 GLN 83 -14.648 -23.924 -10.902 663 HG3 GLN 83 HG3 GLN 83 -12.930 -23.538 -10.974 664 HE21 GLN 83 HE21 GLN 83 -13.159 -23.749 -13.272 665 HE22 GLN 83 HE22 GLN 83 -13.121 -25.314 -14.004 666 H ASP 84 H ASP 84 -15.206 -26.199 -7.120 667 HA ASP 84 HA ASP 84 -13.377 -26.038 -4.824 668 HB2 ASP 84 HB2 ASP 84 -15.885 -25.781 -4.482 669 HB3 ASP 84 HB3 ASP 84 -16.024 -27.484 -4.907 670 H ASN 85 H ASN 85 -12.350 -27.266 -7.051 671 HA ASN 85 HA ASN 85 -11.616 -29.801 -6.039 672 HB2 ASN 85 HB2 ASN 85 -13.980 -30.154 -7.070 673 HB3 ASN 85 HB3 ASN 85 -13.142 -30.048 -8.615 674 HD21 ASN 85 HD21 ASN 85 -11.350 -31.544 -8.957 675 HD22 ASN 85 HD22 ASN 85 -11.440 -33.120 -8.254 676 HA PRO 86 HA PRO 86 -8.790 -27.708 -9.092 677 HB2 PRO 86 HB2 PRO 86 -6.641 -27.653 -7.433 678 HB3 PRO 86 HB3 PRO 86 -7.862 -26.376 -7.465 679 HG2 PRO 86 HG2 PRO 86 -7.572 -28.671 -5.566 680 HG3 PRO 86 HG3 PRO 86 -7.963 -26.977 -5.221 681 HD2 PRO 86 HD2 PRO 86 -9.850 -28.916 -5.322 682 HD3 PRO 86 HD3 PRO 86 -10.178 -27.239 -5.802 683 H ARG 87 H ARG 87 -7.727 -28.944 -10.505 684 HA ARG 87 HA ARG 87 -6.565 -31.480 -9.555 685 HB2 ARG 87 HB2 ARG 87 -8.654 -31.651 -11.006 686 HB3 ARG 87 HB3 ARG 87 -7.668 -31.034 -12.324 687 HG2 ARG 87 HG2 ARG 87 -6.324 -32.941 -12.371 688 HG3 ARG 87 HG3 ARG 87 -6.848 -33.457 -10.766 689 HD2 ARG 87 HD2 ARG 87 -9.185 -33.645 -11.812 690 HD3 ARG 87 HD3 ARG 87 -8.348 -33.568 -13.361 691 HE ARG 87 HE ARG 87 -7.032 -35.532 -12.056 692 HH11 ARG 87 HH11 ARG 87 -10.401 -34.936 -12.696 693 HH12 ARG 87 HH12 ARG 87 -10.825 -36.616 -12.734 694 HH21 ARG 87 HH21 ARG 87 -7.577 -37.746 -12.105 695 HH22 ARG 87 HH22 ARG 87 -9.219 -38.213 -12.397 696 H THR 88 H THR 88 -4.491 -31.870 -10.059 697 HA THR 88 HA THR 88 -2.994 -29.785 -11.396 698 HB THR 88 HB THR 88 -1.000 -31.125 -10.776 699 HG1 THR 88 HG1 THR 88 -1.385 -33.181 -10.450 700 HG21 THR 88 HG21 THR 88 -1.044 -30.572 -8.501 701 HG22 THR 88 HG22 THR 88 -2.774 -30.891 -8.364 702 HG23 THR 88 HG23 THR 88 -2.206 -29.462 -9.228 703 H ILE 89 H ILE 89 -1.933 -29.940 -13.325 704 HA ILE 89 HA ILE 89 -2.795 -32.081 -15.094 705 HB ILE 89 HB ILE 89 -1.107 -29.670 -15.764 706 HG12 ILE 89 HG12 ILE 89 -3.487 -29.050 -16.808 707 HG13 ILE 89 HG13 ILE 89 -4.048 -30.034 -15.461 708 HG21 ILE 89 HG21 ILE 89 -1.889 -30.116 -18.063 709 HG22 ILE 89 HG22 ILE 89 -0.922 -31.433 -17.402 710 HG23 ILE 89 HG23 ILE 89 -2.677 -31.584 -17.485 711 HD11 ILE 89 HD11 ILE 89 -3.483 -28.490 -13.930 712 HD12 ILE 89 HD12 ILE 89 -2.034 -27.993 -14.805 713 HD13 ILE 89 HD13 ILE 89 -3.615 -27.396 -15.307 714 H VAL 90 H VAL 90 -1.479 -33.563 -16.063 715 HA VAL 90 HA VAL 90 1.322 -33.630 -15.141 716 HB VAL 90 HB VAL 90 0.133 -35.458 -14.140 717 HG11 VAL 90 HG11 VAL 90 -0.665 -37.134 -16.205 718 HG12 VAL 90 HG12 VAL 90 -1.715 -36.194 -15.143 719 HG13 VAL 90 HG13 VAL 90 -1.215 -35.533 -16.699 720 HG21 VAL 90 HG21 VAL 90 1.790 -36.905 -14.522 721 HG22 VAL 90 HG22 VAL 90 1.349 -37.089 -16.219 722 HG23 VAL 90 HG23 VAL 90 2.377 -35.748 -15.715 723 HA PRO 91 HA PRO 91 1.397 -33.225 -19.751 724 HB2 PRO 91 HB2 PRO 91 3.496 -31.504 -19.786 725 HB3 PRO 91 HB3 PRO 91 1.822 -30.973 -19.592 726 HG2 PRO 91 HG2 PRO 91 3.934 -31.386 -17.510 727 HG3 PRO 91 HG3 PRO 91 2.763 -30.063 -17.669 728 HD2 PRO 91 HD2 PRO 91 2.414 -32.116 -15.939 729 HD3 PRO 91 HD3 PRO 91 1.055 -31.294 -16.730 730 H LYS 92 H LYS 92 3.226 -33.669 -21.236 731 HA LYS 92 HA LYS 92 5.312 -35.321 -19.975 732 HB2 LYS 92 HB2 LYS 92 3.568 -36.735 -21.010 733 HB3 LYS 92 HB3 LYS 92 3.853 -35.934 -22.551 734 HG2 LYS 92 HG2 LYS 92 6.118 -36.798 -22.611 735 HG3 LYS 92 HG3 LYS 92 5.888 -37.553 -21.031 736 HD2 LYS 92 HD2 LYS 92 3.992 -38.855 -22.046 737 HD3 LYS 92 HD3 LYS 92 4.492 -38.227 -23.617 738 HE2 LYS 92 HE2 LYS 92 5.504 -40.349 -23.420 739 HE3 LYS 92 HE3 LYS 92 6.784 -39.176 -23.113 740 HZ1 LYS 92 HZ1 LYS 92 6.416 -41.231 -21.550 741 HZ2 LYS 92 HZ2 LYS 92 5.282 -40.208 -20.823 742 HZ3 LYS 92 HZ3 LYS 92 6.903 -39.736 -20.924 743 H SER 93 H SER 93 7.337 -34.875 -20.578 744 HA SER 93 HA SER 93 7.715 -33.063 -22.868 745 HB2 SER 93 HB2 SER 93 8.387 -32.434 -20.399 746 HB3 SER 93 HB3 SER 93 9.804 -33.422 -20.753 747 HG SER 93 HG SER 93 10.464 -31.547 -21.517 748 H TYR 94 H TYR 94 10.041 -33.254 -23.776 749 HA TYR 94 HA TYR 94 11.348 -35.768 -23.675 750 HB2 TYR 94 HB2 TYR 94 10.829 -36.366 -26.106 751 HB3 TYR 94 HB3 TYR 94 9.567 -36.687 -24.923 752 HD1 TYR 94 HD2 TYR 94 7.570 -35.230 -24.817 753 HD2 TYR 94 HD1 TYR 94 10.513 -34.765 -27.855 754 HE1 TYR 94 HE2 TYR 94 5.983 -33.898 -26.143 755 HE2 TYR 94 HE1 TYR 94 8.934 -33.432 -29.189 756 HH TYR 94 HH TYR 94 5.579 -33.055 -28.228 757 H ALA 95 H ALA 95 13.385 -35.179 -23.954 758 HA ALA 95 HA ALA 95 13.990 -33.005 -25.845 759 HB1 ALA 95 HB1 ALA 95 14.796 -33.447 -23.164 760 HB2 ALA 95 HB2 ALA 95 16.226 -33.579 -24.189 761 HB3 ALA 95 HB3 ALA 95 15.235 -32.119 -24.240 762 H ASP 96 H ASP 96 16.546 -33.279 -26.413 763 HA ASP 96 HA ASP 96 18.031 -34.356 -27.756 764 HB2 ASP 96 HB2 ASP 96 17.976 -35.874 -25.649 765 HB3 ASP 96 HB3 ASP 96 17.064 -36.985 -26.668 766 H ASN 97 H ASN 97 15.290 -33.898 -28.672 767 HA ASN 97 HA ASN 97 14.647 -36.171 -30.349 768 HB2 ASN 97 HB2 ASN 97 13.379 -33.542 -29.731 769 HB3 ASN 97 HB3 ASN 97 12.957 -34.326 -31.251 770 HD21 ASN 97 HD21 ASN 97 13.684 -35.702 -28.076 771 HD22 ASN 97 HD22 ASN 97 12.164 -36.500 -27.881 772 H PHE 98 H PHE 98 15.021 -36.368 -32.497 773 HA PHE 98 HA PHE 98 16.263 -34.106 -33.901 774 HB2 PHE 98 HB2 PHE 98 17.846 -36.030 -33.028 775 HB3 PHE 98 HB3 PHE 98 17.244 -36.877 -34.449 776 HD1 PHE 98 HD1 PHE 98 18.862 -33.708 -33.384 777 HD2 PHE 98 HD2 PHE 98 18.200 -36.498 -36.530 778 HE1 PHE 98 HE1 PHE 98 20.506 -32.521 -34.779 779 HE2 PHE 98 HE2 PHE 98 19.843 -35.316 -37.928 780 HZ PHE 98 HZ PHE 98 20.999 -33.326 -37.053 781 H THR 99 H THR 99 15.590 -33.799 -35.953 782 HA THR 99 HA THR 99 13.553 -35.653 -36.967 783 HB THR 99 HB THR 99 13.186 -33.644 -38.614 784 HG1 THR 99 HG1 THR 99 14.045 -31.775 -38.004 785 HG21 THR 99 HG21 THR 99 12.085 -32.573 -36.263 786 HG22 THR 99 HG22 THR 99 12.148 -34.319 -36.017 787 HG23 THR 99 HG23 THR 99 11.306 -33.655 -37.416 788 H LYS 100 H LYS 100 13.446 -35.832 -39.396 789 HA LYS 100 HA LYS 100 15.802 -35.416 -40.939 790 HB2 LYS 100 HB2 LYS 100 16.530 -37.338 -39.542 791 HB3 LYS 100 HB3 LYS 100 15.181 -38.275 -40.172 792 HG2 LYS 100 HG2 LYS 100 16.103 -38.095 -42.426 793 HG3 LYS 100 HG3 LYS 100 17.454 -37.150 -41.796 794 HD2 LYS 100 HD2 LYS 100 18.391 -38.970 -40.716 795 HD3 LYS 100 HD3 LYS 100 16.862 -39.849 -40.653 796 HE2 LYS 100 HE2 LYS 100 18.071 -39.236 -43.308 797 HE3 LYS 100 HE3 LYS 100 18.761 -40.537 -42.339 798 HZ1 LYS 100 HZ1 LYS 100 16.023 -40.898 -42.276 799 HZ2 LYS 100 HZ2 LYS 100 17.159 -41.833 -43.113 800 HZ3 LYS 100 HZ3 LYS 100 16.392 -40.538 -43.887 801 HA PRO 101 HA PRO 101 11.765 -36.000 -43.187 802 HB2 PRO 101 HB2 PRO 101 11.882 -33.632 -44.513 803 HB3 PRO 101 HB3 PRO 101 11.176 -33.796 -42.900 804 HG2 PRO 101 HG2 PRO 101 13.898 -32.830 -43.687 805 HG3 PRO 101 HG3 PRO 101 12.783 -32.171 -42.475 806 HD2 PRO 101 HD2 PRO 101 14.893 -33.734 -41.815 807 HD3 PRO 101 HD3 PRO 101 13.375 -33.738 -40.893 808 H ARG 102 H ARG 102 14.850 -34.650 -44.319 809 HA ARG 102 HA ARG 102 16.025 -34.923 -46.252 810 HB2 ARG 102 HB2 ARG 102 15.937 -37.278 -45.212 811 HB3 ARG 102 HB3 ARG 102 14.754 -37.641 -46.463 812 HG2 ARG 102 HG2 ARG 102 16.800 -38.384 -47.318 813 HG3 ARG 102 HG3 ARG 102 16.499 -36.845 -48.129 814 HD2 ARG 102 HD2 ARG 102 18.690 -36.571 -47.522 815 HD3 ARG 102 HD3 ARG 102 17.881 -35.883 -46.115 816 HE ARG 102 HE ARG 102 18.238 -38.560 -45.557 817 HH11 ARG 102 HH11 ARG 102 20.260 -35.821 -46.285 818 HH12 ARG 102 HH12 ARG 102 21.605 -36.403 -45.360 819 HH21 ARG 102 HH21 ARG 102 20.001 -39.335 -44.334 820 HH22 ARG 102 HH22 ARG 102 21.457 -38.402 -44.251 821 H ASP 103 H ASP 103 13.849 -33.453 -46.748 822 HA ASP 103 HA ASP 103 12.225 -34.548 -48.848 823 HB2 ASP 103 HB2 ASP 103 11.260 -32.317 -49.001 824 HB3 ASP 103 HB3 ASP 103 11.380 -32.805 -47.313 825 H MET 104 H MET 104 12.538 -34.467 -50.990 826 HA MET 104 HA MET 104 15.080 -33.698 -52.016 827 HB2 MET 104 HB2 MET 104 14.209 -34.392 -54.179 828 HB3 MET 104 HB3 MET 104 13.780 -35.572 -52.948 829 HG2 MET 104 HG2 MET 104 11.542 -34.408 -52.801 830 HG3 MET 104 HG3 MET 104 12.009 -33.535 -54.258 831 HE1 MET 104 HE1 MET 104 9.534 -35.402 -53.574 832 HE2 MET 104 HE2 MET 104 9.489 -34.841 -55.246 833 HE3 MET 104 HE3 MET 104 9.323 -36.561 -54.887 Start of MODEL 4 1 H1 MET 1 H MET 1 2.763 -12.326 -10.831 2 HA MET 1 HA MET 1 1.708 -12.672 -13.556 3 HB2 MET 1 HB2 MET 1 1.489 -14.411 -11.101 4 HB3 MET 1 HB3 MET 1 0.501 -14.659 -12.535 5 HG2 MET 1 HG2 MET 1 2.206 -16.127 -12.919 6 HG3 MET 1 HG3 MET 1 2.797 -14.698 -13.764 7 HE1 MET 1 HE1 MET 1 5.499 -16.319 -13.269 8 HE2 MET 1 HE2 MET 1 5.474 -17.044 -11.661 9 HE3 MET 1 HE3 MET 1 4.127 -17.308 -12.769 10 H GLN 2 H GLN 2 1.207 -10.361 -11.862 11 HA GLN 2 HA GLN 2 -1.699 -10.668 -11.489 12 HB2 GLN 2 HB2 GLN 2 0.357 -9.280 -9.836 13 HB3 GLN 2 HB3 GLN 2 -1.249 -8.569 -9.929 14 HG2 GLN 2 HG2 GLN 2 -2.038 -10.983 -9.336 15 HG3 GLN 2 HG3 GLN 2 -0.389 -11.161 -8.740 16 HE21 GLN 2 HE21 GLN 2 -3.461 -10.314 -7.912 17 HE22 GLN 2 HE22 GLN 2 -3.129 -9.381 -6.496 18 H GLU 3 H GLU 3 -3.032 -9.160 -12.385 19 HA GLU 3 HA GLU 3 -1.732 -7.060 -13.995 20 HB2 GLU 3 HB2 GLU 3 -4.208 -8.688 -14.569 21 HB3 GLU 3 HB3 GLU 3 -3.769 -7.249 -15.478 22 HG2 GLU 3 HG2 GLU 3 -1.974 -9.643 -15.205 23 HG3 GLU 3 HG3 GLU 3 -3.126 -9.433 -16.522 24 H GLN 4 H GLN 4 -2.114 -5.082 -13.273 25 HA GLN 4 HA GLN 4 -4.081 -4.512 -11.303 26 HB2 GLN 4 HB2 GLN 4 -1.970 -3.277 -11.426 27 HB3 GLN 4 HB3 GLN 4 -2.425 -2.634 -12.998 28 HG2 GLN 4 HG2 GLN 4 -4.180 -1.343 -12.055 29 HG3 GLN 4 HG3 GLN 4 -4.011 -2.144 -10.494 30 HE21 GLN 4 HE21 GLN 4 -1.998 -1.798 -9.330 31 HE22 GLN 4 HE22 GLN 4 -1.181 -0.285 -9.498 32 H VAL 5 H VAL 5 -6.157 -4.033 -11.551 33 HA VAL 5 HA VAL 5 -7.059 -2.857 -14.087 34 HB VAL 5 HB VAL 5 -8.499 -5.100 -12.665 35 HG11 VAL 5 HG11 VAL 5 -9.802 -5.069 -14.872 36 HG12 VAL 5 HG12 VAL 5 -10.136 -3.790 -13.702 37 HG13 VAL 5 HG13 VAL 5 -9.115 -3.461 -15.103 38 HG21 VAL 5 HG21 VAL 5 -6.910 -5.113 -15.228 39 HG22 VAL 5 HG22 VAL 5 -6.509 -5.959 -13.733 40 HG23 VAL 5 HG23 VAL 5 -7.927 -6.438 -14.665 41 H SER 6 H SER 6 -8.428 -1.197 -13.855 42 HA SER 6 HA SER 6 -9.268 -0.494 -11.146 43 HB2 SER 6 HB2 SER 6 -8.952 1.038 -13.708 44 HB3 SER 6 HB3 SER 6 -9.962 1.685 -12.414 45 HG SER 6 HG SER 6 -7.279 1.659 -12.619 46 H ASN 7 H ASN 7 -10.561 -1.435 -14.239 47 HA ASN 7 HA ASN 7 -13.240 -0.640 -13.828 48 HB2 ASN 7 HB2 ASN 7 -11.847 -2.547 -15.659 49 HB3 ASN 7 HB3 ASN 7 -13.601 -2.643 -15.524 50 HD21 ASN 7 HD21 ASN 7 -14.753 -0.532 -15.776 51 HD22 ASN 7 HD22 ASN 7 -14.169 0.542 -16.996 52 H VAL 8 H VAL 8 -15.049 -2.352 -13.787 53 HA VAL 8 HA VAL 8 -15.025 -3.612 -11.282 54 HB VAL 8 HB VAL 8 -17.128 -4.703 -11.998 55 HG11 VAL 8 HG11 VAL 8 -16.598 -1.951 -11.728 56 HG12 VAL 8 HG12 VAL 8 -17.782 -2.116 -13.025 57 HG13 VAL 8 HG13 VAL 8 -18.115 -2.798 -11.432 58 HG21 VAL 8 HG21 VAL 8 -17.874 -4.783 -14.142 59 HG22 VAL 8 HG22 VAL 8 -17.095 -3.266 -14.589 60 HG23 VAL 8 HG23 VAL 8 -16.143 -4.745 -14.475 61 H ARG 9 H ARG 9 -15.863 -6.066 -11.255 62 HA ARG 9 HA ARG 9 -14.201 -7.714 -13.005 63 HB2 ARG 9 HB2 ARG 9 -13.482 -9.030 -10.939 64 HB3 ARG 9 HB3 ARG 9 -12.706 -7.474 -11.201 65 HG2 ARG 9 HG2 ARG 9 -13.839 -6.467 -9.449 66 HG3 ARG 9 HG3 ARG 9 -15.111 -7.691 -9.440 67 HD2 ARG 9 HD2 ARG 9 -13.830 -8.186 -7.551 68 HD3 ARG 9 HD3 ARG 9 -13.268 -9.333 -8.767 69 HE ARG 9 HE ARG 9 -11.623 -7.104 -8.928 70 HH11 ARG 9 HH11 ARG 9 -12.424 -9.571 -6.606 71 HH12 ARG 9 HH12 ARG 9 -10.872 -9.534 -5.836 72 HH21 ARG 9 HH21 ARG 9 -9.577 -7.044 -7.922 73 HH22 ARG 9 HH22 ARG 9 -9.254 -8.096 -6.585 74 H ALA 10 H ALA 10 -14.891 -9.867 -13.199 75 HA ALA 10 HA ALA 10 -17.657 -10.300 -12.313 76 HB1 ALA 10 HB1 ALA 10 -16.218 -10.854 -14.757 77 HB2 ALA 10 HB2 ALA 10 -17.015 -12.298 -14.134 78 HB3 ALA 10 HB3 ALA 10 -17.955 -10.840 -14.450 79 H ARG 11 H ARG 11 -18.087 -11.743 -10.782 80 HA ARG 11 HA ARG 11 -15.970 -13.626 -10.002 81 HB2 ARG 11 HB2 ARG 11 -17.095 -11.895 -8.387 82 HB3 ARG 11 HB3 ARG 11 -18.393 -13.081 -8.329 83 HG2 ARG 11 HG2 ARG 11 -16.835 -14.771 -7.533 84 HG3 ARG 11 HG3 ARG 11 -15.512 -13.608 -7.628 85 HD2 ARG 11 HD2 ARG 11 -17.959 -13.055 -5.985 86 HD3 ARG 11 HD3 ARG 11 -16.627 -14.017 -5.344 87 HE ARG 11 HE ARG 11 -15.545 -11.667 -6.370 88 HH11 ARG 11 HH11 ARG 11 -17.704 -12.656 -3.824 89 HH12 ARG 11 HH12 ARG 11 -17.299 -11.329 -2.786 90 HH21 ARG 11 HH21 ARG 11 -15.003 -9.915 -5.013 91 HH22 ARG 11 HH22 ARG 11 -15.763 -9.770 -3.465 92 H ILE 12 H ILE 12 -16.255 -15.462 -11.137 93 HA ILE 12 HA ILE 12 -18.955 -16.558 -11.424 94 HB ILE 12 HB ILE 12 -16.367 -17.432 -12.713 95 HG12 ILE 12 HG12 ILE 12 -18.715 -16.178 -14.110 96 HG13 ILE 12 HG13 ILE 12 -17.482 -15.175 -13.352 97 HG21 ILE 12 HG21 ILE 12 -19.164 -18.479 -12.850 98 HG22 ILE 12 HG22 ILE 12 -18.083 -18.641 -14.233 99 HG23 ILE 12 HG23 ILE 12 -17.646 -19.361 -12.684 100 HD11 ILE 12 HD11 ILE 12 -15.782 -16.308 -14.751 101 HD12 ILE 12 HD12 ILE 12 -17.087 -17.166 -15.571 102 HD13 ILE 12 HD13 ILE 12 -16.982 -15.409 -15.677 103 H TYR 13 H TYR 13 -19.611 -18.395 -10.450 104 HA TYR 13 HA TYR 13 -17.638 -19.828 -8.794 105 HB2 TYR 13 HB2 TYR 13 -20.304 -18.735 -8.139 106 HB3 TYR 13 HB3 TYR 13 -19.981 -20.355 -7.531 107 HD1 TYR 13 HD2 TYR 13 -17.744 -17.390 -7.907 108 HD2 TYR 13 HD1 TYR 13 -19.580 -20.167 -5.257 109 HE1 TYR 13 HE2 TYR 13 -16.476 -16.430 -6.030 110 HE2 TYR 13 HE1 TYR 13 -18.318 -19.214 -3.374 111 HH TYR 13 HH TYR 13 -17.037 -17.471 -2.710 112 H LYS 14 H LYS 14 -17.830 -22.067 -8.629 113 HA LYS 14 HA LYS 14 -18.852 -23.376 -10.940 114 HB2 LYS 14 HB2 LYS 14 -18.069 -25.437 -9.868 115 HB3 LYS 14 HB3 LYS 14 -16.845 -24.176 -9.795 116 HG2 LYS 14 HG2 LYS 14 -16.838 -24.156 -7.565 117 HG3 LYS 14 HG3 LYS 14 -18.599 -24.222 -7.465 118 HD2 LYS 14 HD2 LYS 14 -18.602 -26.590 -7.720 119 HD3 LYS 14 HD3 LYS 14 -16.888 -26.608 -8.142 120 HE2 LYS 14 HE2 LYS 14 -16.245 -26.056 -5.935 121 HE3 LYS 14 HE3 LYS 14 -17.894 -25.622 -5.484 122 HZ1 LYS 14 HZ1 LYS 14 -17.348 -28.364 -6.373 123 HZ2 LYS 14 HZ2 LYS 14 -18.511 -27.798 -5.283 124 HZ3 LYS 14 HZ3 LYS 14 -16.891 -27.915 -4.807 125 HA PRO 15 HA PRO 15 -22.930 -24.446 -9.711 126 HB2 PRO 15 HB2 PRO 15 -23.227 -26.848 -10.942 127 HB3 PRO 15 HB3 PRO 15 -23.206 -25.315 -11.820 128 HG2 PRO 15 HG2 PRO 15 -21.004 -27.306 -11.431 129 HG3 PRO 15 HG3 PRO 15 -21.468 -26.424 -12.897 130 HD2 PRO 15 HD2 PRO 15 -19.378 -25.675 -11.348 131 HD3 PRO 15 HD3 PRO 15 -20.369 -24.506 -12.244 132 H ALA 16 H ALA 16 -20.401 -26.855 -9.211 133 HA ALA 16 HA ALA 16 -21.946 -28.446 -7.395 134 HB1 ALA 16 HB1 ALA 16 -20.131 -29.852 -7.285 135 HB2 ALA 16 HB2 ALA 16 -19.878 -29.095 -8.859 136 HB3 ALA 16 HB3 ALA 16 -18.966 -28.540 -7.455 137 H LYS 17 H LYS 17 -21.479 -28.744 -5.136 138 HA LYS 17 HA LYS 17 -20.179 -26.449 -3.839 139 HB2 LYS 17 HB2 LYS 17 -22.868 -27.637 -3.144 140 HB3 LYS 17 HB3 LYS 17 -21.991 -26.522 -2.104 141 HG2 LYS 17 HG2 LYS 17 -22.261 -24.739 -3.587 142 HG3 LYS 17 HG3 LYS 17 -22.679 -25.804 -4.931 143 HD2 LYS 17 HD2 LYS 17 -24.732 -24.903 -4.305 144 HD3 LYS 17 HD3 LYS 17 -24.711 -26.464 -3.480 145 HE2 LYS 17 HE2 LYS 17 -25.399 -25.079 -1.782 146 HE3 LYS 17 HE3 LYS 17 -23.655 -25.078 -1.528 147 HZ1 LYS 17 HZ1 LYS 17 -24.024 -23.037 -3.266 148 HZ2 LYS 17 HZ2 LYS 17 -23.852 -22.872 -1.591 149 HZ3 LYS 17 HZ3 LYS 17 -25.396 -22.920 -2.281 150 H SER 18 H SER 18 -21.356 -29.767 -3.536 151 HA SER 18 HA SER 18 -19.245 -30.243 -1.538 152 HB2 SER 18 HB2 SER 18 -21.860 -31.742 -1.545 153 HB3 SER 18 HB3 SER 18 -20.657 -31.644 -0.260 154 HG SER 18 HG SER 18 -21.202 -29.369 -0.135 155 H THR 19 H THR 19 -18.800 -30.567 -4.239 156 HA THR 19 HA THR 19 -18.146 -32.057 -5.841 157 HB THR 19 HB THR 19 -16.815 -33.871 -5.112 158 HG1 THR 19 HG1 THR 19 -17.894 -33.775 -2.500 159 HG21 THR 19 HG21 THR 19 -15.300 -32.677 -3.957 160 HG22 THR 19 HG22 THR 19 -16.416 -32.375 -2.625 161 HG23 THR 19 HG23 THR 19 -16.473 -31.365 -4.069 162 H MET 20 H MET 20 -20.897 -32.022 -5.530 163 HA MET 20 HA MET 20 -21.839 -34.761 -5.392 164 HB2 MET 20 HB2 MET 20 -23.246 -32.143 -5.927 165 HB3 MET 20 HB3 MET 20 -24.064 -33.701 -5.928 166 HG2 MET 20 HG2 MET 20 -23.316 -34.030 -3.585 167 HG3 MET 20 HG3 MET 20 -22.659 -32.397 -3.610 168 HE1 MET 20 HE1 MET 20 -25.104 -33.806 -1.647 169 HE2 MET 20 HE2 MET 20 -24.169 -32.342 -1.343 170 HE3 MET 20 HE3 MET 20 -25.932 -32.277 -1.354 171 H GLN 21 H GLN 21 -22.552 -32.255 -7.814 172 HA GLN 21 HA GLN 21 -22.019 -34.260 -9.908 173 HB2 GLN 21 HB2 GLN 21 -24.178 -32.147 -9.831 174 HB3 GLN 21 HB3 GLN 21 -23.801 -33.129 -11.241 175 HG2 GLN 21 HG2 GLN 21 -24.570 -34.338 -8.606 176 HG3 GLN 21 HG3 GLN 21 -25.762 -33.858 -9.813 177 HE21 GLN 21 HE21 GLN 21 -24.142 -36.411 -8.655 178 HE22 GLN 21 HE22 GLN 21 -24.099 -37.417 -10.058 179 H SER 22 H SER 22 -22.098 -32.849 -12.149 180 HA SER 22 HA SER 22 -20.038 -30.777 -11.771 181 HB2 SER 22 HB2 SER 22 -19.356 -31.382 -14.141 182 HB3 SER 22 HB3 SER 22 -19.050 -32.619 -12.920 183 HG SER 22 HG SER 22 -20.063 -33.773 -14.405 184 H GLY 23 H GLY 23 -22.105 -31.690 -14.520 185 HA2 GLY 23 HA2 GLY 23 -23.852 -29.504 -14.400 186 HA3 GLY 23 HA3 GLY 23 -22.476 -29.038 -15.390 187 H HIS 24 H HIS 24 -25.370 -29.528 -16.015 188 HA HIS 24 HA HIS 24 -24.904 -31.008 -18.453 189 HB2 HIS 24 HB2 HIS 24 -26.755 -32.008 -16.299 190 HB3 HIS 24 HB3 HIS 24 -26.998 -32.430 -17.992 191 HD1 HIS 24 HD1 HIS 24 -25.591 -33.815 -15.105 192 HD2 HIS 24 HD2 HIS 24 -24.288 -33.495 -19.036 193 HE1 HIS 24 HE1 HIS 24 -23.835 -35.593 -15.377 194 H SER 25 H SER 25 -27.307 -31.259 -19.516 195 HA SER 25 HA SER 25 -28.073 -28.605 -20.116 196 HB2 SER 25 HB2 SER 25 -29.642 -31.127 -20.698 197 HB3 SER 25 HB3 SER 25 -29.753 -29.586 -21.547 198 HG SER 25 HG SER 25 -28.181 -30.244 -22.756 199 H LYS 26 H LYS 26 -28.699 -27.569 -18.224 200 HA LYS 26 HA LYS 26 -31.444 -28.052 -17.438 201 HB2 LYS 26 HB2 LYS 26 -29.134 -28.355 -15.531 202 HB3 LYS 26 HB3 LYS 26 -30.746 -27.935 -14.969 203 HG2 LYS 26 HG2 LYS 26 -30.959 -30.159 -14.759 204 HG3 LYS 26 HG3 LYS 26 -31.325 -30.081 -16.483 205 HD2 LYS 26 HD2 LYS 26 -28.698 -30.270 -16.689 206 HD3 LYS 26 HD3 LYS 26 -28.861 -31.015 -15.098 207 HE2 LYS 26 HE2 LYS 26 -30.831 -32.277 -16.466 208 HE3 LYS 26 HE3 LYS 26 -29.655 -32.009 -17.751 209 HZ1 LYS 26 HZ1 LYS 26 -28.375 -32.952 -15.405 210 HZ2 LYS 26 HZ2 LYS 26 -28.390 -33.627 -16.956 211 HZ3 LYS 26 HZ3 LYS 26 -29.617 -34.010 -15.855 212 H LEU 27 H LEU 27 -31.833 -26.387 -15.430 213 HA LEU 27 HA LEU 27 -31.688 -23.834 -16.572 214 HB2 LEU 27 HB2 LEU 27 -32.032 -24.437 -13.643 215 HB3 LEU 27 HB3 LEU 27 -32.587 -23.009 -14.515 216 HG LEU 27 HG LEU 27 -33.645 -25.783 -15.032 217 HD11 LEU 27 HD11 LEU 27 -35.659 -24.882 -13.758 218 HD12 LEU 27 HD12 LEU 27 -34.556 -23.671 -13.105 219 HD13 LEU 27 HD13 LEU 27 -34.260 -25.384 -12.808 220 HD21 LEU 27 HD21 LEU 27 -34.601 -23.024 -15.783 221 HD22 LEU 27 HD22 LEU 27 -35.518 -24.509 -16.038 222 HD23 LEU 27 HD23 LEU 27 -33.981 -24.266 -16.871 223 H LYS 28 H LYS 28 -30.893 -22.052 -14.680 224 HA LYS 28 HA LYS 28 -28.197 -21.708 -15.140 225 HB2 LYS 28 HB2 LYS 28 -29.740 -20.733 -12.729 226 HB3 LYS 28 HB3 LYS 28 -28.227 -20.065 -13.326 227 HG2 LYS 28 HG2 LYS 28 -29.229 -18.928 -14.996 228 HG3 LYS 28 HG3 LYS 28 -30.452 -20.174 -15.259 229 HD2 LYS 28 HD2 LYS 28 -31.874 -19.297 -13.705 230 HD3 LYS 28 HD3 LYS 28 -30.565 -18.655 -12.710 231 HE2 LYS 28 HE2 LYS 28 -31.509 -16.732 -13.581 232 HE3 LYS 28 HE3 LYS 28 -30.186 -17.040 -14.705 233 HZ1 LYS 28 HZ1 LYS 28 -32.555 -16.513 -15.588 234 HZ2 LYS 28 HZ2 LYS 28 -32.844 -18.151 -15.281 235 HZ3 LYS 28 HZ3 LYS 28 -31.617 -17.696 -16.352 236 H ALA 29 H ALA 29 -26.533 -22.932 -14.574 237 HA ALA 29 HA ALA 29 -26.649 -24.392 -12.020 238 HB1 ALA 29 HB1 ALA 29 -26.280 -25.477 -14.430 239 HB2 ALA 29 HB2 ALA 29 -24.602 -25.103 -14.035 240 HB3 ALA 29 HB3 ALA 29 -25.550 -26.135 -12.965 241 H TRP 30 H TRP 30 -24.645 -22.308 -14.034 242 HA TRP 30 HA TRP 30 -22.537 -22.218 -12.038 243 HB2 TRP 30 HB2 TRP 30 -22.891 -21.054 -14.785 244 HB3 TRP 30 HB3 TRP 30 -21.619 -20.459 -13.721 245 HD1 TRP 30 HD1 TRP 30 -22.748 -23.751 -15.407 246 HE1 TRP 30 HE1 TRP 30 -20.668 -25.230 -15.740 247 HE3 TRP 30 HE3 TRP 30 -19.291 -20.840 -13.017 248 HZ2 TRP 30 HZ2 TRP 30 -17.925 -25.171 -15.077 249 HZ3 TRP 30 HZ3 TRP 30 -16.961 -21.624 -12.910 250 HH2 TRP 30 HH2 TRP 30 -16.294 -23.745 -13.919 251 H LYS 31 H LYS 31 -21.847 -20.288 -11.002 252 HA LYS 31 HA LYS 31 -24.028 -18.351 -10.613 253 HB2 LYS 31 HB2 LYS 31 -22.039 -19.583 -8.801 254 HB3 LYS 31 HB3 LYS 31 -22.383 -17.881 -8.519 255 HG2 LYS 31 HG2 LYS 31 -24.847 -18.566 -8.535 256 HG3 LYS 31 HG3 LYS 31 -24.251 -20.220 -8.371 257 HD2 LYS 31 HD2 LYS 31 -23.021 -19.546 -6.343 258 HD3 LYS 31 HD3 LYS 31 -23.690 -17.920 -6.497 259 HE2 LYS 31 HE2 LYS 31 -25.376 -20.405 -6.247 260 HE3 LYS 31 HE3 LYS 31 -24.877 -19.424 -4.870 261 HZ1 LYS 31 HZ1 LYS 31 -26.920 -18.543 -5.361 262 HZ2 LYS 31 HZ2 LYS 31 -26.759 -18.770 -7.030 263 HZ3 LYS 31 HZ3 LYS 31 -25.921 -17.517 -6.262 264 H LEU 32 H LEU 32 -23.590 -16.139 -10.582 265 HA LEU 32 HA LEU 32 -20.893 -15.258 -11.270 266 HB2 LEU 32 HB2 LEU 32 -22.135 -15.684 -13.389 267 HB3 LEU 32 HB3 LEU 32 -23.305 -14.464 -12.893 268 HG LEU 32 HG LEU 32 -21.532 -13.767 -14.580 269 HD11 LEU 32 HD11 LEU 32 -22.869 -12.380 -12.624 270 HD12 LEU 32 HD12 LEU 32 -21.968 -11.669 -13.963 271 HD13 LEU 32 HD13 LEU 32 -21.196 -11.876 -12.391 272 HD21 LEU 32 HD21 LEU 32 -19.350 -13.622 -14.026 273 HD22 LEU 32 HD22 LEU 32 -19.774 -14.900 -12.887 274 HD23 LEU 32 HD23 LEU 32 -19.689 -13.224 -12.342 275 H GLU 33 H GLU 33 -20.389 -13.250 -10.518 276 HA GLU 33 HA GLU 33 -22.477 -11.458 -9.601 277 HB2 GLU 33 HB2 GLU 33 -21.883 -13.150 -7.737 278 HB3 GLU 33 HB3 GLU 33 -20.370 -12.263 -7.612 279 HG2 GLU 33 HG2 GLU 33 -23.010 -10.861 -7.451 280 HG3 GLU 33 HG3 GLU 33 -22.288 -11.632 -6.040 281 H PHE 34 H PHE 34 -21.864 -9.656 -10.604 282 HA PHE 34 HA PHE 34 -19.046 -9.028 -10.936 283 HB2 PHE 34 HB2 PHE 34 -19.844 -7.170 -12.334 284 HB3 PHE 34 HB3 PHE 34 -20.559 -8.698 -12.835 285 HD1 PHE 34 HD2 PHE 34 -21.188 -5.484 -11.180 286 HD2 PHE 34 HD1 PHE 34 -22.908 -9.093 -12.643 287 HE1 PHE 34 HE2 PHE 34 -23.432 -4.495 -10.972 288 HE2 PHE 34 HE1 PHE 34 -25.154 -8.108 -12.439 289 HZ PHE 34 HZ PHE 34 -25.418 -5.808 -11.601 290 H GLU 35 H GLU 35 -17.960 -7.409 -9.932 291 HA GLU 35 HA GLU 35 -19.068 -6.375 -7.499 292 HB2 GLU 35 HB2 GLU 35 -16.422 -6.245 -8.869 293 HB3 GLU 35 HB3 GLU 35 -16.778 -5.045 -7.636 294 HG2 GLU 35 HG2 GLU 35 -16.807 -8.032 -7.276 295 HG3 GLU 35 HG3 GLU 35 -15.576 -6.916 -6.688 296 HA PRO 36 HA PRO 36 -20.529 -2.437 -8.761 297 HB2 PRO 36 HB2 PRO 36 -19.734 -0.836 -6.718 298 HB3 PRO 36 HB3 PRO 36 -21.033 -2.025 -6.558 299 HG2 PRO 36 HG2 PRO 36 -18.165 -2.232 -5.726 300 HG3 PRO 36 HG3 PRO 36 -19.624 -2.735 -4.851 301 HD2 PRO 36 HD2 PRO 36 -18.062 -4.483 -6.207 302 HD3 PRO 36 HD3 PRO 36 -19.817 -4.695 -6.047 303 H SER 37 H SER 37 -19.682 0.044 -8.619 304 HA SER 37 HA SER 37 -16.925 0.097 -9.644 305 HB2 SER 37 HB2 SER 37 -17.969 1.987 -11.201 306 HB3 SER 37 HB3 SER 37 -17.979 0.289 -11.679 307 HG SER 37 HG SER 37 -20.038 1.558 -11.782 308 H CYS 38 H CYS 38 -16.110 2.411 -9.809 309 HA CYS 38 HA CYS 38 -17.023 3.901 -7.439 310 HB2 CYS 38 HB2 CYS 38 -14.703 4.835 -7.384 311 HB3 CYS 38 HB3 CYS 38 -14.777 3.097 -7.121 312 HG CYS 38 HG CYS 38 -13.091 4.779 -9.378 313 H THR 39 H THR 39 -18.159 4.157 -10.085 314 HA THR 39 HA THR 39 -17.215 6.810 -10.921 315 HB THR 39 HB THR 39 -18.404 6.479 -12.990 316 HG1 THR 39 HG1 THR 39 -19.240 3.920 -12.097 317 HG21 THR 39 HG21 THR 39 -16.160 5.292 -12.523 318 HG22 THR 39 HG22 THR 39 -17.089 4.796 -13.939 319 HG23 THR 39 HG23 THR 39 -17.122 3.815 -12.474 320 H GLN 40 H GLN 40 -19.877 5.147 -9.464 321 HA GLN 40 HA GLN 40 -21.854 5.847 -8.584 322 HB2 GLN 40 HB2 GLN 40 -20.521 8.559 -8.688 323 HB3 GLN 40 HB3 GLN 40 -21.963 8.164 -7.762 324 HG2 GLN 40 HG2 GLN 40 -20.643 6.532 -6.467 325 HG3 GLN 40 HG3 GLN 40 -19.204 7.037 -7.350 326 HE21 GLN 40 HE21 GLN 40 -21.712 8.105 -5.138 327 HE22 GLN 40 HE22 GLN 40 -20.808 9.401 -4.442 328 H TYR 41 H TYR 41 -21.668 5.632 -11.423 329 HA TYR 41 HA TYR 41 -22.935 7.859 -12.675 330 HB2 TYR 41 HB2 TYR 41 -21.530 5.917 -13.721 331 HB3 TYR 41 HB3 TYR 41 -23.074 5.072 -13.777 332 HD1 TYR 41 HD1 TYR 41 -21.646 8.410 -14.685 333 HD2 TYR 41 HD2 TYR 41 -24.311 5.256 -15.714 334 HE1 TYR 41 HE1 TYR 41 -22.193 9.564 -16.788 335 HE2 TYR 41 HE2 TYR 41 -24.864 6.401 -17.819 336 HH TYR 41 HH TYR 41 -23.331 9.485 -18.690 337 H THR 42 H THR 42 -24.987 8.438 -12.529 338 HA THR 42 HA THR 42 -26.931 6.653 -11.330 339 HB THR 42 HB THR 42 -28.474 8.627 -11.531 340 HG1 THR 42 HG1 THR 42 -26.142 10.080 -12.254 341 HG21 THR 42 HG21 THR 42 -27.230 10.016 -9.849 342 HG22 THR 42 HG22 THR 42 -25.833 8.973 -10.115 343 HG23 THR 42 HG23 THR 42 -27.325 8.299 -9.458 344 H GLU 43 H GLU 43 -29.273 7.044 -12.397 345 HA GLU 43 HA GLU 43 -29.203 6.919 -15.288 346 HB2 GLU 43 HB2 GLU 43 -28.652 4.607 -14.608 347 HB3 GLU 43 HB3 GLU 43 -30.143 4.539 -13.679 348 HG2 GLU 43 HG2 GLU 43 -31.358 5.005 -15.846 349 HG3 GLU 43 HG3 GLU 43 -29.823 4.706 -16.658 350 HA PRO 44 HA PRO 44 -33.029 8.763 -13.399 351 HB2 PRO 44 HB2 PRO 44 -32.964 11.026 -14.896 352 HB3 PRO 44 HB3 PRO 44 -32.099 10.863 -13.363 353 HG2 PRO 44 HG2 PRO 44 -31.066 10.595 -16.159 354 HG3 PRO 44 HG3 PRO 44 -30.331 11.415 -14.769 355 HD2 PRO 44 HD2 PRO 44 -29.563 8.948 -15.576 356 HD3 PRO 44 HD3 PRO 44 -29.526 9.450 -13.875 357 H LEU 45 H LEU 45 -34.904 8.095 -14.217 358 HA LEU 45 HA LEU 45 -35.251 8.092 -17.141 359 HB2 LEU 45 HB2 LEU 45 -36.434 6.028 -17.043 360 HB3 LEU 45 HB3 LEU 45 -34.890 5.814 -16.219 361 HG LEU 45 HG LEU 45 -37.397 6.392 -14.677 362 HD11 LEU 45 HD11 LEU 45 -37.893 4.464 -16.083 363 HD12 LEU 45 HD12 LEU 45 -37.710 3.987 -14.396 364 HD13 LEU 45 HD13 LEU 45 -36.409 3.678 -15.545 365 HD21 LEU 45 HD21 LEU 45 -35.808 4.684 -13.248 366 HD22 LEU 45 HD22 LEU 45 -35.834 6.439 -13.077 367 HD23 LEU 45 HD23 LEU 45 -34.624 5.672 -14.105 368 H MET 46 H MET 46 -37.652 7.884 -17.721 369 HA MET 46 HA MET 46 -39.325 9.350 -15.801 370 HB2 MET 46 HB2 MET 46 -40.246 10.668 -17.715 371 HB3 MET 46 HB3 MET 46 -38.564 11.022 -17.345 372 HG2 MET 46 HG2 MET 46 -37.789 10.067 -19.272 373 HG3 MET 46 HG3 MET 46 -39.171 8.982 -19.419 374 HE1 MET 46 HE1 MET 46 -41.579 10.612 -21.606 375 HE2 MET 46 HE2 MET 46 -41.022 9.226 -20.668 376 HE3 MET 46 HE3 MET 46 -41.893 10.538 -19.872 377 H ASN 47 H ASN 47 -39.653 6.760 -15.828 378 HA ASN 47 HA ASN 47 -42.047 6.319 -17.485 379 HB2 ASN 47 HB2 ASN 47 -39.863 4.343 -16.803 380 HB3 ASN 47 HB3 ASN 47 -41.417 3.878 -17.487 381 HD21 ASN 47 HD21 ASN 47 -41.990 4.826 -19.569 382 HD22 ASN 47 HD22 ASN 47 -40.732 5.154 -20.707 383 H TRP 48 H TRP 48 -40.316 5.215 -14.575 384 HA TRP 48 HA TRP 48 -42.530 5.580 -12.872 385 HB2 TRP 48 HB2 TRP 48 -43.098 3.239 -12.390 386 HB3 TRP 48 HB3 TRP 48 -43.442 3.646 -14.069 387 HD1 TRP 48 HD1 TRP 48 -41.730 2.626 -15.936 388 HE1 TRP 48 HE1 TRP 48 -40.306 0.483 -15.892 389 HE3 TRP 48 HE3 TRP 48 -41.794 1.714 -10.906 390 HZ2 TRP 48 HZ2 TRP 48 -39.336 -1.351 -13.977 391 HZ3 TRP 48 HZ3 TRP 48 -40.593 -0.256 -10.050 392 HH2 TRP 48 HH2 TRP 48 -39.391 -1.756 -11.555 393 H THR 49 H THR 49 -41.817 5.708 -10.831 394 HA THR 49 HA THR 49 -39.063 4.856 -10.304 395 HB THR 49 HB THR 49 -39.500 7.191 -9.832 396 HG1 THR 49 HG1 THR 49 -38.064 6.311 -8.388 397 HG21 THR 49 HG21 THR 49 -41.499 7.854 -9.104 398 HG22 THR 49 HG22 THR 49 -41.166 7.090 -7.550 399 HG23 THR 49 HG23 THR 49 -41.979 6.181 -8.824 400 H GLY 50 H GLY 50 -38.542 3.915 -8.202 401 HA2 GLY 50 HA2 GLY 50 -39.967 3.006 -6.176 402 HA3 GLY 50 HA3 GLY 50 -40.570 1.950 -7.444 403 H SER 51 H SER 51 -37.883 1.966 -8.757 404 HA SER 51 HA SER 51 -36.753 -0.182 -7.144 405 HB2 SER 51 HB2 SER 51 -35.310 -0.548 -9.183 406 HB3 SER 51 HB3 SER 51 -37.042 -0.722 -9.463 407 HG SER 51 HG SER 51 -35.580 0.681 -10.918 408 H HIS 52 H HIS 52 -36.327 2.045 -5.783 409 HA HIS 52 HA HIS 52 -33.649 3.024 -6.460 410 HB2 HIS 52 HB2 HIS 52 -34.058 4.793 -4.833 411 HB3 HIS 52 HB3 HIS 52 -35.389 4.711 -5.983 412 HD1 HIS 52 HD1 HIS 52 -34.584 4.362 -2.388 413 HD2 HIS 52 HD2 HIS 52 -37.826 3.707 -4.903 414 HE1 HIS 52 HE1 HIS 52 -36.568 4.084 -0.868 415 H ASP 53 H ASP 53 -35.394 1.125 -4.132 416 HA ASP 53 HA ASP 53 -33.548 1.134 -2.020 417 HB2 ASP 53 HB2 ASP 53 -34.611 -1.031 -1.372 418 HB3 ASP 53 HB3 ASP 53 -35.769 0.258 -1.685 419 H THR 54 H THR 54 -33.637 -0.646 -5.027 420 HA THR 54 HA THR 54 -31.437 -2.374 -4.239 421 HB THR 54 HB THR 54 -32.512 -2.188 -7.038 422 HG1 THR 54 HG1 THR 54 -33.667 -3.808 -5.006 423 HG21 THR 54 HG21 THR 54 -30.611 -3.624 -6.756 424 HG22 THR 54 HG22 THR 54 -32.037 -4.645 -6.948 425 HG23 THR 54 HG23 THR 54 -31.340 -4.397 -5.348 426 H LYS 55 H LYS 55 -29.354 -2.011 -4.658 427 HA LYS 55 HA LYS 55 -28.674 0.184 -6.506 428 HB2 LYS 55 HB2 LYS 55 -26.562 0.364 -5.078 429 HB3 LYS 55 HB3 LYS 55 -28.061 0.942 -4.363 430 HG2 LYS 55 HG2 LYS 55 -27.293 -1.873 -3.848 431 HG3 LYS 55 HG3 LYS 55 -26.368 -0.604 -3.044 432 HD2 LYS 55 HD2 LYS 55 -29.335 -0.423 -2.985 433 HD3 LYS 55 HD3 LYS 55 -28.558 -1.637 -1.967 434 HE2 LYS 55 HE2 LYS 55 -27.696 1.242 -1.975 435 HE3 LYS 55 HE3 LYS 55 -28.992 0.655 -0.935 436 HZ1 LYS 55 HZ1 LYS 55 -26.120 0.129 -0.802 437 HZ2 LYS 55 HZ2 LYS 55 -27.162 -1.118 -0.333 438 HZ3 LYS 55 HZ3 LYS 55 -27.231 0.381 0.449 439 H GLN 56 H GLN 56 -29.005 -2.303 -7.569 440 HA GLN 56 HA GLN 56 -27.995 -3.868 -8.873 441 HB2 GLN 56 HB2 GLN 56 -25.623 -2.011 -8.620 442 HB3 GLN 56 HB3 GLN 56 -25.774 -3.313 -9.791 443 HG2 GLN 56 HG2 GLN 56 -26.376 -1.494 -11.045 444 HG3 GLN 56 HG3 GLN 56 -27.946 -2.075 -10.494 445 HE21 GLN 56 HE21 GLN 56 -28.988 -0.137 -10.599 446 HE22 GLN 56 HE22 GLN 56 -28.624 1.201 -9.568 447 H GLN 57 H GLN 57 -28.065 -4.416 -6.138 448 HA GLN 57 HA GLN 57 -25.492 -5.766 -5.671 449 HB2 GLN 57 HB2 GLN 57 -26.164 -5.837 -3.284 450 HB3 GLN 57 HB3 GLN 57 -26.009 -4.200 -3.907 451 HG2 GLN 57 HG2 GLN 57 -28.257 -3.793 -3.792 452 HG3 GLN 57 HG3 GLN 57 -28.684 -5.496 -3.953 453 HE21 GLN 57 HE21 GLN 57 -26.554 -3.752 -1.720 454 HE22 GLN 57 HE22 GLN 57 -27.328 -4.302 -0.277 455 H VAL 58 H VAL 58 -27.401 -6.867 -7.430 456 HA VAL 58 HA VAL 58 -28.561 -9.083 -5.888 457 HB VAL 58 HB VAL 58 -29.863 -9.587 -7.930 458 HG11 VAL 58 HG11 VAL 58 -31.184 -7.354 -7.887 459 HG12 VAL 58 HG12 VAL 58 -31.081 -8.325 -6.417 460 HG13 VAL 58 HG13 VAL 58 -30.050 -6.907 -6.614 461 HG21 VAL 58 HG21 VAL 58 -28.185 -8.576 -9.497 462 HG22 VAL 58 HG22 VAL 58 -29.862 -8.138 -9.823 463 HG23 VAL 58 HG23 VAL 58 -28.791 -6.991 -9.019 464 H CYS 59 H CYS 59 -28.282 -11.247 -6.605 465 HA CYS 59 HA CYS 59 -25.658 -11.712 -7.760 466 HB2 CYS 59 HB2 CYS 59 -25.978 -14.031 -7.058 467 HB3 CYS 59 HB3 CYS 59 -26.322 -12.930 -5.728 468 HG CYS 59 HG CYS 59 -28.508 -14.819 -7.528 469 H LEU 60 H LEU 60 -25.296 -13.209 -9.492 470 HA LEU 60 HA LEU 60 -27.582 -13.407 -11.343 471 HB2 LEU 60 HB2 LEU 60 -24.801 -12.510 -11.724 472 HB3 LEU 60 HB3 LEU 60 -25.437 -13.570 -12.981 473 HG LEU 60 HG LEU 60 -26.885 -11.079 -12.124 474 HD11 LEU 60 HD11 LEU 60 -24.615 -11.379 -14.061 475 HD12 LEU 60 HD12 LEU 60 -24.829 -10.185 -12.781 476 HD13 LEU 60 HD13 LEU 60 -25.823 -10.106 -14.236 477 HD21 LEU 60 HD21 LEU 60 -28.355 -12.269 -13.405 478 HD22 LEU 60 HD22 LEU 60 -27.081 -13.064 -14.330 479 HD23 LEU 60 HD23 LEU 60 -27.503 -11.385 -14.672 480 H SER 61 H SER 61 -27.570 -15.231 -12.803 481 HA SER 61 HA SER 61 -25.860 -17.475 -12.041 482 HB2 SER 61 HB2 SER 61 -28.871 -17.744 -12.162 483 HB3 SER 61 HB3 SER 61 -27.708 -18.992 -11.715 484 HG SER 61 HG SER 61 -28.490 -16.697 -10.278 485 H PHE 62 H PHE 62 -25.216 -18.625 -13.751 486 HA PHE 62 HA PHE 62 -26.647 -18.223 -16.295 487 HB2 PHE 62 HB2 PHE 62 -23.698 -18.579 -15.757 488 HB3 PHE 62 HB3 PHE 62 -24.401 -18.714 -17.364 489 HD1 PHE 62 HD1 PHE 62 -24.012 -16.395 -14.497 490 HD2 PHE 62 HD2 PHE 62 -24.765 -16.816 -18.664 491 HE1 PHE 62 HE1 PHE 62 -23.832 -13.956 -14.773 492 HE2 PHE 62 HE2 PHE 62 -24.586 -14.379 -18.947 493 HZ PHE 62 HZ PHE 62 -24.118 -12.946 -17.001 494 H THR 63 H THR 63 -26.475 -20.015 -17.844 495 HA THR 63 HA THR 63 -27.020 -22.520 -16.537 496 HB THR 63 HB THR 63 -26.840 -22.005 -19.508 497 HG1 THR 63 HG1 THR 63 -28.868 -21.261 -19.424 498 HG21 THR 63 HG21 THR 63 -27.461 -24.314 -17.887 499 HG22 THR 63 HG22 THR 63 -27.250 -24.195 -19.635 500 HG23 THR 63 HG23 THR 63 -28.827 -23.875 -18.912 501 H THR 64 H THR 64 -24.706 -21.513 -19.060 502 HA THR 64 HA THR 64 -22.948 -23.712 -18.182 503 HB THR 64 HB THR 64 -21.968 -23.354 -20.595 504 HG1 THR 64 HG1 THR 64 -23.602 -22.723 -22.064 505 HG21 THR 64 HG21 THR 64 -23.150 -25.381 -19.635 506 HG22 THR 64 HG22 THR 64 -23.276 -25.172 -21.381 507 HG23 THR 64 HG23 THR 64 -24.632 -24.739 -20.341 508 H ARG 65 H ARG 65 -20.683 -23.330 -18.201 509 HA ARG 65 HA ARG 65 -19.838 -20.952 -17.087 510 HB2 ARG 65 HB2 ARG 65 -17.524 -21.688 -17.754 511 HB3 ARG 65 HB3 ARG 65 -18.462 -22.885 -16.873 512 HG2 ARG 65 HG2 ARG 65 -19.047 -23.921 -19.074 513 HG3 ARG 65 HG3 ARG 65 -17.894 -22.816 -19.824 514 HD2 ARG 65 HD2 ARG 65 -16.527 -24.609 -19.495 515 HD3 ARG 65 HD3 ARG 65 -16.299 -23.788 -17.951 516 HE ARG 65 HE ARG 65 -17.353 -25.532 -16.907 517 HH11 ARG 65 HH11 ARG 65 -17.981 -25.699 -20.327 518 HH12 ARG 65 HH12 ARG 65 -18.740 -27.254 -20.244 519 HH21 ARG 65 HH21 ARG 65 -18.351 -27.579 -16.784 520 HH22 ARG 65 HH22 ARG 65 -18.951 -28.323 -18.229 521 H GLU 66 H GLU 66 -19.600 -21.968 -20.486 522 HA GLU 66 HA GLU 66 -18.246 -19.802 -21.526 523 HB2 GLU 66 HB2 GLU 66 -18.773 -21.778 -22.850 524 HB3 GLU 66 HB3 GLU 66 -20.486 -21.387 -22.795 525 HG2 GLU 66 HG2 GLU 66 -20.197 -19.494 -24.177 526 HG3 GLU 66 HG3 GLU 66 -18.444 -19.560 -24.020 527 H LEU 67 H LEU 67 -21.572 -20.033 -20.503 528 HA LEU 67 HA LEU 67 -22.499 -17.669 -21.778 529 HB2 LEU 67 HB2 LEU 67 -23.709 -19.721 -20.529 530 HB3 LEU 67 HB3 LEU 67 -23.767 -18.512 -19.249 531 HG LEU 67 HG LEU 67 -24.965 -16.990 -20.769 532 HD11 LEU 67 HD11 LEU 67 -24.180 -17.676 -22.905 533 HD12 LEU 67 HD12 LEU 67 -25.915 -17.988 -22.862 534 HD13 LEU 67 HD13 LEU 67 -24.775 -19.319 -22.666 535 HD21 LEU 67 HD21 LEU 67 -25.974 -19.601 -19.875 536 HD22 LEU 67 HD22 LEU 67 -26.964 -18.791 -21.088 537 HD23 LEU 67 HD23 LEU 67 -26.590 -17.977 -19.568 538 H ALA 68 H ALA 68 -21.209 -18.367 -18.560 539 HA ALA 68 HA ALA 68 -21.632 -15.809 -17.454 540 HB1 ALA 68 HB1 ALA 68 -20.705 -16.672 -15.607 541 HB2 ALA 68 HB2 ALA 68 -20.753 -18.199 -16.488 542 HB3 ALA 68 HB3 ALA 68 -19.275 -17.238 -16.470 543 H ILE 69 H ILE 69 -18.557 -17.246 -18.565 544 HA ILE 69 HA ILE 69 -17.018 -14.947 -18.458 545 HB ILE 69 HB ILE 69 -16.777 -17.244 -20.403 546 HG12 ILE 69 HG12 ILE 69 -14.772 -17.499 -18.555 547 HG13 ILE 69 HG13 ILE 69 -16.084 -16.861 -17.570 548 HG21 ILE 69 HG21 ILE 69 -14.294 -16.428 -20.270 549 HG22 ILE 69 HG22 ILE 69 -15.429 -15.662 -21.381 550 HG23 ILE 69 HG23 ILE 69 -15.040 -14.887 -19.846 551 HD11 ILE 69 HD11 ILE 69 -15.663 -19.503 -18.290 552 HD12 ILE 69 HD12 ILE 69 -17.107 -18.822 -17.541 553 HD13 ILE 69 HD13 ILE 69 -17.011 -18.973 -19.295 554 H ALA 70 H ALA 70 -19.221 -16.045 -20.959 555 HA ALA 70 HA ALA 70 -18.467 -14.343 -23.038 556 HB1 ALA 70 HB1 ALA 70 -20.879 -14.594 -23.773 557 HB2 ALA 70 HB2 ALA 70 -19.969 -16.087 -23.545 558 HB3 ALA 70 HB3 ALA 70 -21.120 -15.560 -22.317 559 H TYR 71 H TYR 71 -20.154 -13.687 -20.092 560 HA TYR 71 HA TYR 71 -21.306 -11.202 -20.970 561 HB2 TYR 71 HB2 TYR 71 -22.222 -12.688 -19.123 562 HB3 TYR 71 HB3 TYR 71 -20.905 -12.099 -18.116 563 HD1 TYR 71 HD1 TYR 71 -23.014 -10.243 -20.563 564 HD2 TYR 71 HD2 TYR 71 -21.939 -10.798 -16.483 565 HE1 TYR 71 HE1 TYR 71 -24.367 -8.285 -19.946 566 HE2 TYR 71 HE2 TYR 71 -23.292 -8.841 -15.856 567 HH TYR 71 HH TYR 71 -25.014 -6.934 -18.309 568 H ALA 72 H ALA 72 -18.813 -11.984 -18.537 569 HA ALA 72 HA ALA 72 -17.906 -9.404 -18.086 570 HB1 ALA 72 HB1 ALA 72 -16.172 -10.343 -16.915 571 HB2 ALA 72 HB2 ALA 72 -17.303 -11.696 -16.961 572 HB3 ALA 72 HB3 ALA 72 -15.943 -11.645 -18.082 573 H VAL 73 H VAL 73 -16.600 -11.803 -20.376 574 HA VAL 73 HA VAL 73 -14.575 -10.240 -21.466 575 HB VAL 73 HB VAL 73 -16.236 -12.338 -22.872 576 HG11 VAL 73 HG11 VAL 73 -13.998 -12.560 -24.163 577 HG12 VAL 73 HG12 VAL 73 -15.120 -11.269 -24.597 578 HG13 VAL 73 HG13 VAL 73 -13.709 -10.914 -23.601 579 HG21 VAL 73 HG21 VAL 73 -15.021 -12.953 -20.709 580 HG22 VAL 73 HG22 VAL 73 -14.700 -13.945 -22.131 581 HG23 VAL 73 HG23 VAL 73 -13.532 -12.725 -21.626 582 H ALA 74 H ALA 74 -18.012 -10.269 -22.122 583 HA ALA 74 HA ALA 74 -18.140 -8.967 -24.555 584 HB1 ALA 74 HB1 ALA 74 -19.992 -9.852 -22.862 585 HB2 ALA 74 HB2 ALA 74 -20.092 -8.131 -22.488 586 HB3 ALA 74 HB3 ALA 74 -20.355 -8.691 -24.139 587 H HIS 75 H HIS 75 -17.357 -7.685 -21.406 588 HA HIS 75 HA HIS 75 -16.993 -5.030 -22.629 589 HB2 HIS 75 HB2 HIS 75 -18.178 -5.809 -20.000 590 HB3 HIS 75 HB3 HIS 75 -17.284 -4.296 -20.103 591 HD1 HIS 75 HD1 HIS 75 -18.174 -2.770 -22.301 592 HD2 HIS 75 HD2 HIS 75 -20.797 -5.462 -20.528 593 HE1 HIS 75 HE1 HIS 75 -20.474 -2.011 -22.977 594 H LYS 76 H LYS 76 -15.155 -7.358 -22.251 595 HA LYS 76 HA LYS 76 -13.019 -7.799 -21.589 596 HB2 LYS 76 HB2 LYS 76 -13.007 -4.799 -21.849 597 HB3 LYS 76 HB3 LYS 76 -11.552 -5.693 -21.427 598 HG2 LYS 76 HG2 LYS 76 -11.294 -5.569 -23.682 599 HG3 LYS 76 HG3 LYS 76 -12.194 -7.084 -23.570 600 HD2 LYS 76 HD2 LYS 76 -13.294 -5.903 -25.257 601 HD3 LYS 76 HD3 LYS 76 -14.291 -5.619 -23.828 602 HE2 LYS 76 HE2 LYS 76 -14.106 -3.501 -24.749 603 HE3 LYS 76 HE3 LYS 76 -12.836 -3.503 -23.526 604 HZ1 LYS 76 HZ1 LYS 76 -12.098 -4.380 -26.209 605 HZ2 LYS 76 HZ2 LYS 76 -11.210 -3.487 -25.081 606 HZ3 LYS 76 HZ3 LYS 76 -12.409 -2.729 -26.004 607 H ILE 77 H ILE 77 -14.586 -8.164 -19.498 608 HA ILE 77 HA ILE 77 -13.391 -6.684 -17.255 609 HB ILE 77 HB ILE 77 -15.877 -8.401 -17.292 610 HG12 ILE 77 HG12 ILE 77 -15.701 -5.411 -16.933 611 HG13 ILE 77 HG13 ILE 77 -15.933 -6.158 -18.510 612 HG21 ILE 77 HG21 ILE 77 -15.214 -8.572 -15.108 613 HG22 ILE 77 HG22 ILE 77 -14.380 -7.018 -15.125 614 HG23 ILE 77 HG23 ILE 77 -16.140 -7.073 -15.034 615 HD11 ILE 77 HD11 ILE 77 -17.764 -6.631 -16.176 616 HD12 ILE 77 HD12 ILE 77 -18.013 -5.360 -17.373 617 HD13 ILE 77 HD13 ILE 77 -18.029 -7.053 -17.868 618 H ASP 78 H ASP 78 -12.400 -7.743 -15.567 619 HA ASP 78 HA ASP 78 -11.181 -10.246 -16.172 620 HB2 ASP 78 HB2 ASP 78 -11.146 -8.410 -13.794 621 HB3 ASP 78 HB3 ASP 78 -10.405 -10.006 -13.703 622 H TYR 79 H TYR 79 -12.313 -12.077 -16.134 623 HA TYR 79 HA TYR 79 -14.318 -12.467 -14.024 624 HB2 TYR 79 HB2 TYR 79 -15.180 -14.292 -15.448 625 HB3 TYR 79 HB3 TYR 79 -15.169 -12.745 -16.287 626 HD1 TYR 79 HD1 TYR 79 -13.569 -16.049 -16.053 627 HD2 TYR 79 HD2 TYR 79 -13.757 -12.380 -18.199 628 HE1 TYR 79 HE1 TYR 79 -12.276 -17.060 -17.884 629 HE2 TYR 79 HE2 TYR 79 -12.466 -13.382 -20.036 630 HH TYR 79 HH TYR 79 -10.898 -16.427 -19.734 631 H THR 80 H THR 80 -14.137 -14.058 -12.543 632 HA THR 80 HA THR 80 -11.852 -15.902 -12.786 633 HB THR 80 HB THR 80 -11.248 -14.245 -11.137 634 HG1 THR 80 HG1 THR 80 -10.859 -15.660 -9.434 635 HG21 THR 80 HG21 THR 80 -13.130 -14.745 -9.059 636 HG22 THR 80 HG22 THR 80 -14.017 -14.296 -10.516 637 HG23 THR 80 HG23 THR 80 -12.771 -13.225 -9.875 638 H VAL 81 H VAL 81 -12.452 -17.960 -12.778 639 HA VAL 81 HA VAL 81 -15.110 -18.672 -11.790 640 HB VAL 81 HB VAL 81 -14.732 -20.836 -12.918 641 HG11 VAL 81 HG11 VAL 81 -15.236 -18.362 -14.072 642 HG12 VAL 81 HG12 VAL 81 -14.060 -19.120 -15.148 643 HG13 VAL 81 HG13 VAL 81 -15.576 -19.943 -14.774 644 HG21 VAL 81 HG21 VAL 81 -12.015 -19.845 -13.004 645 HG22 VAL 81 HG22 VAL 81 -12.625 -21.481 -13.256 646 HG23 VAL 81 HG23 VAL 81 -12.578 -20.341 -14.601 647 H LEU 82 H LEU 82 -15.416 -19.698 -9.926 648 HA LEU 82 HA LEU 82 -13.066 -20.727 -8.501 649 HB2 LEU 82 HB2 LEU 82 -14.345 -19.027 -7.332 650 HB3 LEU 82 HB3 LEU 82 -15.814 -19.985 -7.506 651 HG LEU 82 HG LEU 82 -14.179 -21.717 -6.173 652 HD11 LEU 82 HD11 LEU 82 -12.550 -19.750 -6.002 653 HD12 LEU 82 HD12 LEU 82 -12.941 -20.628 -4.522 654 HD13 LEU 82 HD13 LEU 82 -13.700 -19.069 -4.850 655 HD21 LEU 82 HD21 LEU 82 -16.600 -20.644 -5.797 656 HD22 LEU 82 HD22 LEU 82 -15.722 -19.819 -4.509 657 HD23 LEU 82 HD23 LEU 82 -15.762 -21.582 -4.560 658 H GLN 83 H GLN 83 -12.740 -22.841 -8.599 659 HA GLN 83 HA GLN 83 -15.077 -24.617 -8.845 660 HB2 GLN 83 HB2 GLN 83 -12.245 -25.327 -9.594 661 HB3 GLN 83 HB3 GLN 83 -13.724 -26.176 -10.026 662 HG2 GLN 83 HG2 GLN 83 -13.009 -23.411 -10.972 663 HG3 GLN 83 HG3 GLN 83 -12.720 -24.891 -11.885 664 HE21 GLN 83 HE21 GLN 83 -14.524 -26.101 -12.612 665 HE22 GLN 83 HE22 GLN 83 -16.062 -25.347 -12.839 666 H ASP 84 H ASP 84 -14.754 -26.811 -7.878 667 HA ASP 84 HA ASP 84 -14.362 -26.682 -5.150 668 HB2 ASP 84 HB2 ASP 84 -15.425 -28.541 -6.651 669 HB3 ASP 84 HB3 ASP 84 -13.808 -29.238 -6.616 670 H ASN 85 H ASN 85 -12.718 -27.506 -3.760 671 HA ASN 85 HA ASN 85 -10.133 -26.647 -4.374 672 HB2 ASN 85 HB2 ASN 85 -11.362 -28.251 -2.186 673 HB3 ASN 85 HB3 ASN 85 -9.608 -28.296 -2.340 674 HD21 ASN 85 HD21 ASN 85 -9.652 -27.286 -0.232 675 HD22 ASN 85 HD22 ASN 85 -9.844 -25.573 -0.119 676 HA PRO 86 HA PRO 86 -8.161 -29.939 -6.502 677 HB2 PRO 86 HB2 PRO 86 -5.695 -29.980 -5.366 678 HB3 PRO 86 HB3 PRO 86 -6.232 -28.693 -6.452 679 HG2 PRO 86 HG2 PRO 86 -6.130 -28.729 -3.461 680 HG3 PRO 86 HG3 PRO 86 -5.665 -27.434 -4.580 681 HD2 PRO 86 HD2 PRO 86 -8.028 -27.437 -3.258 682 HD3 PRO 86 HD3 PRO 86 -7.842 -26.739 -4.880 683 H ARG 87 H ARG 87 -6.830 -31.993 -6.148 684 HA ARG 87 HA ARG 87 -7.970 -33.424 -3.853 685 HB2 ARG 87 HB2 ARG 87 -7.118 -34.242 -6.599 686 HB3 ARG 87 HB3 ARG 87 -7.084 -35.437 -5.309 687 HG2 ARG 87 HG2 ARG 87 -9.549 -33.818 -5.756 688 HG3 ARG 87 HG3 ARG 87 -9.192 -35.191 -6.805 689 HD2 ARG 87 HD2 ARG 87 -9.219 -36.704 -4.982 690 HD3 ARG 87 HD3 ARG 87 -9.209 -35.392 -3.804 691 HE ARG 87 HE ARG 87 -11.502 -35.323 -5.512 692 HH11 ARG 87 HH11 ARG 87 -10.142 -36.791 -2.663 693 HH12 ARG 87 HH12 ARG 87 -11.682 -37.153 -1.956 694 HH21 ARG 87 HH21 ARG 87 -13.536 -35.795 -4.592 695 HH22 ARG 87 HH22 ARG 87 -13.612 -36.588 -3.054 696 H THR 88 H THR 88 -6.524 -35.356 -3.161 697 HA THR 88 HA THR 88 -3.697 -34.572 -3.076 698 HB THR 88 HB THR 88 -4.677 -33.691 -1.020 699 HG1 THR 88 HG1 THR 88 -2.768 -34.303 -0.330 700 HG21 THR 88 HG21 THR 88 -6.243 -36.027 -1.113 701 HG22 THR 88 HG22 THR 88 -6.287 -34.748 0.100 702 HG23 THR 88 HG23 THR 88 -5.251 -36.154 0.338 703 H ILE 89 H ILE 89 -2.263 -36.248 -3.026 704 HA ILE 89 HA ILE 89 -1.501 -38.359 -3.426 705 HB ILE 89 HB ILE 89 -3.679 -39.355 -1.611 706 HG12 ILE 89 HG12 ILE 89 -1.121 -37.951 -0.809 707 HG13 ILE 89 HG13 ILE 89 -2.755 -37.346 -0.565 708 HG21 ILE 89 HG21 ILE 89 -1.641 -40.647 -2.876 709 HG22 ILE 89 HG22 ILE 89 -0.924 -40.292 -1.305 710 HG23 ILE 89 HG23 ILE 89 -2.430 -41.204 -1.400 711 HD11 ILE 89 HD11 ILE 89 -2.575 -38.238 1.466 712 HD12 ILE 89 HD12 ILE 89 -2.847 -39.785 0.663 713 HD13 ILE 89 HD13 ILE 89 -1.203 -39.244 1.002 714 H VAL 90 H VAL 90 -3.436 -37.402 -5.280 715 HA VAL 90 HA VAL 90 -5.525 -39.087 -5.909 716 HB VAL 90 HB VAL 90 -5.020 -38.460 -8.336 717 HG11 VAL 90 HG11 VAL 90 -6.138 -36.487 -8.066 718 HG12 VAL 90 HG12 VAL 90 -6.408 -37.198 -6.474 719 HG13 VAL 90 HG13 VAL 90 -5.147 -35.984 -6.696 720 HG21 VAL 90 HG21 VAL 90 -2.526 -38.034 -7.574 721 HG22 VAL 90 HG22 VAL 90 -3.261 -37.104 -8.879 722 HG23 VAL 90 HG23 VAL 90 -3.150 -36.414 -7.261 723 HA PRO 91 HA PRO 91 -3.860 -42.940 -7.193 724 HB2 PRO 91 HB2 PRO 91 -5.572 -43.631 -9.184 725 HB3 PRO 91 HB3 PRO 91 -6.026 -43.651 -7.476 726 HG2 PRO 91 HG2 PRO 91 -6.577 -41.571 -9.557 727 HG3 PRO 91 HG3 PRO 91 -7.659 -42.222 -8.312 728 HD2 PRO 91 HD2 PRO 91 -6.401 -39.839 -8.046 729 HD3 PRO 91 HD3 PRO 91 -6.768 -40.884 -6.659 730 H LYS 92 H LYS 92 -1.915 -42.894 -8.164 731 HA LYS 92 HA LYS 92 -1.825 -42.654 -11.055 732 HB2 LYS 92 HB2 LYS 92 -0.009 -41.028 -11.060 733 HB3 LYS 92 HB3 LYS 92 -1.435 -40.351 -10.285 734 HG2 LYS 92 HG2 LYS 92 -0.339 -41.099 -8.084 735 HG3 LYS 92 HG3 LYS 92 1.138 -41.239 -9.041 736 HD2 LYS 92 HD2 LYS 92 1.144 -38.943 -9.559 737 HD3 LYS 92 HD3 LYS 92 -0.531 -38.738 -9.039 738 HE2 LYS 92 HE2 LYS 92 0.540 -37.875 -7.219 739 HE3 LYS 92 HE3 LYS 92 0.461 -39.567 -6.734 740 HZ1 LYS 92 HZ1 LYS 92 2.790 -38.278 -8.051 741 HZ2 LYS 92 HZ2 LYS 92 2.711 -39.878 -7.509 742 HZ3 LYS 92 HZ3 LYS 92 2.667 -38.605 -6.396 743 H SER 93 H SER 93 -0.257 -43.897 -11.973 744 HA SER 93 HA SER 93 2.105 -44.756 -10.717 745 HB2 SER 93 HB2 SER 93 -0.307 -46.436 -10.285 746 HB3 SER 93 HB3 SER 93 1.184 -47.280 -10.701 747 HG SER 93 HG SER 93 2.180 -46.260 -8.930 748 H TYR 94 H TYR 94 3.433 -45.894 -12.111 749 HA TYR 94 HA TYR 94 2.518 -47.218 -14.445 750 HB2 TYR 94 HB2 TYR 94 3.341 -45.641 -16.135 751 HB3 TYR 94 HB3 TYR 94 2.045 -44.926 -15.184 752 HD1 TYR 94 HD1 TYR 94 2.619 -43.259 -13.397 753 HD2 TYR 94 HD2 TYR 94 5.491 -44.655 -16.209 754 HE1 TYR 94 HE1 TYR 94 4.058 -41.334 -12.875 755 HE2 TYR 94 HE2 TYR 94 6.938 -42.735 -15.693 756 HH TYR 94 HH TYR 94 6.388 -40.231 -14.704 757 H ALA 95 H ALA 95 4.010 -48.695 -14.874 758 HA ALA 95 HA ALA 95 6.785 -48.169 -14.045 759 HB1 ALA 95 HB1 ALA 95 5.622 -50.038 -12.901 760 HB2 ALA 95 HB2 ALA 95 5.472 -50.850 -14.460 761 HB3 ALA 95 HB3 ALA 95 7.068 -50.539 -13.777 762 H ASP 96 H ASP 96 7.853 -47.430 -15.786 763 HA ASP 96 HA ASP 96 7.497 -48.840 -18.344 764 HB2 ASP 96 HB2 ASP 96 7.173 -46.254 -18.059 765 HB3 ASP 96 HB3 ASP 96 8.934 -46.223 -18.108 766 H ASN 97 H ASN 97 8.967 -50.391 -18.591 767 HA ASN 97 HA ASN 97 11.784 -49.707 -18.301 768 HB2 ASN 97 HB2 ASN 97 10.820 -52.296 -17.111 769 HB3 ASN 97 HB3 ASN 97 12.349 -51.459 -16.847 770 HD21 ASN 97 HD21 ASN 97 9.392 -52.140 -15.552 771 HD22 ASN 97 HD22 ASN 97 9.310 -50.889 -14.364 772 H PHE 98 H PHE 98 12.856 -50.374 -20.036 773 HA PHE 98 HA PHE 98 12.180 -52.888 -21.321 774 HB2 PHE 98 HB2 PHE 98 12.052 -51.813 -23.573 775 HB3 PHE 98 HB3 PHE 98 10.713 -51.390 -22.511 776 HD1 PHE 98 HD1 PHE 98 10.619 -49.152 -21.474 777 HD2 PHE 98 HD2 PHE 98 13.572 -50.174 -24.365 778 HE1 PHE 98 HE1 PHE 98 11.089 -46.763 -21.833 779 HE2 PHE 98 HE2 PHE 98 14.047 -47.787 -24.727 780 HZ PHE 98 HZ PHE 98 12.807 -46.078 -23.460 781 H THR 99 H THR 99 13.904 -53.850 -22.281 782 HA THR 99 HA THR 99 16.190 -52.522 -23.253 783 HB THR 99 HB THR 99 16.630 -52.032 -20.894 784 HG1 THR 99 HG1 THR 99 18.437 -54.086 -21.611 785 HG21 THR 99 HG21 THR 99 17.215 -54.804 -20.140 786 HG22 THR 99 HG22 THR 99 15.499 -54.467 -20.370 787 HG23 THR 99 HG23 THR 99 16.438 -53.518 -19.217 788 H LYS 100 H LYS 100 17.286 -53.871 -24.551 789 HA LYS 100 HA LYS 100 17.287 -56.737 -24.028 790 HB2 LYS 100 HB2 LYS 100 16.656 -57.086 -26.506 791 HB3 LYS 100 HB3 LYS 100 15.370 -56.736 -25.360 792 HG2 LYS 100 HG2 LYS 100 15.130 -54.538 -26.127 793 HG3 LYS 100 HG3 LYS 100 16.680 -54.572 -26.970 794 HD2 LYS 100 HD2 LYS 100 14.991 -54.757 -28.630 795 HD3 LYS 100 HD3 LYS 100 15.708 -56.360 -28.454 796 HE2 LYS 100 HE2 LYS 100 13.856 -57.107 -27.126 797 HE3 LYS 100 HE3 LYS 100 13.183 -55.478 -27.064 798 HZ1 LYS 100 HZ1 LYS 100 13.196 -55.748 -29.642 799 HZ2 LYS 100 HZ2 LYS 100 11.940 -56.409 -28.721 800 HZ3 LYS 100 HZ3 LYS 100 13.191 -57.401 -29.280 801 HA PRO 101 HA PRO 101 21.339 -56.578 -25.706 802 HB2 PRO 101 HB2 PRO 101 21.556 -59.021 -26.871 803 HB3 PRO 101 HB3 PRO 101 21.554 -58.789 -25.118 804 HG2 PRO 101 HG2 PRO 101 19.314 -59.623 -26.922 805 HG3 PRO 101 HG3 PRO 101 19.772 -60.266 -25.335 806 HD2 PRO 101 HD2 PRO 101 17.730 -58.519 -25.664 807 HD3 PRO 101 HD3 PRO 101 18.730 -58.552 -24.199 808 H ARG 102 H ARG 102 22.522 -57.426 -27.880 809 HA ARG 102 HA ARG 102 20.886 -56.631 -30.186 810 HB2 ARG 102 HB2 ARG 102 22.694 -55.234 -31.041 811 HB3 ARG 102 HB3 ARG 102 22.175 -54.670 -29.458 812 HG2 ARG 102 HG2 ARG 102 24.445 -56.572 -29.559 813 HG3 ARG 102 HG3 ARG 102 24.727 -54.917 -30.107 814 HD2 ARG 102 HD2 ARG 102 23.611 -55.737 -27.427 815 HD3 ARG 102 HD3 ARG 102 25.252 -55.172 -27.735 816 HE ARG 102 HE ARG 102 23.564 -53.199 -28.673 817 HH11 ARG 102 HH11 ARG 102 24.244 -54.745 -25.629 818 HH12 ARG 102 HH12 ARG 102 23.839 -53.351 -24.682 819 HH21 ARG 102 HH21 ARG 102 23.030 -51.357 -27.438 820 HH22 ARG 102 HH22 ARG 102 23.148 -51.425 -25.712 821 H ASP 103 H ASP 103 21.784 -59.232 -29.240 822 HA ASP 103 HA ASP 103 23.307 -60.031 -31.623 823 HB2 ASP 103 HB2 ASP 103 24.651 -59.955 -29.393 824 HB3 ASP 103 HB3 ASP 103 23.753 -61.418 -28.997 825 H MET 104 H MET 104 22.081 -61.344 -32.788 826 HA MET 104 HA MET 104 19.725 -62.565 -31.850 827 HB2 MET 104 HB2 MET 104 20.451 -61.975 -34.269 828 HB3 MET 104 HB3 MET 104 21.227 -63.552 -34.257 829 HG2 MET 104 HG2 MET 104 19.243 -64.686 -34.219 830 HG3 MET 104 HG3 MET 104 18.377 -63.365 -33.440 831 HE1 MET 104 HE1 MET 104 18.622 -64.309 -37.833 832 HE2 MET 104 HE2 MET 104 20.135 -64.367 -36.929 833 HE3 MET 104 HE3 MET 104 18.766 -65.357 -36.422 Start of MODEL 5 1 H1 MET 1 H MET 1 4.376 4.369 -9.984 2 HA MET 1 HA MET 1 3.079 2.439 -10.789 3 HB2 MET 1 HB2 MET 1 3.083 2.469 -7.771 4 HB3 MET 1 HB3 MET 1 3.178 1.066 -8.826 5 HG2 MET 1 HG2 MET 1 5.373 1.823 -9.615 6 HG3 MET 1 HG3 MET 1 5.277 3.200 -8.521 7 HE1 MET 1 HE1 MET 1 7.095 -0.727 -7.663 8 HE2 MET 1 HE2 MET 1 5.636 -0.824 -8.649 9 HE3 MET 1 HE3 MET 1 6.959 0.237 -9.134 10 H GLN 2 H GLN 2 1.249 4.705 -10.665 11 HA GLN 2 HA GLN 2 -1.056 3.756 -9.186 12 HB2 GLN 2 HB2 GLN 2 -0.934 6.058 -11.134 13 HB3 GLN 2 HB3 GLN 2 -2.142 5.774 -9.889 14 HG2 GLN 2 HG2 GLN 2 -0.373 6.076 -8.178 15 HG3 GLN 2 HG3 GLN 2 0.747 6.499 -9.471 16 HE21 GLN 2 HE21 GLN 2 -0.284 8.046 -7.172 17 HE22 GLN 2 HE22 GLN 2 -0.954 9.486 -7.853 18 H GLU 3 H GLU 3 -2.732 2.639 -9.988 19 HA GLU 3 HA GLU 3 -2.592 1.833 -12.798 20 HB2 GLU 3 HB2 GLU 3 -4.320 0.698 -10.593 21 HB3 GLU 3 HB3 GLU 3 -4.059 0.005 -12.188 22 HG2 GLU 3 HG2 GLU 3 -1.546 0.031 -11.439 23 HG3 GLU 3 HG3 GLU 3 -2.256 0.065 -9.825 24 H GLN 4 H GLN 4 -4.225 2.169 -14.248 25 HA GLN 4 HA GLN 4 -6.418 3.917 -13.344 26 HB2 GLN 4 HB2 GLN 4 -6.462 4.665 -15.775 27 HB3 GLN 4 HB3 GLN 4 -5.081 5.186 -14.819 28 HG2 GLN 4 HG2 GLN 4 -3.612 3.861 -15.954 29 HG3 GLN 4 HG3 GLN 4 -4.841 2.672 -16.379 30 HE21 GLN 4 HE21 GLN 4 -2.877 4.967 -17.603 31 HE22 GLN 4 HE22 GLN 4 -3.755 5.388 -19.029 32 H VAL 5 H VAL 5 -7.655 2.007 -12.829 33 HA VAL 5 HA VAL 5 -8.746 0.672 -15.220 34 HB VAL 5 HB VAL 5 -8.679 -0.453 -12.419 35 HG11 VAL 5 HG11 VAL 5 -8.979 -2.405 -14.470 36 HG12 VAL 5 HG12 VAL 5 -10.096 -1.988 -13.169 37 HG13 VAL 5 HG13 VAL 5 -10.184 -1.141 -14.714 38 HG21 VAL 5 HG21 VAL 5 -6.486 -0.720 -12.885 39 HG22 VAL 5 HG22 VAL 5 -7.073 -2.086 -13.834 40 HG23 VAL 5 HG23 VAL 5 -6.723 -0.548 -14.625 41 H SER 6 H SER 6 -10.692 1.440 -15.694 42 HA SER 6 HA SER 6 -12.470 2.240 -13.488 43 HB2 SER 6 HB2 SER 6 -11.704 3.906 -15.363 44 HB3 SER 6 HB3 SER 6 -12.928 3.082 -16.330 45 HG SER 6 HG SER 6 -14.489 3.781 -14.975 46 H ASN 7 H ASN 7 -12.666 -0.281 -13.571 47 HA ASN 7 HA ASN 7 -15.177 -0.833 -14.934 48 HB2 ASN 7 HB2 ASN 7 -12.612 -2.297 -15.460 49 HB3 ASN 7 HB3 ASN 7 -14.150 -3.147 -15.573 50 HD21 ASN 7 HD21 ASN 7 -15.804 -2.088 -16.967 51 HD22 ASN 7 HD22 ASN 7 -15.256 -1.354 -18.431 52 H VAL 8 H VAL 8 -15.747 -3.298 -14.335 53 HA VAL 8 HA VAL 8 -15.364 -3.493 -11.419 54 HB VAL 8 HB VAL 8 -17.502 -4.685 -11.329 55 HG11 VAL 8 HG11 VAL 8 -17.934 -2.495 -10.875 56 HG12 VAL 8 HG12 VAL 8 -17.303 -1.934 -12.425 57 HG13 VAL 8 HG13 VAL 8 -18.903 -2.672 -12.337 58 HG21 VAL 8 HG21 VAL 8 -17.091 -4.990 -14.097 59 HG22 VAL 8 HG22 VAL 8 -18.438 -5.591 -13.129 60 HG23 VAL 8 HG23 VAL 8 -18.546 -4.012 -13.907 61 H ARG 9 H ARG 9 -15.889 -5.870 -10.679 62 HA ARG 9 HA ARG 9 -14.340 -7.691 -12.402 63 HB2 ARG 9 HB2 ARG 9 -14.440 -7.758 -9.384 64 HB3 ARG 9 HB3 ARG 9 -13.403 -8.715 -10.436 65 HG2 ARG 9 HG2 ARG 9 -13.269 -5.717 -10.308 66 HG3 ARG 9 HG3 ARG 9 -12.314 -6.771 -9.263 67 HD2 ARG 9 HD2 ARG 9 -10.794 -6.665 -10.911 68 HD3 ARG 9 HD3 ARG 9 -11.825 -7.854 -11.707 69 HE ARG 9 HE ARG 9 -12.337 -6.276 -13.269 70 HH11 ARG 9 HH11 ARG 9 -11.158 -4.669 -10.414 71 HH12 ARG 9 HH12 ARG 9 -11.171 -3.094 -11.137 72 HH21 ARG 9 HH21 ARG 9 -12.357 -4.208 -14.232 73 HH22 ARG 9 HH22 ARG 9 -11.853 -2.834 -13.308 74 H ALA 10 H ALA 10 -15.089 -9.749 -12.693 75 HA ALA 10 HA ALA 10 -17.779 -10.296 -11.635 76 HB1 ALA 10 HB1 ALA 10 -17.268 -12.112 -13.684 77 HB2 ALA 10 HB2 ALA 10 -18.286 -10.673 -13.766 78 HB3 ALA 10 HB3 ALA 10 -16.591 -10.584 -14.247 79 H ARG 11 H ARG 11 -18.060 -11.914 -10.244 80 HA ARG 11 HA ARG 11 -15.832 -13.784 -9.824 81 HB2 ARG 11 HB2 ARG 11 -17.771 -12.465 -8.040 82 HB3 ARG 11 HB3 ARG 11 -17.479 -14.163 -7.684 83 HG2 ARG 11 HG2 ARG 11 -15.206 -13.802 -7.259 84 HG3 ARG 11 HG3 ARG 11 -15.225 -12.220 -8.042 85 HD2 ARG 11 HD2 ARG 11 -16.888 -11.548 -6.213 86 HD3 ARG 11 HD3 ARG 11 -16.368 -13.014 -5.382 87 HE ARG 11 HE ARG 11 -14.084 -11.578 -6.086 88 HH11 ARG 11 HH11 ARG 11 -16.857 -11.245 -4.007 89 HH12 ARG 11 HH12 ARG 11 -16.032 -10.260 -2.846 90 HH21 ARG 11 HH21 ARG 11 -12.987 -10.282 -4.563 91 HH22 ARG 11 HH22 ARG 11 -13.830 -9.711 -3.163 92 H ILE 12 H ILE 12 -16.168 -15.536 -11.063 93 HA ILE 12 HA ILE 12 -18.859 -16.646 -11.305 94 HB ILE 12 HB ILE 12 -16.294 -17.444 -12.686 95 HG12 ILE 12 HG12 ILE 12 -18.709 -16.036 -13.833 96 HG13 ILE 12 HG13 ILE 12 -17.275 -15.188 -13.264 97 HG21 ILE 12 HG21 ILE 12 -17.907 -18.674 -14.207 98 HG22 ILE 12 HG22 ILE 12 -17.647 -19.371 -12.609 99 HG23 ILE 12 HG23 ILE 12 -19.114 -18.450 -12.941 100 HD11 ILE 12 HD11 ILE 12 -15.936 -16.453 -14.913 101 HD12 ILE 12 HD12 ILE 12 -17.429 -17.163 -15.526 102 HD13 ILE 12 HD13 ILE 12 -17.168 -15.424 -15.643 103 H TYR 13 H TYR 13 -19.528 -18.327 -10.148 104 HA TYR 13 HA TYR 13 -17.503 -19.993 -8.802 105 HB2 TYR 13 HB2 TYR 13 -18.635 -18.710 -7.127 106 HB3 TYR 13 HB3 TYR 13 -20.209 -19.081 -7.822 107 HD1 TYR 13 HD2 TYR 13 -17.260 -21.129 -6.761 108 HD2 TYR 13 HD1 TYR 13 -21.450 -20.452 -6.453 109 HE1 TYR 13 HE2 TYR 13 -17.458 -23.068 -5.261 110 HE2 TYR 13 HE1 TYR 13 -21.659 -22.389 -4.951 111 HH TYR 13 HH TYR 13 -18.813 -24.181 -3.858 112 H LYS 14 H LYS 14 -17.744 -22.187 -8.848 113 HA LYS 14 HA LYS 14 -19.880 -23.208 -10.596 114 HB2 LYS 14 HB2 LYS 14 -17.431 -23.490 -11.260 115 HB3 LYS 14 HB3 LYS 14 -17.306 -24.628 -9.925 116 HG2 LYS 14 HG2 LYS 14 -19.166 -25.931 -10.976 117 HG3 LYS 14 HG3 LYS 14 -19.034 -24.863 -12.376 118 HD2 LYS 14 HD2 LYS 14 -16.668 -25.523 -12.618 119 HD3 LYS 14 HD3 LYS 14 -16.860 -26.637 -11.262 120 HE2 LYS 14 HE2 LYS 14 -18.625 -26.785 -13.685 121 HE3 LYS 14 HE3 LYS 14 -17.052 -27.580 -13.641 122 HZ1 LYS 14 HZ1 LYS 14 -17.763 -29.112 -12.154 123 HZ2 LYS 14 HZ2 LYS 14 -19.259 -28.781 -12.870 124 HZ3 LYS 14 HZ3 LYS 14 -18.851 -28.062 -11.394 125 HA PRO 15 HA PRO 15 -21.103 -24.839 -6.500 126 HB2 PRO 15 HB2 PRO 15 -23.747 -24.949 -7.108 127 HB3 PRO 15 HB3 PRO 15 -22.951 -23.474 -6.545 128 HG2 PRO 15 HG2 PRO 15 -23.656 -24.298 -9.335 129 HG3 PRO 15 HG3 PRO 15 -23.833 -22.715 -8.557 130 HD2 PRO 15 HD2 PRO 15 -21.787 -23.293 -10.234 131 HD3 PRO 15 HD3 PRO 15 -21.615 -22.173 -8.867 132 H ALA 16 H ALA 16 -22.148 -26.853 -5.911 133 HA ALA 16 HA ALA 16 -21.479 -28.979 -7.699 134 HB1 ALA 16 HB1 ALA 16 -22.688 -30.340 -5.830 135 HB2 ALA 16 HB2 ALA 16 -21.134 -29.573 -5.501 136 HB3 ALA 16 HB3 ALA 16 -22.626 -28.813 -4.948 137 H LYS 17 H LYS 17 -22.897 -30.578 -8.545 138 HA LYS 17 HA LYS 17 -25.444 -29.469 -9.405 139 HB2 LYS 17 HB2 LYS 17 -25.503 -31.328 -10.980 140 HB3 LYS 17 HB3 LYS 17 -23.951 -30.505 -11.063 141 HG2 LYS 17 HG2 LYS 17 -23.192 -32.631 -11.037 142 HG3 LYS 17 HG3 LYS 17 -23.315 -32.391 -9.292 143 HD2 LYS 17 HD2 LYS 17 -25.168 -33.723 -9.102 144 HD3 LYS 17 HD3 LYS 17 -25.713 -33.384 -10.747 145 HE2 LYS 17 HE2 LYS 17 -24.374 -34.997 -11.668 146 HE3 LYS 17 HE3 LYS 17 -23.169 -34.882 -10.386 147 HZ1 LYS 17 HZ1 LYS 17 -24.964 -35.895 -8.916 148 HZ2 LYS 17 HZ2 LYS 17 -24.206 -36.917 -10.030 149 HZ3 LYS 17 HZ3 LYS 17 -25.753 -36.312 -10.353 150 H SER 18 H SER 18 -24.210 -31.875 -7.241 151 HA SER 18 HA SER 18 -26.409 -33.566 -6.994 152 HB2 SER 18 HB2 SER 18 -25.519 -34.111 -4.756 153 HB3 SER 18 HB3 SER 18 -24.239 -34.061 -5.967 154 HG SER 18 HG SER 18 -24.335 -32.729 -3.717 155 H THR 19 H THR 19 -27.704 -33.696 -4.848 156 HA THR 19 HA THR 19 -29.372 -32.859 -3.546 157 HB THR 19 HB THR 19 -28.206 -30.106 -3.623 158 HG1 THR 19 HG1 THR 19 -26.415 -30.712 -2.631 159 HG21 THR 19 HG21 THR 19 -28.800 -30.161 -1.243 160 HG22 THR 19 HG22 THR 19 -29.325 -31.836 -1.412 161 HG23 THR 19 HG23 THR 19 -30.187 -30.552 -2.259 162 H MET 20 H MET 20 -29.893 -32.972 -6.251 163 HA MET 20 HA MET 20 -31.822 -30.795 -6.518 164 HB2 MET 20 HB2 MET 20 -29.736 -31.511 -8.572 165 HB3 MET 20 HB3 MET 20 -31.211 -30.649 -8.988 166 HG2 MET 20 HG2 MET 20 -30.489 -29.006 -7.128 167 HG3 MET 20 HG3 MET 20 -28.902 -29.745 -7.326 168 HE1 MET 20 HE1 MET 20 -28.225 -26.496 -8.943 169 HE2 MET 20 HE2 MET 20 -29.897 -26.260 -8.433 170 HE3 MET 20 HE3 MET 20 -28.777 -27.152 -7.401 171 H GLN 21 H GLN 21 -33.618 -31.295 -7.842 172 HA GLN 21 HA GLN 21 -34.314 -34.068 -7.837 173 HB2 GLN 21 HB2 GLN 21 -35.747 -31.647 -8.939 174 HB3 GLN 21 HB3 GLN 21 -36.436 -33.264 -8.888 175 HG2 GLN 21 HG2 GLN 21 -35.646 -31.552 -6.546 176 HG3 GLN 21 HG3 GLN 21 -37.277 -32.003 -7.041 177 HE21 GLN 21 HE21 GLN 21 -37.967 -34.148 -6.737 178 HE22 GLN 21 HE22 GLN 21 -37.193 -35.187 -5.594 179 H SER 22 H SER 22 -34.751 -35.412 -9.595 180 HA SER 22 HA SER 22 -33.325 -34.664 -12.049 181 HB2 SER 22 HB2 SER 22 -32.448 -36.676 -11.105 182 HB3 SER 22 HB3 SER 22 -34.062 -37.349 -10.875 183 HG SER 22 HG SER 22 -32.786 -38.081 -12.772 184 H GLY 23 H GLY 23 -34.227 -35.228 -14.115 185 HA2 GLY 23 HA2 GLY 23 -36.113 -36.044 -15.411 186 HA3 GLY 23 HA3 GLY 23 -37.161 -35.546 -14.091 187 H HIS 24 H HIS 24 -36.643 -33.041 -13.556 188 HA HIS 24 HA HIS 24 -36.683 -31.590 -16.114 189 HB2 HIS 24 HB2 HIS 24 -38.979 -31.992 -14.958 190 HB3 HIS 24 HB3 HIS 24 -38.439 -30.759 -13.823 191 HD1 HIS 24 HD1 HIS 24 -39.894 -31.209 -17.161 192 HD2 HIS 24 HD2 HIS 24 -38.013 -28.174 -15.036 193 HE1 HIS 24 HE1 HIS 24 -40.403 -29.093 -18.420 194 H SER 25 H SER 25 -34.355 -31.494 -15.192 195 HA SER 25 HA SER 25 -34.084 -29.330 -13.233 196 HB2 SER 25 HB2 SER 25 -32.810 -31.548 -13.022 197 HB3 SER 25 HB3 SER 25 -31.826 -30.975 -14.368 198 HG SER 25 HG SER 25 -30.902 -29.545 -13.103 199 H LYS 26 H LYS 26 -35.037 -28.297 -15.466 200 HA LYS 26 HA LYS 26 -32.843 -27.417 -17.170 201 HB2 LYS 26 HB2 LYS 26 -35.833 -27.122 -17.293 202 HB3 LYS 26 HB3 LYS 26 -34.784 -26.157 -18.321 203 HG2 LYS 26 HG2 LYS 26 -34.616 -29.152 -18.240 204 HG3 LYS 26 HG3 LYS 26 -35.734 -28.296 -19.305 205 HD2 LYS 26 HD2 LYS 26 -32.837 -27.559 -19.281 206 HD3 LYS 26 HD3 LYS 26 -33.375 -28.981 -20.177 207 HE2 LYS 26 HE2 LYS 26 -34.777 -26.367 -20.543 208 HE3 LYS 26 HE3 LYS 26 -33.244 -26.662 -21.361 209 HZ1 LYS 26 HZ1 LYS 26 -35.522 -27.288 -22.466 210 HZ2 LYS 26 HZ2 LYS 26 -35.329 -28.707 -21.566 211 HZ3 LYS 26 HZ3 LYS 26 -34.150 -28.251 -22.690 212 H LEU 27 H LEU 27 -32.052 -26.403 -15.002 213 HA LEU 27 HA LEU 27 -32.926 -23.596 -15.021 214 HB2 LEU 27 HB2 LEU 27 -32.169 -25.157 -12.557 215 HB3 LEU 27 HB3 LEU 27 -32.663 -23.467 -12.618 216 HG LEU 27 HG LEU 27 -34.491 -25.701 -13.460 217 HD11 LEU 27 HD11 LEU 27 -34.515 -24.427 -10.745 218 HD12 LEU 27 HD12 LEU 27 -33.626 -25.915 -11.071 219 HD13 LEU 27 HD13 LEU 27 -35.375 -25.863 -11.300 220 HD21 LEU 27 HD21 LEU 27 -36.130 -23.848 -12.638 221 HD22 LEU 27 HD22 LEU 27 -35.396 -23.731 -14.236 222 HD23 LEU 27 HD23 LEU 27 -34.751 -22.781 -12.898 223 H LYS 28 H LYS 28 -31.226 -22.255 -13.695 224 HA LYS 28 HA LYS 28 -28.851 -22.219 -15.113 225 HB2 LYS 28 HB2 LYS 28 -28.193 -20.488 -13.734 226 HB3 LYS 28 HB3 LYS 28 -29.935 -20.471 -13.489 227 HG2 LYS 28 HG2 LYS 28 -27.910 -21.760 -11.669 228 HG3 LYS 28 HG3 LYS 28 -28.739 -20.228 -11.386 229 HD2 LYS 28 HD2 LYS 28 -30.119 -22.892 -11.707 230 HD3 LYS 28 HD3 LYS 28 -29.739 -22.140 -10.156 231 HE2 LYS 28 HE2 LYS 28 -31.138 -20.231 -10.721 232 HE3 LYS 28 HE3 LYS 28 -31.479 -20.929 -12.304 233 HZ1 LYS 28 HZ1 LYS 28 -33.190 -21.963 -11.384 234 HZ2 LYS 28 HZ2 LYS 28 -32.771 -21.414 -9.841 235 HZ3 LYS 28 HZ3 LYS 28 -32.124 -22.862 -10.427 236 H ALA 29 H ALA 29 -26.621 -22.490 -14.210 237 HA ALA 29 HA ALA 29 -26.407 -24.707 -12.305 238 HB1 ALA 29 HB1 ALA 29 -24.519 -24.943 -14.515 239 HB2 ALA 29 HB2 ALA 29 -25.524 -26.171 -13.743 240 HB3 ALA 29 HB3 ALA 29 -26.203 -25.142 -15.004 241 H TRP 30 H TRP 30 -24.716 -22.227 -14.186 242 HA TRP 30 HA TRP 30 -22.542 -22.215 -12.226 243 HB2 TRP 30 HB2 TRP 30 -22.859 -21.090 -14.995 244 HB3 TRP 30 HB3 TRP 30 -21.595 -20.488 -13.925 245 HD1 TRP 30 HD1 TRP 30 -22.735 -23.816 -15.541 246 HE1 TRP 30 HE1 TRP 30 -20.658 -25.306 -15.844 247 HE3 TRP 30 HE3 TRP 30 -19.265 -20.850 -13.240 248 HZ2 TRP 30 HZ2 TRP 30 -17.913 -25.233 -15.193 249 HZ3 TRP 30 HZ3 TRP 30 -16.936 -21.633 -13.122 250 HH2 TRP 30 HH2 TRP 30 -16.275 -23.780 -14.079 251 H LYS 31 H LYS 31 -21.867 -20.284 -11.195 252 HA LYS 31 HA LYS 31 -24.014 -18.284 -10.936 253 HB2 LYS 31 HB2 LYS 31 -23.180 -19.811 -8.944 254 HB3 LYS 31 HB3 LYS 31 -21.898 -18.609 -8.852 255 HG2 LYS 31 HG2 LYS 31 -23.510 -16.851 -8.507 256 HG3 LYS 31 HG3 LYS 31 -24.842 -17.988 -8.731 257 HD2 LYS 31 HD2 LYS 31 -24.679 -17.806 -6.416 258 HD3 LYS 31 HD3 LYS 31 -23.771 -19.278 -6.767 259 HE2 LYS 31 HE2 LYS 31 -22.336 -18.190 -5.335 260 HE3 LYS 31 HE3 LYS 31 -21.737 -17.649 -6.902 261 HZ1 LYS 31 HZ1 LYS 31 -22.200 -15.957 -4.987 262 HZ2 LYS 31 HZ2 LYS 31 -23.790 -16.046 -5.555 263 HZ3 LYS 31 HZ3 LYS 31 -22.548 -15.553 -6.592 264 H LEU 32 H LEU 32 -23.471 -16.088 -10.821 265 HA LEU 32 HA LEU 32 -20.706 -15.297 -11.218 266 HB2 LEU 32 HB2 LEU 32 -21.486 -15.747 -13.482 267 HB3 LEU 32 HB3 LEU 32 -22.860 -14.672 -13.232 268 HG LEU 32 HG LEU 32 -20.838 -13.831 -14.595 269 HD11 LEU 32 HD11 LEU 32 -21.406 -11.651 -14.086 270 HD12 LEU 32 HD12 LEU 32 -21.603 -11.991 -12.367 271 HD13 LEU 32 HD13 LEU 32 -22.818 -12.544 -13.520 272 HD21 LEU 32 HD21 LEU 32 -18.909 -13.252 -13.553 273 HD22 LEU 32 HD22 LEU 32 -19.371 -14.588 -12.499 274 HD23 LEU 32 HD23 LEU 32 -19.706 -12.926 -12.013 275 H GLU 33 H GLU 33 -20.294 -13.468 -10.154 276 HA GLU 33 HA GLU 33 -22.511 -11.613 -9.620 277 HB2 GLU 33 HB2 GLU 33 -21.211 -11.280 -7.346 278 HB3 GLU 33 HB3 GLU 33 -22.419 -12.545 -7.526 279 HG2 GLU 33 HG2 GLU 33 -20.901 -14.208 -7.407 280 HG3 GLU 33 HG3 GLU 33 -19.652 -13.277 -8.232 281 H PHE 34 H PHE 34 -22.018 -9.732 -10.515 282 HA PHE 34 HA PHE 34 -19.206 -8.961 -10.786 283 HB2 PHE 34 HB2 PHE 34 -19.899 -7.450 -12.500 284 HB3 PHE 34 HB3 PHE 34 -20.748 -8.966 -12.787 285 HD1 PHE 34 HD2 PHE 34 -23.150 -9.161 -12.078 286 HD2 PHE 34 HD1 PHE 34 -21.066 -5.451 -12.152 287 HE1 PHE 34 HE2 PHE 34 -25.297 -7.959 -12.070 288 HE2 PHE 34 HE1 PHE 34 -23.209 -4.242 -12.143 289 HZ PHE 34 HZ PHE 34 -25.329 -5.497 -12.103 290 H GLU 35 H GLU 35 -18.377 -7.094 -9.933 291 HA GLU 35 HA GLU 35 -19.446 -6.111 -7.551 292 HB2 GLU 35 HB2 GLU 35 -17.218 -5.369 -9.346 293 HB3 GLU 35 HB3 GLU 35 -17.802 -4.088 -8.292 294 HG2 GLU 35 HG2 GLU 35 -15.884 -5.523 -7.447 295 HG3 GLU 35 HG3 GLU 35 -17.243 -5.259 -6.356 296 HA PRO 36 HA PRO 36 -22.343 -2.996 -8.617 297 HB2 PRO 36 HB2 PRO 36 -21.806 -1.050 -6.804 298 HB3 PRO 36 HB3 PRO 36 -22.579 -2.579 -6.371 299 HG2 PRO 36 HG2 PRO 36 -19.714 -1.758 -6.090 300 HG3 PRO 36 HG3 PRO 36 -20.745 -2.632 -4.942 301 HD2 PRO 36 HD2 PRO 36 -18.936 -3.883 -6.521 302 HD3 PRO 36 HD3 PRO 36 -20.462 -4.646 -6.027 303 H SER 37 H SER 37 -22.514 -0.519 -8.981 304 HA SER 37 HA SER 37 -20.083 0.700 -9.998 305 HB2 SER 37 HB2 SER 37 -22.253 -0.359 -11.749 306 HB3 SER 37 HB3 SER 37 -21.518 1.183 -12.190 307 HG SER 37 HG SER 37 -20.402 -1.376 -12.118 308 H CYS 38 H CYS 38 -20.125 2.706 -9.258 309 HA CYS 38 HA CYS 38 -22.413 3.952 -8.196 310 HB2 CYS 38 HB2 CYS 38 -20.147 4.528 -7.469 311 HB3 CYS 38 HB3 CYS 38 -19.787 5.179 -9.062 312 HG CYS 38 HG CYS 38 -20.112 7.332 -7.348 313 H THR 39 H THR 39 -20.847 4.169 -11.340 314 HA THR 39 HA THR 39 -22.798 6.161 -12.226 315 HB THR 39 HB THR 39 -20.574 5.029 -13.911 316 HG1 THR 39 HG1 THR 39 -19.300 6.776 -13.118 317 HG21 THR 39 HG21 THR 39 -20.994 6.741 -15.340 318 HG22 THR 39 HG22 THR 39 -21.424 7.858 -14.045 319 HG23 THR 39 HG23 THR 39 -22.594 6.663 -14.603 320 H GLN 40 H GLN 40 -23.938 3.713 -11.678 321 HA GLN 40 HA GLN 40 -24.091 1.890 -13.780 322 HB2 GLN 40 HB2 GLN 40 -25.072 1.785 -11.377 323 HB3 GLN 40 HB3 GLN 40 -26.481 2.557 -12.091 324 HG2 GLN 40 HG2 GLN 40 -27.019 0.719 -13.361 325 HG3 GLN 40 HG3 GLN 40 -25.369 0.097 -13.351 326 HE21 GLN 40 HE21 GLN 40 -25.787 -1.914 -12.600 327 HE22 GLN 40 HE22 GLN 40 -26.423 -2.248 -11.028 328 H TYR 41 H TYR 41 -24.694 2.199 -15.809 329 HA TYR 41 HA TYR 41 -26.573 4.368 -16.425 330 HB2 TYR 41 HB2 TYR 41 -25.742 4.189 -18.730 331 HB3 TYR 41 HB3 TYR 41 -24.424 4.456 -17.596 332 HD1 TYR 41 HD2 TYR 41 -26.045 1.983 -19.789 333 HD2 TYR 41 HD1 TYR 41 -22.719 2.802 -17.263 334 HE1 TYR 41 HE2 TYR 41 -24.894 -0.005 -20.669 335 HE2 TYR 41 HE1 TYR 41 -21.558 0.818 -18.138 336 HH TYR 41 HH TYR 41 -21.681 -0.557 -20.355 337 H THR 42 H THR 42 -28.453 4.023 -17.540 338 HA THR 42 HA THR 42 -29.728 1.532 -17.257 339 HB THR 42 HB THR 42 -31.027 3.581 -17.347 340 HG1 THR 42 HG1 THR 42 -32.032 1.643 -18.097 341 HG21 THR 42 HG21 THR 42 -30.777 5.165 -18.906 342 HG22 THR 42 HG22 THR 42 -30.948 3.999 -20.219 343 HG23 THR 42 HG23 THR 42 -29.373 4.259 -19.468 344 H GLU 43 H GLU 43 -29.939 -0.189 -18.568 345 HA GLU 43 HA GLU 43 -28.586 -0.062 -21.179 346 HB2 GLU 43 HB2 GLU 43 -28.819 -2.179 -19.102 347 HB3 GLU 43 HB3 GLU 43 -28.767 -2.695 -20.782 348 HG2 GLU 43 HG2 GLU 43 -26.670 -1.341 -21.028 349 HG3 GLU 43 HG3 GLU 43 -26.695 -1.120 -19.279 350 HA PRO 44 HA PRO 44 -32.278 -0.961 -23.371 351 HB2 PRO 44 HB2 PRO 44 -31.422 -2.692 -25.278 352 HB3 PRO 44 HB3 PRO 44 -31.023 -0.971 -25.295 353 HG2 PRO 44 HG2 PRO 44 -29.373 -3.289 -24.363 354 HG3 PRO 44 HG3 PRO 44 -28.884 -1.883 -25.327 355 HD2 PRO 44 HD2 PRO 44 -28.395 -2.070 -22.670 356 HD3 PRO 44 HD3 PRO 44 -28.705 -0.519 -23.477 357 H LEU 45 H LEU 45 -33.991 -2.346 -23.358 358 HA LEU 45 HA LEU 45 -34.087 -4.461 -21.558 359 HB2 LEU 45 HB2 LEU 45 -35.836 -3.686 -23.868 360 HB3 LEU 45 HB3 LEU 45 -36.191 -5.104 -22.883 361 HG LEU 45 HG LEU 45 -36.058 -3.370 -20.912 362 HD11 LEU 45 HD11 LEU 45 -36.133 -1.700 -23.331 363 HD12 LEU 45 HD12 LEU 45 -35.570 -1.322 -21.704 364 HD13 LEU 45 HD13 LEU 45 -37.293 -1.272 -22.074 365 HD21 LEU 45 HD21 LEU 45 -38.545 -2.817 -21.493 366 HD22 LEU 45 HD22 LEU 45 -38.062 -4.474 -21.129 367 HD23 LEU 45 HD23 LEU 45 -38.285 -3.968 -22.804 368 H MET 46 H MET 46 -34.181 -6.715 -21.810 369 HA MET 46 HA MET 46 -33.825 -8.038 -24.284 370 HB2 MET 46 HB2 MET 46 -31.524 -6.904 -23.707 371 HB3 MET 46 HB3 MET 46 -31.360 -8.264 -22.605 372 HG2 MET 46 HG2 MET 46 -31.509 -9.828 -24.398 373 HG3 MET 46 HG3 MET 46 -31.931 -8.555 -25.541 374 HE1 MET 46 HE1 MET 46 -29.719 -6.604 -26.400 375 HE2 MET 46 HE2 MET 46 -28.856 -7.917 -27.201 376 HE3 MET 46 HE3 MET 46 -30.617 -7.952 -27.102 377 H ASN 47 H ASN 47 -34.406 -10.122 -24.071 378 HA ASN 47 HA ASN 47 -35.231 -12.007 -23.096 379 HB2 ASN 47 HB2 ASN 47 -32.671 -12.016 -22.548 380 HB3 ASN 47 HB3 ASN 47 -33.210 -11.711 -20.899 381 HD21 ASN 47 HD21 ASN 47 -31.991 -13.850 -20.798 382 HD22 ASN 47 HD22 ASN 47 -32.956 -15.276 -20.947 383 H TRP 48 H TRP 48 -36.483 -9.569 -22.331 384 HA TRP 48 HA TRP 48 -36.955 -9.621 -19.496 385 HB2 TRP 48 HB2 TRP 48 -37.068 -7.525 -20.809 386 HB3 TRP 48 HB3 TRP 48 -38.465 -8.159 -21.673 387 HD1 TRP 48 HD1 TRP 48 -37.588 -7.704 -17.905 388 HE1 TRP 48 HE1 TRP 48 -39.654 -6.713 -16.737 389 HE3 TRP 48 HE3 TRP 48 -40.730 -7.410 -21.927 390 HZ2 TRP 48 HZ2 TRP 48 -42.272 -5.912 -17.428 391 HZ3 TRP 48 HZ3 TRP 48 -42.999 -6.520 -21.588 392 HH2 TRP 48 HH2 TRP 48 -43.752 -5.788 -19.384 393 H THR 49 H THR 49 -38.548 -10.838 -22.373 394 HA THR 49 HA THR 49 -40.888 -11.699 -20.888 395 HB THR 49 HB THR 49 -41.585 -12.698 -23.089 396 HG1 THR 49 HG1 THR 49 -40.136 -12.811 -24.617 397 HG21 THR 49 HG21 THR 49 -42.633 -10.717 -23.086 398 HG22 THR 49 HG22 THR 49 -41.354 -10.173 -24.171 399 HG23 THR 49 HG23 THR 49 -41.223 -9.880 -22.438 400 H GLY 50 H GLY 50 -40.518 -13.374 -19.549 401 HA2 GLY 50 HA2 GLY 50 -40.273 -15.972 -20.434 402 HA3 GLY 50 HA3 GLY 50 -38.631 -15.444 -20.100 403 H SER 51 H SER 51 -38.709 -17.209 -18.513 404 HA SER 51 HA SER 51 -40.212 -16.533 -16.083 405 HB2 SER 51 HB2 SER 51 -40.696 -18.754 -16.474 406 HB3 SER 51 HB3 SER 51 -39.127 -19.075 -17.213 407 HG SER 51 HG SER 51 -39.180 -20.043 -15.198 408 H HIS 52 H HIS 52 -39.141 -15.385 -14.629 409 HA HIS 52 HA HIS 52 -36.281 -15.957 -14.216 410 HB2 HIS 52 HB2 HIS 52 -36.085 -13.523 -13.534 411 HB3 HIS 52 HB3 HIS 52 -36.345 -13.817 -15.251 412 HD1 HIS 52 HD1 HIS 52 -38.182 -12.521 -16.293 413 HD2 HIS 52 HD2 HIS 52 -38.614 -12.790 -12.169 414 HE1 HIS 52 HE1 HIS 52 -40.165 -11.082 -15.730 415 H ASP 53 H ASP 53 -35.551 -16.052 -12.119 416 HA ASP 53 HA ASP 53 -37.554 -15.690 -9.994 417 HB2 ASP 53 HB2 ASP 53 -37.168 -18.120 -10.637 418 HB3 ASP 53 HB3 ASP 53 -35.534 -17.931 -10.007 419 H THR 54 H THR 54 -36.536 -13.638 -9.640 420 HA THR 54 HA THR 54 -34.541 -13.715 -7.630 421 HB THR 54 HB THR 54 -32.932 -14.036 -9.356 422 HG1 THR 54 HG1 THR 54 -31.732 -12.113 -9.137 423 HG21 THR 54 HG21 THR 54 -33.575 -13.517 -11.441 424 HG22 THR 54 HG22 THR 54 -33.014 -11.886 -11.074 425 HG23 THR 54 HG23 THR 54 -34.717 -12.298 -10.876 426 H LYS 55 H LYS 55 -34.792 -11.981 -6.365 427 HA LYS 55 HA LYS 55 -36.314 -9.707 -7.447 428 HB2 LYS 55 HB2 LYS 55 -36.045 -10.759 -4.629 429 HB3 LYS 55 HB3 LYS 55 -36.825 -9.233 -5.022 430 HG2 LYS 55 HG2 LYS 55 -37.690 -11.917 -6.077 431 HG3 LYS 55 HG3 LYS 55 -38.412 -11.094 -4.693 432 HD2 LYS 55 HD2 LYS 55 -39.002 -9.201 -6.149 433 HD3 LYS 55 HD3 LYS 55 -38.312 -10.061 -7.527 434 HE2 LYS 55 HE2 LYS 55 -39.937 -11.884 -7.156 435 HE3 LYS 55 HE3 LYS 55 -40.654 -10.948 -5.844 436 HZ1 LYS 55 HZ1 LYS 55 -41.190 -9.207 -7.440 437 HZ2 LYS 55 HZ2 LYS 55 -41.899 -10.675 -7.887 438 HZ3 LYS 55 HZ3 LYS 55 -40.519 -10.123 -8.695 439 H GLN 56 H GLN 56 -33.597 -9.786 -7.986 440 HA GLN 56 HA GLN 56 -32.751 -7.325 -6.760 441 HB2 GLN 56 HB2 GLN 56 -30.509 -8.317 -6.085 442 HB3 GLN 56 HB3 GLN 56 -31.879 -8.702 -5.051 443 HG2 GLN 56 HG2 GLN 56 -31.187 -10.579 -7.248 444 HG3 GLN 56 HG3 GLN 56 -30.168 -10.543 -5.809 445 HE21 GLN 56 HE21 GLN 56 -31.441 -12.828 -6.379 446 HE22 GLN 56 HE22 GLN 56 -32.744 -13.101 -5.279 447 H GLN 57 H GLN 57 -30.491 -6.718 -7.628 448 HA GLN 57 HA GLN 57 -30.144 -7.761 -10.355 449 HB2 GLN 57 HB2 GLN 57 -29.735 -5.474 -11.161 450 HB3 GLN 57 HB3 GLN 57 -31.361 -5.656 -10.515 451 HG2 GLN 57 HG2 GLN 57 -30.931 -4.343 -8.681 452 HG3 GLN 57 HG3 GLN 57 -29.195 -4.644 -8.741 453 HE21 GLN 57 HE21 GLN 57 -31.359 -2.302 -9.063 454 HE22 GLN 57 HE22 GLN 57 -30.582 -1.294 -10.230 455 H VAL 58 H VAL 58 -28.712 -8.261 -7.831 456 HA VAL 58 HA VAL 58 -26.084 -7.102 -8.477 457 HB VAL 58 HB VAL 58 -26.989 -8.407 -5.906 458 HG11 VAL 58 HG11 VAL 58 -24.676 -6.821 -5.564 459 HG12 VAL 58 HG12 VAL 58 -24.837 -8.569 -5.388 460 HG13 VAL 58 HG13 VAL 58 -24.389 -7.876 -6.947 461 HG21 VAL 58 HG21 VAL 58 -26.976 -5.607 -6.866 462 HG22 VAL 58 HG22 VAL 58 -28.057 -6.410 -5.727 463 HG23 VAL 58 HG23 VAL 58 -26.457 -5.885 -5.204 464 H CYS 59 H CYS 59 -27.578 -10.146 -7.378 465 HA CYS 59 HA CYS 59 -25.241 -11.655 -8.185 466 HB2 CYS 59 HB2 CYS 59 -27.876 -12.451 -6.949 467 HB3 CYS 59 HB3 CYS 59 -26.645 -13.619 -7.412 468 HG CYS 59 HG CYS 59 -26.918 -12.570 -4.545 469 H LEU 60 H LEU 60 -25.116 -13.093 -9.874 470 HA LEU 60 HA LEU 60 -27.393 -13.142 -11.739 471 HB2 LEU 60 HB2 LEU 60 -24.681 -12.188 -12.158 472 HB3 LEU 60 HB3 LEU 60 -25.139 -13.434 -13.317 473 HG LEU 60 HG LEU 60 -26.608 -10.841 -12.837 474 HD11 LEU 60 HD11 LEU 60 -24.684 -11.750 -14.954 475 HD12 LEU 60 HD12 LEU 60 -24.634 -10.288 -13.969 476 HD13 LEU 60 HD13 LEU 60 -25.847 -10.456 -15.239 477 HD21 LEU 60 HD21 LEU 60 -27.729 -11.597 -15.021 478 HD22 LEU 60 HD22 LEU 60 -28.246 -12.355 -13.515 479 HD23 LEU 60 HD23 LEU 60 -27.145 -13.207 -14.600 480 H SER 61 H SER 61 -27.724 -15.047 -12.875 481 HA SER 61 HA SER 61 -26.027 -17.326 -12.099 482 HB2 SER 61 HB2 SER 61 -28.386 -18.563 -12.435 483 HB3 SER 61 HB3 SER 61 -27.870 -17.915 -10.879 484 HG SER 61 HG SER 61 -29.359 -16.423 -11.007 485 H PHE 62 H PHE 62 -25.248 -18.466 -13.745 486 HA PHE 62 HA PHE 62 -26.448 -18.062 -16.403 487 HB2 PHE 62 HB2 PHE 62 -23.610 -18.590 -15.544 488 HB3 PHE 62 HB3 PHE 62 -24.138 -18.851 -17.204 489 HD1 PHE 62 HD1 PHE 62 -24.735 -16.987 -18.629 490 HD2 PHE 62 HD2 PHE 62 -23.414 -16.369 -14.630 491 HE1 PHE 62 HE1 PHE 62 -24.370 -14.603 -19.121 492 HE2 PHE 62 HE2 PHE 62 -23.047 -13.985 -15.115 493 HZ PHE 62 HZ PHE 62 -23.527 -13.099 -17.363 494 H THR 63 H THR 63 -26.376 -19.887 -17.887 495 HA THR 63 HA THR 63 -27.137 -22.335 -16.546 496 HB THR 63 HB THR 63 -26.941 -22.144 -19.523 497 HG1 THR 63 HG1 THR 63 -28.547 -20.735 -19.656 498 HG21 THR 63 HG21 THR 63 -29.029 -23.453 -19.378 499 HG22 THR 63 HG22 THR 63 -28.940 -23.368 -17.618 500 HG23 THR 63 HG23 THR 63 -27.695 -24.227 -18.524 501 H THR 64 H THR 64 -24.687 -21.340 -18.924 502 HA THR 64 HA THR 64 -23.145 -23.749 -18.201 503 HB THR 64 HB THR 64 -22.116 -23.243 -20.610 504 HG1 THR 64 HG1 THR 64 -24.798 -22.285 -20.727 505 HG21 THR 64 HG21 THR 64 -23.090 -25.372 -19.884 506 HG22 THR 64 HG22 THR 64 -23.606 -24.960 -21.520 507 HG23 THR 64 HG23 THR 64 -24.708 -24.729 -20.164 508 H ARG 65 H ARG 65 -20.797 -23.528 -18.450 509 HA ARG 65 HA ARG 65 -19.760 -21.360 -17.069 510 HB2 ARG 65 HB2 ARG 65 -18.538 -23.431 -17.209 511 HB3 ARG 65 HB3 ARG 65 -18.395 -23.283 -18.954 512 HG2 ARG 65 HG2 ARG 65 -17.037 -21.222 -18.594 513 HG3 ARG 65 HG3 ARG 65 -17.064 -21.578 -16.865 514 HD2 ARG 65 HD2 ARG 65 -16.287 -23.966 -18.024 515 HD3 ARG 65 HD3 ARG 65 -15.457 -22.745 -18.985 516 HE ARG 65 HE ARG 65 -15.174 -22.236 -16.205 517 HH11 ARG 65 HH11 ARG 65 -14.012 -24.265 -18.784 518 HH12 ARG 65 HH12 ARG 65 -12.471 -24.546 -18.045 519 HH21 ARG 65 HH21 ARG 65 -13.147 -22.597 -15.221 520 HH22 ARG 65 HH22 ARG 65 -11.981 -23.598 -16.018 521 H GLU 66 H GLU 66 -19.467 -22.011 -20.566 522 HA GLU 66 HA GLU 66 -18.163 -19.699 -21.314 523 HB2 GLU 66 HB2 GLU 66 -18.938 -21.793 -22.694 524 HB3 GLU 66 HB3 GLU 66 -20.335 -20.791 -23.059 525 HG2 GLU 66 HG2 GLU 66 -19.023 -19.174 -24.152 526 HG3 GLU 66 HG3 GLU 66 -17.524 -19.844 -23.509 527 H LEU 67 H LEU 67 -21.586 -20.203 -20.691 528 HA LEU 67 HA LEU 67 -22.611 -17.833 -21.732 529 HB2 LEU 67 HB2 LEU 67 -23.620 -19.982 -20.366 530 HB3 LEU 67 HB3 LEU 67 -23.825 -18.671 -19.205 531 HG LEU 67 HG LEU 67 -25.137 -17.421 -20.852 532 HD11 LEU 67 HD11 LEU 67 -25.915 -19.001 -22.830 533 HD12 LEU 67 HD12 LEU 67 -24.297 -19.663 -22.602 534 HD13 LEU 67 HD13 LEU 67 -24.504 -17.950 -22.971 535 HD21 LEU 67 HD21 LEU 67 -25.903 -20.113 -19.896 536 HD22 LEU 67 HD22 LEU 67 -26.953 -19.369 -21.103 537 HD23 LEU 67 HD23 LEU 67 -26.636 -18.541 -19.577 538 H ALA 68 H ALA 68 -21.226 -18.504 -18.544 539 HA ALA 68 HA ALA 68 -21.746 -15.972 -17.412 540 HB1 ALA 68 HB1 ALA 68 -20.748 -16.797 -15.580 541 HB2 ALA 68 HB2 ALA 68 -20.783 -18.326 -16.460 542 HB3 ALA 68 HB3 ALA 68 -19.324 -17.334 -16.473 543 H ILE 69 H ILE 69 -18.600 -17.269 -18.495 544 HA ILE 69 HA ILE 69 -17.172 -14.908 -18.410 545 HB ILE 69 HB ILE 69 -16.828 -17.184 -20.366 546 HG12 ILE 69 HG12 ILE 69 -14.833 -17.412 -18.524 547 HG13 ILE 69 HG13 ILE 69 -16.137 -16.780 -17.525 548 HG21 ILE 69 HG21 ILE 69 -15.565 -15.483 -21.300 549 HG22 ILE 69 HG22 ILE 69 -15.149 -14.794 -19.731 550 HG23 ILE 69 HG23 ILE 69 -14.394 -16.297 -20.260 551 HD11 ILE 69 HD11 ILE 69 -15.728 -19.398 -18.051 552 HD12 ILE 69 HD12 ILE 69 -17.283 -18.700 -17.598 553 HD13 ILE 69 HD13 ILE 69 -16.905 -18.983 -19.297 554 H ALA 70 H ALA 70 -19.302 -16.119 -20.929 555 HA ALA 70 HA ALA 70 -18.641 -14.417 -23.019 556 HB1 ALA 70 HB1 ALA 70 -21.073 -15.916 -22.232 557 HB2 ALA 70 HB2 ALA 70 -21.255 -14.657 -23.454 558 HB3 ALA 70 HB3 ALA 70 -20.126 -15.985 -23.720 559 H TYR 71 H TYR 71 -20.358 -13.762 -20.072 560 HA TYR 71 HA TYR 71 -21.501 -11.280 -20.975 561 HB2 TYR 71 HB2 TYR 71 -22.642 -12.528 -19.239 562 HB3 TYR 71 HB3 TYR 71 -21.213 -12.475 -18.211 563 HD1 TYR 71 HD2 TYR 71 -23.372 -10.036 -20.060 564 HD2 TYR 71 HD1 TYR 71 -21.306 -10.984 -16.464 565 HE1 TYR 71 HE2 TYR 71 -24.186 -7.947 -19.048 566 HE2 TYR 71 HE1 TYR 71 -22.116 -8.899 -15.441 567 HH TYR 71 HH TYR 71 -22.969 -6.758 -16.053 568 H ALA 72 H ALA 72 -18.926 -12.142 -18.667 569 HA ALA 72 HA ALA 72 -18.068 -9.547 -18.103 570 HB1 ALA 72 HB1 ALA 72 -16.809 -12.241 -17.919 571 HB2 ALA 72 HB2 ALA 72 -15.808 -10.809 -17.680 572 HB3 ALA 72 HB3 ALA 72 -17.206 -11.092 -16.642 573 H VAL 73 H VAL 73 -16.677 -11.875 -20.424 574 HA VAL 73 HA VAL 73 -14.709 -10.273 -21.510 575 HB VAL 73 HB VAL 73 -16.399 -12.310 -22.968 576 HG11 VAL 73 HG11 VAL 73 -14.323 -12.502 -24.400 577 HG12 VAL 73 HG12 VAL 73 -15.277 -11.031 -24.611 578 HG13 VAL 73 HG13 VAL 73 -13.787 -10.991 -23.666 579 HG21 VAL 73 HG21 VAL 73 -13.690 -12.694 -21.712 580 HG22 VAL 73 HG22 VAL 73 -15.201 -13.074 -20.884 581 HG23 VAL 73 HG23 VAL 73 -14.768 -13.927 -22.366 582 H ALA 74 H ALA 74 -18.154 -10.277 -22.147 583 HA ALA 74 HA ALA 74 -18.300 -8.872 -24.516 584 HB1 ALA 74 HB1 ALA 74 -20.157 -9.843 -22.948 585 HB2 ALA 74 HB2 ALA 74 -20.206 -8.193 -22.327 586 HB3 ALA 74 HB3 ALA 74 -20.515 -8.502 -24.036 587 H HIS 75 H HIS 75 -17.480 -7.721 -21.327 588 HA HIS 75 HA HIS 75 -17.060 -5.035 -22.461 589 HB2 HIS 75 HB2 HIS 75 -18.995 -5.457 -20.688 590 HB3 HIS 75 HB3 HIS 75 -17.656 -5.319 -19.553 591 HD1 HIS 75 HD1 HIS 75 -19.612 -3.187 -19.199 592 HD2 HIS 75 HD2 HIS 75 -16.639 -2.894 -22.088 593 HE1 HIS 75 HE1 HIS 75 -19.385 -0.730 -19.686 594 H LYS 76 H LYS 76 -15.281 -7.398 -22.056 595 HA LYS 76 HA LYS 76 -13.186 -7.894 -21.307 596 HB2 LYS 76 HB2 LYS 76 -12.945 -4.881 -21.216 597 HB3 LYS 76 HB3 LYS 76 -11.606 -6.020 -21.247 598 HG2 LYS 76 HG2 LYS 76 -13.656 -5.887 -23.437 599 HG3 LYS 76 HG3 LYS 76 -12.200 -4.889 -23.432 600 HD2 LYS 76 HD2 LYS 76 -10.801 -6.691 -23.743 601 HD3 LYS 76 HD3 LYS 76 -11.941 -7.834 -23.029 602 HE2 LYS 76 HE2 LYS 76 -13.165 -8.029 -24.969 603 HE3 LYS 76 HE3 LYS 76 -12.669 -6.447 -25.567 604 HZ1 LYS 76 HZ1 LYS 76 -10.374 -7.996 -25.358 605 HZ2 LYS 76 HZ2 LYS 76 -11.133 -7.462 -26.771 606 HZ3 LYS 76 HZ3 LYS 76 -11.536 -8.967 -26.112 607 H ILE 77 H ILE 77 -15.000 -8.126 -19.301 608 HA ILE 77 HA ILE 77 -13.947 -6.724 -16.969 609 HB ILE 77 HB ILE 77 -16.206 -8.723 -17.075 610 HG12 ILE 77 HG12 ILE 77 -16.348 -5.701 -17.130 611 HG13 ILE 77 HG13 ILE 77 -16.632 -6.748 -18.517 612 HG21 ILE 77 HG21 ILE 77 -16.156 -8.573 -14.862 613 HG22 ILE 77 HG22 ILE 77 -14.846 -7.397 -14.937 614 HG23 ILE 77 HG23 ILE 77 -16.522 -6.854 -14.998 615 HD11 ILE 77 HD11 ILE 77 -18.519 -7.772 -17.289 616 HD12 ILE 77 HD12 ILE 77 -18.270 -6.593 -16.001 617 HD13 ILE 77 HD13 ILE 77 -18.732 -6.052 -17.614 618 H ASP 78 H ASP 78 -12.872 -7.691 -15.302 619 HA ASP 78 HA ASP 78 -11.447 -10.090 -15.873 620 HB2 ASP 78 HB2 ASP 78 -11.516 -8.103 -13.671 621 HB3 ASP 78 HB3 ASP 78 -10.923 -9.710 -13.261 622 H TYR 79 H TYR 79 -12.636 -11.916 -15.975 623 HA TYR 79 HA TYR 79 -14.532 -12.492 -13.816 624 HB2 TYR 79 HB2 TYR 79 -15.333 -14.311 -15.281 625 HB3 TYR 79 HB3 TYR 79 -15.400 -12.744 -16.081 626 HD1 TYR 79 HD1 TYR 79 -13.889 -12.222 -17.925 627 HD2 TYR 79 HD2 TYR 79 -13.796 -16.028 -16.025 628 HE1 TYR 79 HE1 TYR 79 -12.579 -13.120 -19.802 629 HE2 TYR 79 HE2 TYR 79 -12.484 -16.936 -17.897 630 HH TYR 79 HH TYR 79 -10.795 -15.350 -19.900 631 H THR 80 H THR 80 -14.132 -13.970 -12.296 632 HA THR 80 HA THR 80 -11.730 -15.649 -12.608 633 HB THR 80 HB THR 80 -11.390 -14.119 -10.795 634 HG1 THR 80 HG1 THR 80 -10.614 -15.740 -9.692 635 HG21 THR 80 HG21 THR 80 -12.914 -13.894 -8.925 636 HG22 THR 80 HG22 THR 80 -13.992 -15.105 -9.620 637 HG23 THR 80 HG23 THR 80 -13.772 -13.553 -10.426 638 H VAL 81 H VAL 81 -12.029 -17.772 -12.708 639 HA VAL 81 HA VAL 81 -14.668 -18.870 -12.148 640 HB VAL 81 HB VAL 81 -13.737 -20.964 -13.137 641 HG11 VAL 81 HG11 VAL 81 -13.531 -18.450 -14.789 642 HG12 VAL 81 HG12 VAL 81 -13.611 -20.086 -15.449 643 HG13 VAL 81 HG13 VAL 81 -14.971 -19.434 -14.532 644 HG21 VAL 81 HG21 VAL 81 -11.482 -19.882 -14.467 645 HG22 VAL 81 HG22 VAL 81 -11.278 -19.591 -12.740 646 HG23 VAL 81 HG23 VAL 81 -11.542 -21.231 -13.333 647 H LEU 82 H LEU 82 -15.150 -19.814 -10.287 648 HA LEU 82 HA LEU 82 -12.950 -20.763 -8.577 649 HB2 LEU 82 HB2 LEU 82 -14.213 -18.992 -7.555 650 HB3 LEU 82 HB3 LEU 82 -15.729 -19.829 -7.883 651 HG LEU 82 HG LEU 82 -15.059 -21.595 -6.291 652 HD11 LEU 82 HD11 LEU 82 -12.934 -21.792 -5.699 653 HD12 LEU 82 HD12 LEU 82 -13.069 -20.275 -4.811 654 HD13 LEU 82 HD13 LEU 82 -12.531 -20.268 -6.490 655 HD21 LEU 82 HD21 LEU 82 -15.886 -20.457 -4.513 656 HD22 LEU 82 HD22 LEU 82 -16.208 -19.245 -5.752 657 HD23 LEU 82 HD23 LEU 82 -14.781 -19.099 -4.726 658 H GLN 83 H GLN 83 -12.692 -22.890 -8.613 659 HA GLN 83 HA GLN 83 -15.055 -24.597 -9.008 660 HB2 GLN 83 HB2 GLN 83 -12.214 -24.811 -9.841 661 HB3 GLN 83 HB3 GLN 83 -13.027 -26.307 -9.402 662 HG2 GLN 83 HG2 GLN 83 -14.790 -25.801 -11.043 663 HG3 GLN 83 HG3 GLN 83 -13.903 -24.352 -11.514 664 HE21 GLN 83 HE21 GLN 83 -12.260 -24.516 -12.926 665 HE22 GLN 83 HE22 GLN 83 -11.709 -26.000 -13.618 666 H ASP 84 H ASP 84 -15.068 -26.670 -7.852 667 HA ASP 84 HA ASP 84 -13.666 -26.534 -5.265 668 HB2 ASP 84 HB2 ASP 84 -16.226 -25.947 -5.339 669 HB3 ASP 84 HB3 ASP 84 -16.420 -27.695 -5.444 670 H ASN 85 H ASN 85 -12.257 -28.159 -5.282 671 HA ASN 85 HA ASN 85 -11.344 -30.230 -5.514 672 HB2 ASN 85 HB2 ASN 85 -13.087 -30.833 -3.904 673 HB3 ASN 85 HB3 ASN 85 -14.231 -31.090 -5.219 674 HD21 ASN 85 HD21 ASN 85 -14.215 -33.173 -3.858 675 HD22 ASN 85 HD22 ASN 85 -13.173 -34.424 -4.435 676 HA PRO 86 HA PRO 86 -12.492 -30.313 -10.018 677 HB2 PRO 86 HB2 PRO 86 -9.962 -29.912 -10.915 678 HB3 PRO 86 HB3 PRO 86 -11.056 -28.587 -10.502 679 HG2 PRO 86 HG2 PRO 86 -8.849 -29.796 -8.881 680 HG3 PRO 86 HG3 PRO 86 -9.268 -28.087 -9.102 681 HD2 PRO 86 HD2 PRO 86 -9.973 -29.486 -6.894 682 HD3 PRO 86 HD3 PRO 86 -10.972 -28.174 -7.552 683 H ARG 87 H ARG 87 -12.017 -31.937 -11.544 684 HA ARG 87 HA ARG 87 -11.274 -34.443 -10.437 685 HB2 ARG 87 HB2 ARG 87 -12.078 -33.450 -13.129 686 HB3 ARG 87 HB3 ARG 87 -11.273 -35.011 -13.035 687 HG2 ARG 87 HG2 ARG 87 -13.021 -36.007 -11.970 688 HG3 ARG 87 HG3 ARG 87 -13.547 -34.511 -11.197 689 HD2 ARG 87 HD2 ARG 87 -14.711 -33.802 -13.055 690 HD3 ARG 87 HD3 ARG 87 -13.737 -34.769 -14.162 691 HE ARG 87 HE ARG 87 -15.100 -36.564 -12.573 692 HH11 ARG 87 HH11 ARG 87 -15.907 -34.024 -14.812 693 HH12 ARG 87 HH12 ARG 87 -17.394 -34.759 -15.312 694 HH21 ARG 87 HH21 ARG 87 -17.055 -37.543 -13.223 695 HH22 ARG 87 HH22 ARG 87 -18.046 -36.760 -14.407 696 H THR 88 H THR 88 -9.677 -35.870 -11.773 697 HA THR 88 HA THR 88 -7.188 -34.340 -12.169 698 HB THR 88 HB THR 88 -5.984 -36.404 -11.360 699 HG1 THR 88 HG1 THR 88 -8.178 -37.597 -11.547 700 HG21 THR 88 HG21 THR 88 -7.805 -34.965 -9.429 701 HG22 THR 88 HG22 THR 88 -6.183 -34.473 -9.918 702 HG23 THR 88 HG23 THR 88 -6.410 -35.937 -8.962 703 H ILE 89 H ILE 89 -9.222 -35.270 -14.114 704 HA ILE 89 HA ILE 89 -8.426 -37.532 -15.526 705 HB ILE 89 HB ILE 89 -9.541 -36.557 -17.476 706 HG12 ILE 89 HG12 ILE 89 -10.674 -34.218 -16.813 707 HG13 ILE 89 HG13 ILE 89 -9.178 -34.063 -15.898 708 HG21 ILE 89 HG21 ILE 89 -11.585 -36.915 -16.609 709 HG22 ILE 89 HG22 ILE 89 -10.690 -37.304 -15.141 710 HG23 ILE 89 HG23 ILE 89 -11.381 -35.695 -15.353 711 HD11 ILE 89 HD11 ILE 89 -9.126 -34.814 -18.789 712 HD12 ILE 89 HD12 ILE 89 -9.277 -33.130 -18.286 713 HD13 ILE 89 HD13 ILE 89 -7.865 -34.071 -17.805 714 H VAL 90 H VAL 90 -7.303 -37.683 -17.585 715 HA VAL 90 HA VAL 90 -5.354 -35.578 -18.140 716 HB VAL 90 HB VAL 90 -3.566 -37.402 -18.352 717 HG11 VAL 90 HG11 VAL 90 -4.552 -36.653 -15.601 718 HG12 VAL 90 HG12 VAL 90 -2.916 -37.170 -16.017 719 HG13 VAL 90 HG13 VAL 90 -3.546 -35.645 -16.642 720 HG21 VAL 90 HG21 VAL 90 -5.284 -38.839 -16.347 721 HG22 VAL 90 HG22 VAL 90 -5.294 -39.244 -18.063 722 HG23 VAL 90 HG23 VAL 90 -3.807 -39.403 -17.129 723 HA PRO 91 HA PRO 91 -6.048 -36.642 -22.342 724 HB2 PRO 91 HB2 PRO 91 -3.631 -36.086 -23.448 725 HB3 PRO 91 HB3 PRO 91 -4.747 -34.830 -22.896 726 HG2 PRO 91 HG2 PRO 91 -2.346 -35.967 -21.517 727 HG3 PRO 91 HG3 PRO 91 -2.866 -34.277 -21.646 728 HD2 PRO 91 HD2 PRO 91 -3.300 -35.770 -19.429 729 HD3 PRO 91 HD3 PRO 91 -4.417 -34.494 -19.955 730 H LYS 92 H LYS 92 -5.835 -38.311 -23.790 731 HA LYS 92 HA LYS 92 -3.711 -40.280 -23.337 732 HB2 LYS 92 HB2 LYS 92 -5.405 -42.110 -23.589 733 HB3 LYS 92 HB3 LYS 92 -5.552 -41.184 -22.100 734 HG2 LYS 92 HG2 LYS 92 -7.371 -39.873 -23.144 735 HG3 LYS 92 HG3 LYS 92 -7.261 -40.916 -24.564 736 HD2 LYS 92 HD2 LYS 92 -8.102 -42.755 -23.438 737 HD3 LYS 92 HD3 LYS 92 -7.637 -42.126 -21.856 738 HE2 LYS 92 HE2 LYS 92 -9.370 -40.349 -22.143 739 HE3 LYS 92 HE3 LYS 92 -9.892 -41.170 -23.613 740 HZ1 LYS 92 HZ1 LYS 92 -10.070 -43.202 -22.032 741 HZ2 LYS 92 HZ2 LYS 92 -11.305 -42.047 -22.055 742 HZ3 LYS 92 HZ3 LYS 92 -10.155 -42.030 -20.815 743 H SER 93 H SER 93 -2.727 -40.750 -25.182 744 HA SER 93 HA SER 93 -4.148 -41.235 -27.613 745 HB2 SER 93 HB2 SER 93 -3.924 -38.647 -27.363 746 HB3 SER 93 HB3 SER 93 -2.239 -38.923 -27.805 747 HG SER 93 HG SER 93 -4.321 -38.753 -29.414 748 H TYR 94 H TYR 94 -2.844 -42.167 -29.226 749 HA TYR 94 HA TYR 94 0.003 -42.415 -28.827 750 HB2 TYR 94 HB2 TYR 94 -1.283 -44.178 -27.362 751 HB3 TYR 94 HB3 TYR 94 -1.475 -45.018 -28.897 752 HD1 TYR 94 HD1 TYR 94 1.052 -43.656 -26.549 753 HD2 TYR 94 HD2 TYR 94 0.295 -46.273 -29.818 754 HE1 TYR 94 HE1 TYR 94 3.305 -44.610 -26.299 755 HE2 TYR 94 HE2 TYR 94 2.546 -47.234 -29.577 756 HH TYR 94 HH TYR 94 4.961 -45.945 -28.220 757 H ALA 95 H ALA 95 0.813 -42.200 -30.794 758 HA ALA 95 HA ALA 95 -0.777 -43.006 -33.111 759 HB1 ALA 95 HB1 ALA 95 0.299 -41.412 -34.309 760 HB2 ALA 95 HB2 ALA 95 0.555 -40.730 -32.702 761 HB3 ALA 95 HB3 ALA 95 1.834 -41.664 -33.477 762 H ASP 96 H ASP 96 0.846 -43.661 -35.032 763 HA ASP 96 HA ASP 96 2.786 -45.628 -34.079 764 HB2 ASP 96 HB2 ASP 96 0.926 -47.055 -34.247 765 HB3 ASP 96 HB3 ASP 96 0.324 -46.246 -35.692 766 H ASN 97 H ASN 97 4.556 -45.722 -35.324 767 HA ASN 97 HA ASN 97 4.431 -44.917 -38.118 768 HB2 ASN 97 HB2 ASN 97 4.873 -42.806 -36.994 769 HB3 ASN 97 HB3 ASN 97 6.200 -43.531 -36.092 770 HD21 ASN 97 HD21 ASN 97 5.191 -42.136 -39.056 771 HD22 ASN 97 HD22 ASN 97 6.728 -42.159 -39.846 772 H PHE 98 H PHE 98 6.272 -45.560 -39.347 773 HA PHE 98 HA PHE 98 8.319 -47.149 -38.049 774 HB2 PHE 98 HB2 PHE 98 7.878 -49.165 -39.358 775 HB3 PHE 98 HB3 PHE 98 6.486 -48.765 -38.359 776 HD1 PHE 98 HD1 PHE 98 4.495 -47.690 -39.413 777 HD2 PHE 98 HD2 PHE 98 7.713 -49.278 -41.702 778 HE1 PHE 98 HE1 PHE 98 3.052 -47.731 -41.405 779 HE2 PHE 98 HE2 PHE 98 6.275 -49.322 -43.698 780 HZ PHE 98 HZ PHE 98 3.942 -48.547 -43.552 781 H THR 99 H THR 99 10.206 -46.939 -39.077 782 HA THR 99 HA THR 99 10.304 -46.476 -41.940 783 HB THR 99 HB THR 99 11.942 -44.493 -41.435 784 HG1 THR 99 HG1 THR 99 11.878 -43.802 -39.444 785 HG21 THR 99 HG21 THR 99 10.327 -43.129 -42.249 786 HG22 THR 99 HG22 THR 99 9.158 -43.607 -41.018 787 HG23 THR 99 HG23 THR 99 9.433 -44.640 -42.420 788 H LYS 100 H LYS 100 12.346 -46.862 -42.854 789 HA LYS 100 HA LYS 100 14.480 -47.739 -41.055 790 HB2 LYS 100 HB2 LYS 100 12.938 -49.664 -41.902 791 HB3 LYS 100 HB3 LYS 100 13.782 -49.438 -43.428 792 HG2 LYS 100 HG2 LYS 100 15.083 -51.055 -42.503 793 HG3 LYS 100 HG3 LYS 100 15.911 -49.625 -41.883 794 HD2 LYS 100 HD2 LYS 100 15.693 -50.934 -39.985 795 HD3 LYS 100 HD3 LYS 100 14.288 -49.872 -39.871 796 HE2 LYS 100 HE2 LYS 100 13.333 -51.921 -39.450 797 HE3 LYS 100 HE3 LYS 100 13.101 -51.790 -41.192 798 HZ1 LYS 100 HZ1 LYS 100 14.584 -53.714 -39.724 799 HZ2 LYS 100 HZ2 LYS 100 15.577 -52.945 -40.856 800 HZ3 LYS 100 HZ3 LYS 100 14.158 -53.716 -41.361 801 HA PRO 101 HA PRO 101 15.963 -45.130 -44.600 802 HB2 PRO 101 HB2 PRO 101 17.489 -43.492 -43.063 803 HB3 PRO 101 HB3 PRO 101 15.772 -43.202 -43.364 804 HG2 PRO 101 HG2 PRO 101 17.094 -44.442 -40.982 805 HG3 PRO 101 HG3 PRO 101 15.770 -43.263 -41.039 806 HD2 PRO 101 HD2 PRO 101 15.350 -45.906 -40.623 807 HD3 PRO 101 HD3 PRO 101 14.184 -44.877 -41.479 808 H ARG 102 H ARG 102 17.482 -46.237 -45.666 809 HA ARG 102 HA ARG 102 19.723 -47.413 -44.210 810 HB2 ARG 102 HB2 ARG 102 18.393 -48.735 -45.892 811 HB3 ARG 102 HB3 ARG 102 19.056 -47.690 -47.142 812 HG2 ARG 102 HG2 ARG 102 21.216 -48.518 -46.860 813 HG3 ARG 102 HG3 ARG 102 20.844 -49.205 -45.277 814 HD2 ARG 102 HD2 ARG 102 19.578 -50.155 -47.839 815 HD3 ARG 102 HD3 ARG 102 21.047 -50.859 -47.166 816 HE ARG 102 HE ARG 102 18.374 -51.315 -46.288 817 HH11 ARG 102 HH11 ARG 102 21.679 -51.115 -45.212 818 HH12 ARG 102 HH12 ARG 102 21.435 -52.155 -43.848 819 HH21 ARG 102 HH21 ARG 102 18.039 -52.686 -44.496 820 HH22 ARG 102 HH22 ARG 102 19.365 -53.050 -43.442 821 H ASP 103 H ASP 103 20.917 -45.538 -43.750 822 HA ASP 103 HA ASP 103 22.117 -44.219 -46.096 823 HB2 ASP 103 HB2 ASP 103 22.565 -42.296 -44.624 824 HB3 ASP 103 HB3 ASP 103 20.844 -42.668 -44.701 825 H MET 104 H MET 104 24.360 -43.781 -46.069 826 HA MET 104 HA MET 104 25.980 -45.842 -45.120 827 HB2 MET 104 HB2 MET 104 26.921 -43.048 -45.767 828 HB3 MET 104 HB3 MET 104 27.854 -44.536 -45.861 829 HG2 MET 104 HG2 MET 104 26.217 -45.298 -47.626 830 HG3 MET 104 HG3 MET 104 25.607 -43.645 -47.638 831 HE1 MET 104 HE1 MET 104 28.560 -45.980 -49.100 832 HE2 MET 104 HE2 MET 104 29.890 -44.894 -48.701 833 HE3 MET 104 HE3 MET 104 28.874 -45.553 -47.418 Start of MODEL 6 1 H1 MET 1 H MET 1 -0.362 15.530 -12.552 2 HA MET 1 HA MET 1 -1.645 13.466 -14.216 3 HB2 MET 1 HB2 MET 1 0.987 13.544 -12.767 4 HB3 MET 1 HB3 MET 1 0.248 12.013 -13.217 5 HG2 MET 1 HG2 MET 1 0.813 14.208 -15.187 6 HG3 MET 1 HG3 MET 1 1.956 12.921 -14.813 7 HE1 MET 1 HE1 MET 1 1.440 10.608 -17.317 8 HE2 MET 1 HE2 MET 1 2.275 11.181 -15.872 9 HE3 MET 1 HE3 MET 1 1.023 9.946 -15.735 10 H GLN 2 H GLN 2 -3.458 14.106 -12.594 11 HA GLN 2 HA GLN 2 -3.227 12.362 -10.230 12 HB2 GLN 2 HB2 GLN 2 -4.938 14.832 -10.558 13 HB3 GLN 2 HB3 GLN 2 -4.891 13.803 -9.134 14 HG2 GLN 2 HG2 GLN 2 -2.781 14.520 -8.521 15 HG3 GLN 2 HG3 GLN 2 -2.392 15.084 -10.146 16 HE21 GLN 2 HE21 GLN 2 -1.862 16.722 -8.095 17 HE22 GLN 2 HE22 GLN 2 -2.976 18.042 -8.054 18 H GLU 3 H GLU 3 -3.861 10.903 -12.230 19 HA GLU 3 HA GLU 3 -6.756 10.497 -12.004 20 HB2 GLU 3 HB2 GLU 3 -7.006 10.099 -14.368 21 HB3 GLU 3 HB3 GLU 3 -6.291 11.689 -14.136 22 HG2 GLU 3 HG2 GLU 3 -4.094 10.798 -14.670 23 HG3 GLU 3 HG3 GLU 3 -4.783 9.187 -14.863 24 H GLN 4 H GLN 4 -7.435 8.357 -12.145 25 HA GLN 4 HA GLN 4 -5.290 6.342 -12.256 26 HB2 GLN 4 HB2 GLN 4 -6.414 5.083 -10.498 27 HB3 GLN 4 HB3 GLN 4 -6.011 6.698 -9.934 28 HG2 GLN 4 HG2 GLN 4 -8.721 6.110 -11.049 29 HG3 GLN 4 HG3 GLN 4 -8.324 5.707 -9.379 30 HE21 GLN 4 HE21 GLN 4 -10.323 7.488 -9.983 31 HE22 GLN 4 HE22 GLN 4 -9.851 9.076 -9.490 32 H VAL 5 H VAL 5 -6.022 4.168 -12.829 33 HA VAL 5 HA VAL 5 -8.512 4.152 -14.398 34 HB VAL 5 HB VAL 5 -7.309 2.684 -16.067 35 HG11 VAL 5 HG11 VAL 5 -6.873 5.597 -15.688 36 HG12 VAL 5 HG12 VAL 5 -5.969 4.785 -16.967 37 HG13 VAL 5 HG13 VAL 5 -7.732 4.737 -16.965 38 HG21 VAL 5 HG21 VAL 5 -4.958 2.621 -16.150 39 HG22 VAL 5 HG22 VAL 5 -4.798 3.884 -14.929 40 HG23 VAL 5 HG23 VAL 5 -5.370 2.280 -14.469 41 H SER 6 H SER 6 -9.687 2.288 -14.340 42 HA SER 6 HA SER 6 -8.665 -0.218 -13.488 43 HB2 SER 6 HB2 SER 6 -8.603 0.645 -11.278 44 HB3 SER 6 HB3 SER 6 -10.158 1.453 -11.467 45 HG SER 6 HG SER 6 -11.187 -0.417 -11.199 46 H ASN 7 H ASN 7 -10.314 -1.879 -13.409 47 HA ASN 7 HA ASN 7 -12.898 -1.073 -14.552 48 HB2 ASN 7 HB2 ASN 7 -11.329 -1.889 -16.340 49 HB3 ASN 7 HB3 ASN 7 -11.303 -3.451 -15.526 50 HD21 ASN 7 HD21 ASN 7 -13.392 -1.111 -17.114 51 HD22 ASN 7 HD22 ASN 7 -14.591 -2.249 -17.617 52 H VAL 8 H VAL 8 -14.630 -2.545 -14.181 53 HA VAL 8 HA VAL 8 -14.725 -3.635 -11.617 54 HB VAL 8 HB VAL 8 -16.816 -4.755 -12.342 55 HG11 VAL 8 HG11 VAL 8 -17.048 -2.074 -13.557 56 HG12 VAL 8 HG12 VAL 8 -17.984 -2.819 -12.259 57 HG13 VAL 8 HG13 VAL 8 -16.391 -2.139 -11.922 58 HG21 VAL 8 HG21 VAL 8 -16.525 -3.500 -15.034 59 HG22 VAL 8 HG22 VAL 8 -15.799 -5.079 -14.731 60 HG23 VAL 8 HG23 VAL 8 -17.536 -4.854 -14.528 61 H ARG 9 H ARG 9 -15.569 -6.051 -11.379 62 HA ARG 9 HA ARG 9 -13.897 -7.873 -12.940 63 HB2 ARG 9 HB2 ARG 9 -13.818 -7.569 -9.940 64 HB3 ARG 9 HB3 ARG 9 -13.246 -9.014 -10.763 65 HG2 ARG 9 HG2 ARG 9 -11.414 -7.964 -11.636 66 HG3 ARG 9 HG3 ARG 9 -12.186 -6.377 -11.631 67 HD2 ARG 9 HD2 ARG 9 -11.841 -6.100 -9.323 68 HD3 ARG 9 HD3 ARG 9 -11.488 -7.811 -9.087 69 HE ARG 9 HE ARG 9 -9.534 -6.931 -10.780 70 HH11 ARG 9 HH11 ARG 9 -10.676 -5.990 -7.630 71 HH12 ARG 9 HH12 ARG 9 -9.130 -5.421 -7.095 72 HH21 ARG 9 HH21 ARG 9 -7.492 -6.184 -10.088 73 HH22 ARG 9 HH22 ARG 9 -7.320 -5.530 -8.495 74 H ALA 10 H ALA 10 -14.729 -9.914 -13.173 75 HA ALA 10 HA ALA 10 -17.452 -10.295 -12.139 76 HB1 ALA 10 HB1 ALA 10 -16.115 -10.942 -14.656 77 HB2 ALA 10 HB2 ALA 10 -17.097 -12.257 -14.008 78 HB3 ALA 10 HB3 ALA 10 -17.824 -10.680 -14.312 79 H ARG 11 H ARG 11 -17.928 -11.896 -10.762 80 HA ARG 11 HA ARG 11 -15.778 -13.789 -10.082 81 HB2 ARG 11 HB2 ARG 11 -16.369 -12.373 -8.215 82 HB3 ARG 11 HB3 ARG 11 -18.075 -12.744 -8.423 83 HG2 ARG 11 HG2 ARG 11 -17.616 -15.090 -7.848 84 HG3 ARG 11 HG3 ARG 11 -15.923 -14.672 -7.579 85 HD2 ARG 11 HD2 ARG 11 -16.759 -14.560 -5.440 86 HD3 ARG 11 HD3 ARG 11 -16.923 -12.884 -5.962 87 HE ARG 11 HE ARG 11 -19.184 -13.102 -5.768 88 HH11 ARG 11 HH11 ARG 11 -17.777 -16.276 -6.012 89 HH12 ARG 11 HH12 ARG 11 -19.272 -17.103 -5.730 90 HH21 ARG 11 HH21 ARG 11 -21.160 -14.179 -5.395 91 HH22 ARG 11 HH22 ARG 11 -21.196 -15.910 -5.379 92 H ILE 12 H ILE 12 -16.131 -15.585 -11.256 93 HA ILE 12 HA ILE 12 -18.855 -16.620 -11.520 94 HB ILE 12 HB ILE 12 -16.296 -17.553 -12.827 95 HG12 ILE 12 HG12 ILE 12 -18.610 -16.175 -14.173 96 HG13 ILE 12 HG13 ILE 12 -17.299 -15.255 -13.444 97 HG21 ILE 12 HG21 ILE 12 -19.046 -18.618 -12.777 98 HG22 ILE 12 HG22 ILE 12 -18.264 -18.558 -14.356 99 HG23 ILE 12 HG23 ILE 12 -17.510 -19.446 -13.032 100 HD11 ILE 12 HD11 ILE 12 -15.704 -16.406 -14.905 101 HD12 ILE 12 HD12 ILE 12 -17.041 -17.277 -15.655 102 HD13 ILE 12 HD13 ILE 12 -16.932 -15.524 -15.812 103 H TYR 13 H TYR 13 -19.556 -18.450 -10.567 104 HA TYR 13 HA TYR 13 -17.606 -20.056 -9.056 105 HB2 TYR 13 HB2 TYR 13 -18.760 -18.636 -7.462 106 HB3 TYR 13 HB3 TYR 13 -20.323 -19.124 -8.108 107 HD1 TYR 13 HD1 TYR 13 -17.248 -20.832 -6.822 108 HD2 TYR 13 HD2 TYR 13 -21.496 -20.597 -6.789 109 HE1 TYR 13 HE1 TYR 13 -17.332 -22.681 -5.203 110 HE2 TYR 13 HE2 TYR 13 -21.592 -22.445 -5.170 111 HH TYR 13 HH TYR 13 -20.241 -23.562 -3.569 112 H LYS 14 H LYS 14 -17.829 -22.219 -9.202 113 HA LYS 14 HA LYS 14 -19.806 -23.232 -11.078 114 HB2 LYS 14 HB2 LYS 14 -18.497 -25.208 -11.181 115 HB3 LYS 14 HB3 LYS 14 -17.356 -23.871 -11.137 116 HG2 LYS 14 HG2 LYS 14 -16.352 -25.142 -9.581 117 HG3 LYS 14 HG3 LYS 14 -17.543 -24.399 -8.510 118 HD2 LYS 14 HD2 LYS 14 -17.915 -26.584 -7.988 119 HD3 LYS 14 HD3 LYS 14 -19.011 -26.447 -9.365 120 HE2 LYS 14 HE2 LYS 14 -17.199 -27.298 -10.826 121 HE3 LYS 14 HE3 LYS 14 -16.197 -27.533 -9.395 122 HZ1 LYS 14 HZ1 LYS 14 -18.400 -29.117 -10.382 123 HZ2 LYS 14 HZ2 LYS 14 -18.441 -28.832 -8.716 124 HZ3 LYS 14 HZ3 LYS 14 -17.088 -29.570 -9.415 125 HA PRO 15 HA PRO 15 -22.568 -24.940 -8.122 126 HB2 PRO 15 HB2 PRO 15 -23.434 -27.147 -9.443 127 HB3 PRO 15 HB3 PRO 15 -23.916 -25.506 -9.893 128 HG2 PRO 15 HG2 PRO 15 -21.813 -27.262 -11.101 129 HG3 PRO 15 HG3 PRO 15 -23.008 -26.230 -11.908 130 HD2 PRO 15 HD2 PRO 15 -20.427 -25.483 -11.574 131 HD3 PRO 15 HD3 PRO 15 -21.766 -24.317 -11.577 132 H ALA 16 H ALA 16 -21.618 -25.698 -6.308 133 HA ALA 16 HA ALA 16 -19.692 -27.742 -6.189 134 HB1 ALA 16 HB1 ALA 16 -19.956 -27.663 -3.814 135 HB2 ALA 16 HB2 ALA 16 -20.100 -26.017 -4.434 136 HB3 ALA 16 HB3 ALA 16 -21.545 -26.912 -3.963 137 H LYS 17 H LYS 17 -19.843 -29.894 -5.450 138 HA LYS 17 HA LYS 17 -22.160 -31.288 -6.402 139 HB2 LYS 17 HB2 LYS 17 -19.590 -32.166 -5.101 140 HB3 LYS 17 HB3 LYS 17 -20.877 -33.306 -5.468 141 HG2 LYS 17 HG2 LYS 17 -20.595 -33.102 -7.745 142 HG3 LYS 17 HG3 LYS 17 -19.840 -31.512 -7.614 143 HD2 LYS 17 HD2 LYS 17 -18.097 -32.995 -8.182 144 HD3 LYS 17 HD3 LYS 17 -17.909 -32.687 -6.454 145 HE2 LYS 17 HE2 LYS 17 -17.687 -34.967 -6.498 146 HE3 LYS 17 HE3 LYS 17 -19.425 -34.821 -6.238 147 HZ1 LYS 17 HZ1 LYS 17 -18.083 -36.073 -8.357 148 HZ2 LYS 17 HZ2 LYS 17 -18.962 -34.775 -8.990 149 HZ3 LYS 17 HZ3 LYS 17 -19.749 -35.968 -8.085 150 H SER 18 H SER 18 -23.190 -33.027 -5.047 151 HA SER 18 HA SER 18 -24.586 -33.542 -3.324 152 HB2 SER 18 HB2 SER 18 -23.553 -33.913 -1.282 153 HB3 SER 18 HB3 SER 18 -22.156 -33.823 -2.354 154 HG SER 18 HG SER 18 -22.695 -32.312 -0.248 155 H THR 19 H THR 19 -24.739 -30.852 -4.481 156 HA THR 19 HA THR 19 -25.486 -29.152 -2.240 157 HB THR 19 HB THR 19 -24.271 -28.169 -4.157 158 HG1 THR 19 HG1 THR 19 -26.930 -27.168 -3.905 159 HG21 THR 19 HG21 THR 19 -26.787 -28.421 -5.772 160 HG22 THR 19 HG22 THR 19 -25.545 -29.672 -5.829 161 HG23 THR 19 HG23 THR 19 -25.157 -28.021 -6.311 162 H MET 20 H MET 20 -26.972 -31.035 -4.789 163 HA MET 20 HA MET 20 -29.557 -30.708 -3.488 164 HB2 MET 20 HB2 MET 20 -30.705 -30.231 -5.609 165 HB3 MET 20 HB3 MET 20 -29.570 -28.958 -5.183 166 HG2 MET 20 HG2 MET 20 -27.931 -29.973 -6.742 167 HG3 MET 20 HG3 MET 20 -29.171 -31.125 -7.230 168 HE1 MET 20 HE1 MET 20 -28.702 -30.318 -9.776 169 HE2 MET 20 HE2 MET 20 -28.812 -28.632 -10.282 170 HE3 MET 20 HE3 MET 20 -27.528 -29.142 -9.184 171 H GLN 21 H GLN 21 -31.090 -32.349 -4.059 172 HA GLN 21 HA GLN 21 -29.843 -34.878 -4.573 173 HB2 GLN 21 HB2 GLN 21 -32.652 -34.003 -3.962 174 HB3 GLN 21 HB3 GLN 21 -32.310 -35.660 -4.445 175 HG2 GLN 21 HG2 GLN 21 -31.018 -36.070 -2.538 176 HG3 GLN 21 HG3 GLN 21 -30.869 -34.354 -2.166 177 HE21 GLN 21 HE21 GLN 21 -31.914 -33.929 -0.366 178 HE22 GLN 21 HE22 GLN 21 -33.477 -34.520 0.072 179 H SER 22 H SER 22 -32.053 -32.747 -6.316 180 HA SER 22 HA SER 22 -31.400 -34.178 -8.782 181 HB2 SER 22 HB2 SER 22 -34.253 -33.400 -8.188 182 HB3 SER 22 HB3 SER 22 -33.651 -34.452 -9.469 183 HG SER 22 HG SER 22 -33.837 -34.976 -6.698 184 H GLY 23 H GLY 23 -32.200 -32.932 -10.734 185 HA2 GLY 23 HA2 GLY 23 -31.598 -30.100 -10.285 186 HA3 GLY 23 HA3 GLY 23 -31.522 -30.942 -11.826 187 H HIS 24 H HIS 24 -34.095 -32.169 -11.679 188 HA HIS 24 HA HIS 24 -36.257 -31.768 -12.262 189 HB2 HIS 24 HB2 HIS 24 -36.202 -30.739 -9.921 190 HB3 HIS 24 HB3 HIS 24 -36.070 -29.179 -10.726 191 HD1 HIS 24 HD1 HIS 24 -38.444 -29.037 -9.248 192 HD2 HIS 24 HD2 HIS 24 -38.437 -31.213 -12.787 193 HE1 HIS 24 HE1 HIS 24 -40.859 -29.227 -9.924 194 H SER 25 H SER 25 -34.508 -31.154 -14.206 195 HA SER 25 HA SER 25 -34.162 -29.933 -16.100 196 HB2 SER 25 HB2 SER 25 -36.099 -29.294 -17.254 197 HB3 SER 25 HB3 SER 25 -36.688 -30.533 -16.146 198 HG SER 25 HG SER 25 -37.915 -28.490 -16.271 199 H LYS 26 H LYS 26 -33.311 -28.687 -13.705 200 HA LYS 26 HA LYS 26 -34.071 -26.057 -13.322 201 HB2 LYS 26 HB2 LYS 26 -32.269 -27.600 -12.138 202 HB3 LYS 26 HB3 LYS 26 -31.166 -26.731 -13.195 203 HG2 LYS 26 HG2 LYS 26 -31.133 -25.501 -11.230 204 HG3 LYS 26 HG3 LYS 26 -32.254 -24.606 -12.259 205 HD2 LYS 26 HD2 LYS 26 -33.389 -24.695 -10.238 206 HD3 LYS 26 HD3 LYS 26 -34.072 -26.064 -11.119 207 HE2 LYS 26 HE2 LYS 26 -33.555 -26.698 -8.832 208 HE3 LYS 26 HE3 LYS 26 -32.517 -27.569 -9.961 209 HZ1 LYS 26 HZ1 LYS 26 -31.434 -26.575 -7.911 210 HZ2 LYS 26 HZ2 LYS 26 -31.635 -25.068 -8.653 211 HZ3 LYS 26 HZ3 LYS 26 -30.688 -26.258 -9.396 212 H LEU 27 H LEU 27 -33.210 -24.058 -14.052 213 HA LEU 27 HA LEU 27 -32.257 -24.176 -16.825 214 HB2 LEU 27 HB2 LEU 27 -33.339 -21.763 -15.396 215 HB3 LEU 27 HB3 LEU 27 -33.155 -22.006 -17.132 216 HG LEU 27 HG LEU 27 -35.162 -23.356 -15.330 217 HD11 LEU 27 HD11 LEU 27 -36.454 -22.048 -17.396 218 HD12 LEU 27 HD12 LEU 27 -35.185 -20.926 -16.907 219 HD13 LEU 27 HD13 LEU 27 -36.347 -21.515 -15.719 220 HD21 LEU 27 HD21 LEU 27 -34.694 -23.660 -18.295 221 HD22 LEU 27 HD22 LEU 27 -36.047 -24.344 -17.392 222 HD23 LEU 27 HD23 LEU 27 -34.401 -24.886 -17.061 223 H LYS 28 H LYS 28 -31.414 -23.101 -13.639 224 HA LYS 28 HA LYS 28 -28.992 -21.806 -14.698 225 HB2 LYS 28 HB2 LYS 28 -28.837 -20.668 -12.522 226 HB3 LYS 28 HB3 LYS 28 -30.359 -20.323 -13.332 227 HG2 LYS 28 HG2 LYS 28 -31.405 -22.111 -11.916 228 HG3 LYS 28 HG3 LYS 28 -29.893 -22.171 -11.007 229 HD2 LYS 28 HD2 LYS 28 -31.073 -20.674 -9.736 230 HD3 LYS 28 HD3 LYS 28 -30.274 -19.568 -10.855 231 HE2 LYS 28 HE2 LYS 28 -32.233 -19.338 -12.166 232 HE3 LYS 28 HE3 LYS 28 -33.018 -20.693 -11.357 233 HZ1 LYS 28 HZ1 LYS 28 -32.411 -18.934 -9.349 234 HZ2 LYS 28 HZ2 LYS 28 -33.938 -19.187 -10.032 235 HZ3 LYS 28 HZ3 LYS 28 -32.946 -17.943 -10.611 236 H ALA 29 H ALA 29 -27.021 -22.584 -14.193 237 HA ALA 29 HA ALA 29 -26.861 -24.753 -12.208 238 HB1 ALA 29 HB1 ALA 29 -25.947 -26.205 -13.649 239 HB2 ALA 29 HB2 ALA 29 -26.662 -25.177 -14.891 240 HB3 ALA 29 HB3 ALA 29 -24.972 -24.963 -14.435 241 H TRP 30 H TRP 30 -25.066 -22.305 -14.041 242 HA TRP 30 HA TRP 30 -22.952 -22.350 -12.013 243 HB2 TRP 30 HB2 TRP 30 -23.118 -21.202 -14.793 244 HB3 TRP 30 HB3 TRP 30 -21.831 -20.745 -13.681 245 HD1 TRP 30 HD1 TRP 30 -23.253 -23.942 -15.347 246 HE1 TRP 30 HE1 TRP 30 -21.312 -25.604 -15.659 247 HE3 TRP 30 HE3 TRP 30 -19.541 -21.300 -13.027 248 HZ2 TRP 30 HZ2 TRP 30 -18.570 -25.772 -15.008 249 HZ3 TRP 30 HZ3 TRP 30 -17.288 -22.282 -12.913 250 HH2 TRP 30 HH2 TRP 30 -16.814 -24.473 -13.884 251 H LYS 31 H LYS 31 -22.119 -20.291 -11.203 252 HA LYS 31 HA LYS 31 -24.243 -18.258 -10.979 253 HB2 LYS 31 HB2 LYS 31 -22.302 -19.283 -8.913 254 HB3 LYS 31 HB3 LYS 31 -23.156 -17.758 -8.721 255 HG2 LYS 31 HG2 LYS 31 -24.702 -20.242 -9.296 256 HG3 LYS 31 HG3 LYS 31 -24.103 -19.938 -7.664 257 HD2 LYS 31 HD2 LYS 31 -25.183 -17.600 -7.975 258 HD3 LYS 31 HD3 LYS 31 -26.088 -18.379 -9.275 259 HE2 LYS 31 HE2 LYS 31 -26.614 -20.181 -7.487 260 HE3 LYS 31 HE3 LYS 31 -26.134 -18.938 -6.333 261 HZ1 LYS 31 HZ1 LYS 31 -28.530 -19.147 -7.916 262 HZ2 LYS 31 HZ2 LYS 31 -27.825 -17.611 -7.962 263 HZ3 LYS 31 HZ3 LYS 31 -28.254 -18.300 -6.477 264 H LEU 32 H LEU 32 -23.590 -16.069 -10.825 265 HA LEU 32 HA LEU 32 -20.798 -15.410 -11.255 266 HB2 LEU 32 HB2 LEU 32 -21.645 -15.862 -13.511 267 HB3 LEU 32 HB3 LEU 32 -22.921 -14.671 -13.265 268 HG LEU 32 HG LEU 32 -20.862 -14.012 -14.660 269 HD11 LEU 32 HD11 LEU 32 -21.265 -11.805 -14.189 270 HD12 LEU 32 HD12 LEU 32 -21.354 -12.077 -12.449 271 HD13 LEU 32 HD13 LEU 32 -22.697 -12.558 -13.486 272 HD21 LEU 32 HD21 LEU 32 -18.867 -13.594 -13.660 273 HD22 LEU 32 HD22 LEU 32 -19.418 -14.899 -12.608 274 HD23 LEU 32 HD23 LEU 32 -19.600 -13.219 -12.099 275 H GLU 33 H GLU 33 -20.287 -13.544 -10.289 276 HA GLU 33 HA GLU 33 -22.425 -11.607 -9.735 277 HB2 GLU 33 HB2 GLU 33 -22.075 -12.972 -7.716 278 HB3 GLU 33 HB3 GLU 33 -20.368 -12.552 -7.730 279 HG2 GLU 33 HG2 GLU 33 -21.113 -11.041 -6.212 280 HG3 GLU 33 HG3 GLU 33 -21.327 -10.097 -7.686 281 H PHE 34 H PHE 34 -21.846 -9.848 -10.824 282 HA PHE 34 HA PHE 34 -19.035 -9.185 -11.172 283 HB2 PHE 34 HB2 PHE 34 -19.778 -7.553 -12.778 284 HB3 PHE 34 HB3 PHE 34 -20.654 -9.051 -13.074 285 HD1 PHE 34 HD2 PHE 34 -23.026 -9.237 -12.509 286 HD2 PHE 34 HD1 PHE 34 -20.902 -5.578 -12.038 287 HE1 PHE 34 HE2 PHE 34 -25.160 -8.023 -12.348 288 HE2 PHE 34 HE1 PHE 34 -23.032 -4.359 -11.875 289 HZ PHE 34 HZ PHE 34 -25.165 -5.581 -12.031 290 H GLU 35 H GLU 35 -18.028 -7.389 -10.358 291 HA GLU 35 HA GLU 35 -18.947 -6.358 -7.904 292 HB2 GLU 35 HB2 GLU 35 -16.568 -6.489 -8.478 293 HB3 GLU 35 HB3 GLU 35 -16.799 -5.292 -9.745 294 HG2 GLU 35 HG2 GLU 35 -15.997 -3.949 -8.106 295 HG3 GLU 35 HG3 GLU 35 -17.718 -3.852 -7.739 296 HA PRO 36 HA PRO 36 -21.681 -3.163 -9.246 297 HB2 PRO 36 HB2 PRO 36 -21.784 -1.760 -6.924 298 HB3 PRO 36 HB3 PRO 36 -22.614 -3.304 -7.151 299 HG2 PRO 36 HG2 PRO 36 -19.999 -2.738 -5.806 300 HG3 PRO 36 HG3 PRO 36 -21.314 -3.812 -5.291 301 HD2 PRO 36 HD2 PRO 36 -19.072 -4.730 -6.501 302 HD3 PRO 36 HD3 PRO 36 -20.655 -5.505 -6.710 303 H SER 37 H SER 37 -21.380 -1.297 -10.302 304 HA SER 37 HA SER 37 -19.071 0.375 -9.560 305 HB2 SER 37 HB2 SER 37 -18.313 -0.477 -11.570 306 HB3 SER 37 HB3 SER 37 -19.938 -0.638 -12.237 307 HG SER 37 HG SER 37 -19.343 1.125 -13.253 308 H CYS 38 H CYS 38 -22.102 0.413 -11.437 309 HA CYS 38 HA CYS 38 -22.899 2.865 -10.107 310 HB2 CYS 38 HB2 CYS 38 -23.227 4.139 -12.136 311 HB3 CYS 38 HB3 CYS 38 -21.548 3.620 -12.054 312 HG CYS 38 HG CYS 38 -22.377 1.282 -13.744 313 H THR 39 H THR 39 -25.101 3.601 -11.205 314 HA THR 39 HA THR 39 -26.749 1.169 -11.362 315 HB THR 39 HB THR 39 -28.643 2.600 -10.672 316 HG1 THR 39 HG1 THR 39 -28.418 4.704 -10.612 317 HG21 THR 39 HG21 THR 39 -26.903 1.451 -9.071 318 HG22 THR 39 HG22 THR 39 -28.144 2.524 -8.424 319 HG23 THR 39 HG23 THR 39 -26.501 3.118 -8.659 320 H GLN 40 H GLN 40 -27.493 0.656 -13.304 321 HA GLN 40 HA GLN 40 -28.190 2.822 -15.168 322 HB2 GLN 40 HB2 GLN 40 -26.655 0.294 -15.744 323 HB3 GLN 40 HB3 GLN 40 -27.448 1.223 -17.010 324 HG2 GLN 40 HG2 GLN 40 -26.077 3.202 -15.948 325 HG3 GLN 40 HG3 GLN 40 -25.052 1.882 -15.385 326 HE21 GLN 40 HE21 GLN 40 -26.632 3.098 -18.312 327 HE22 GLN 40 HE22 GLN 40 -25.359 2.654 -19.393 328 H TYR 41 H TYR 41 -30.063 2.577 -16.298 329 HA TYR 41 HA TYR 41 -32.048 0.877 -15.293 330 HB2 TYR 41 HB2 TYR 41 -32.434 3.036 -16.509 331 HB3 TYR 41 HB3 TYR 41 -32.035 2.207 -18.010 332 HD1 TYR 41 HD1 TYR 41 -34.195 1.408 -15.056 333 HD2 TYR 41 HD2 TYR 41 -33.899 1.775 -19.285 334 HE1 TYR 41 HE1 TYR 41 -36.537 0.692 -15.276 335 HE2 TYR 41 HE2 TYR 41 -36.242 1.061 -19.516 336 HH TYR 41 HH TYR 41 -38.369 0.841 -16.846 337 H THR 42 H THR 42 -32.066 -1.260 -15.456 338 HA THR 42 HA THR 42 -31.364 -2.474 -18.050 339 HB THR 42 HB THR 42 -31.056 -3.998 -15.488 340 HG1 THR 42 HG1 THR 42 -29.455 -2.745 -14.928 341 HG21 THR 42 HG21 THR 42 -29.057 -4.381 -17.535 342 HG22 THR 42 HG22 THR 42 -30.680 -4.565 -18.198 343 HG23 THR 42 HG23 THR 42 -30.171 -5.548 -16.827 344 H GLU 43 H GLU 43 -32.715 -4.014 -18.861 345 HA GLU 43 HA GLU 43 -35.393 -4.054 -18.003 346 HB2 GLU 43 HB2 GLU 43 -33.787 -5.567 -20.006 347 HB3 GLU 43 HB3 GLU 43 -35.359 -6.213 -19.554 348 HG2 GLU 43 HG2 GLU 43 -36.502 -4.493 -20.517 349 HG3 GLU 43 HG3 GLU 43 -35.186 -3.343 -20.291 350 HA PRO 44 HA PRO 44 -35.633 -7.214 -14.971 351 HB2 PRO 44 HB2 PRO 44 -37.940 -8.485 -15.629 352 HB3 PRO 44 HB3 PRO 44 -37.903 -6.864 -14.923 353 HG2 PRO 44 HG2 PRO 44 -38.221 -7.676 -17.787 354 HG3 PRO 44 HG3 PRO 44 -39.092 -6.430 -16.874 355 HD2 PRO 44 HD2 PRO 44 -37.058 -5.845 -18.562 356 HD3 PRO 44 HD3 PRO 44 -37.387 -4.896 -17.098 357 H LEU 45 H LEU 45 -35.899 -8.218 -18.327 358 HA LEU 45 HA LEU 45 -35.370 -10.149 -19.415 359 HB2 LEU 45 HB2 LEU 45 -33.150 -9.436 -18.692 360 HB3 LEU 45 HB3 LEU 45 -33.358 -10.308 -17.175 361 HG LEU 45 HG LEU 45 -33.707 -12.324 -18.932 362 HD11 LEU 45 HD11 LEU 45 -31.985 -12.113 -20.674 363 HD12 LEU 45 HD12 LEU 45 -31.753 -10.424 -20.223 364 HD13 LEU 45 HD13 LEU 45 -33.299 -10.954 -20.886 365 HD21 LEU 45 HD21 LEU 45 -31.677 -11.393 -17.153 366 HD22 LEU 45 HD22 LEU 45 -30.916 -12.110 -18.574 367 HD23 LEU 45 HD23 LEU 45 -32.069 -13.047 -17.623 368 H MET 46 H MET 46 -37.554 -10.848 -18.504 369 HA MET 46 HA MET 46 -37.263 -13.529 -17.518 370 HB2 MET 46 HB2 MET 46 -37.264 -11.992 -15.460 371 HB3 MET 46 HB3 MET 46 -38.957 -11.697 -15.832 372 HG2 MET 46 HG2 MET 46 -39.562 -13.903 -15.397 373 HG3 MET 46 HG3 MET 46 -37.901 -14.478 -15.518 374 HE1 MET 46 HE1 MET 46 -40.610 -14.076 -12.929 375 HE2 MET 46 HE2 MET 46 -40.047 -12.755 -11.906 376 HE3 MET 46 HE3 MET 46 -40.468 -12.447 -13.591 377 H ASN 47 H ASN 47 -39.386 -14.656 -17.408 378 HA ASN 47 HA ASN 47 -40.866 -14.265 -19.735 379 HB2 ASN 47 HB2 ASN 47 -41.917 -15.655 -17.269 380 HB3 ASN 47 HB3 ASN 47 -42.320 -15.987 -18.951 381 HD21 ASN 47 HD21 ASN 47 -40.912 -17.168 -20.213 382 HD22 ASN 47 HD22 ASN 47 -39.590 -18.059 -19.547 383 H TRP 48 H TRP 48 -43.344 -14.020 -19.696 384 HA TRP 48 HA TRP 48 -44.001 -11.405 -19.069 385 HB2 TRP 48 HB2 TRP 48 -45.206 -13.187 -20.569 386 HB3 TRP 48 HB3 TRP 48 -46.133 -13.511 -19.108 387 HD1 TRP 48 HD1 TRP 48 -45.068 -10.167 -20.791 388 HE1 TRP 48 HE1 TRP 48 -47.168 -8.695 -21.008 389 HE3 TRP 48 HE3 TRP 48 -48.520 -13.388 -18.834 390 HZ2 TRP 48 HZ2 TRP 48 -49.924 -8.876 -20.425 391 HZ3 TRP 48 HZ3 TRP 48 -50.868 -12.662 -18.697 392 HH2 TRP 48 HH2 TRP 48 -51.553 -10.452 -19.477 393 H THR 49 H THR 49 -44.524 -10.377 -17.255 394 HA THR 49 HA THR 49 -45.125 -11.991 -14.869 395 HB THR 49 HB THR 49 -44.275 -10.208 -13.513 396 HG1 THR 49 HG1 THR 49 -44.180 -8.753 -15.957 397 HG21 THR 49 HG21 THR 49 -42.089 -9.922 -15.350 398 HG22 THR 49 HG22 THR 49 -42.706 -11.574 -15.411 399 HG23 THR 49 HG23 THR 49 -42.183 -10.882 -13.875 400 H GLY 50 H GLY 50 -46.315 -10.400 -13.175 401 HA2 GLY 50 HA2 GLY 50 -48.916 -9.981 -14.335 402 HA3 GLY 50 HA3 GLY 50 -48.474 -9.753 -12.650 403 H SER 51 H SER 51 -48.266 -7.735 -11.901 404 HA SER 51 HA SER 51 -48.178 -5.553 -13.881 405 HB2 SER 51 HB2 SER 51 -49.856 -5.945 -11.453 406 HB3 SER 51 HB3 SER 51 -49.310 -4.306 -11.804 407 HG SER 51 HG SER 51 -51.235 -5.771 -13.016 408 H HIS 52 H HIS 52 -47.759 -5.828 -10.352 409 HA HIS 52 HA HIS 52 -45.100 -4.607 -10.650 410 HB2 HIS 52 HB2 HIS 52 -47.004 -3.940 -8.406 411 HB3 HIS 52 HB3 HIS 52 -45.473 -3.157 -8.784 412 HD1 HIS 52 HD1 HIS 52 -45.602 -2.190 -11.492 413 HD2 HIS 52 HD2 HIS 52 -49.047 -2.370 -9.175 414 HE1 HIS 52 HE1 HIS 52 -47.213 -0.579 -12.556 415 H ASP 53 H ASP 53 -44.940 -7.153 -10.547 416 HA ASP 53 HA ASP 53 -44.595 -7.915 -7.721 417 HB2 ASP 53 HB2 ASP 53 -44.711 -10.279 -8.562 418 HB3 ASP 53 HB3 ASP 53 -46.204 -9.365 -8.757 419 H THR 54 H THR 54 -42.707 -6.408 -9.360 420 HA THR 54 HA THR 54 -40.583 -8.245 -10.043 421 HB THR 54 HB THR 54 -39.267 -6.176 -10.502 422 HG1 THR 54 HG1 THR 54 -41.652 -4.710 -10.116 423 HG21 THR 54 HG21 THR 54 -40.796 -7.298 -12.180 424 HG22 THR 54 HG22 THR 54 -40.417 -5.606 -12.498 425 HG23 THR 54 HG23 THR 54 -41.978 -6.045 -11.807 426 H LYS 55 H LYS 55 -38.337 -7.766 -9.179 427 HA LYS 55 HA LYS 55 -38.158 -6.704 -6.512 428 HB2 LYS 55 HB2 LYS 55 -37.270 -8.894 -5.583 429 HB3 LYS 55 HB3 LYS 55 -39.009 -8.804 -5.832 430 HG2 LYS 55 HG2 LYS 55 -37.337 -9.914 -8.020 431 HG3 LYS 55 HG3 LYS 55 -37.606 -10.902 -6.583 432 HD2 LYS 55 HD2 LYS 55 -40.091 -10.352 -6.909 433 HD3 LYS 55 HD3 LYS 55 -39.625 -9.820 -8.527 434 HE2 LYS 55 HE2 LYS 55 -39.237 -12.565 -7.339 435 HE3 LYS 55 HE3 LYS 55 -40.372 -12.115 -8.611 436 HZ1 LYS 55 HZ1 LYS 55 -38.269 -11.364 -9.851 437 HZ2 LYS 55 HZ2 LYS 55 -38.610 -13.018 -9.770 438 HZ3 LYS 55 HZ3 LYS 55 -37.438 -12.346 -8.752 439 H GLN 56 H GLN 56 -36.139 -6.003 -6.095 440 HA GLN 56 HA GLN 56 -34.213 -5.873 -8.105 441 HB2 GLN 56 HB2 GLN 56 -33.958 -5.504 -5.121 442 HB3 GLN 56 HB3 GLN 56 -32.665 -5.143 -6.257 443 HG2 GLN 56 HG2 GLN 56 -33.727 -3.303 -7.101 444 HG3 GLN 56 HG3 GLN 56 -35.332 -3.905 -6.691 445 HE21 GLN 56 HE21 GLN 56 -36.290 -2.956 -5.049 446 HE22 GLN 56 HE22 GLN 56 -35.510 -2.101 -3.767 447 H GLN 57 H GLN 57 -32.391 -7.020 -8.585 448 HA GLN 57 HA GLN 57 -32.150 -9.637 -7.276 449 HB2 GLN 57 HB2 GLN 57 -31.086 -10.422 -9.281 450 HB3 GLN 57 HB3 GLN 57 -32.555 -9.571 -9.739 451 HG2 GLN 57 HG2 GLN 57 -31.011 -7.537 -10.067 452 HG3 GLN 57 HG3 GLN 57 -29.708 -8.724 -10.070 453 HE21 GLN 57 HE21 GLN 57 -32.649 -7.707 -11.682 454 HE22 GLN 57 HE22 GLN 57 -32.303 -8.459 -13.199 455 H VAL 58 H VAL 58 -29.930 -10.529 -7.083 456 HA VAL 58 HA VAL 58 -27.981 -8.408 -6.451 457 HB VAL 58 HB VAL 58 -28.377 -11.015 -4.976 458 HG11 VAL 58 HG11 VAL 58 -26.691 -10.153 -3.424 459 HG12 VAL 58 HG12 VAL 58 -26.034 -10.343 -5.051 460 HG13 VAL 58 HG13 VAL 58 -26.465 -8.740 -4.454 461 HG21 VAL 58 HG21 VAL 58 -29.043 -9.556 -3.092 462 HG22 VAL 58 HG22 VAL 58 -28.980 -8.168 -4.178 463 HG23 VAL 58 HG23 VAL 58 -30.149 -9.458 -4.461 464 H CYS 59 H CYS 59 -27.959 -11.965 -6.714 465 HA CYS 59 HA CYS 59 -25.464 -11.776 -8.233 466 HB2 CYS 59 HB2 CYS 59 -25.220 -14.175 -7.764 467 HB3 CYS 59 HB3 CYS 59 -25.452 -13.255 -6.282 468 HG CYS 59 HG CYS 59 -26.837 -15.587 -5.899 469 H LEU 60 H LEU 60 -25.161 -12.962 -10.179 470 HA LEU 60 HA LEU 60 -27.650 -13.282 -11.701 471 HB2 LEU 60 HB2 LEU 60 -25.188 -12.042 -12.274 472 HB3 LEU 60 HB3 LEU 60 -25.286 -13.462 -13.313 473 HG LEU 60 HG LEU 60 -27.263 -11.188 -13.184 474 HD11 LEU 60 HD11 LEU 60 -26.171 -11.680 -15.764 475 HD12 LEU 60 HD12 LEU 60 -24.846 -11.520 -14.613 476 HD13 LEU 60 HD13 LEU 60 -26.041 -10.232 -14.764 477 HD21 LEU 60 HD21 LEU 60 -28.656 -12.915 -13.730 478 HD22 LEU 60 HD22 LEU 60 -27.365 -13.878 -14.449 479 HD23 LEU 60 HD23 LEU 60 -28.040 -12.508 -15.333 480 H SER 61 H SER 61 -28.265 -15.201 -12.501 481 HA SER 61 HA SER 61 -26.492 -17.496 -12.014 482 HB2 SER 61 HB2 SER 61 -29.396 -17.831 -12.646 483 HB3 SER 61 HB3 SER 61 -28.353 -18.810 -11.614 484 HG SER 61 HG SER 61 -29.293 -17.722 -10.075 485 H PHE 62 H PHE 62 -25.792 -18.736 -13.650 486 HA PHE 62 HA PHE 62 -26.892 -18.210 -16.334 487 HB2 PHE 62 HB2 PHE 62 -24.041 -18.619 -15.451 488 HB3 PHE 62 HB3 PHE 62 -24.535 -18.862 -17.123 489 HD1 PHE 62 HD1 PHE 62 -25.954 -16.845 -18.118 490 HD2 PHE 62 HD2 PHE 62 -23.220 -16.562 -14.869 491 HE1 PHE 62 HE1 PHE 62 -25.703 -14.435 -18.544 492 HE2 PHE 62 HE2 PHE 62 -22.965 -14.151 -15.289 493 HZ PHE 62 HZ PHE 62 -24.208 -13.084 -17.128 494 H THR 63 H THR 63 -26.791 -19.982 -17.844 495 HA THR 63 HA THR 63 -27.474 -22.483 -16.604 496 HB THR 63 HB THR 63 -27.080 -22.201 -19.561 497 HG1 THR 63 HG1 THR 63 -28.771 -20.901 -19.753 498 HG21 THR 63 HG21 THR 63 -27.835 -24.324 -19.139 499 HG22 THR 63 HG22 THR 63 -29.380 -23.486 -19.292 500 HG23 THR 63 HG23 THR 63 -28.723 -23.839 -17.695 501 H THR 64 H THR 64 -24.924 -21.407 -18.843 502 HA THR 64 HA THR 64 -23.368 -23.789 -18.067 503 HB THR 64 HB THR 64 -22.141 -23.084 -20.342 504 HG1 THR 64 HG1 THR 64 -23.356 -21.559 -21.219 505 HG21 THR 64 HG21 THR 64 -23.191 -24.917 -21.366 506 HG22 THR 64 HG22 THR 64 -24.701 -24.650 -20.495 507 HG23 THR 64 HG23 THR 64 -23.287 -25.268 -19.641 508 H ARG 65 H ARG 65 -20.932 -23.400 -18.481 509 HA ARG 65 HA ARG 65 -20.124 -21.256 -16.789 510 HB2 ARG 65 HB2 ARG 65 -18.945 -23.415 -16.837 511 HB3 ARG 65 HB3 ARG 65 -18.450 -23.107 -18.496 512 HG2 ARG 65 HG2 ARG 65 -17.455 -20.912 -17.391 513 HG3 ARG 65 HG3 ARG 65 -17.440 -21.952 -15.965 514 HD2 ARG 65 HD2 ARG 65 -16.369 -23.658 -17.692 515 HD3 ARG 65 HD3 ARG 65 -15.898 -22.161 -18.496 516 HE ARG 65 HE ARG 65 -15.142 -21.764 -15.924 517 HH11 ARG 65 HH11 ARG 65 -14.549 -24.285 -18.251 518 HH12 ARG 65 HH12 ARG 65 -12.990 -24.689 -17.610 519 HH21 ARG 65 HH21 ARG 65 -13.092 -22.288 -15.071 520 HH22 ARG 65 HH22 ARG 65 -12.163 -23.553 -15.801 521 H GLU 66 H GLU 66 -19.637 -21.942 -20.247 522 HA GLU 66 HA GLU 66 -18.137 -19.729 -20.937 523 HB2 GLU 66 HB2 GLU 66 -20.263 -21.158 -22.538 524 HB3 GLU 66 HB3 GLU 66 -19.148 -19.980 -23.215 525 HG2 GLU 66 HG2 GLU 66 -18.492 -22.664 -22.037 526 HG3 GLU 66 HG3 GLU 66 -18.306 -22.140 -23.709 527 H LEU 67 H LEU 67 -21.538 -19.950 -20.227 528 HA LEU 67 HA LEU 67 -22.434 -17.568 -21.394 529 HB2 LEU 67 HB2 LEU 67 -23.559 -19.586 -19.920 530 HB3 LEU 67 HB3 LEU 67 -23.663 -18.212 -18.821 531 HG LEU 67 HG LEU 67 -25.720 -18.333 -19.995 532 HD11 LEU 67 HD11 LEU 67 -24.568 -16.231 -21.683 533 HD12 LEU 67 HD12 LEU 67 -24.180 -16.099 -19.969 534 HD13 LEU 67 HD13 LEU 67 -25.864 -16.152 -20.489 535 HD21 LEU 67 HD21 LEU 67 -23.999 -18.649 -22.435 536 HD22 LEU 67 HD22 LEU 67 -25.682 -18.134 -22.543 537 HD23 LEU 67 HD23 LEU 67 -25.282 -19.703 -21.843 538 H ALA 68 H ALA 68 -21.074 -18.202 -18.183 539 HA ALA 68 HA ALA 68 -21.398 -15.603 -17.151 540 HB1 ALA 68 HB1 ALA 68 -20.579 -17.964 -16.114 541 HB2 ALA 68 HB2 ALA 68 -19.045 -17.100 -16.219 542 HB3 ALA 68 HB3 ALA 68 -20.388 -16.406 -15.309 543 H ILE 69 H ILE 69 -18.580 -17.157 -18.679 544 HA ILE 69 HA ILE 69 -16.904 -14.891 -18.570 545 HB ILE 69 HB ILE 69 -16.823 -17.217 -20.495 546 HG12 ILE 69 HG12 ILE 69 -14.783 -17.619 -18.768 547 HG13 ILE 69 HG13 ILE 69 -15.928 -16.815 -17.701 548 HG21 ILE 69 HG21 ILE 69 -15.025 -14.895 -20.045 549 HG22 ILE 69 HG22 ILE 69 -14.296 -16.460 -20.402 550 HG23 ILE 69 HG23 ILE 69 -15.433 -15.736 -21.540 551 HD11 ILE 69 HD11 ILE 69 -15.853 -19.486 -18.223 552 HD12 ILE 69 HD12 ILE 69 -17.244 -18.608 -17.588 553 HD13 ILE 69 HD13 ILE 69 -17.119 -18.929 -19.317 554 H ALA 70 H ALA 70 -19.309 -15.956 -20.882 555 HA ALA 70 HA ALA 70 -18.599 -14.263 -23.021 556 HB1 ALA 70 HB1 ALA 70 -20.079 -15.743 -23.837 557 HB2 ALA 70 HB2 ALA 70 -20.906 -15.923 -22.290 558 HB3 ALA 70 HB3 ALA 70 -21.279 -14.551 -23.333 559 H TYR 71 H TYR 71 -20.251 -13.679 -20.038 560 HA TYR 71 HA TYR 71 -21.473 -11.211 -20.891 561 HB2 TYR 71 HB2 TYR 71 -22.395 -12.729 -19.090 562 HB3 TYR 71 HB3 TYR 71 -21.081 -12.178 -18.057 563 HD1 TYR 71 HD2 TYR 71 -23.346 -10.367 -20.415 564 HD2 TYR 71 HD1 TYR 71 -21.951 -10.799 -16.420 565 HE1 TYR 71 HE2 TYR 71 -24.698 -8.427 -19.740 566 HE2 TYR 71 HE1 TYR 71 -23.300 -8.862 -15.733 567 HH TYR 71 HH TYR 71 -25.768 -7.652 -17.414 568 H ALA 72 H ALA 72 -18.784 -12.111 -18.744 569 HA ALA 72 HA ALA 72 -17.989 -9.478 -18.131 570 HB1 ALA 72 HB1 ALA 72 -15.754 -10.650 -17.608 571 HB2 ALA 72 HB2 ALA 72 -17.181 -11.097 -16.672 572 HB3 ALA 72 HB3 ALA 72 -16.623 -12.138 -17.981 573 H VAL 73 H VAL 73 -16.588 -11.818 -20.433 574 HA VAL 73 HA VAL 73 -14.621 -10.221 -21.526 575 HB VAL 73 HB VAL 73 -16.309 -12.271 -22.969 576 HG11 VAL 73 HG11 VAL 73 -13.865 -12.346 -24.146 577 HG12 VAL 73 HG12 VAL 73 -15.246 -11.441 -24.770 578 HG13 VAL 73 HG13 VAL 73 -14.022 -10.624 -23.797 579 HG21 VAL 73 HG21 VAL 73 -15.033 -12.940 -20.850 580 HG22 VAL 73 HG22 VAL 73 -14.762 -13.899 -22.306 581 HG23 VAL 73 HG23 VAL 73 -13.573 -12.695 -21.808 582 H ALA 74 H ALA 74 -18.065 -10.232 -22.167 583 HA ALA 74 HA ALA 74 -18.210 -8.842 -24.544 584 HB1 ALA 74 HB1 ALA 74 -20.136 -8.088 -22.417 585 HB2 ALA 74 HB2 ALA 74 -20.423 -8.552 -24.094 586 HB3 ALA 74 HB3 ALA 74 -20.054 -9.786 -22.889 587 H HIS 75 H HIS 75 -17.397 -7.670 -21.361 588 HA HIS 75 HA HIS 75 -17.048 -4.972 -22.495 589 HB2 HIS 75 HB2 HIS 75 -18.157 -5.843 -19.856 590 HB3 HIS 75 HB3 HIS 75 -17.301 -4.308 -19.960 591 HD1 HIS 75 HD1 HIS 75 -18.430 -2.408 -21.301 592 HD2 HIS 75 HD2 HIS 75 -20.662 -5.907 -21.100 593 HE1 HIS 75 HE1 HIS 75 -20.733 -1.783 -22.096 594 H LYS 76 H LYS 76 -15.201 -7.309 -22.241 595 HA LYS 76 HA LYS 76 -13.053 -7.772 -21.638 596 HB2 LYS 76 HB2 LYS 76 -12.909 -4.752 -21.574 597 HB3 LYS 76 HB3 LYS 76 -11.518 -5.828 -21.599 598 HG2 LYS 76 HG2 LYS 76 -13.571 -6.014 -23.755 599 HG3 LYS 76 HG3 LYS 76 -12.358 -4.733 -23.797 600 HD2 LYS 76 HD2 LYS 76 -10.594 -6.245 -23.996 601 HD3 LYS 76 HD3 LYS 76 -11.558 -7.594 -23.393 602 HE2 LYS 76 HE2 LYS 76 -11.434 -8.026 -25.668 603 HE3 LYS 76 HE3 LYS 76 -12.989 -7.212 -25.510 604 HZ1 LYS 76 HZ1 LYS 76 -11.873 -6.264 -27.351 605 HZ2 LYS 76 HZ2 LYS 76 -10.441 -6.048 -26.479 606 HZ3 LYS 76 HZ3 LYS 76 -11.805 -5.117 -26.110 607 H ILE 77 H ILE 77 -14.796 -7.979 -19.515 608 HA ILE 77 HA ILE 77 -13.521 -6.651 -17.246 609 HB ILE 77 HB ILE 77 -15.947 -8.449 -17.313 610 HG12 ILE 77 HG12 ILE 77 -15.825 -5.453 -16.935 611 HG13 ILE 77 HG13 ILE 77 -16.152 -6.223 -18.484 612 HG21 ILE 77 HG21 ILE 77 -16.198 -7.112 -15.021 613 HG22 ILE 77 HG22 ILE 77 -15.351 -8.655 -15.135 614 HG23 ILE 77 HG23 ILE 77 -14.438 -7.145 -15.127 615 HD11 ILE 77 HD11 ILE 77 -18.278 -6.600 -17.957 616 HD12 ILE 77 HD12 ILE 77 -17.868 -7.195 -16.348 617 HD13 ILE 77 HD13 ILE 77 -18.020 -5.461 -16.636 618 H ASP 78 H ASP 78 -12.407 -7.702 -15.657 619 HA ASP 78 HA ASP 78 -11.190 -10.192 -16.337 620 HB2 ASP 78 HB2 ASP 78 -10.978 -8.247 -14.087 621 HB3 ASP 78 HB3 ASP 78 -10.387 -9.885 -13.816 622 H TYR 79 H TYR 79 -12.341 -12.014 -16.250 623 HA TYR 79 HA TYR 79 -14.222 -12.416 -14.037 624 HB2 TYR 79 HB2 TYR 79 -15.102 -14.283 -15.387 625 HB3 TYR 79 HB3 TYR 79 -15.135 -12.762 -16.272 626 HD1 TYR 79 HD1 TYR 79 -13.519 -16.049 -16.002 627 HD2 TYR 79 HD2 TYR 79 -13.753 -12.426 -18.220 628 HE1 TYR 79 HE1 TYR 79 -12.268 -17.100 -17.840 629 HE2 TYR 79 HE2 TYR 79 -12.505 -13.468 -20.065 630 HH TYR 79 HH TYR 79 -10.685 -16.002 -19.852 631 H THR 80 H THR 80 -13.977 -13.997 -12.546 632 HA THR 80 HA THR 80 -11.554 -15.664 -12.751 633 HB THR 80 HB THR 80 -11.225 -14.116 -10.958 634 HG1 THR 80 HG1 THR 80 -10.565 -16.180 -10.389 635 HG21 THR 80 HG21 THR 80 -13.420 -13.316 -10.522 636 HG22 THR 80 HG22 THR 80 -12.862 -14.073 -9.030 637 HG23 THR 80 HG23 THR 80 -13.993 -14.924 -10.082 638 H VAL 81 H VAL 81 -11.709 -17.821 -12.349 639 HA VAL 81 HA VAL 81 -14.421 -18.898 -12.105 640 HB VAL 81 HB VAL 81 -13.351 -21.068 -12.751 641 HG11 VAL 81 HG11 VAL 81 -13.356 -18.646 -14.485 642 HG12 VAL 81 HG12 VAL 81 -12.716 -20.158 -15.129 643 HG13 VAL 81 HG13 VAL 81 -14.379 -20.080 -14.548 644 HG21 VAL 81 HG21 VAL 81 -11.144 -21.300 -12.727 645 HG22 VAL 81 HG22 VAL 81 -10.978 -20.015 -13.923 646 HG23 VAL 81 HG23 VAL 81 -10.982 -19.623 -12.204 647 H LEU 82 H LEU 82 -15.117 -19.607 -10.209 648 HA LEU 82 HA LEU 82 -13.137 -20.387 -8.177 649 HB2 LEU 82 HB2 LEU 82 -15.905 -19.247 -7.972 650 HB3 LEU 82 HB3 LEU 82 -15.128 -20.044 -6.604 651 HG LEU 82 HG LEU 82 -13.794 -17.747 -7.992 652 HD11 LEU 82 HD11 LEU 82 -14.833 -16.340 -6.143 653 HD12 LEU 82 HD12 LEU 82 -16.013 -17.639 -5.972 654 HD13 LEU 82 HD13 LEU 82 -15.872 -16.773 -7.502 655 HD21 LEU 82 HD21 LEU 82 -12.428 -18.978 -6.456 656 HD22 LEU 82 HD22 LEU 82 -13.683 -18.921 -5.217 657 HD23 LEU 82 HD23 LEU 82 -12.858 -17.440 -5.706 658 H GLN 83 H GLN 83 -12.920 -22.502 -7.922 659 HA GLN 83 HA GLN 83 -15.324 -24.192 -8.067 660 HB2 GLN 83 HB2 GLN 83 -12.605 -25.050 -9.055 661 HB3 GLN 83 HB3 GLN 83 -14.130 -25.911 -9.229 662 HG2 GLN 83 HG2 GLN 83 -14.849 -23.760 -10.529 663 HG3 GLN 83 HG3 GLN 83 -13.109 -23.541 -10.712 664 HE21 GLN 83 HE21 GLN 83 -12.097 -24.620 -12.270 665 HE22 GLN 83 HE22 GLN 83 -12.790 -25.878 -13.229 666 H ASP 84 H ASP 84 -15.282 -26.090 -6.770 667 HA ASP 84 HA ASP 84 -14.260 -25.755 -4.206 668 HB2 ASP 84 HB2 ASP 84 -16.148 -27.270 -4.864 669 HB3 ASP 84 HB3 ASP 84 -14.954 -28.402 -5.489 670 H ASN 85 H ASN 85 -12.381 -26.220 -3.231 671 HA ASN 85 HA ASN 85 -10.180 -26.740 -2.982 672 HB2 ASN 85 HB2 ASN 85 -11.240 -29.035 -3.071 673 HB3 ASN 85 HB3 ASN 85 -10.777 -29.102 -4.769 674 HD21 ASN 85 HD21 ASN 85 -9.651 -31.041 -3.898 675 HD22 ASN 85 HD22 ASN 85 -8.043 -30.827 -3.301 676 HA PRO 86 HA PRO 86 -9.198 -24.967 -7.178 677 HB2 PRO 86 HB2 PRO 86 -8.074 -22.687 -6.220 678 HB3 PRO 86 HB3 PRO 86 -9.807 -22.847 -6.533 679 HG2 PRO 86 HG2 PRO 86 -8.321 -23.065 -3.943 680 HG3 PRO 86 HG3 PRO 86 -9.854 -22.243 -4.288 681 HD2 PRO 86 HD2 PRO 86 -9.740 -24.685 -3.125 682 HD3 PRO 86 HD3 PRO 86 -11.069 -24.199 -4.197 683 H ARG 87 H ARG 87 -7.241 -25.149 -8.165 684 HA ARG 87 HA ARG 87 -5.141 -26.482 -6.821 685 HB2 ARG 87 HB2 ARG 87 -5.589 -26.755 -9.228 686 HB3 ARG 87 HB3 ARG 87 -5.109 -25.087 -9.503 687 HG2 ARG 87 HG2 ARG 87 -2.863 -25.533 -9.048 688 HG3 ARG 87 HG3 ARG 87 -3.237 -27.063 -8.252 689 HD2 ARG 87 HD2 ARG 87 -3.735 -28.121 -10.300 690 HD3 ARG 87 HD3 ARG 87 -3.808 -26.585 -11.163 691 HE ARG 87 HE ARG 87 -1.241 -26.794 -10.166 692 HH11 ARG 87 HH11 ARG 87 -3.286 -28.572 -12.352 693 HH12 ARG 87 HH12 ARG 87 -1.969 -29.159 -13.313 694 HH21 ARG 87 HH21 ARG 87 0.501 -27.561 -11.424 695 HH22 ARG 87 HH22 ARG 87 0.185 -28.583 -12.784 696 H THR 88 H THR 88 -3.003 -25.773 -6.405 697 HA THR 88 HA THR 88 -2.539 -22.885 -6.387 698 HB THR 88 HB THR 88 -3.437 -23.292 -4.178 699 HG1 THR 88 HG1 THR 88 -1.334 -22.049 -4.578 700 HG21 THR 88 HG21 THR 88 -3.194 -25.552 -3.714 701 HG22 THR 88 HG22 THR 88 -1.977 -24.828 -2.662 702 HG23 THR 88 HG23 THR 88 -1.496 -25.571 -4.187 703 H ILE 89 H ILE 89 -0.385 -22.287 -6.486 704 HA ILE 89 HA ILE 89 1.841 -22.471 -6.930 705 HB ILE 89 HB ILE 89 1.718 -25.257 -5.784 706 HG12 ILE 89 HG12 ILE 89 2.090 -22.633 -4.322 707 HG13 ILE 89 HG13 ILE 89 0.676 -23.676 -4.215 708 HG21 ILE 89 HG21 ILE 89 4.065 -24.741 -5.155 709 HG22 ILE 89 HG22 ILE 89 3.789 -24.771 -6.896 710 HG23 ILE 89 HG23 ILE 89 3.931 -23.229 -6.052 711 HD11 ILE 89 HD11 ILE 89 2.171 -25.461 -3.316 712 HD12 ILE 89 HD12 ILE 89 3.458 -24.258 -3.247 713 HD13 ILE 89 HD13 ILE 89 1.997 -24.043 -2.283 714 H VAL 90 H VAL 90 3.250 -23.280 -8.519 715 HA VAL 90 HA VAL 90 2.225 -25.442 -10.216 716 HB VAL 90 HB VAL 90 2.959 -24.028 -12.225 717 HG11 VAL 90 HG11 VAL 90 0.628 -22.596 -11.368 718 HG12 VAL 90 HG12 VAL 90 0.769 -23.887 -12.564 719 HG13 VAL 90 HG13 VAL 90 0.514 -24.282 -10.864 720 HG21 VAL 90 HG21 VAL 90 2.844 -21.617 -11.949 721 HG22 VAL 90 HG22 VAL 90 2.567 -21.808 -10.217 722 HG23 VAL 90 HG23 VAL 90 4.110 -22.290 -10.920 723 HA PRO 91 HA PRO 91 6.399 -26.788 -10.429 724 HB2 PRO 91 HB2 PRO 91 6.490 -27.872 -12.917 725 HB3 PRO 91 HB3 PRO 91 5.627 -28.627 -11.572 726 HG2 PRO 91 HG2 PRO 91 4.554 -26.950 -13.808 727 HG3 PRO 91 HG3 PRO 91 3.894 -28.442 -13.112 728 HD2 PRO 91 HD2 PRO 91 2.937 -25.990 -12.476 729 HD3 PRO 91 HD3 PRO 91 2.953 -27.339 -11.321 730 H LYS 92 H LYS 92 8.447 -26.489 -11.515 731 HA LYS 92 HA LYS 92 8.554 -24.360 -13.515 732 HB2 LYS 92 HB2 LYS 92 8.789 -23.515 -11.053 733 HB3 LYS 92 HB3 LYS 92 10.403 -24.206 -11.159 734 HG2 LYS 92 HG2 LYS 92 10.972 -22.758 -12.980 735 HG3 LYS 92 HG3 LYS 92 9.313 -22.164 -13.083 736 HD2 LYS 92 HD2 LYS 92 9.506 -21.147 -10.893 737 HD3 LYS 92 HD3 LYS 92 11.124 -21.822 -10.694 738 HE2 LYS 92 HE2 LYS 92 12.071 -20.338 -12.163 739 HE3 LYS 92 HE3 LYS 92 10.578 -20.123 -13.075 740 HZ1 LYS 92 HZ1 LYS 92 11.400 -18.853 -10.548 741 HZ2 LYS 92 HZ2 LYS 92 9.758 -19.000 -10.923 742 HZ3 LYS 92 HZ3 LYS 92 10.785 -18.137 -11.952 743 H SER 93 H SER 93 9.823 -25.005 -15.114 744 HA SER 93 HA SER 93 12.412 -26.116 -14.679 745 HB2 SER 93 HB2 SER 93 11.992 -28.292 -15.813 746 HB3 SER 93 HB3 SER 93 11.161 -28.158 -14.264 747 HG SER 93 HG SER 93 9.620 -28.880 -15.608 748 H TYR 94 H TYR 94 13.597 -25.252 -16.235 749 HA TYR 94 HA TYR 94 12.918 -25.456 -18.992 750 HB2 TYR 94 HB2 TYR 94 12.740 -23.048 -19.480 751 HB3 TYR 94 HB3 TYR 94 11.432 -23.597 -18.439 752 HD1 TYR 94 HD2 TYR 94 11.523 -23.071 -15.986 753 HD2 TYR 94 HD1 TYR 94 14.236 -21.355 -18.777 754 HE1 TYR 94 HE2 TYR 94 12.077 -21.314 -14.357 755 HE2 TYR 94 HE1 TYR 94 14.801 -19.594 -17.154 756 HH TYR 94 HH TYR 94 14.014 -19.768 -13.906 757 H ALA 95 H ALA 95 14.778 -25.660 -20.039 758 HA ALA 95 HA ALA 95 17.261 -24.988 -18.732 759 HB1 ALA 95 HB1 ALA 95 16.637 -26.305 -21.366 760 HB2 ALA 95 HB2 ALA 95 18.277 -25.999 -20.794 761 HB3 ALA 95 HB3 ALA 95 17.210 -27.068 -19.882 762 H ASP 96 H ASP 96 18.998 -23.842 -19.927 763 HA ASP 96 HA ASP 96 18.240 -21.988 -21.990 764 HB2 ASP 96 HB2 ASP 96 18.595 -21.091 -19.149 765 HB3 ASP 96 HB3 ASP 96 19.049 -20.020 -20.473 766 H ASN 97 H ASN 97 19.929 -22.350 -23.283 767 HA ASN 97 HA ASN 97 22.624 -22.072 -22.129 768 HB2 ASN 97 HB2 ASN 97 21.528 -24.148 -23.971 769 HB3 ASN 97 HB3 ASN 97 23.195 -23.632 -24.205 770 HD21 ASN 97 HD21 ASN 97 24.660 -23.846 -22.418 771 HD22 ASN 97 HD22 ASN 97 24.403 -25.085 -21.241 772 H PHE 98 H PHE 98 24.242 -21.811 -24.117 773 HA PHE 98 HA PHE 98 23.143 -20.123 -26.208 774 HB2 PHE 98 HB2 PHE 98 24.755 -18.282 -25.700 775 HB3 PHE 98 HB3 PHE 98 23.503 -18.483 -24.479 776 HD1 PHE 98 HD2 PHE 98 24.055 -19.567 -22.317 777 HD2 PHE 98 HD1 PHE 98 27.042 -18.562 -25.177 778 HE1 PHE 98 HE2 PHE 98 25.781 -19.760 -20.576 779 HE2 PHE 98 HE1 PHE 98 28.774 -18.755 -23.441 780 HZ PHE 98 HZ PHE 98 28.145 -19.353 -21.136 781 H THR 99 H THR 99 24.145 -20.540 -28.061 782 HA THR 99 HA THR 99 26.910 -21.551 -27.974 783 HB THR 99 HB THR 99 25.012 -22.499 -30.088 784 HG1 THR 99 HG1 THR 99 24.000 -23.755 -28.720 785 HG21 THR 99 HG21 THR 99 26.614 -24.574 -29.507 786 HG22 THR 99 HG22 THR 99 27.662 -23.248 -29.003 787 HG23 THR 99 HG23 THR 99 27.056 -23.312 -30.657 788 H LYS 100 H LYS 100 27.642 -19.434 -28.466 789 HA LYS 100 HA LYS 100 27.261 -18.713 -31.293 790 HB2 LYS 100 HB2 LYS 100 26.003 -17.198 -29.704 791 HB3 LYS 100 HB3 LYS 100 27.564 -16.693 -29.070 792 HG2 LYS 100 HG2 LYS 100 28.056 -16.205 -31.611 793 HG3 LYS 100 HG3 LYS 100 26.295 -16.102 -31.688 794 HD2 LYS 100 HD2 LYS 100 27.907 -14.602 -29.639 795 HD3 LYS 100 HD3 LYS 100 27.564 -13.938 -31.238 796 HE2 LYS 100 HE2 LYS 100 25.108 -14.453 -30.703 797 HE3 LYS 100 HE3 LYS 100 25.646 -14.623 -29.033 798 HZ1 LYS 100 HZ1 LYS 100 26.548 -12.221 -30.372 799 HZ2 LYS 100 HZ2 LYS 100 25.925 -12.424 -28.813 800 HZ3 LYS 100 HZ3 LYS 100 24.875 -12.313 -30.134 801 HA PRO 101 HA PRO 101 31.756 -19.246 -30.222 802 HB2 PRO 101 HB2 PRO 101 32.334 -20.786 -32.381 803 HB3 PRO 101 HB3 PRO 101 31.736 -21.454 -30.858 804 HG2 PRO 101 HG2 PRO 101 30.239 -20.849 -33.379 805 HG3 PRO 101 HG3 PRO 101 30.120 -22.266 -32.319 806 HD2 PRO 101 HD2 PRO 101 28.331 -20.236 -32.242 807 HD3 PRO 101 HD3 PRO 101 28.771 -21.175 -30.802 808 H ARG 102 H ARG 102 33.654 -18.810 -31.728 809 HA ARG 102 HA ARG 102 32.907 -16.873 -33.816 810 HB2 ARG 102 HB2 ARG 102 34.756 -15.435 -33.123 811 HB3 ARG 102 HB3 ARG 102 33.623 -15.671 -31.800 812 HG2 ARG 102 HG2 ARG 102 35.932 -17.517 -31.950 813 HG3 ARG 102 HG3 ARG 102 36.251 -15.844 -31.484 814 HD2 ARG 102 HD2 ARG 102 34.153 -17.568 -30.180 815 HD3 ARG 102 HD3 ARG 102 35.806 -17.428 -29.583 816 HE ARG 102 HE ARG 102 33.698 -15.500 -29.311 817 HH11 ARG 102 HH11 ARG 102 37.147 -15.960 -29.428 818 HH12 ARG 102 HH12 ARG 102 37.501 -14.520 -28.530 819 HH21 ARG 102 HH21 ARG 102 34.150 -13.603 -28.127 820 HH22 ARG 102 HH22 ARG 102 35.795 -13.182 -27.789 821 H ASP 103 H ASP 103 34.537 -16.529 -35.461 822 HA ASP 103 HA ASP 103 36.714 -18.437 -35.627 823 HB2 ASP 103 HB2 ASP 103 34.534 -19.500 -36.544 824 HB3 ASP 103 HB3 ASP 103 34.753 -18.405 -37.905 825 H MET 104 H MET 104 37.954 -18.111 -37.728 826 HA MET 104 HA MET 104 38.762 -15.454 -37.941 827 HB2 MET 104 HB2 MET 104 39.936 -17.659 -38.681 828 HB3 MET 104 HB3 MET 104 39.117 -17.383 -40.212 829 HG2 MET 104 HG2 MET 104 40.197 -15.203 -40.401 830 HG3 MET 104 HG3 MET 104 41.013 -15.475 -38.864 831 HE1 MET 104 HE1 MET 104 42.478 -18.011 -38.633 832 HE2 MET 104 HE2 MET 104 43.916 -17.697 -39.604 833 HE3 MET 104 HE3 MET 104 43.216 -16.409 -38.623 Start of MODEL 7 1 H1 MET 1 H MET 1 -2.106 -5.808 -5.373 2 HA MET 1 HA MET 1 -3.725 -4.714 -7.115 3 HB2 MET 1 HB2 MET 1 -4.168 -4.623 -4.130 4 HB3 MET 1 HB3 MET 1 -5.432 -4.305 -5.311 5 HG2 MET 1 HG2 MET 1 -3.869 -6.862 -5.326 6 HG3 MET 1 HG3 MET 1 -5.289 -6.643 -4.305 7 HE1 MET 1 HE1 MET 1 -6.479 -9.029 -6.916 8 HE2 MET 1 HE2 MET 1 -4.900 -8.674 -7.617 9 HE3 MET 1 HE3 MET 1 -5.067 -8.863 -5.871 10 H GLN 2 H GLN 2 -2.241 -2.864 -7.768 11 HA GLN 2 HA GLN 2 -3.360 -0.385 -6.672 12 HB2 GLN 2 HB2 GLN 2 -0.463 -1.097 -6.944 13 HB3 GLN 2 HB3 GLN 2 -0.967 0.578 -7.124 14 HG2 GLN 2 HG2 GLN 2 -1.781 -1.021 -4.731 15 HG3 GLN 2 HG3 GLN 2 -0.198 -0.250 -4.817 16 HE21 GLN 2 HE21 GLN 2 -2.735 0.191 -3.203 17 HE22 GLN 2 HE22 GLN 2 -3.018 1.890 -3.336 18 H GLU 3 H GLU 3 -4.376 0.597 -8.280 19 HA GLU 3 HA GLU 3 -3.057 1.219 -10.734 20 HB2 GLU 3 HB2 GLU 3 -4.688 0.082 -12.223 21 HB3 GLU 3 HB3 GLU 3 -3.670 -1.037 -11.328 22 HG2 GLU 3 HG2 GLU 3 -5.628 -1.101 -9.644 23 HG3 GLU 3 HG3 GLU 3 -6.572 -0.429 -10.971 24 H GLN 4 H GLN 4 -4.015 2.918 -11.789 25 HA GLN 4 HA GLN 4 -6.271 4.148 -10.389 26 HB2 GLN 4 HB2 GLN 4 -4.384 5.324 -12.438 27 HB3 GLN 4 HB3 GLN 4 -5.623 6.207 -11.554 28 HG2 GLN 4 HG2 GLN 4 -3.467 4.733 -10.100 29 HG3 GLN 4 HG3 GLN 4 -3.177 6.340 -10.763 30 HE21 GLN 4 HE21 GLN 4 -3.107 5.617 -8.016 31 HE22 GLN 4 HE22 GLN 4 -4.347 6.511 -7.210 32 H VAL 5 H VAL 5 -8.027 3.054 -11.231 33 HA VAL 5 HA VAL 5 -9.072 4.018 -13.677 34 HB VAL 5 HB VAL 5 -7.465 2.381 -14.612 35 HG11 VAL 5 HG11 VAL 5 -7.282 0.259 -13.915 36 HG12 VAL 5 HG12 VAL 5 -8.162 0.808 -12.487 37 HG13 VAL 5 HG13 VAL 5 -9.029 0.041 -13.819 38 HG21 VAL 5 HG21 VAL 5 -9.059 1.243 -16.080 39 HG22 VAL 5 HG22 VAL 5 -10.369 1.643 -14.971 40 HG23 VAL 5 HG23 VAL 5 -9.512 2.927 -15.823 41 H SER 6 H SER 6 -11.253 3.532 -13.930 42 HA SER 6 HA SER 6 -12.478 2.230 -11.602 43 HB2 SER 6 HB2 SER 6 -13.290 4.449 -11.831 44 HB3 SER 6 HB3 SER 6 -13.503 4.273 -13.572 45 HG SER 6 HG SER 6 -15.194 3.618 -11.540 46 H ASN 7 H ASN 7 -12.842 0.135 -11.971 47 HA ASN 7 HA ASN 7 -14.540 -0.608 -14.202 48 HB2 ASN 7 HB2 ASN 7 -13.070 -2.421 -14.959 49 HB3 ASN 7 HB3 ASN 7 -12.284 -0.856 -15.141 50 HD21 ASN 7 HD21 ASN 7 -10.799 -3.124 -15.157 51 HD22 ASN 7 HD22 ASN 7 -9.856 -3.229 -13.713 52 H VAL 8 H VAL 8 -15.329 -2.851 -14.008 53 HA VAL 8 HA VAL 8 -15.505 -3.631 -11.176 54 HB VAL 8 HB VAL 8 -17.584 -4.835 -11.841 55 HG11 VAL 8 HG11 VAL 8 -18.812 -3.010 -11.381 56 HG12 VAL 8 HG12 VAL 8 -17.245 -2.217 -11.220 57 HG13 VAL 8 HG13 VAL 8 -18.144 -2.094 -12.732 58 HG21 VAL 8 HG21 VAL 8 -18.128 -3.404 -14.253 59 HG22 VAL 8 HG22 VAL 8 -16.625 -4.306 -14.443 60 HG23 VAL 8 HG23 VAL 8 -18.105 -5.146 -13.979 61 H ARG 9 H ARG 9 -16.292 -6.126 -11.159 62 HA ARG 9 HA ARG 9 -14.611 -7.706 -12.951 63 HB2 ARG 9 HB2 ARG 9 -14.381 -7.708 -9.940 64 HB3 ARG 9 HB3 ARG 9 -13.747 -8.994 -10.957 65 HG2 ARG 9 HG2 ARG 9 -12.080 -7.666 -11.832 66 HG3 ARG 9 HG3 ARG 9 -12.946 -6.170 -11.482 67 HD2 ARG 9 HD2 ARG 9 -10.992 -6.519 -10.012 68 HD3 ARG 9 HD3 ARG 9 -12.510 -6.419 -9.123 69 HE ARG 9 HE ARG 9 -12.207 -9.072 -9.474 70 HH11 ARG 9 HH11 ARG 9 -10.083 -6.589 -8.275 71 HH12 ARG 9 HH12 ARG 9 -9.229 -7.653 -7.207 72 HH21 ARG 9 HH21 ARG 9 -11.090 -10.483 -8.072 73 HH22 ARG 9 HH22 ARG 9 -9.802 -9.867 -7.093 74 H ALA 10 H ALA 10 -15.238 -9.874 -13.149 75 HA ALA 10 HA ALA 10 -17.960 -10.408 -12.189 76 HB1 ALA 10 HB1 ALA 10 -18.328 -11.015 -14.290 77 HB2 ALA 10 HB2 ALA 10 -16.617 -10.837 -14.685 78 HB3 ALA 10 HB3 ALA 10 -17.222 -12.369 -14.054 79 H ARG 11 H ARG 11 -18.196 -11.737 -10.526 80 HA ARG 11 HA ARG 11 -16.023 -13.563 -9.826 81 HB2 ARG 11 HB2 ARG 11 -18.509 -12.888 -8.246 82 HB3 ARG 11 HB3 ARG 11 -17.095 -13.754 -7.663 83 HG2 ARG 11 HG2 ARG 11 -15.864 -11.539 -8.384 84 HG3 ARG 11 HG3 ARG 11 -17.475 -10.852 -8.161 85 HD2 ARG 11 HD2 ARG 11 -16.040 -12.514 -6.097 86 HD3 ARG 11 HD3 ARG 11 -16.013 -10.751 -6.138 87 HE ARG 11 HE ARG 11 -18.651 -11.304 -6.124 88 HH11 ARG 11 HH11 ARG 11 -15.999 -12.371 -4.137 89 HH12 ARG 11 HH12 ARG 11 -16.973 -12.578 -2.720 90 HH21 ARG 11 HH21 ARG 11 -19.944 -11.573 -4.265 91 HH22 ARG 11 HH22 ARG 11 -19.218 -12.126 -2.794 92 H ILE 12 H ILE 12 -16.180 -15.411 -10.962 93 HA ILE 12 HA ILE 12 -18.808 -16.708 -11.176 94 HB ILE 12 HB ILE 12 -16.266 -17.334 -12.683 95 HG12 ILE 12 HG12 ILE 12 -18.769 -16.012 -13.737 96 HG13 ILE 12 HG13 ILE 12 -17.372 -15.100 -13.171 97 HG21 ILE 12 HG21 ILE 12 -17.849 -18.623 -14.150 98 HG22 ILE 12 HG22 ILE 12 -17.589 -19.299 -12.543 99 HG23 ILE 12 HG23 ILE 12 -19.068 -18.408 -12.895 100 HD11 ILE 12 HD11 ILE 12 -17.214 -15.242 -15.524 101 HD12 ILE 12 HD12 ILE 12 -16.007 -16.347 -14.866 102 HD13 ILE 12 HD13 ILE 12 -17.523 -16.978 -15.509 103 H TYR 13 H TYR 13 -19.232 -18.580 -10.169 104 HA TYR 13 HA TYR 13 -17.080 -20.278 -9.214 105 HB2 TYR 13 HB2 TYR 13 -17.994 -20.304 -6.889 106 HB3 TYR 13 HB3 TYR 13 -17.271 -18.767 -7.348 107 HD1 TYR 13 HD1 TYR 13 -18.757 -16.838 -7.928 108 HD2 TYR 13 HD2 TYR 13 -20.279 -20.449 -6.269 109 HE1 TYR 13 HE1 TYR 13 -20.831 -15.671 -7.305 110 HE2 TYR 13 HE2 TYR 13 -22.357 -19.292 -5.643 111 HH TYR 13 HH TYR 13 -23.058 -16.061 -6.717 112 H LYS 14 H LYS 14 -17.747 -22.387 -8.695 113 HA LYS 14 HA LYS 14 -20.459 -23.043 -9.633 114 HB2 LYS 14 HB2 LYS 14 -18.675 -23.979 -11.023 115 HB3 LYS 14 HB3 LYS 14 -17.961 -24.747 -9.612 116 HG2 LYS 14 HG2 LYS 14 -19.926 -26.153 -9.356 117 HG3 LYS 14 HG3 LYS 14 -20.688 -25.358 -10.736 118 HD2 LYS 14 HD2 LYS 14 -19.820 -27.194 -11.784 119 HD3 LYS 14 HD3 LYS 14 -18.447 -26.095 -11.936 120 HE2 LYS 14 HE2 LYS 14 -17.619 -28.208 -11.188 121 HE3 LYS 14 HE3 LYS 14 -17.523 -27.079 -9.837 122 HZ1 LYS 14 HZ1 LYS 14 -18.388 -29.259 -9.184 123 HZ2 LYS 14 HZ2 LYS 14 -19.696 -29.064 -10.239 124 HZ3 LYS 14 HZ3 LYS 14 -19.517 -28.030 -8.912 125 HA PRO 15 HA PRO 15 -20.680 -24.003 -5.167 126 HB2 PRO 15 HB2 PRO 15 -23.354 -23.574 -5.000 127 HB3 PRO 15 HB3 PRO 15 -22.165 -22.271 -4.902 128 HG2 PRO 15 HG2 PRO 15 -23.817 -23.156 -7.236 129 HG3 PRO 15 HG3 PRO 15 -23.452 -21.512 -6.683 130 HD2 PRO 15 HD2 PRO 15 -22.151 -22.673 -8.754 131 HD3 PRO 15 HD3 PRO 15 -21.369 -21.506 -7.669 132 H ALA 16 H ALA 16 -21.555 -25.791 -4.087 133 HA ALA 16 HA ALA 16 -22.403 -27.956 -5.850 134 HB1 ALA 16 HB1 ALA 16 -21.638 -29.441 -4.257 135 HB2 ALA 16 HB2 ALA 16 -20.536 -28.080 -4.046 136 HB3 ALA 16 HB3 ALA 16 -21.881 -28.305 -2.928 137 H LYS 17 H LYS 17 -24.397 -28.800 -5.876 138 HA LYS 17 HA LYS 17 -26.250 -28.144 -3.697 139 HB2 LYS 17 HB2 LYS 17 -26.989 -27.942 -6.620 140 HB3 LYS 17 HB3 LYS 17 -28.010 -27.554 -5.241 141 HG2 LYS 17 HG2 LYS 17 -26.342 -25.763 -4.651 142 HG3 LYS 17 HG3 LYS 17 -25.586 -26.068 -6.217 143 HD2 LYS 17 HD2 LYS 17 -28.489 -25.337 -5.850 144 HD3 LYS 17 HD3 LYS 17 -27.213 -24.174 -6.212 145 HE2 LYS 17 HE2 LYS 17 -26.689 -25.711 -8.215 146 HE3 LYS 17 HE3 LYS 17 -28.292 -26.388 -7.922 147 HZ1 LYS 17 HZ1 LYS 17 -29.212 -24.146 -8.151 148 HZ2 LYS 17 HZ2 LYS 17 -28.413 -24.642 -9.556 149 HZ3 LYS 17 HZ3 LYS 17 -27.672 -23.542 -8.506 150 H SER 18 H SER 18 -28.383 -29.429 -4.064 151 HA SER 18 HA SER 18 -27.623 -32.203 -4.260 152 HB2 SER 18 HB2 SER 18 -30.410 -31.124 -3.834 153 HB3 SER 18 HB3 SER 18 -29.774 -32.700 -3.361 154 HG SER 18 HG SER 18 -28.770 -31.815 -1.685 155 H THR 19 H THR 19 -28.193 -33.660 -5.804 156 HA THR 19 HA THR 19 -29.597 -32.591 -8.167 157 HB THR 19 HB THR 19 -28.304 -34.552 -9.332 158 HG1 THR 19 HG1 THR 19 -27.371 -35.366 -7.394 159 HG21 THR 19 HG21 THR 19 -27.134 -31.902 -8.512 160 HG22 THR 19 HG22 THR 19 -27.918 -32.327 -10.033 161 HG23 THR 19 HG23 THR 19 -26.327 -32.983 -9.648 162 H MET 20 H MET 20 -29.070 -35.446 -6.147 163 HA MET 20 HA MET 20 -30.349 -37.279 -5.731 164 HB2 MET 20 HB2 MET 20 -32.637 -35.738 -6.956 165 HB3 MET 20 HB3 MET 20 -32.734 -37.050 -5.788 166 HG2 MET 20 HG2 MET 20 -31.518 -35.562 -4.173 167 HG3 MET 20 HG3 MET 20 -31.734 -34.254 -5.335 168 HE1 MET 20 HE1 MET 20 -34.366 -36.065 -2.330 169 HE2 MET 20 HE2 MET 20 -32.620 -35.875 -2.494 170 HE3 MET 20 HE3 MET 20 -33.608 -34.517 -1.956 171 H GLN 21 H GLN 21 -28.926 -37.134 -8.201 172 HA GLN 21 HA GLN 21 -28.726 -38.184 -10.210 173 HB2 GLN 21 HB2 GLN 21 -30.704 -39.990 -8.822 174 HB3 GLN 21 HB3 GLN 21 -30.013 -40.367 -10.394 175 HG2 GLN 21 HG2 GLN 21 -28.707 -41.540 -8.856 176 HG3 GLN 21 HG3 GLN 21 -27.743 -40.130 -9.291 177 HE21 GLN 21 HE21 GLN 21 -26.590 -39.715 -7.527 178 HE22 GLN 21 HE22 GLN 21 -27.234 -39.469 -5.944 179 H SER 22 H SER 22 -30.258 -35.983 -10.439 180 HA SER 22 HA SER 22 -32.820 -36.496 -11.594 181 HB2 SER 22 HB2 SER 22 -32.851 -34.130 -12.126 182 HB3 SER 22 HB3 SER 22 -32.198 -34.340 -10.502 183 HG SER 22 HG SER 22 -31.080 -33.075 -12.500 184 H GLY 23 H GLY 23 -33.422 -36.651 -13.710 185 HA2 GLY 23 HA2 GLY 23 -31.597 -37.684 -15.571 186 HA3 GLY 23 HA3 GLY 23 -33.215 -37.109 -15.949 187 H HIS 24 H HIS 24 -33.511 -34.988 -16.670 188 HA HIS 24 HA HIS 24 -31.275 -33.905 -18.098 189 HB2 HIS 24 HB2 HIS 24 -34.168 -33.155 -17.817 190 HB3 HIS 24 HB3 HIS 24 -33.037 -32.047 -18.588 191 HD1 HIS 24 HD1 HIS 24 -34.656 -35.401 -19.051 192 HD2 HIS 24 HD2 HIS 24 -32.225 -32.762 -21.147 193 HE1 HIS 24 HE1 HIS 24 -34.598 -36.269 -21.411 194 H SER 25 H SER 25 -30.156 -32.027 -17.735 195 HA SER 25 HA SER 25 -30.661 -30.688 -15.157 196 HB2 SER 25 HB2 SER 25 -28.568 -32.149 -15.308 197 HB3 SER 25 HB3 SER 25 -27.939 -30.946 -16.435 198 HG SER 25 HG SER 25 -27.277 -30.066 -14.625 199 H LYS 26 H LYS 26 -32.043 -29.336 -16.618 200 HA LYS 26 HA LYS 26 -30.485 -27.403 -18.184 201 HB2 LYS 26 HB2 LYS 26 -32.512 -28.608 -19.165 202 HB3 LYS 26 HB3 LYS 26 -33.490 -27.622 -18.087 203 HG2 LYS 26 HG2 LYS 26 -33.561 -26.391 -20.017 204 HG3 LYS 26 HG3 LYS 26 -32.197 -25.642 -19.185 205 HD2 LYS 26 HD2 LYS 26 -31.437 -25.960 -21.377 206 HD3 LYS 26 HD3 LYS 26 -30.737 -27.306 -20.473 207 HE2 LYS 26 HE2 LYS 26 -31.567 -28.279 -22.435 208 HE3 LYS 26 HE3 LYS 26 -32.783 -28.640 -21.211 209 HZ1 LYS 26 HZ1 LYS 26 -34.258 -27.137 -22.107 210 HZ2 LYS 26 HZ2 LYS 26 -33.515 -27.743 -23.501 211 HZ3 LYS 26 HZ3 LYS 26 -33.057 -26.235 -22.886 212 H LEU 27 H LEU 27 -30.122 -27.116 -15.508 213 HA LEU 27 HA LEU 27 -31.663 -24.678 -14.912 214 HB2 LEU 27 HB2 LEU 27 -30.792 -26.859 -13.032 215 HB3 LEU 27 HB3 LEU 27 -31.316 -25.269 -12.484 216 HG LEU 27 HG LEU 27 -33.483 -25.821 -13.821 217 HD11 LEU 27 HD11 LEU 27 -31.997 -28.299 -13.995 218 HD12 LEU 27 HD12 LEU 27 -33.465 -27.800 -14.834 219 HD13 LEU 27 HD13 LEU 27 -33.569 -28.524 -13.229 220 HD21 LEU 27 HD21 LEU 27 -34.466 -26.765 -11.835 221 HD22 LEU 27 HD22 LEU 27 -33.282 -25.543 -11.371 222 HD23 LEU 27 HD23 LEU 27 -32.880 -27.255 -11.238 223 H LYS 28 H LYS 28 -30.499 -23.281 -13.261 224 HA LYS 28 HA LYS 28 -28.058 -22.433 -14.266 225 HB2 LYS 28 HB2 LYS 28 -29.103 -22.047 -11.455 226 HB3 LYS 28 HB3 LYS 28 -27.857 -21.079 -12.234 227 HG2 LYS 28 HG2 LYS 28 -29.347 -19.932 -13.510 228 HG3 LYS 28 HG3 LYS 28 -30.485 -21.279 -13.590 229 HD2 LYS 28 HD2 LYS 28 -29.978 -19.823 -11.016 230 HD3 LYS 28 HD3 LYS 28 -31.130 -19.205 -12.203 231 HE2 LYS 28 HE2 LYS 28 -31.270 -22.044 -11.256 232 HE3 LYS 28 HE3 LYS 28 -31.983 -20.742 -10.306 233 HZ1 LYS 28 HZ1 LYS 28 -32.925 -20.237 -12.777 234 HZ2 LYS 28 HZ2 LYS 28 -33.764 -21.095 -11.585 235 HZ3 LYS 28 HZ3 LYS 28 -32.892 -21.929 -12.770 236 H ALA 29 H ALA 29 -26.102 -23.301 -14.201 237 HA ALA 29 HA ALA 29 -25.474 -25.203 -12.041 238 HB1 ALA 29 HB1 ALA 29 -25.285 -25.507 -14.794 239 HB2 ALA 29 HB2 ALA 29 -23.623 -25.248 -14.263 240 HB3 ALA 29 HB3 ALA 29 -24.578 -26.555 -13.564 241 H TRP 30 H TRP 30 -24.264 -22.431 -13.854 242 HA TRP 30 HA TRP 30 -22.063 -22.176 -11.915 243 HB2 TRP 30 HB2 TRP 30 -22.369 -21.222 -14.756 244 HB3 TRP 30 HB3 TRP 30 -21.149 -20.546 -13.680 245 HD1 TRP 30 HD1 TRP 30 -22.044 -23.773 -15.539 246 HE1 TRP 30 HE1 TRP 30 -19.959 -25.280 -15.618 247 HE3 TRP 30 HE3 TRP 30 -18.974 -21.070 -12.473 248 HZ2 TRP 30 HZ2 TRP 30 -17.357 -25.319 -14.523 249 HZ3 TRP 30 HZ3 TRP 30 -16.702 -21.911 -12.040 250 HH2 TRP 30 HH2 TRP 30 -15.914 -23.992 -13.044 251 H LYS 31 H LYS 31 -21.808 -20.327 -10.739 252 HA LYS 31 HA LYS 31 -24.028 -18.405 -10.869 253 HB2 LYS 31 HB2 LYS 31 -22.198 -19.232 -8.621 254 HB3 LYS 31 HB3 LYS 31 -23.216 -17.800 -8.525 255 HG2 LYS 31 HG2 LYS 31 -25.082 -19.564 -9.219 256 HG3 LYS 31 HG3 LYS 31 -23.950 -20.665 -8.429 257 HD2 LYS 31 HD2 LYS 31 -24.237 -19.698 -6.370 258 HD3 LYS 31 HD3 LYS 31 -24.644 -18.120 -7.048 259 HE2 LYS 31 HE2 LYS 31 -26.809 -19.092 -7.817 260 HE3 LYS 31 HE3 LYS 31 -26.398 -20.571 -6.949 261 HZ1 LYS 31 HZ1 LYS 31 -26.045 -18.593 -5.105 262 HZ2 LYS 31 HZ2 LYS 31 -27.378 -19.628 -5.208 263 HZ3 LYS 31 HZ3 LYS 31 -27.433 -18.104 -5.940 264 H LEU 32 H LEU 32 -23.668 -16.296 -11.264 265 HA LEU 32 HA LEU 32 -20.872 -15.380 -11.391 266 HB2 LEU 32 HB2 LEU 32 -21.723 -15.740 -13.638 267 HB3 LEU 32 HB3 LEU 32 -23.119 -14.723 -13.290 268 HG LEU 32 HG LEU 32 -21.163 -13.767 -14.688 269 HD11 LEU 32 HD11 LEU 32 -21.959 -12.048 -12.373 270 HD12 LEU 32 HD12 LEU 32 -23.160 -12.588 -13.547 271 HD13 LEU 32 HD13 LEU 32 -21.782 -11.621 -14.076 272 HD21 LEU 32 HD21 LEU 32 -20.006 -12.925 -12.093 273 HD22 LEU 32 HD22 LEU 32 -19.236 -13.127 -13.668 274 HD23 LEU 32 HD23 LEU 32 -19.605 -14.540 -12.677 275 H GLU 33 H GLU 33 -20.458 -13.674 -10.157 276 HA GLU 33 HA GLU 33 -22.655 -11.825 -9.516 277 HB2 GLU 33 HB2 GLU 33 -22.388 -13.169 -7.557 278 HB3 GLU 33 HB3 GLU 33 -20.637 -13.023 -7.620 279 HG2 GLU 33 HG2 GLU 33 -21.680 -11.642 -5.864 280 HG3 GLU 33 HG3 GLU 33 -20.745 -10.707 -7.028 281 H PHE 34 H PHE 34 -22.083 -10.076 -10.669 282 HA PHE 34 HA PHE 34 -19.310 -9.255 -10.857 283 HB2 PHE 34 HB2 PHE 34 -20.052 -7.636 -12.449 284 HB3 PHE 34 HB3 PHE 34 -20.937 -9.121 -12.783 285 HD1 PHE 34 HD2 PHE 34 -23.310 -9.322 -12.016 286 HD2 PHE 34 HD1 PHE 34 -21.170 -5.645 -11.898 287 HE1 PHE 34 HE2 PHE 34 -25.436 -8.095 -11.844 288 HE2 PHE 34 HE1 PHE 34 -23.292 -4.412 -11.725 289 HZ PHE 34 HZ PHE 34 -25.429 -5.637 -11.698 290 H GLU 35 H GLU 35 -18.404 -7.456 -9.941 291 HA GLU 35 HA GLU 35 -19.342 -6.588 -7.462 292 HB2 GLU 35 HB2 GLU 35 -17.233 -5.652 -9.353 293 HB3 GLU 35 HB3 GLU 35 -17.683 -4.594 -8.024 294 HG2 GLU 35 HG2 GLU 35 -16.663 -7.415 -7.797 295 HG3 GLU 35 HG3 GLU 35 -15.777 -5.939 -7.416 296 HA PRO 36 HA PRO 36 -22.221 -3.368 -8.222 297 HB2 PRO 36 HB2 PRO 36 -21.565 -1.537 -6.327 298 HB3 PRO 36 HB3 PRO 36 -22.349 -3.074 -5.947 299 HG2 PRO 36 HG2 PRO 36 -19.458 -2.323 -5.749 300 HG3 PRO 36 HG3 PRO 36 -20.456 -3.243 -4.607 301 HD2 PRO 36 HD2 PRO 36 -18.743 -4.434 -6.334 302 HD3 PRO 36 HD3 PRO 36 -20.261 -5.196 -5.816 303 H SER 37 H SER 37 -22.301 -1.924 -9.816 304 HA SER 37 HA SER 37 -19.919 -0.301 -10.377 305 HB2 SER 37 HB2 SER 37 -21.090 0.056 -12.621 306 HB3 SER 37 HB3 SER 37 -20.500 -1.574 -12.293 307 HG SER 37 HG SER 37 -22.661 -1.521 -13.120 308 H CYS 38 H CYS 38 -23.262 -0.141 -9.487 309 HA CYS 38 HA CYS 38 -24.603 1.576 -8.839 310 HB2 CYS 38 HB2 CYS 38 -22.113 3.288 -8.832 311 HB3 CYS 38 HB3 CYS 38 -23.597 3.554 -7.924 312 HG CYS 38 HG CYS 38 -22.959 2.178 -5.844 313 H THR 39 H THR 39 -24.240 1.054 -11.621 314 HA THR 39 HA THR 39 -24.406 3.731 -12.820 315 HB THR 39 HB THR 39 -22.808 2.157 -13.862 316 HG1 THR 39 HG1 THR 39 -23.951 3.775 -15.119 317 HG21 THR 39 HG21 THR 39 -25.167 0.576 -14.843 318 HG22 THR 39 HG22 THR 39 -24.321 0.138 -13.357 319 HG23 THR 39 HG23 THR 39 -23.455 0.155 -14.893 320 H GLN 40 H GLN 40 -26.159 4.330 -14.108 321 HA GLN 40 HA GLN 40 -28.673 3.220 -13.312 322 HB2 GLN 40 HB2 GLN 40 -28.097 5.284 -15.443 323 HB3 GLN 40 HB3 GLN 40 -29.661 4.954 -14.710 324 HG2 GLN 40 HG2 GLN 40 -28.643 5.609 -12.506 325 HG3 GLN 40 HG3 GLN 40 -27.241 6.171 -13.415 326 HE21 GLN 40 HE21 GLN 40 -30.382 6.884 -12.345 327 HE22 GLN 40 HE22 GLN 40 -30.561 8.412 -13.131 328 H TYR 41 H TYR 41 -28.686 1.090 -14.068 329 HA TYR 41 HA TYR 41 -28.492 0.653 -16.947 330 HB2 TYR 41 HB2 TYR 41 -27.492 -0.850 -15.032 331 HB3 TYR 41 HB3 TYR 41 -29.116 -1.529 -14.995 332 HD1 TYR 41 HD2 TYR 41 -26.194 -0.932 -17.199 333 HD2 TYR 41 HD1 TYR 41 -29.810 -3.095 -16.614 334 HE1 TYR 41 HE2 TYR 41 -25.623 -2.389 -19.096 335 HE2 TYR 41 HE1 TYR 41 -29.248 -4.560 -18.508 336 HH TYR 41 HH TYR 41 -26.131 -4.499 -20.015 337 H THR 42 H THR 42 -30.435 1.807 -17.477 338 HA THR 42 HA THR 42 -32.946 0.598 -16.588 339 HB THR 42 HB THR 42 -32.776 2.940 -18.460 340 HG1 THR 42 HG1 THR 42 -32.683 3.123 -15.618 341 HG21 THR 42 HG21 THR 42 -34.993 2.392 -18.226 342 HG22 THR 42 HG22 THR 42 -34.809 3.499 -16.865 343 HG23 THR 42 HG23 THR 42 -34.776 1.756 -16.596 344 H GLU 43 H GLU 43 -32.756 -1.372 -17.754 345 HA GLU 43 HA GLU 43 -34.002 -1.366 -20.273 346 HB2 GLU 43 HB2 GLU 43 -31.509 -0.638 -20.715 347 HB3 GLU 43 HB3 GLU 43 -31.196 -2.361 -20.553 348 HG2 GLU 43 HG2 GLU 43 -31.487 -1.742 -22.878 349 HG3 GLU 43 HG3 GLU 43 -32.770 -2.829 -22.350 350 HA PRO 44 HA PRO 44 -34.043 -5.287 -17.771 351 HB2 PRO 44 HB2 PRO 44 -36.750 -5.477 -17.671 352 HB3 PRO 44 HB3 PRO 44 -35.807 -4.554 -16.494 353 HG2 PRO 44 HG2 PRO 44 -37.311 -3.583 -18.893 354 HG3 PRO 44 HG3 PRO 44 -37.235 -2.888 -17.264 355 HD2 PRO 44 HD2 PRO 44 -35.780 -1.918 -19.331 356 HD3 PRO 44 HD3 PRO 44 -35.201 -1.878 -17.653 357 H LEU 45 H LEU 45 -33.542 -6.913 -19.106 358 HA LEU 45 HA LEU 45 -34.993 -7.245 -21.616 359 HB2 LEU 45 HB2 LEU 45 -32.420 -8.237 -20.505 360 HB3 LEU 45 HB3 LEU 45 -33.224 -9.208 -21.736 361 HG LEU 45 HG LEU 45 -32.719 -6.309 -22.249 362 HD11 LEU 45 HD11 LEU 45 -30.644 -8.184 -23.160 363 HD12 LEU 45 HD12 LEU 45 -30.640 -7.822 -21.435 364 HD13 LEU 45 HD13 LEU 45 -30.508 -6.513 -22.609 365 HD21 LEU 45 HD21 LEU 45 -34.090 -7.851 -23.735 366 HD22 LEU 45 HD22 LEU 45 -32.568 -8.655 -24.121 367 HD23 LEU 45 HD23 LEU 45 -32.789 -6.948 -24.510 368 H MET 46 H MET 46 -35.212 -9.732 -22.203 369 HA MET 46 HA MET 46 -36.222 -11.256 -19.926 370 HB2 MET 46 HB2 MET 46 -38.347 -11.729 -21.038 371 HB3 MET 46 HB3 MET 46 -38.159 -10.005 -20.753 372 HG2 MET 46 HG2 MET 46 -37.792 -9.546 -23.006 373 HG3 MET 46 HG3 MET 46 -37.418 -11.228 -23.380 374 HE1 MET 46 HE1 MET 46 -39.194 -12.129 -25.190 375 HE2 MET 46 HE2 MET 46 -38.971 -13.051 -23.703 376 HE3 MET 46 HE3 MET 46 -40.593 -12.800 -24.350 377 H ASN 47 H ASN 47 -36.825 -13.515 -20.591 378 HA ASN 47 HA ASN 47 -35.967 -14.596 -23.053 379 HB2 ASN 47 HB2 ASN 47 -33.897 -15.602 -22.521 380 HB3 ASN 47 HB3 ASN 47 -33.755 -13.945 -21.940 381 HD21 ASN 47 HD21 ASN 47 -35.157 -14.073 -19.591 382 HD22 ASN 47 HD22 ASN 47 -34.336 -15.118 -18.485 383 H TRP 48 H TRP 48 -35.489 -17.122 -22.643 384 HA TRP 48 HA TRP 48 -37.909 -18.165 -21.618 385 HB2 TRP 48 HB2 TRP 48 -35.370 -19.371 -22.659 386 HB3 TRP 48 HB3 TRP 48 -36.567 -20.399 -21.877 387 HD1 TRP 48 HD1 TRP 48 -37.587 -17.472 -24.138 388 HE1 TRP 48 HE1 TRP 48 -38.776 -18.421 -26.214 389 HE3 TRP 48 HE3 TRP 48 -36.775 -22.455 -23.332 390 HZ2 TRP 48 HZ2 TRP 48 -39.301 -20.947 -27.358 391 HZ3 TRP 48 HZ3 TRP 48 -37.654 -24.072 -24.965 392 HH2 TRP 48 HH2 TRP 48 -38.891 -23.332 -26.936 393 H THR 49 H THR 49 -34.557 -18.636 -20.486 394 HA THR 49 HA THR 49 -35.467 -19.737 -17.983 395 HB THR 49 HB THR 49 -33.002 -19.695 -17.402 396 HG1 THR 49 HG1 THR 49 -31.602 -18.902 -18.825 397 HG21 THR 49 HG21 THR 49 -32.644 -21.684 -18.483 398 HG22 THR 49 HG22 THR 49 -33.287 -21.093 -20.016 399 HG23 THR 49 HG23 THR 49 -34.386 -21.533 -18.709 400 H GLY 50 H GLY 50 -36.732 -17.836 -17.342 401 HA2 GLY 50 HA2 GLY 50 -35.836 -16.423 -15.260 402 HA3 GLY 50 HA3 GLY 50 -35.235 -15.456 -16.598 403 H SER 51 H SER 51 -38.295 -17.172 -15.966 404 HA SER 51 HA SER 51 -39.837 -15.089 -17.166 405 HB2 SER 51 HB2 SER 51 -40.764 -17.394 -15.435 406 HB3 SER 51 HB3 SER 51 -41.781 -16.404 -16.481 407 HG SER 51 HG SER 51 -39.561 -17.785 -17.527 408 H HIS 52 H HIS 52 -38.814 -15.851 -13.930 409 HA HIS 52 HA HIS 52 -40.662 -14.463 -12.403 410 HB2 HIS 52 HB2 HIS 52 -37.754 -15.087 -12.046 411 HB3 HIS 52 HB3 HIS 52 -38.564 -14.040 -10.886 412 HD1 HIS 52 HD1 HIS 52 -39.462 -17.384 -12.490 413 HD2 HIS 52 HD2 HIS 52 -39.358 -15.515 -8.781 414 HE1 HIS 52 HE1 HIS 52 -40.294 -19.098 -10.850 415 H ASP 53 H ASP 53 -40.265 -12.376 -11.226 416 HA ASP 53 HA ASP 53 -40.226 -10.231 -12.991 417 HB2 ASP 53 HB2 ASP 53 -39.999 -8.804 -10.969 418 HB3 ASP 53 HB3 ASP 53 -41.243 -10.040 -10.800 419 H THR 54 H THR 54 -38.704 -8.786 -13.668 420 HA THR 54 HA THR 54 -35.920 -9.606 -13.303 421 HB THR 54 HB THR 54 -36.770 -7.409 -15.159 422 HG1 THR 54 HG1 THR 54 -38.162 -9.206 -15.567 423 HG21 THR 54 HG21 THR 54 -34.797 -7.836 -16.256 424 HG22 THR 54 HG22 THR 54 -34.773 -9.534 -15.780 425 HG23 THR 54 HG23 THR 54 -34.340 -8.283 -14.614 426 H LYS 55 H LYS 55 -37.081 -8.387 -11.074 427 HA LYS 55 HA LYS 55 -36.782 -5.641 -10.834 428 HB2 LYS 55 HB2 LYS 55 -36.635 -5.991 -8.449 429 HB3 LYS 55 HB3 LYS 55 -37.799 -7.125 -9.122 430 HG2 LYS 55 HG2 LYS 55 -36.223 -8.924 -8.974 431 HG3 LYS 55 HG3 LYS 55 -34.938 -7.815 -8.489 432 HD2 LYS 55 HD2 LYS 55 -37.463 -8.084 -6.889 433 HD3 LYS 55 HD3 LYS 55 -36.106 -9.190 -6.659 434 HE2 LYS 55 HE2 LYS 55 -34.649 -7.355 -6.098 435 HE3 LYS 55 HE3 LYS 55 -35.914 -6.187 -6.473 436 HZ1 LYS 55 HZ1 LYS 55 -36.499 -6.311 -4.353 437 HZ2 LYS 55 HZ2 LYS 55 -35.443 -7.598 -4.058 438 HZ3 LYS 55 HZ3 LYS 55 -37.010 -7.903 -4.619 439 H GLN 56 H GLN 56 -35.051 -4.642 -9.304 440 HA GLN 56 HA GLN 56 -32.556 -4.821 -10.661 441 HB2 GLN 56 HB2 GLN 56 -33.574 -2.759 -9.556 442 HB3 GLN 56 HB3 GLN 56 -33.032 -3.437 -8.027 443 HG2 GLN 56 HG2 GLN 56 -30.756 -3.286 -8.665 444 HG3 GLN 56 HG3 GLN 56 -31.183 -2.914 -10.335 445 HE21 GLN 56 HE21 GLN 56 -31.013 -1.698 -7.077 446 HE22 GLN 56 HE22 GLN 56 -31.146 -0.023 -7.483 447 H GLN 57 H GLN 57 -31.667 -6.845 -10.417 448 HA GLN 57 HA GLN 57 -31.052 -7.710 -7.676 449 HB2 GLN 57 HB2 GLN 57 -31.434 -9.176 -10.256 450 HB3 GLN 57 HB3 GLN 57 -30.421 -9.887 -9.007 451 HG2 GLN 57 HG2 GLN 57 -32.173 -10.256 -7.596 452 HG3 GLN 57 HG3 GLN 57 -33.118 -8.914 -8.238 453 HE21 GLN 57 HE21 GLN 57 -32.044 -12.197 -8.847 454 HE22 GLN 57 HE22 GLN 57 -33.319 -12.614 -9.935 455 H VAL 58 H VAL 58 -28.929 -8.709 -7.319 456 HA VAL 58 HA VAL 58 -26.850 -7.381 -8.931 457 HB VAL 58 HB VAL 58 -25.414 -7.650 -6.862 458 HG11 VAL 58 HG11 VAL 58 -26.203 -5.485 -7.420 459 HG12 VAL 58 HG12 VAL 58 -27.833 -5.857 -6.856 460 HG13 VAL 58 HG13 VAL 58 -26.511 -5.702 -5.698 461 HG21 VAL 58 HG21 VAL 58 -26.755 -9.331 -5.723 462 HG22 VAL 58 HG22 VAL 58 -26.594 -7.888 -4.722 463 HG23 VAL 58 HG23 VAL 58 -28.098 -8.195 -5.592 464 H CYS 59 H CYS 59 -27.931 -10.376 -7.514 465 HA CYS 59 HA CYS 59 -25.507 -11.783 -8.293 466 HB2 CYS 59 HB2 CYS 59 -28.048 -12.767 -6.978 467 HB3 CYS 59 HB3 CYS 59 -26.630 -13.760 -7.290 468 HG CYS 59 HG CYS 59 -27.224 -12.410 -4.563 469 H LEU 60 H LEU 60 -25.272 -12.950 -10.097 470 HA LEU 60 HA LEU 60 -27.640 -13.299 -11.816 471 HB2 LEU 60 HB2 LEU 60 -24.838 -12.542 -12.354 472 HB3 LEU 60 HB3 LEU 60 -25.579 -13.643 -13.516 473 HG LEU 60 HG LEU 60 -26.621 -10.911 -12.766 474 HD11 LEU 60 HD11 LEU 60 -26.053 -10.693 -15.346 475 HD12 LEU 60 HD12 LEU 60 -24.849 -11.911 -14.924 476 HD13 LEU 60 HD13 LEU 60 -24.859 -10.356 -14.092 477 HD21 LEU 60 HD21 LEU 60 -28.042 -11.353 -14.842 478 HD22 LEU 60 HD22 LEU 60 -28.495 -12.186 -13.355 479 HD23 LEU 60 HD23 LEU 60 -27.620 -13.051 -14.619 480 H SER 61 H SER 61 -27.969 -15.260 -12.864 481 HA SER 61 HA SER 61 -26.271 -17.494 -11.971 482 HB2 SER 61 HB2 SER 61 -29.238 -17.790 -12.397 483 HB3 SER 61 HB3 SER 61 -28.141 -18.849 -11.511 484 HG SER 61 HG SER 61 -29.033 -16.265 -10.758 485 H PHE 62 H PHE 62 -25.396 -18.571 -13.600 486 HA PHE 62 HA PHE 62 -26.754 -18.511 -16.215 487 HB2 PHE 62 HB2 PHE 62 -23.804 -18.537 -15.564 488 HB3 PHE 62 HB3 PHE 62 -24.441 -18.835 -17.179 489 HD1 PHE 62 HD2 PHE 62 -25.710 -17.029 -18.344 490 HD2 PHE 62 HD1 PHE 62 -23.586 -16.353 -14.718 491 HE1 PHE 62 HE2 PHE 62 -25.751 -14.607 -18.776 492 HE2 PHE 62 HE1 PHE 62 -23.623 -13.930 -15.144 493 HZ PHE 62 HZ PHE 62 -24.707 -13.054 -17.175 494 H THR 63 H THR 63 -26.912 -20.397 -17.385 495 HA THR 63 HA THR 63 -26.967 -22.820 -15.915 496 HB THR 63 HB THR 63 -27.024 -22.637 -18.923 497 HG1 THR 63 HG1 THR 63 -29.048 -21.894 -18.821 498 HG21 THR 63 HG21 THR 63 -27.261 -24.852 -18.604 499 HG22 THR 63 HG22 THR 63 -28.911 -24.443 -18.131 500 HG23 THR 63 HG23 THR 63 -27.669 -24.660 -16.899 501 H THR 64 H THR 64 -24.876 -21.693 -18.567 502 HA THR 64 HA THR 64 -22.951 -23.798 -17.828 503 HB THR 64 HB THR 64 -22.062 -23.095 -20.254 504 HG1 THR 64 HG1 THR 64 -23.921 -22.753 -21.598 505 HG21 THR 64 HG21 THR 64 -22.801 -25.354 -19.381 506 HG22 THR 64 HG22 THR 64 -23.066 -25.072 -21.102 507 HG23 THR 64 HG23 THR 64 -24.414 -24.956 -19.970 508 H ARG 65 H ARG 65 -20.655 -23.238 -18.182 509 HA ARG 65 HA ARG 65 -19.989 -20.832 -16.852 510 HB2 ARG 65 HB2 ARG 65 -17.637 -21.466 -17.385 511 HB3 ARG 65 HB3 ARG 65 -18.561 -22.753 -16.620 512 HG2 ARG 65 HG2 ARG 65 -18.995 -23.365 -19.192 513 HG3 ARG 65 HG3 ARG 65 -17.414 -22.592 -19.330 514 HD2 ARG 65 HD2 ARG 65 -16.359 -24.245 -18.201 515 HD3 ARG 65 HD3 ARG 65 -17.729 -24.531 -17.128 516 HE ARG 65 HE ARG 65 -18.475 -25.411 -19.650 517 HH11 ARG 65 HH11 ARG 65 -16.086 -26.189 -17.240 518 HH12 ARG 65 HH12 ARG 65 -15.998 -27.862 -17.678 519 HH21 ARG 65 HH21 ARG 65 -18.368 -27.614 -20.237 520 HH22 ARG 65 HH22 ARG 65 -17.296 -28.671 -19.384 521 H GLU 66 H GLU 66 -19.644 -21.861 -20.236 522 HA GLU 66 HA GLU 66 -18.345 -19.658 -21.269 523 HB2 GLU 66 HB2 GLU 66 -20.424 -21.469 -22.481 524 HB3 GLU 66 HB3 GLU 66 -19.638 -20.199 -23.409 525 HG2 GLU 66 HG2 GLU 66 -17.446 -21.319 -22.569 526 HG3 GLU 66 HG3 GLU 66 -18.490 -22.711 -22.287 527 H LEU 67 H LEU 67 -21.680 -19.993 -20.303 528 HA LEU 67 HA LEU 67 -22.674 -17.679 -21.612 529 HB2 LEU 67 HB2 LEU 67 -23.622 -19.562 -19.550 530 HB3 LEU 67 HB3 LEU 67 -24.346 -17.955 -19.517 531 HG LEU 67 HG LEU 67 -24.348 -19.811 -21.897 532 HD11 LEU 67 HD11 LEU 67 -25.924 -20.877 -20.712 533 HD12 LEU 67 HD12 LEU 67 -26.938 -19.503 -21.149 534 HD13 LEU 67 HD13 LEU 67 -26.128 -19.539 -19.582 535 HD21 LEU 67 HD21 LEU 67 -26.222 -18.115 -22.522 536 HD22 LEU 67 HD22 LEU 67 -24.532 -17.705 -22.816 537 HD23 LEU 67 HD23 LEU 67 -25.368 -17.046 -21.409 538 H ALA 68 H ALA 68 -21.294 -18.271 -18.420 539 HA ALA 68 HA ALA 68 -21.832 -15.695 -17.362 540 HB1 ALA 68 HB1 ALA 68 -20.993 -16.549 -15.481 541 HB2 ALA 68 HB2 ALA 68 -20.848 -18.069 -16.363 542 HB3 ALA 68 HB3 ALA 68 -19.469 -16.975 -16.259 543 H ILE 69 H ILE 69 -18.723 -17.109 -18.410 544 HA ILE 69 HA ILE 69 -17.216 -14.790 -18.328 545 HB ILE 69 HB ILE 69 -16.918 -17.089 -20.264 546 HG12 ILE 69 HG12 ILE 69 -14.969 -17.305 -18.316 547 HG13 ILE 69 HG13 ILE 69 -16.379 -16.771 -17.406 548 HG21 ILE 69 HG21 ILE 69 -15.143 -14.782 -19.561 549 HG22 ILE 69 HG22 ILE 69 -14.464 -16.308 -20.125 550 HG23 ILE 69 HG23 ILE 69 -15.580 -15.407 -21.151 551 HD11 ILE 69 HD11 ILE 69 -17.235 -18.806 -17.465 552 HD12 ILE 69 HD12 ILE 69 -17.129 -18.848 -19.225 553 HD13 ILE 69 HD13 ILE 69 -15.755 -19.364 -18.247 554 H ALA 70 H ALA 70 -19.395 -15.948 -20.820 555 HA ALA 70 HA ALA 70 -18.645 -14.283 -22.929 556 HB1 ALA 70 HB1 ALA 70 -20.129 -15.875 -23.615 557 HB2 ALA 70 HB2 ALA 70 -21.140 -15.712 -22.179 558 HB3 ALA 70 HB3 ALA 70 -21.223 -14.500 -23.457 559 H TYR 71 H TYR 71 -20.314 -13.567 -19.992 560 HA TYR 71 HA TYR 71 -21.448 -11.085 -20.936 561 HB2 TYR 71 HB2 TYR 71 -22.505 -12.482 -19.146 562 HB3 TYR 71 HB3 TYR 71 -21.163 -12.062 -18.088 563 HD1 TYR 71 HD2 TYR 71 -23.260 -10.049 -20.439 564 HD2 TYR 71 HD1 TYR 71 -21.901 -10.617 -16.448 565 HE1 TYR 71 HE2 TYR 71 -24.449 -8.009 -19.751 566 HE2 TYR 71 HE1 TYR 71 -23.087 -8.579 -15.748 567 HH TYR 71 HH TYR 71 -23.874 -6.392 -16.979 568 H ALA 72 H ALA 72 -18.774 -12.061 -18.819 569 HA ALA 72 HA ALA 72 -17.924 -9.431 -18.197 570 HB1 ALA 72 HB1 ALA 72 -17.324 -11.869 -17.217 571 HB2 ALA 72 HB2 ALA 72 -15.885 -11.556 -18.187 572 HB3 ALA 72 HB3 ALA 72 -16.357 -10.425 -16.918 573 H VAL 73 H VAL 73 -16.560 -11.853 -20.436 574 HA VAL 73 HA VAL 73 -14.537 -10.335 -21.535 575 HB VAL 73 HB VAL 73 -16.267 -12.355 -22.969 576 HG11 VAL 73 HG11 VAL 73 -13.517 -11.311 -23.641 577 HG12 VAL 73 HG12 VAL 73 -14.352 -12.621 -24.477 578 HG13 VAL 73 HG13 VAL 73 -15.002 -10.983 -24.533 579 HG21 VAL 73 HG21 VAL 73 -13.592 -12.784 -21.657 580 HG22 VAL 73 HG22 VAL 73 -15.128 -13.112 -20.856 581 HG23 VAL 73 HG23 VAL 73 -14.683 -14.003 -22.313 582 H ALA 74 H ALA 74 -17.968 -10.188 -22.144 583 HA ALA 74 HA ALA 74 -18.053 -8.859 -24.574 584 HB1 ALA 74 HB1 ALA 74 -19.899 -9.606 -22.682 585 HB2 ALA 74 HB2 ALA 74 -20.006 -7.845 -22.662 586 HB3 ALA 74 HB3 ALA 74 -20.247 -8.726 -24.171 587 H HIS 75 H HIS 75 -17.164 -7.673 -21.424 588 HA HIS 75 HA HIS 75 -16.678 -5.022 -22.611 589 HB2 HIS 75 HB2 HIS 75 -17.982 -5.745 -20.023 590 HB3 HIS 75 HB3 HIS 75 -17.004 -4.283 -20.089 591 HD1 HIS 75 HD1 HIS 75 -20.266 -4.709 -19.886 592 HD2 HIS 75 HD2 HIS 75 -18.023 -3.233 -23.056 593 HE1 HIS 75 HE1 HIS 75 -21.858 -3.313 -21.242 594 H LYS 76 H LYS 76 -14.967 -7.433 -22.201 595 HA LYS 76 HA LYS 76 -12.876 -7.983 -21.480 596 HB2 LYS 76 HB2 LYS 76 -12.658 -5.673 -22.752 597 HB3 LYS 76 HB3 LYS 76 -12.212 -5.090 -21.153 598 HG2 LYS 76 HG2 LYS 76 -10.184 -5.611 -22.173 599 HG3 LYS 76 HG3 LYS 76 -10.512 -6.993 -21.124 600 HD2 LYS 76 HD2 LYS 76 -9.847 -7.985 -23.121 601 HD3 LYS 76 HD3 LYS 76 -11.609 -8.036 -23.214 602 HE2 LYS 76 HE2 LYS 76 -10.936 -7.280 -25.322 603 HE3 LYS 76 HE3 LYS 76 -11.424 -5.817 -24.470 604 HZ1 LYS 76 HZ1 LYS 76 -9.093 -6.118 -25.759 605 HZ2 LYS 76 HZ2 LYS 76 -8.634 -6.511 -24.180 606 HZ3 LYS 76 HZ3 LYS 76 -9.349 -5.013 -24.504 607 H ILE 77 H ILE 77 -14.706 -8.059 -19.437 608 HA ILE 77 HA ILE 77 -13.529 -6.684 -17.151 609 HB ILE 77 HB ILE 77 -15.937 -8.500 -17.291 610 HG12 ILE 77 HG12 ILE 77 -15.825 -5.496 -16.976 611 HG13 ILE 77 HG13 ILE 77 -16.118 -6.309 -18.509 612 HG21 ILE 77 HG21 ILE 77 -14.468 -7.307 -15.062 613 HG22 ILE 77 HG22 ILE 77 -16.203 -6.994 -15.032 614 HG23 ILE 77 HG23 ILE 77 -15.607 -8.652 -15.081 615 HD11 ILE 77 HD11 ILE 77 -18.260 -5.929 -17.897 616 HD12 ILE 77 HD12 ILE 77 -18.025 -7.469 -17.069 617 HD13 ILE 77 HD13 ILE 77 -17.891 -5.957 -16.173 618 H ASP 78 H ASP 78 -12.511 -7.685 -15.459 619 HA ASP 78 HA ASP 78 -11.204 -10.156 -16.008 620 HB2 ASP 78 HB2 ASP 78 -11.228 -8.219 -13.732 621 HB3 ASP 78 HB3 ASP 78 -10.555 -9.827 -13.470 622 H TYR 79 H TYR 79 -12.454 -11.936 -16.076 623 HA TYR 79 HA TYR 79 -14.388 -12.393 -13.922 624 HB2 TYR 79 HB2 TYR 79 -15.277 -14.181 -15.356 625 HB3 TYR 79 HB3 TYR 79 -15.232 -12.641 -16.206 626 HD1 TYR 79 HD1 TYR 79 -13.761 -15.993 -15.973 627 HD2 TYR 79 HD2 TYR 79 -13.742 -12.297 -18.080 628 HE1 TYR 79 HE1 TYR 79 -12.480 -17.043 -17.791 629 HE2 TYR 79 HE2 TYR 79 -12.461 -13.337 -19.905 630 HH TYR 79 HH TYR 79 -10.741 -15.668 -19.847 631 H THR 80 H THR 80 -14.136 -13.949 -12.428 632 HA THR 80 HA THR 80 -11.779 -15.703 -12.677 633 HB THR 80 HB THR 80 -11.427 -14.132 -10.878 634 HG1 THR 80 HG1 THR 80 -10.658 -15.735 -9.741 635 HG21 THR 80 HG21 THR 80 -14.225 -14.418 -10.489 636 HG22 THR 80 HG22 THR 80 -13.116 -13.310 -9.683 637 HG23 THR 80 HG23 THR 80 -13.422 -14.906 -8.998 638 H VAL 81 H VAL 81 -12.223 -17.791 -12.858 639 HA VAL 81 HA VAL 81 -14.886 -18.758 -12.134 640 HB VAL 81 HB VAL 81 -14.228 -20.819 -13.359 641 HG11 VAL 81 HG11 VAL 81 -14.436 -19.879 -15.554 642 HG12 VAL 81 HG12 VAL 81 -15.398 -18.905 -14.442 643 HG13 VAL 81 HG13 VAL 81 -13.830 -18.320 -14.996 644 HG21 VAL 81 HG21 VAL 81 -11.635 -19.640 -13.145 645 HG22 VAL 81 HG22 VAL 81 -12.080 -21.236 -13.751 646 HG23 VAL 81 HG23 VAL 81 -12.034 -19.857 -14.849 647 H LEU 82 H LEU 82 -15.236 -19.874 -10.334 648 HA LEU 82 HA LEU 82 -12.919 -20.999 -8.911 649 HB2 LEU 82 HB2 LEU 82 -14.048 -19.278 -7.657 650 HB3 LEU 82 HB3 LEU 82 -15.601 -20.079 -7.888 651 HG LEU 82 HG LEU 82 -14.681 -22.001 -6.538 652 HD11 LEU 82 HD11 LEU 82 -12.345 -20.262 -6.598 653 HD12 LEU 82 HD12 LEU 82 -12.474 -21.979 -6.215 654 HD13 LEU 82 HD13 LEU 82 -12.793 -20.771 -4.970 655 HD21 LEU 82 HD21 LEU 82 -15.562 -21.104 -4.659 656 HD22 LEU 82 HD22 LEU 82 -16.029 -19.817 -5.769 657 HD23 LEU 82 HD23 LEU 82 -14.588 -19.638 -4.767 658 H GLN 83 H GLN 83 -12.727 -23.124 -9.109 659 HA GLN 83 HA GLN 83 -15.136 -24.742 -9.539 660 HB2 GLN 83 HB2 GLN 83 -12.268 -25.041 -10.281 661 HB3 GLN 83 HB3 GLN 83 -13.194 -26.507 -9.990 662 HG2 GLN 83 HG2 GLN 83 -14.897 -25.538 -11.631 663 HG3 GLN 83 HG3 GLN 83 -13.621 -24.409 -12.083 664 HE21 GLN 83 HE21 GLN 83 -13.825 -25.390 -14.194 665 HE22 GLN 83 HE22 GLN 83 -12.988 -26.863 -14.531 666 H ASP 84 H ASP 84 -15.314 -26.806 -8.440 667 HA ASP 84 HA ASP 84 -14.908 -26.577 -5.653 668 HB2 ASP 84 HB2 ASP 84 -15.721 -28.913 -7.387 669 HB3 ASP 84 HB3 ASP 84 -15.663 -28.993 -5.628 670 H ASN 85 H ASN 85 -13.160 -28.255 -8.200 671 HA ASN 85 HA ASN 85 -10.795 -28.395 -6.604 672 HB2 ASN 85 HB2 ASN 85 -11.657 -30.320 -5.585 673 HB3 ASN 85 HB3 ASN 85 -12.419 -30.880 -7.071 674 HD21 ASN 85 HD21 ASN 85 -9.750 -31.129 -5.053 675 HD22 ASN 85 HD22 ASN 85 -8.733 -32.068 -6.090 676 HA PRO 86 HA PRO 86 -9.078 -28.257 -10.656 677 HB2 PRO 86 HB2 PRO 86 -6.527 -28.973 -10.062 678 HB3 PRO 86 HB3 PRO 86 -7.197 -27.386 -9.664 679 HG2 PRO 86 HG2 PRO 86 -6.848 -29.789 -7.912 680 HG3 PRO 86 HG3 PRO 86 -6.523 -28.083 -7.551 681 HD2 PRO 86 HD2 PRO 86 -8.768 -29.346 -6.717 682 HD3 PRO 86 HD3 PRO 86 -8.741 -27.619 -7.127 683 H ARG 87 H ARG 87 -9.746 -29.797 -12.040 684 HA ARG 87 HA ARG 87 -9.794 -32.531 -11.662 685 HB2 ARG 87 HB2 ARG 87 -11.007 -31.515 -13.479 686 HB3 ARG 87 HB3 ARG 87 -9.515 -30.951 -14.221 687 HG2 ARG 87 HG2 ARG 87 -10.338 -32.853 -15.430 688 HG3 ARG 87 HG3 ARG 87 -8.853 -33.301 -14.589 689 HD2 ARG 87 HD2 ARG 87 -10.354 -35.095 -14.264 690 HD3 ARG 87 HD3 ARG 87 -10.323 -34.203 -12.743 691 HE ARG 87 HE ARG 87 -12.421 -33.109 -14.033 692 HH11 ARG 87 HH11 ARG 87 -11.512 -36.400 -13.358 693 HH12 ARG 87 HH12 ARG 87 -13.145 -36.974 -13.285 694 HH21 ARG 87 HH21 ARG 87 -14.576 -33.851 -13.938 695 HH22 ARG 87 HH22 ARG 87 -14.887 -35.523 -13.616 696 H THR 88 H THR 88 -7.382 -30.772 -13.619 697 HA THR 88 HA THR 88 -5.344 -32.679 -12.730 698 HB THR 88 HB THR 88 -6.159 -33.554 -14.874 699 HG1 THR 88 HG1 THR 88 -4.152 -34.000 -15.424 700 HG21 THR 88 HG21 THR 88 -6.653 -31.045 -15.627 701 HG22 THR 88 HG22 THR 88 -6.369 -32.336 -16.792 702 HG23 THR 88 HG23 THR 88 -5.064 -31.231 -16.365 703 H ILE 89 H ILE 89 -3.363 -31.797 -12.431 704 HA ILE 89 HA ILE 89 -2.908 -29.063 -13.416 705 HB ILE 89 HB ILE 89 -1.812 -28.478 -11.298 706 HG12 ILE 89 HG12 ILE 89 -2.623 -30.157 -9.367 707 HG13 ILE 89 HG13 ILE 89 -2.463 -31.313 -10.686 708 HG21 ILE 89 HG21 ILE 89 -4.626 -29.456 -10.843 709 HG22 ILE 89 HG22 ILE 89 -3.805 -28.147 -9.995 710 HG23 ILE 89 HG23 ILE 89 -4.209 -27.974 -11.703 711 HD11 ILE 89 HD11 ILE 89 -0.425 -30.006 -9.098 712 HD12 ILE 89 HD12 ILE 89 -0.326 -31.448 -10.109 713 HD13 ILE 89 HD13 ILE 89 -0.135 -29.851 -10.830 714 H VAL 90 H VAL 90 -0.829 -28.567 -14.019 715 HA VAL 90 HA VAL 90 1.235 -28.985 -14.892 716 HB VAL 90 HB VAL 90 1.538 -30.695 -12.420 717 HG11 VAL 90 HG11 VAL 90 3.977 -29.873 -12.762 718 HG12 VAL 90 HG12 VAL 90 3.374 -31.224 -13.726 719 HG13 VAL 90 HG13 VAL 90 3.467 -29.609 -14.429 720 HG21 VAL 90 HG21 VAL 90 1.588 -28.840 -11.197 721 HG22 VAL 90 HG22 VAL 90 2.777 -28.108 -12.273 722 HG23 VAL 90 HG23 VAL 90 1.056 -27.941 -12.617 723 HA PRO 91 HA PRO 91 -0.115 -33.071 -16.641 724 HB2 PRO 91 HB2 PRO 91 -0.094 -32.236 -19.224 725 HB3 PRO 91 HB3 PRO 91 -1.496 -32.047 -18.164 726 HG2 PRO 91 HG2 PRO 91 0.597 -30.043 -18.912 727 HG3 PRO 91 HG3 PRO 91 -1.159 -29.833 -18.790 728 HD2 PRO 91 HD2 PRO 91 0.542 -29.031 -16.842 729 HD3 PRO 91 HD3 PRO 91 -1.100 -29.611 -16.497 730 H LYS 92 H LYS 92 1.118 -34.542 -17.880 731 HA LYS 92 HA LYS 92 3.887 -34.373 -17.597 732 HB2 LYS 92 HB2 LYS 92 2.804 -36.515 -17.818 733 HB3 LYS 92 HB3 LYS 92 2.209 -36.100 -19.421 734 HG2 LYS 92 HG2 LYS 92 4.428 -36.146 -20.324 735 HG3 LYS 92 HG3 LYS 92 5.122 -36.364 -18.716 736 HD2 LYS 92 HD2 LYS 92 4.129 -38.540 -18.517 737 HD3 LYS 92 HD3 LYS 92 3.222 -38.313 -20.014 738 HE2 LYS 92 HE2 LYS 92 5.027 -39.652 -20.643 739 HE3 LYS 92 HE3 LYS 92 5.510 -38.029 -21.131 740 HZ1 LYS 92 HZ1 LYS 92 6.355 -38.440 -18.497 741 HZ2 LYS 92 HZ2 LYS 92 7.305 -38.226 -19.878 742 HZ3 LYS 92 HZ3 LYS 92 6.839 -39.782 -19.405 743 H SER 93 H SER 93 2.180 -34.469 -20.727 744 HA SER 93 HA SER 93 3.422 -32.160 -21.772 745 HB2 SER 93 HB2 SER 93 4.926 -33.283 -23.424 746 HB3 SER 93 HB3 SER 93 5.462 -33.466 -21.754 747 HG SER 93 HG SER 93 4.311 -35.368 -23.476 748 H TYR 94 H TYR 94 3.254 -32.204 -24.295 749 HA TYR 94 HA TYR 94 1.397 -33.948 -25.518 750 HB2 TYR 94 HB2 TYR 94 -0.278 -32.912 -24.150 751 HB3 TYR 94 HB3 TYR 94 0.325 -31.302 -24.527 752 HD1 TYR 94 HD2 TYR 94 -1.368 -34.261 -25.984 753 HD2 TYR 94 HD1 TYR 94 -0.459 -30.128 -26.416 754 HE1 TYR 94 HE2 TYR 94 -2.951 -34.115 -27.860 755 HE2 TYR 94 HE1 TYR 94 -2.041 -29.968 -28.292 756 HH TYR 94 HH TYR 94 -3.813 -32.823 -29.446 757 H ALA 95 H ALA 95 1.835 -33.876 -27.616 758 HA ALA 95 HA ALA 95 3.322 -31.609 -28.681 759 HB1 ALA 95 HB1 ALA 95 3.704 -34.238 -29.022 760 HB2 ALA 95 HB2 ALA 95 2.682 -33.909 -30.423 761 HB3 ALA 95 HB3 ALA 95 4.196 -33.031 -30.210 762 H ASP 96 H ASP 96 2.755 -30.632 -30.721 763 HA ASP 96 HA ASP 96 -0.050 -30.902 -31.520 764 HB2 ASP 96 HB2 ASP 96 -0.117 -28.342 -31.676 765 HB3 ASP 96 HB3 ASP 96 -0.238 -29.055 -30.070 766 H ASN 97 H ASN 97 0.064 -31.460 -33.590 767 HA ASN 97 HA ASN 97 1.410 -29.745 -35.474 768 HB2 ASN 97 HB2 ASN 97 2.726 -31.598 -36.502 769 HB3 ASN 97 HB3 ASN 97 3.279 -31.162 -34.888 770 HD21 ASN 97 HD21 ASN 97 2.680 -33.682 -36.854 771 HD22 ASN 97 HD22 ASN 97 2.365 -34.913 -35.683 772 H PHE 98 H PHE 98 0.834 -30.203 -37.679 773 HA PHE 98 HA PHE 98 -1.460 -32.024 -37.966 774 HB2 PHE 98 HB2 PHE 98 -2.055 -29.538 -37.805 775 HB3 PHE 98 HB3 PHE 98 -1.288 -29.369 -39.381 776 HD1 PHE 98 HD2 PHE 98 -3.732 -31.682 -37.759 777 HD2 PHE 98 HD1 PHE 98 -2.717 -29.338 -41.163 778 HE1 PHE 98 HE2 PHE 98 -5.831 -32.363 -38.847 779 HE2 PHE 98 HE1 PHE 98 -4.815 -30.013 -42.257 780 HZ PHE 98 HZ PHE 98 -6.374 -31.529 -41.100 781 H THR 99 H THR 99 -1.059 -33.527 -39.434 782 HA THR 99 HA THR 99 0.327 -32.809 -41.902 783 HB THR 99 HB THR 99 2.161 -33.616 -40.586 784 HG1 THR 99 HG1 THR 99 2.704 -35.491 -41.833 785 HG21 THR 99 HG21 THR 99 0.170 -35.353 -39.464 786 HG22 THR 99 HG22 THR 99 1.796 -35.001 -38.879 787 HG23 THR 99 HG23 THR 99 1.539 -36.304 -40.037 788 H LYS 100 H LYS 100 -0.736 -33.604 -43.588 789 HA LYS 100 HA LYS 100 -3.064 -35.079 -43.451 790 HB2 LYS 100 HB2 LYS 100 -2.560 -35.634 -45.902 791 HB3 LYS 100 HB3 LYS 100 -2.668 -33.935 -45.462 792 HG2 LYS 100 HG2 LYS 100 -0.361 -33.625 -45.617 793 HG3 LYS 100 HG3 LYS 100 -0.033 -35.358 -45.546 794 HD2 LYS 100 HD2 LYS 100 0.283 -34.851 -47.794 795 HD3 LYS 100 HD3 LYS 100 -1.369 -35.470 -47.752 796 HE2 LYS 100 HE2 LYS 100 -2.122 -33.065 -47.536 797 HE3 LYS 100 HE3 LYS 100 -0.462 -32.603 -47.913 798 HZ1 LYS 100 HZ1 LYS 100 -1.712 -32.573 -49.918 799 HZ2 LYS 100 HZ2 LYS 100 -2.336 -34.120 -49.642 800 HZ3 LYS 100 HZ3 LYS 100 -0.692 -33.921 -49.991 801 HA PRO 101 HA PRO 101 -2.002 -39.294 -42.847 802 HB2 PRO 101 HB2 PRO 101 -3.840 -40.553 -44.399 803 HB3 PRO 101 HB3 PRO 101 -4.254 -39.753 -42.879 804 HG2 PRO 101 HG2 PRO 101 -4.550 -38.757 -45.687 805 HG3 PRO 101 HG3 PRO 101 -5.685 -38.633 -44.330 806 HD2 PRO 101 HD2 PRO 101 -4.095 -36.577 -45.091 807 HD3 PRO 101 HD3 PRO 101 -4.577 -36.838 -43.402 808 H ARG 102 H ARG 102 -2.245 -38.143 -46.160 809 HA ARG 102 HA ARG 102 -1.114 -38.672 -48.060 810 HB2 ARG 102 HB2 ARG 102 0.807 -38.367 -46.374 811 HB3 ARG 102 HB3 ARG 102 0.898 -40.123 -46.358 812 HG2 ARG 102 HG2 ARG 102 2.470 -39.597 -47.941 813 HG3 ARG 102 HG3 ARG 102 1.044 -39.861 -48.946 814 HD2 ARG 102 HD2 ARG 102 0.660 -37.511 -49.140 815 HD3 ARG 102 HD3 ARG 102 1.897 -37.155 -47.935 816 HE ARG 102 HE ARG 102 3.459 -37.272 -49.591 817 HH11 ARG 102 HH11 ARG 102 0.600 -38.957 -50.641 818 HH12 ARG 102 HH12 ARG 102 1.201 -39.250 -52.240 819 HH21 ARG 102 HH21 ARG 102 4.261 -37.650 -51.692 820 HH22 ARG 102 HH22 ARG 102 3.284 -38.506 -52.836 821 H ASP 103 H ASP 103 -3.096 -40.531 -46.926 822 HA ASP 103 HA ASP 103 -2.118 -43.077 -48.034 823 HB2 ASP 103 HB2 ASP 103 -2.921 -43.118 -45.675 824 HB3 ASP 103 HB3 ASP 103 -4.511 -42.614 -46.241 825 H MET 104 H MET 104 -2.772 -43.548 -50.016 826 HA MET 104 HA MET 104 -5.250 -42.328 -51.019 827 HB2 MET 104 HB2 MET 104 -2.823 -43.415 -52.442 828 HB3 MET 104 HB3 MET 104 -4.308 -42.986 -53.281 829 HG2 MET 104 HG2 MET 104 -4.023 -40.692 -52.145 830 HG3 MET 104 HG3 MET 104 -2.362 -41.211 -51.868 831 HE1 MET 104 HE1 MET 104 -3.464 -38.555 -54.070 832 HE2 MET 104 HE2 MET 104 -2.133 -38.901 -52.966 833 HE3 MET 104 HE3 MET 104 -1.823 -38.728 -54.695 Start of MODEL 8 1 H1 MET 1 H MET 1 6.159 2.715 -11.770 2 HA MET 1 HA MET 1 5.389 3.686 -14.358 3 HB2 MET 1 HB2 MET 1 4.350 1.530 -12.535 4 HB3 MET 1 HB3 MET 1 3.497 1.968 -14.010 5 HG2 MET 1 HG2 MET 1 4.774 0.255 -14.783 6 HG3 MET 1 HG3 MET 1 5.858 1.609 -15.096 7 HE1 MET 1 HE1 MET 1 6.817 -2.126 -13.306 8 HE2 MET 1 HE2 MET 1 5.856 -1.542 -14.665 9 HE3 MET 1 HE3 MET 1 7.616 -1.411 -14.708 10 H GLN 2 H GLN 2 3.895 5.161 -14.832 11 HA GLN 2 HA GLN 2 2.068 6.021 -12.685 12 HB2 GLN 2 HB2 GLN 2 2.018 8.216 -13.971 13 HB3 GLN 2 HB3 GLN 2 3.512 7.837 -13.125 14 HG2 GLN 2 HG2 GLN 2 3.247 7.049 -15.980 15 HG3 GLN 2 HG3 GLN 2 3.525 8.745 -15.585 16 HE21 GLN 2 HE21 GLN 2 5.160 6.474 -16.809 17 HE22 GLN 2 HE22 GLN 2 6.667 6.561 -15.968 18 H GLU 3 H GLU 3 1.661 3.894 -14.683 19 HA GLU 3 HA GLU 3 -0.587 5.056 -16.190 20 HB2 GLU 3 HB2 GLU 3 1.040 2.567 -16.734 21 HB3 GLU 3 HB3 GLU 3 -0.391 3.031 -17.643 22 HG2 GLU 3 HG2 GLU 3 0.827 5.213 -18.131 23 HG3 GLU 3 HG3 GLU 3 2.272 4.400 -17.532 24 H GLN 4 H GLN 4 -2.512 4.660 -15.341 25 HA GLN 4 HA GLN 4 -3.023 2.025 -14.154 26 HB2 GLN 4 HB2 GLN 4 -3.497 4.714 -12.914 27 HB3 GLN 4 HB3 GLN 4 -4.531 3.355 -12.496 28 HG2 GLN 4 HG2 GLN 4 -1.543 3.209 -12.288 29 HG3 GLN 4 HG3 GLN 4 -2.552 3.825 -10.981 30 HE21 GLN 4 HE21 GLN 4 -4.538 2.283 -10.618 31 HE22 GLN 4 HE22 GLN 4 -4.114 0.619 -10.425 32 H VAL 5 H VAL 5 -5.540 1.941 -13.643 33 HA VAL 5 HA VAL 5 -7.256 3.376 -15.405 34 HB VAL 5 HB VAL 5 -6.223 1.943 -17.090 35 HG11 VAL 5 HG11 VAL 5 -5.739 0.110 -15.344 36 HG12 VAL 5 HG12 VAL 5 -7.363 -0.470 -15.725 37 HG13 VAL 5 HG13 VAL 5 -6.137 -0.380 -16.991 38 HG21 VAL 5 HG21 VAL 5 -8.913 0.724 -16.707 39 HG22 VAL 5 HG22 VAL 5 -8.794 2.472 -16.912 40 HG23 VAL 5 HG23 VAL 5 -8.174 1.393 -18.161 41 H SER 6 H SER 6 -9.364 3.162 -14.819 42 HA SER 6 HA SER 6 -9.892 1.448 -12.510 43 HB2 SER 6 HB2 SER 6 -12.100 2.852 -12.551 44 HB3 SER 6 HB3 SER 6 -10.603 3.605 -11.999 45 HG SER 6 HG SER 6 -11.863 4.831 -13.573 46 H ASN 7 H ASN 7 -11.187 -0.282 -12.579 47 HA ASN 7 HA ASN 7 -13.195 -0.591 -14.631 48 HB2 ASN 7 HB2 ASN 7 -12.238 -2.861 -15.301 49 HB3 ASN 7 HB3 ASN 7 -11.408 -1.441 -15.930 50 HD21 ASN 7 HD21 ASN 7 -11.238 -4.146 -13.785 51 HD22 ASN 7 HD22 ASN 7 -9.557 -4.012 -13.412 52 H VAL 8 H VAL 8 -14.169 -2.927 -14.398 53 HA VAL 8 HA VAL 8 -14.478 -3.418 -11.510 54 HB VAL 8 HB VAL 8 -16.686 -4.386 -12.068 55 HG11 VAL 8 HG11 VAL 8 -17.529 -2.373 -11.659 56 HG12 VAL 8 HG12 VAL 8 -15.938 -1.687 -11.996 57 HG13 VAL 8 HG13 VAL 8 -17.133 -1.825 -13.288 58 HG21 VAL 8 HG21 VAL 8 -15.867 -4.792 -14.523 59 HG22 VAL 8 HG22 VAL 8 -17.568 -4.465 -14.192 60 HG23 VAL 8 HG23 VAL 8 -16.524 -3.177 -14.790 61 H ARG 9 H ARG 9 -15.498 -5.783 -11.248 62 HA ARG 9 HA ARG 9 -14.070 -7.703 -12.922 63 HB2 ARG 9 HB2 ARG 9 -13.811 -7.666 -9.910 64 HB3 ARG 9 HB3 ARG 9 -13.106 -8.852 -10.999 65 HG2 ARG 9 HG2 ARG 9 -11.290 -7.539 -10.701 66 HG3 ARG 9 HG3 ARG 9 -12.021 -6.669 -12.051 67 HD2 ARG 9 HD2 ARG 9 -12.647 -4.908 -10.757 68 HD3 ARG 9 HD3 ARG 9 -12.900 -5.910 -9.329 69 HE ARG 9 HE ARG 9 -10.147 -5.786 -9.964 70 HH11 ARG 9 HH11 ARG 9 -12.735 -3.874 -8.634 71 HH12 ARG 9 HH12 ARG 9 -11.688 -2.897 -7.659 72 HH21 ARG 9 HH21 ARG 9 -8.758 -4.507 -8.686 73 HH22 ARG 9 HH22 ARG 9 -9.425 -3.258 -7.690 74 H ALA 10 H ALA 10 -14.844 -9.879 -12.707 75 HA ALA 10 HA ALA 10 -17.547 -10.026 -11.537 76 HB1 ALA 10 HB1 ALA 10 -16.731 -10.429 -14.205 77 HB2 ALA 10 HB2 ALA 10 -17.172 -12.010 -13.556 78 HB3 ALA 10 HB3 ALA 10 -18.331 -10.682 -13.505 79 H ARG 11 H ARG 11 -18.203 -12.017 -10.615 80 HA ARG 11 HA ARG 11 -15.963 -13.783 -9.867 81 HB2 ARG 11 HB2 ARG 11 -18.282 -12.761 -8.248 82 HB3 ARG 11 HB3 ARG 11 -17.429 -14.229 -7.790 83 HG2 ARG 11 HG2 ARG 11 -15.957 -11.664 -8.254 84 HG3 ARG 11 HG3 ARG 11 -16.725 -12.018 -6.706 85 HD2 ARG 11 HD2 ARG 11 -15.298 -14.329 -7.416 86 HD3 ARG 11 HD3 ARG 11 -14.230 -12.970 -7.765 87 HE ARG 11 HE ARG 11 -14.059 -12.558 -5.513 88 HH11 ARG 11 HH11 ARG 11 -16.660 -14.797 -6.095 89 HH12 ARG 11 HH12 ARG 11 -16.887 -15.172 -4.418 90 HH21 ARG 11 HH21 ARG 11 -14.349 -13.041 -3.303 91 HH22 ARG 11 HH22 ARG 11 -15.573 -14.171 -2.831 92 H ILE 12 H ILE 12 -16.200 -15.513 -11.161 93 HA ILE 12 HA ILE 12 -18.877 -16.672 -11.494 94 HB ILE 12 HB ILE 12 -16.337 -17.287 -13.009 95 HG12 ILE 12 HG12 ILE 12 -18.780 -15.769 -13.941 96 HG13 ILE 12 HG13 ILE 12 -17.305 -14.994 -13.374 97 HG21 ILE 12 HG21 ILE 12 -17.393 -19.123 -13.678 98 HG22 ILE 12 HG22 ILE 12 -18.857 -18.655 -12.813 99 HG23 ILE 12 HG23 ILE 12 -18.588 -18.089 -14.461 100 HD11 ILE 12 HD11 ILE 12 -17.888 -16.320 -15.928 101 HD12 ILE 12 HD12 ILE 12 -16.800 -14.981 -15.557 102 HD13 ILE 12 HD13 ILE 12 -16.293 -16.641 -15.247 103 H TYR 13 H TYR 13 -19.413 -18.327 -10.248 104 HA TYR 13 HA TYR 13 -17.286 -20.147 -9.329 105 HB2 TYR 13 HB2 TYR 13 -17.985 -18.896 -7.415 106 HB3 TYR 13 HB3 TYR 13 -19.685 -19.108 -7.818 107 HD1 TYR 13 HD2 TYR 13 -16.665 -21.175 -7.054 108 HD2 TYR 13 HD1 TYR 13 -20.876 -20.714 -6.665 109 HE1 TYR 13 HE2 TYR 13 -16.746 -23.177 -5.628 110 HE2 TYR 13 HE1 TYR 13 -20.969 -22.714 -5.237 111 HH TYR 13 HH TYR 13 -18.760 -23.934 -3.635 112 H LYS 14 H LYS 14 -17.744 -22.334 -9.286 113 HA LYS 14 HA LYS 14 -20.189 -23.123 -10.725 114 HB2 LYS 14 HB2 LYS 14 -17.998 -23.619 -11.827 115 HB3 LYS 14 HB3 LYS 14 -17.605 -24.670 -10.473 116 HG2 LYS 14 HG2 LYS 14 -19.627 -26.015 -11.011 117 HG3 LYS 14 HG3 LYS 14 -19.845 -25.019 -12.453 118 HD2 LYS 14 HD2 LYS 14 -18.684 -26.866 -13.258 119 HD3 LYS 14 HD3 LYS 14 -17.406 -25.678 -12.995 120 HE2 LYS 14 HE2 LYS 14 -16.717 -26.727 -10.990 121 HE3 LYS 14 HE3 LYS 14 -18.168 -27.727 -10.929 122 HZ1 LYS 14 HZ1 LYS 14 -16.673 -29.211 -11.755 123 HZ2 LYS 14 HZ2 LYS 14 -15.761 -28.040 -12.568 124 HZ3 LYS 14 HZ3 LYS 14 -17.236 -28.562 -13.213 125 HA PRO 15 HA PRO 15 -20.947 -24.739 -6.513 126 HB2 PRO 15 HB2 PRO 15 -23.651 -24.609 -6.731 127 HB3 PRO 15 HB3 PRO 15 -22.655 -23.221 -6.273 128 HG2 PRO 15 HG2 PRO 15 -23.824 -23.917 -8.941 129 HG3 PRO 15 HG3 PRO 15 -23.749 -22.342 -8.128 130 HD2 PRO 15 HD2 PRO 15 -22.024 -23.053 -10.091 131 HD3 PRO 15 HD3 PRO 15 -21.558 -21.985 -8.752 132 H ALA 16 H ALA 16 -20.337 -26.854 -6.787 133 HA ALA 16 HA ALA 16 -22.169 -28.602 -8.290 134 HB1 ALA 16 HB1 ALA 16 -19.351 -29.261 -7.462 135 HB2 ALA 16 HB2 ALA 16 -20.372 -30.123 -8.614 136 HB3 ALA 16 HB3 ALA 16 -19.763 -28.515 -9.007 137 H LYS 17 H LYS 17 -23.587 -29.589 -7.018 138 HA LYS 17 HA LYS 17 -22.768 -31.264 -4.878 139 HB2 LYS 17 HB2 LYS 17 -23.996 -30.115 -3.060 140 HB3 LYS 17 HB3 LYS 17 -22.611 -29.195 -3.632 141 HG2 LYS 17 HG2 LYS 17 -23.941 -27.608 -4.686 142 HG3 LYS 17 HG3 LYS 17 -25.353 -28.667 -4.705 143 HD2 LYS 17 HD2 LYS 17 -25.774 -27.053 -3.030 144 HD3 LYS 17 HD3 LYS 17 -25.320 -28.529 -2.175 145 HE2 LYS 17 HE2 LYS 17 -23.137 -27.700 -1.736 146 HE3 LYS 17 HE3 LYS 17 -23.358 -26.345 -2.842 147 HZ1 LYS 17 HZ1 LYS 17 -25.115 -26.659 -0.496 148 HZ2 LYS 17 HZ2 LYS 17 -24.741 -25.257 -1.364 149 HZ3 LYS 17 HZ3 LYS 17 -23.590 -25.944 -0.331 150 H SER 18 H SER 18 -24.946 -31.825 -3.532 151 HA SER 18 HA SER 18 -26.643 -33.072 -5.421 152 HB2 SER 18 HB2 SER 18 -27.821 -33.965 -3.554 153 HB3 SER 18 HB3 SER 18 -26.133 -33.862 -3.054 154 HG SER 18 HG SER 18 -27.729 -33.042 -1.518 155 H THR 19 H THR 19 -29.153 -32.867 -4.991 156 HA THR 19 HA THR 19 -29.923 -30.342 -5.999 157 HB THR 19 HB THR 19 -31.940 -32.137 -4.716 158 HG1 THR 19 HG1 THR 19 -31.020 -33.751 -5.769 159 HG21 THR 19 HG21 THR 19 -33.093 -30.512 -5.810 160 HG22 THR 19 HG22 THR 19 -32.852 -31.596 -7.180 161 HG23 THR 19 HG23 THR 19 -31.789 -30.207 -6.957 162 H MET 20 H MET 20 -29.698 -28.572 -4.762 163 HA MET 20 HA MET 20 -29.801 -28.404 -2.000 164 HB2 MET 20 HB2 MET 20 -29.145 -26.651 -3.854 165 HB3 MET 20 HB3 MET 20 -30.807 -26.119 -3.644 166 HG2 MET 20 HG2 MET 20 -30.448 -25.386 -1.498 167 HG3 MET 20 HG3 MET 20 -29.075 -26.461 -1.247 168 HE1 MET 20 HE1 MET 20 -27.669 -24.971 -0.174 169 HE2 MET 20 HE2 MET 20 -26.801 -23.604 -0.869 170 HE3 MET 20 HE3 MET 20 -28.437 -23.385 -0.246 171 H GLN 21 H GLN 21 -31.476 -27.045 -0.774 172 HA GLN 21 HA GLN 21 -33.988 -28.419 -0.961 173 HB2 GLN 21 HB2 GLN 21 -34.594 -27.185 1.045 174 HB3 GLN 21 HB3 GLN 21 -32.973 -27.847 1.211 175 HG2 GLN 21 HG2 GLN 21 -32.624 -25.753 2.016 176 HG3 GLN 21 HG3 GLN 21 -32.271 -25.481 0.309 177 HE21 GLN 21 HE21 GLN 21 -32.778 -23.261 1.382 178 HE22 GLN 21 HE22 GLN 21 -34.401 -22.711 1.170 179 H SER 22 H SER 22 -32.782 -25.223 -1.752 180 HA SER 22 HA SER 22 -35.438 -24.552 -2.842 181 HB2 SER 22 HB2 SER 22 -33.438 -22.891 -1.362 182 HB3 SER 22 HB3 SER 22 -34.443 -22.115 -2.588 183 HG SER 22 HG SER 22 -35.688 -21.966 -0.845 184 H GLY 23 H GLY 23 -35.543 -24.245 -4.970 185 HA2 GLY 23 HA2 GLY 23 -34.765 -23.278 -7.011 186 HA3 GLY 23 HA3 GLY 23 -33.119 -23.417 -6.411 187 H HIS 24 H HIS 24 -33.025 -26.048 -5.621 188 HA HIS 24 HA HIS 24 -32.478 -28.087 -6.481 189 HB2 HIS 24 HB2 HIS 24 -34.991 -27.796 -8.129 190 HB3 HIS 24 HB3 HIS 24 -34.250 -29.284 -7.547 191 HD1 HIS 24 HD1 HIS 24 -34.038 -29.080 -4.665 192 HD2 HIS 24 HD2 HIS 24 -37.198 -27.283 -6.678 193 HE1 HIS 24 HE1 HIS 24 -35.846 -28.778 -2.944 194 H SER 25 H SER 25 -31.326 -25.848 -7.816 195 HA SER 25 HA SER 25 -30.169 -25.297 -9.698 196 HB2 SER 25 HB2 SER 25 -30.431 -28.170 -10.564 197 HB3 SER 25 HB3 SER 25 -29.090 -27.058 -10.837 198 HG SER 25 HG SER 25 -29.253 -28.798 -8.937 199 H LYS 26 H LYS 26 -32.873 -24.776 -9.861 200 HA LYS 26 HA LYS 26 -34.069 -25.802 -12.225 201 HB2 LYS 26 HB2 LYS 26 -35.411 -24.842 -10.424 202 HB3 LYS 26 HB3 LYS 26 -34.654 -23.274 -10.671 203 HG2 LYS 26 HG2 LYS 26 -35.731 -22.959 -12.734 204 HG3 LYS 26 HG3 LYS 26 -36.200 -24.656 -12.839 205 HD2 LYS 26 HD2 LYS 26 -37.630 -24.304 -10.819 206 HD3 LYS 26 HD3 LYS 26 -37.260 -22.582 -10.924 207 HE2 LYS 26 HE2 LYS 26 -38.287 -22.447 -13.098 208 HE3 LYS 26 HE3 LYS 26 -38.528 -24.193 -13.137 209 HZ1 LYS 26 HZ1 LYS 26 -39.685 -22.895 -10.838 210 HZ2 LYS 26 HZ2 LYS 26 -40.356 -24.040 -11.887 211 HZ3 LYS 26 HZ3 LYS 26 -40.360 -22.402 -12.310 212 H LEU 27 H LEU 27 -32.811 -25.577 -14.021 213 HA LEU 27 HA LEU 27 -31.736 -24.591 -15.770 214 HB2 LEU 27 HB2 LEU 27 -33.485 -22.224 -15.138 215 HB3 LEU 27 HB3 LEU 27 -32.772 -22.644 -16.695 216 HG LEU 27 HG LEU 27 -34.750 -24.473 -15.384 217 HD11 LEU 27 HD11 LEU 27 -35.350 -21.834 -15.975 218 HD12 LEU 27 HD12 LEU 27 -36.498 -23.159 -15.781 219 HD13 LEU 27 HD13 LEU 27 -35.906 -22.734 -17.387 220 HD21 LEU 27 HD21 LEU 27 -35.238 -24.839 -17.878 221 HD22 LEU 27 HD22 LEU 27 -33.737 -25.491 -17.221 222 HD23 LEU 27 HD23 LEU 27 -33.714 -23.995 -18.156 223 H LYS 28 H LYS 28 -30.438 -24.335 -13.263 224 HA LYS 28 HA LYS 28 -28.664 -22.149 -13.890 225 HB2 LYS 28 HB2 LYS 28 -28.794 -21.177 -11.589 226 HB3 LYS 28 HB3 LYS 28 -30.238 -20.917 -12.561 227 HG2 LYS 28 HG2 LYS 28 -31.218 -22.940 -11.399 228 HG3 LYS 28 HG3 LYS 28 -29.853 -22.838 -10.286 229 HD2 LYS 28 HD2 LYS 28 -30.641 -20.308 -10.151 230 HD3 LYS 28 HD3 LYS 28 -32.186 -21.025 -10.617 231 HE2 LYS 28 HE2 LYS 28 -32.040 -22.562 -8.718 232 HE3 LYS 28 HE3 LYS 28 -30.496 -21.850 -8.257 233 HZ1 LYS 28 HZ1 LYS 28 -31.659 -20.430 -7.035 234 HZ2 LYS 28 HZ2 LYS 28 -33.130 -20.943 -7.692 235 HZ3 LYS 28 HZ3 LYS 28 -32.234 -19.734 -8.466 236 H ALA 29 H ALA 29 -26.781 -23.183 -13.863 237 HA ALA 29 HA ALA 29 -26.238 -25.047 -11.643 238 HB1 ALA 29 HB1 ALA 29 -26.070 -25.457 -14.443 239 HB2 ALA 29 HB2 ALA 29 -24.432 -25.494 -13.790 240 HB3 ALA 29 HB3 ALA 29 -25.664 -26.577 -13.142 241 H TRP 30 H TRP 30 -25.104 -22.337 -13.513 242 HA TRP 30 HA TRP 30 -22.669 -22.214 -11.865 243 HB2 TRP 30 HB2 TRP 30 -23.312 -21.177 -14.612 244 HB3 TRP 30 HB3 TRP 30 -21.992 -20.483 -13.673 245 HD1 TRP 30 HD1 TRP 30 -23.084 -23.939 -15.050 246 HE1 TRP 30 HE1 TRP 30 -20.957 -25.297 -15.558 247 HE3 TRP 30 HE3 TRP 30 -19.583 -20.641 -13.317 248 HZ2 TRP 30 HZ2 TRP 30 -18.165 -25.008 -15.262 249 HZ3 TRP 30 HZ3 TRP 30 -17.206 -21.259 -13.466 250 HH2 TRP 30 HH2 TRP 30 -16.514 -23.398 -14.418 251 H LYS 31 H LYS 31 -22.002 -20.140 -11.049 252 HA LYS 31 HA LYS 31 -24.233 -18.246 -10.704 253 HB2 LYS 31 HB2 LYS 31 -23.871 -19.494 -8.638 254 HB3 LYS 31 HB3 LYS 31 -22.165 -19.068 -8.657 255 HG2 LYS 31 HG2 LYS 31 -22.571 -16.871 -8.064 256 HG3 LYS 31 HG3 LYS 31 -24.244 -16.924 -8.620 257 HD2 LYS 31 HD2 LYS 31 -23.272 -18.572 -6.301 258 HD3 LYS 31 HD3 LYS 31 -23.857 -16.919 -6.101 259 HE2 LYS 31 HE2 LYS 31 -25.889 -17.872 -7.513 260 HE3 LYS 31 HE3 LYS 31 -25.338 -19.393 -6.817 261 HZ1 LYS 31 HZ1 LYS 31 -26.123 -18.837 -4.822 262 HZ2 LYS 31 HZ2 LYS 31 -27.000 -17.627 -5.614 263 HZ3 LYS 31 HZ3 LYS 31 -25.511 -17.262 -4.899 264 H LEU 32 H LEU 32 -23.813 -16.176 -11.176 265 HA LEU 32 HA LEU 32 -20.996 -15.370 -11.488 266 HB2 LEU 32 HB2 LEU 32 -21.933 -15.621 -13.675 267 HB3 LEU 32 HB3 LEU 32 -23.366 -14.699 -13.222 268 HG LEU 32 HG LEU 32 -21.562 -13.587 -14.700 269 HD11 LEU 32 HD11 LEU 32 -21.949 -11.643 -12.640 270 HD12 LEU 32 HD12 LEU 32 -23.406 -12.622 -12.808 271 HD13 LEU 32 HD13 LEU 32 -22.744 -11.779 -14.208 272 HD21 LEU 32 HD21 LEU 32 -19.592 -12.940 -13.808 273 HD22 LEU 32 HD22 LEU 32 -19.865 -14.322 -12.746 274 HD23 LEU 32 HD23 LEU 32 -20.274 -12.694 -12.200 275 H GLU 33 H GLU 33 -20.428 -13.742 -10.218 276 HA GLU 33 HA GLU 33 -22.516 -11.866 -9.318 277 HB2 GLU 33 HB2 GLU 33 -21.914 -13.170 -7.420 278 HB3 GLU 33 HB3 GLU 33 -20.200 -13.044 -7.789 279 HG2 GLU 33 HG2 GLU 33 -21.490 -10.461 -7.401 280 HG3 GLU 33 HG3 GLU 33 -21.572 -11.510 -5.987 281 H PHE 34 H PHE 34 -22.174 -10.135 -10.594 282 HA PHE 34 HA PHE 34 -19.509 -9.253 -11.266 283 HB2 PHE 34 HB2 PHE 34 -22.249 -8.631 -12.119 284 HB3 PHE 34 HB3 PHE 34 -21.179 -7.233 -12.073 285 HD1 PHE 34 HD2 PHE 34 -18.793 -7.686 -13.160 286 HD2 PHE 34 HD1 PHE 34 -22.358 -9.826 -14.068 287 HE1 PHE 34 HE2 PHE 34 -17.841 -8.343 -15.331 288 HE2 PHE 34 HE1 PHE 34 -21.411 -10.487 -16.241 289 HZ PHE 34 HZ PHE 34 -19.150 -9.745 -16.876 290 H GLU 35 H GLU 35 -18.538 -7.316 -10.642 291 HA GLU 35 HA GLU 35 -19.055 -6.509 -7.961 292 HB2 GLU 35 HB2 GLU 35 -17.094 -5.799 -10.074 293 HB3 GLU 35 HB3 GLU 35 -17.347 -4.620 -8.797 294 HG2 GLU 35 HG2 GLU 35 -17.071 -6.938 -7.384 295 HG3 GLU 35 HG3 GLU 35 -15.968 -7.189 -8.735 296 HA PRO 36 HA PRO 36 -21.776 -3.101 -8.429 297 HB2 PRO 36 HB2 PRO 36 -20.796 -1.324 -6.625 298 HB3 PRO 36 HB3 PRO 36 -21.639 -2.805 -6.155 299 HG2 PRO 36 HG2 PRO 36 -18.698 -2.255 -6.272 300 HG3 PRO 36 HG3 PRO 36 -19.629 -3.106 -5.025 301 HD2 PRO 36 HD2 PRO 36 -18.198 -4.409 -6.918 302 HD3 PRO 36 HD3 PRO 36 -19.700 -5.065 -6.237 303 H SER 37 H SER 37 -22.035 -1.253 -9.598 304 HA SER 37 HA SER 37 -19.596 0.138 -10.491 305 HB2 SER 37 HB2 SER 37 -21.916 -0.883 -12.101 306 HB3 SER 37 HB3 SER 37 -21.003 0.519 -12.660 307 HG SER 37 HG SER 37 -19.121 -1.031 -12.165 308 H CYS 38 H CYS 38 -23.085 0.626 -10.996 309 HA CYS 38 HA CYS 38 -22.957 3.116 -9.476 310 HB2 CYS 38 HB2 CYS 38 -23.881 2.954 -12.351 311 HB3 CYS 38 HB3 CYS 38 -24.097 4.353 -11.308 312 HG CYS 38 HG CYS 38 -21.517 5.114 -11.205 313 H THR 39 H THR 39 -25.135 4.058 -9.121 314 HA THR 39 HA THR 39 -26.908 2.158 -8.094 315 HB THR 39 HB THR 39 -26.881 4.458 -7.280 316 HG1 THR 39 HG1 THR 39 -29.431 3.984 -8.442 317 HG21 THR 39 HG21 THR 39 -28.278 5.279 -9.819 318 HG22 THR 39 HG22 THR 39 -26.537 5.454 -9.592 319 HG23 THR 39 HG23 THR 39 -27.656 6.312 -8.533 320 H GLN 40 H GLN 40 -28.753 1.213 -8.838 321 HA GLN 40 HA GLN 40 -29.473 1.735 -11.647 322 HB2 GLN 40 HB2 GLN 40 -28.314 -0.464 -11.228 323 HB3 GLN 40 HB3 GLN 40 -29.696 -0.929 -10.246 324 HG2 GLN 40 HG2 GLN 40 -31.152 -0.882 -12.113 325 HG3 GLN 40 HG3 GLN 40 -29.936 -0.102 -13.123 326 HE21 GLN 40 HE21 GLN 40 -31.480 -2.763 -13.110 327 HE22 GLN 40 HE22 GLN 40 -30.255 -3.930 -13.459 328 H TYR 41 H TYR 41 -31.573 2.084 -12.098 329 HA TYR 41 HA TYR 41 -33.393 2.424 -9.889 330 HB2 TYR 41 HB2 TYR 41 -33.163 3.918 -11.987 331 HB3 TYR 41 HB3 TYR 41 -34.138 2.693 -12.792 332 HD1 TYR 41 HD2 TYR 41 -34.155 4.861 -9.753 333 HD2 TYR 41 HD1 TYR 41 -36.447 2.880 -12.742 334 HE1 TYR 41 HE2 TYR 41 -36.198 5.923 -8.885 335 HE2 TYR 41 HE1 TYR 41 -38.495 3.937 -11.881 336 HH TYR 41 HH TYR 41 -38.378 6.366 -9.337 337 H THR 42 H THR 42 -33.326 0.081 -9.351 338 HA THR 42 HA THR 42 -34.421 -1.897 -11.018 339 HB THR 42 HB THR 42 -34.684 -3.254 -9.023 340 HG1 THR 42 HG1 THR 42 -34.560 -2.376 -6.989 341 HG21 THR 42 HG21 THR 42 -32.290 -2.078 -9.867 342 HG22 THR 42 HG22 THR 42 -32.476 -3.564 -8.936 343 HG23 THR 42 HG23 THR 42 -32.241 -2.026 -8.105 344 H GLU 43 H GLU 43 -36.468 -2.645 -11.338 345 HA GLU 43 HA GLU 43 -38.686 -1.710 -9.757 346 HB2 GLU 43 HB2 GLU 43 -38.083 0.075 -11.577 347 HB3 GLU 43 HB3 GLU 43 -38.870 -1.052 -12.674 348 HG2 GLU 43 HG2 GLU 43 -40.509 0.510 -12.040 349 HG3 GLU 43 HG3 GLU 43 -40.868 -0.970 -11.151 350 HA PRO 44 HA PRO 44 -39.076 -5.897 -11.781 351 HB2 PRO 44 HB2 PRO 44 -39.543 -7.247 -9.472 352 HB3 PRO 44 HB3 PRO 44 -37.917 -6.943 -10.094 353 HG2 PRO 44 HG2 PRO 44 -39.435 -5.483 -7.967 354 HG3 PRO 44 HG3 PRO 44 -37.731 -5.976 -7.987 355 HD2 PRO 44 HD2 PRO 44 -38.522 -3.447 -8.541 356 HD3 PRO 44 HD3 PRO 44 -37.099 -4.191 -9.300 357 H LEU 45 H LEU 45 -40.983 -7.103 -12.063 358 HA LEU 45 HA LEU 45 -43.386 -5.704 -11.942 359 HB2 LEU 45 HB2 LEU 45 -43.024 -7.542 -13.476 360 HB3 LEU 45 HB3 LEU 45 -42.906 -8.675 -12.131 361 HG LEU 45 HG LEU 45 -45.337 -7.950 -11.616 362 HD11 LEU 45 HD11 LEU 45 -45.739 -6.134 -12.992 363 HD12 LEU 45 HD12 LEU 45 -46.487 -7.460 -13.882 364 HD13 LEU 45 HD13 LEU 45 -44.903 -6.858 -14.367 365 HD21 LEU 45 HD21 LEU 45 -44.346 -10.122 -12.705 366 HD22 LEU 45 HD22 LEU 45 -45.135 -9.497 -14.155 367 HD23 LEU 45 HD23 LEU 45 -46.084 -9.825 -12.704 368 H MET 46 H MET 46 -42.332 -8.435 -9.903 369 HA MET 46 HA MET 46 -44.559 -8.330 -8.169 370 HB2 MET 46 HB2 MET 46 -42.927 -10.258 -8.494 371 HB3 MET 46 HB3 MET 46 -41.828 -9.379 -7.439 372 HG2 MET 46 HG2 MET 46 -42.862 -10.824 -5.982 373 HG3 MET 46 HG3 MET 46 -43.810 -9.353 -5.787 374 HE1 MET 46 HE1 MET 46 -46.612 -10.410 -5.223 375 HE2 MET 46 HE2 MET 46 -46.290 -12.143 -5.177 376 HE3 MET 46 HE3 MET 46 -45.113 -11.008 -4.515 377 H ASN 47 H ASN 47 -45.039 -6.945 -6.601 378 HA ASN 47 HA ASN 47 -43.261 -4.805 -5.932 379 HB2 ASN 47 HB2 ASN 47 -46.010 -5.613 -5.011 380 HB3 ASN 47 HB3 ASN 47 -45.139 -4.296 -4.230 381 HD21 ASN 47 HD21 ASN 47 -46.970 -5.280 -6.934 382 HD22 ASN 47 HD22 ASN 47 -46.955 -3.775 -7.781 383 H TRP 48 H TRP 48 -41.652 -4.949 -4.529 384 HA TRP 48 HA TRP 48 -41.725 -7.009 -2.455 385 HB2 TRP 48 HB2 TRP 48 -39.559 -5.401 -3.747 386 HB3 TRP 48 HB3 TRP 48 -39.284 -6.066 -2.140 387 HD1 TRP 48 HD1 TRP 48 -41.300 -8.047 -4.711 388 HE1 TRP 48 HE1 TRP 48 -39.961 -10.146 -5.369 389 HE3 TRP 48 HE3 TRP 48 -36.903 -6.988 -2.326 390 HZ2 TRP 48 HZ2 TRP 48 -37.384 -11.211 -4.934 391 HZ3 TRP 48 HZ3 TRP 48 -35.051 -8.598 -2.497 392 HH2 TRP 48 HH2 TRP 48 -35.289 -10.666 -3.774 393 H THR 49 H THR 49 -40.574 -6.292 -0.342 394 HA THR 49 HA THR 49 -42.096 -4.041 0.687 395 HB THR 49 HB THR 49 -41.128 -4.772 2.906 396 HG1 THR 49 HG1 THR 49 -39.411 -6.008 2.601 397 HG21 THR 49 HG21 THR 49 -43.315 -5.614 1.676 398 HG22 THR 49 HG22 THR 49 -42.788 -6.324 3.203 399 HG23 THR 49 HG23 THR 49 -42.443 -7.147 1.682 400 H GLY 50 H GLY 50 -41.275 -2.126 1.359 401 HA2 GLY 50 HA2 GLY 50 -38.839 -1.196 0.357 402 HA3 GLY 50 HA3 GLY 50 -39.781 -0.403 1.611 403 H SER 51 H SER 51 -36.808 -1.021 1.134 404 HA SER 51 HA SER 51 -36.294 -1.900 3.889 405 HB2 SER 51 HB2 SER 51 -34.169 -3.011 2.872 406 HB3 SER 51 HB3 SER 51 -35.710 -3.861 2.762 407 HG SER 51 HG SER 51 -34.463 -3.744 0.770 408 H HIS 52 H HIS 52 -34.820 -0.713 4.964 409 HA HIS 52 HA HIS 52 -33.696 1.592 3.586 410 HB2 HIS 52 HB2 HIS 52 -34.902 1.561 5.913 411 HB3 HIS 52 HB3 HIS 52 -33.324 1.060 6.513 412 HD1 HIS 52 HD1 HIS 52 -34.585 3.831 4.214 413 HD2 HIS 52 HD2 HIS 52 -31.900 3.197 7.320 414 HE1 HIS 52 HE1 HIS 52 -33.530 6.071 4.658 415 H ASP 53 H ASP 53 -32.539 -1.006 5.733 416 HA ASP 53 HA ASP 53 -29.782 -0.406 5.058 417 HB2 ASP 53 HB2 ASP 53 -30.991 -2.532 6.837 418 HB3 ASP 53 HB3 ASP 53 -29.262 -2.265 6.631 419 H THR 54 H THR 54 -28.947 -1.145 3.228 420 HA THR 54 HA THR 54 -28.924 -3.900 2.572 421 HB THR 54 HB THR 54 -31.235 -3.367 1.825 422 HG1 THR 54 HG1 THR 54 -30.833 -4.835 0.367 423 HG21 THR 54 HG21 THR 54 -31.626 -1.919 -0.051 424 HG22 THR 54 HG22 THR 54 -29.898 -1.627 -0.247 425 HG23 THR 54 HG23 THR 54 -30.743 -1.006 1.171 426 H LYS 55 H LYS 55 -27.670 -4.356 0.644 427 HA LYS 55 HA LYS 55 -25.708 -2.256 0.148 428 HB2 LYS 55 HB2 LYS 55 -25.693 -5.161 -0.693 429 HB3 LYS 55 HB3 LYS 55 -24.352 -4.033 -0.849 430 HG2 LYS 55 HG2 LYS 55 -23.989 -3.965 1.460 431 HG3 LYS 55 HG3 LYS 55 -25.569 -4.668 1.816 432 HD2 LYS 55 HD2 LYS 55 -24.688 -6.720 0.511 433 HD3 LYS 55 HD3 LYS 55 -23.096 -6.003 0.771 434 HE2 LYS 55 HE2 LYS 55 -25.082 -6.687 2.936 435 HE3 LYS 55 HE3 LYS 55 -23.675 -7.655 2.500 436 HZ1 LYS 55 HZ1 LYS 55 -22.596 -5.226 2.924 437 HZ2 LYS 55 HZ2 LYS 55 -22.656 -6.465 4.072 438 HZ3 LYS 55 HZ3 LYS 55 -23.832 -5.249 4.079 439 H GLN 56 H GLN 56 -24.737 -2.608 -2.260 440 HA GLN 56 HA GLN 56 -27.029 -2.327 -4.091 441 HB2 GLN 56 HB2 GLN 56 -25.666 -0.222 -3.478 442 HB3 GLN 56 HB3 GLN 56 -24.404 -0.915 -4.487 443 HG2 GLN 56 HG2 GLN 56 -26.268 -1.082 -6.274 444 HG3 GLN 56 HG3 GLN 56 -27.100 0.100 -5.266 445 HE21 GLN 56 HE21 GLN 56 -26.313 2.177 -5.125 446 HE22 GLN 56 HE22 GLN 56 -25.093 2.790 -6.183 447 H GLN 57 H GLN 57 -25.317 -4.676 -3.422 448 HA GLN 57 HA GLN 57 -23.941 -5.120 -5.969 449 HB2 GLN 57 HB2 GLN 57 -22.530 -5.746 -4.214 450 HB3 GLN 57 HB3 GLN 57 -23.841 -6.462 -3.286 451 HG2 GLN 57 HG2 GLN 57 -23.748 -8.434 -4.407 452 HG3 GLN 57 HG3 GLN 57 -23.197 -7.685 -5.904 453 HE21 GLN 57 HE21 GLN 57 -22.310 -9.518 -3.269 454 HE22 GLN 57 HE22 GLN 57 -20.594 -9.389 -3.418 455 H VAL 58 H VAL 58 -24.680 -6.480 -7.487 456 HA VAL 58 HA VAL 58 -26.986 -8.187 -6.814 457 HB VAL 58 HB VAL 58 -26.623 -6.761 -9.449 458 HG11 VAL 58 HG11 VAL 58 -28.009 -8.456 -10.021 459 HG12 VAL 58 HG12 VAL 58 -28.559 -8.711 -8.363 460 HG13 VAL 58 HG13 VAL 58 -29.225 -7.388 -9.321 461 HG21 VAL 58 HG21 VAL 58 -28.848 -5.669 -8.325 462 HG22 VAL 58 HG22 VAL 58 -27.801 -5.859 -6.919 463 HG23 VAL 58 HG23 VAL 58 -27.249 -4.928 -8.312 464 H CYS 59 H CYS 59 -27.111 -10.178 -7.840 465 HA CYS 59 HA CYS 59 -24.973 -10.929 -9.680 466 HB2 CYS 59 HB2 CYS 59 -24.579 -13.032 -8.333 467 HB3 CYS 59 HB3 CYS 59 -23.978 -11.547 -7.606 468 HG CYS 59 HG CYS 59 -24.923 -12.828 -5.447 469 H LEU 60 H LEU 60 -25.394 -12.891 -10.843 470 HA LEU 60 HA LEU 60 -28.150 -13.883 -10.662 471 HB2 LEU 60 HB2 LEU 60 -28.468 -13.746 -13.022 472 HB3 LEU 60 HB3 LEU 60 -27.982 -12.157 -12.436 473 HG LEU 60 HG LEU 60 -25.818 -13.891 -13.463 474 HD11 LEU 60 HD11 LEU 60 -26.424 -13.035 -15.807 475 HD12 LEU 60 HD12 LEU 60 -28.056 -12.858 -15.166 476 HD13 LEU 60 HD13 LEU 60 -27.283 -14.444 -15.184 477 HD21 LEU 60 HD21 LEU 60 -26.550 -10.984 -13.791 478 HD22 LEU 60 HD22 LEU 60 -25.086 -11.743 -14.418 479 HD23 LEU 60 HD23 LEU 60 -25.355 -11.649 -12.677 480 H SER 61 H SER 61 -28.436 -15.894 -12.033 481 HA SER 61 HA SER 61 -26.013 -17.552 -11.802 482 HB2 SER 61 HB2 SER 61 -27.529 -19.474 -11.508 483 HB3 SER 61 HB3 SER 61 -27.813 -18.239 -10.281 484 HG SER 61 HG SER 61 -29.808 -18.461 -10.941 485 H PHE 62 H PHE 62 -25.483 -18.983 -13.449 486 HA PHE 62 HA PHE 62 -26.912 -18.550 -15.989 487 HB2 PHE 62 HB2 PHE 62 -23.997 -18.691 -15.351 488 HB3 PHE 62 HB3 PHE 62 -24.544 -19.284 -16.917 489 HD1 PHE 62 HD1 PHE 62 -26.340 -17.576 -18.038 490 HD2 PHE 62 HD2 PHE 62 -23.227 -16.543 -15.325 491 HE1 PHE 62 HE1 PHE 62 -26.355 -15.273 -18.904 492 HE2 PHE 62 HE2 PHE 62 -23.237 -14.238 -16.186 493 HZ PHE 62 HZ PHE 62 -24.803 -13.601 -17.977 494 H THR 63 H THR 63 -26.342 -20.394 -17.601 495 HA THR 63 HA THR 63 -26.941 -22.909 -16.220 496 HB THR 63 HB THR 63 -27.053 -22.737 -19.188 497 HG1 THR 63 HG1 THR 63 -28.043 -20.780 -18.528 498 HG21 THR 63 HG21 THR 63 -29.189 -24.019 -18.699 499 HG22 THR 63 HG22 THR 63 -28.681 -24.035 -17.012 500 HG23 THR 63 HG23 THR 63 -27.685 -24.814 -18.240 501 H THR 64 H THR 64 -24.701 -21.477 -18.535 502 HA THR 64 HA THR 64 -22.877 -23.729 -18.062 503 HB THR 64 HB THR 64 -22.191 -23.298 -20.577 504 HG1 THR 64 HG1 THR 64 -24.012 -22.789 -21.843 505 HG21 THR 64 HG21 THR 64 -23.030 -25.422 -19.543 506 HG22 THR 64 HG22 THR 64 -23.497 -25.199 -21.229 507 HG23 THR 64 HG23 THR 64 -24.666 -24.902 -19.944 508 H ARG 65 H ARG 65 -20.654 -23.234 -18.294 509 HA ARG 65 HA ARG 65 -19.857 -20.753 -17.330 510 HB2 ARG 65 HB2 ARG 65 -17.551 -21.461 -18.141 511 HB3 ARG 65 HB3 ARG 65 -18.366 -22.559 -17.035 512 HG2 ARG 65 HG2 ARG 65 -18.960 -24.027 -18.835 513 HG3 ARG 65 HG3 ARG 65 -18.343 -22.882 -20.027 514 HD2 ARG 65 HD2 ARG 65 -16.559 -24.303 -19.886 515 HD3 ARG 65 HD3 ARG 65 -16.125 -23.145 -18.628 516 HE ARG 65 HE ARG 65 -17.569 -25.069 -17.331 517 HH11 ARG 65 HH11 ARG 65 -14.719 -25.046 -19.330 518 HH12 ARG 65 HH12 ARG 65 -14.004 -26.420 -18.553 519 HH21 ARG 65 HH21 ARG 65 -16.638 -26.877 -16.299 520 HH22 ARG 65 HH22 ARG 65 -15.097 -27.460 -16.829 521 H GLU 66 H GLU 66 -20.008 -21.952 -20.651 522 HA GLU 66 HA GLU 66 -18.684 -19.940 -21.990 523 HB2 GLU 66 HB2 GLU 66 -21.187 -21.391 -22.868 524 HB3 GLU 66 HB3 GLU 66 -20.120 -20.480 -23.928 525 HG2 GLU 66 HG2 GLU 66 -18.278 -22.061 -23.117 526 HG3 GLU 66 HG3 GLU 66 -19.594 -23.063 -22.510 527 H LEU 67 H LEU 67 -21.845 -19.885 -20.519 528 HA LEU 67 HA LEU 67 -22.639 -17.412 -21.767 529 HB2 LEU 67 HB2 LEU 67 -23.801 -19.305 -19.807 530 HB3 LEU 67 HB3 LEU 67 -24.364 -17.636 -19.738 531 HG LEU 67 HG LEU 67 -24.420 -19.206 -22.298 532 HD11 LEU 67 HD11 LEU 67 -26.625 -19.061 -20.248 533 HD12 LEU 67 HD12 LEU 67 -25.630 -20.480 -20.566 534 HD13 LEU 67 HD13 LEU 67 -26.694 -19.852 -21.823 535 HD21 LEU 67 HD21 LEU 67 -24.723 -16.634 -22.061 536 HD22 LEU 67 HD22 LEU 67 -26.320 -17.061 -21.446 537 HD23 LEU 67 HD23 LEU 67 -25.839 -17.555 -23.069 538 H ALA 68 H ALA 68 -21.208 -18.423 -18.727 539 HA ALA 68 HA ALA 68 -21.506 -15.951 -17.368 540 HB1 ALA 68 HB1 ALA 68 -20.480 -16.972 -15.639 541 HB2 ALA 68 HB2 ALA 68 -20.779 -18.425 -16.593 542 HB3 ALA 68 HB3 ALA 68 -19.201 -17.641 -16.653 543 H ILE 69 H ILE 69 -18.598 -17.438 -18.813 544 HA ILE 69 HA ILE 69 -16.946 -15.198 -18.567 545 HB ILE 69 HB ILE 69 -16.841 -17.434 -20.593 546 HG12 ILE 69 HG12 ILE 69 -14.763 -17.824 -18.894 547 HG13 ILE 69 HG13 ILE 69 -15.929 -17.085 -17.802 548 HG21 ILE 69 HG21 ILE 69 -15.509 -15.872 -21.616 549 HG22 ILE 69 HG22 ILE 69 -15.038 -15.117 -20.094 550 HG23 ILE 69 HG23 ILE 69 -14.335 -16.664 -20.565 551 HD11 ILE 69 HD11 ILE 69 -15.783 -19.726 -18.323 552 HD12 ILE 69 HD12 ILE 69 -17.245 -18.898 -17.785 553 HD13 ILE 69 HD13 ILE 69 -16.998 -19.225 -19.500 554 H ALA 70 H ALA 70 -19.243 -16.105 -21.062 555 HA ALA 70 HA ALA 70 -18.487 -14.345 -23.085 556 HB1 ALA 70 HB1 ALA 70 -21.121 -14.401 -23.480 557 HB2 ALA 70 HB2 ALA 70 -20.075 -15.773 -23.852 558 HB3 ALA 70 HB3 ALA 70 -20.990 -15.745 -22.345 559 H TYR 71 H TYR 71 -20.266 -13.780 -20.129 560 HA TYR 71 HA TYR 71 -21.287 -11.222 -20.829 561 HB2 TYR 71 HB2 TYR 71 -21.223 -12.932 -18.462 562 HB3 TYR 71 HB3 TYR 71 -21.085 -11.222 -18.069 563 HD1 TYR 71 HD1 TYR 71 -22.983 -12.717 -20.886 564 HD2 TYR 71 HD2 TYR 71 -23.183 -10.795 -17.095 565 HE1 TYR 71 HE1 TYR 71 -25.417 -12.465 -21.149 566 HE2 TYR 71 HE2 TYR 71 -25.616 -10.540 -17.346 567 HH TYR 71 HH TYR 71 -27.375 -10.848 -18.663 568 H ALA 72 H ALA 72 -18.613 -12.163 -18.660 569 HA ALA 72 HA ALA 72 -17.629 -9.622 -18.142 570 HB1 ALA 72 HB1 ALA 72 -15.457 -11.489 -18.343 571 HB2 ALA 72 HB2 ALA 72 -16.186 -10.770 -16.907 572 HB3 ALA 72 HB3 ALA 72 -16.852 -12.255 -17.583 573 H VAL 73 H VAL 73 -16.529 -11.910 -20.648 574 HA VAL 73 HA VAL 73 -14.588 -10.334 -21.833 575 HB VAL 73 HB VAL 73 -16.450 -12.273 -23.213 576 HG11 VAL 73 HG11 VAL 73 -14.633 -12.469 -24.874 577 HG12 VAL 73 HG12 VAL 73 -15.344 -10.855 -24.829 578 HG13 VAL 73 HG13 VAL 73 -13.782 -11.155 -24.065 579 HG21 VAL 73 HG21 VAL 73 -15.085 -13.096 -21.230 580 HG22 VAL 73 HG22 VAL 73 -14.888 -13.972 -22.748 581 HG23 VAL 73 HG23 VAL 73 -13.661 -12.815 -22.231 582 H ALA 74 H ALA 74 -18.068 -10.201 -22.164 583 HA ALA 74 HA ALA 74 -18.354 -8.720 -24.483 584 HB1 ALA 74 HB1 ALA 74 -20.129 -7.922 -22.278 585 HB2 ALA 74 HB2 ALA 74 -20.516 -8.527 -23.890 586 HB3 ALA 74 HB3 ALA 74 -20.064 -9.653 -22.611 587 H HIS 75 H HIS 75 -17.441 -7.661 -21.258 588 HA HIS 75 HA HIS 75 -16.965 -4.966 -22.350 589 HB2 HIS 75 HB2 HIS 75 -18.778 -5.497 -20.412 590 HB3 HIS 75 HB3 HIS 75 -17.343 -5.226 -19.427 591 HD1 HIS 75 HD1 HIS 75 -18.047 -2.988 -18.472 592 HD2 HIS 75 HD2 HIS 75 -18.099 -3.077 -22.625 593 HE1 HIS 75 HE1 HIS 75 -18.376 -0.601 -19.192 594 H LYS 76 H LYS 76 -15.297 -7.506 -21.914 595 HA LYS 76 HA LYS 76 -13.191 -8.073 -21.253 596 HB2 LYS 76 HB2 LYS 76 -12.942 -5.101 -21.666 597 HB3 LYS 76 HB3 LYS 76 -11.558 -6.094 -21.231 598 HG2 LYS 76 HG2 LYS 76 -13.106 -7.112 -23.498 599 HG3 LYS 76 HG3 LYS 76 -12.348 -5.541 -23.770 600 HD2 LYS 76 HD2 LYS 76 -10.805 -7.227 -24.468 601 HD3 LYS 76 HD3 LYS 76 -10.196 -6.532 -22.963 602 HE2 LYS 76 HE2 LYS 76 -9.943 -8.900 -22.826 603 HE3 LYS 76 HE3 LYS 76 -11.259 -8.440 -21.748 604 HZ1 LYS 76 HZ1 LYS 76 -11.717 -10.431 -23.127 605 HZ2 LYS 76 HZ2 LYS 76 -11.662 -9.455 -24.507 606 HZ3 LYS 76 HZ3 LYS 76 -12.850 -9.191 -23.331 607 H ILE 77 H ILE 77 -14.880 -8.040 -19.133 608 HA ILE 77 HA ILE 77 -13.617 -6.519 -16.988 609 HB ILE 77 HB ILE 77 -16.024 -8.344 -16.934 610 HG12 ILE 77 HG12 ILE 77 -16.096 -5.377 -16.520 611 HG13 ILE 77 HG13 ILE 77 -16.026 -6.019 -18.157 612 HG21 ILE 77 HG21 ILE 77 -15.533 -8.430 -14.740 613 HG22 ILE 77 HG22 ILE 77 -14.475 -7.022 -14.817 614 HG23 ILE 77 HG23 ILE 77 -16.221 -6.806 -14.715 615 HD11 ILE 77 HD11 ILE 77 -18.294 -5.701 -17.735 616 HD12 ILE 77 HD12 ILE 77 -18.044 -7.431 -17.496 617 HD13 ILE 77 HD13 ILE 77 -18.176 -6.356 -16.103 618 H ASP 78 H ASP 78 -12.520 -7.415 -15.285 619 HA ASP 78 HA ASP 78 -11.213 -9.902 -15.749 620 HB2 ASP 78 HB2 ASP 78 -11.209 -7.941 -13.465 621 HB3 ASP 78 HB3 ASP 78 -10.342 -9.471 -13.361 622 H TYR 79 H TYR 79 -12.569 -11.633 -15.727 623 HA TYR 79 HA TYR 79 -14.285 -12.022 -13.378 624 HB2 TYR 79 HB2 TYR 79 -15.467 -13.681 -14.687 625 HB3 TYR 79 HB3 TYR 79 -15.325 -12.201 -15.629 626 HD1 TYR 79 HD2 TYR 79 -13.701 -12.087 -17.507 627 HD2 TYR 79 HD1 TYR 79 -14.468 -15.716 -15.422 628 HE1 TYR 79 HE2 TYR 79 -12.689 -13.356 -19.355 629 HE2 TYR 79 HE1 TYR 79 -13.457 -16.995 -17.265 630 HH TYR 79 HH TYR 79 -11.540 -15.674 -19.583 631 H THR 80 H THR 80 -14.042 -13.720 -12.006 632 HA THR 80 HA THR 80 -11.648 -15.389 -12.406 633 HB THR 80 HB THR 80 -11.590 -13.904 -10.414 634 HG1 THR 80 HG1 THR 80 -10.387 -15.758 -10.226 635 HG21 THR 80 HG21 THR 80 -13.032 -14.434 -8.497 636 HG22 THR 80 HG22 THR 80 -13.904 -15.609 -9.482 637 HG23 THR 80 HG23 THR 80 -13.975 -13.894 -9.885 638 H VAL 81 H VAL 81 -11.788 -17.576 -12.301 639 HA VAL 81 HA VAL 81 -14.495 -18.704 -12.093 640 HB VAL 81 HB VAL 81 -12.025 -19.935 -13.324 641 HG11 VAL 81 HG11 VAL 81 -13.190 -21.826 -13.026 642 HG12 VAL 81 HG12 VAL 81 -14.690 -20.961 -12.685 643 HG13 VAL 81 HG13 VAL 81 -14.191 -21.239 -14.354 644 HG21 VAL 81 HG21 VAL 81 -13.408 -19.576 -15.454 645 HG22 VAL 81 HG22 VAL 81 -14.330 -18.414 -14.500 646 HG23 VAL 81 HG23 VAL 81 -12.601 -18.174 -14.751 647 H LEU 82 H LEU 82 -14.961 -19.581 -10.193 648 HA LEU 82 HA LEU 82 -12.803 -20.852 -8.648 649 HB2 LEU 82 HB2 LEU 82 -15.320 -19.446 -7.868 650 HB3 LEU 82 HB3 LEU 82 -14.618 -20.645 -6.785 651 HG LEU 82 HG LEU 82 -13.952 -18.413 -6.123 652 HD11 LEU 82 HD11 LEU 82 -11.720 -18.861 -5.768 653 HD12 LEU 82 HD12 LEU 82 -11.494 -19.559 -7.372 654 HD13 LEU 82 HD13 LEU 82 -12.354 -20.467 -6.129 655 HD21 LEU 82 HD21 LEU 82 -12.859 -16.880 -7.503 656 HD22 LEU 82 HD22 LEU 82 -14.146 -17.529 -8.521 657 HD23 LEU 82 HD23 LEU 82 -12.488 -18.100 -8.722 658 H GLN 83 H GLN 83 -12.780 -22.990 -8.703 659 HA GLN 83 HA GLN 83 -15.346 -24.425 -8.815 660 HB2 GLN 83 HB2 GLN 83 -14.331 -26.112 -10.258 661 HB3 GLN 83 HB3 GLN 83 -14.257 -24.524 -11.012 662 HG2 GLN 83 HG2 GLN 83 -11.888 -24.408 -9.997 663 HG3 GLN 83 HG3 GLN 83 -12.050 -26.155 -9.834 664 HE21 GLN 83 HE21 GLN 83 -10.805 -23.861 -11.734 665 HE22 GLN 83 HE22 GLN 83 -10.856 -24.656 -13.266 666 H ASP 84 H ASP 84 -15.315 -26.570 -7.890 667 HA ASP 84 HA ASP 84 -13.103 -27.034 -6.008 668 HB2 ASP 84 HB2 ASP 84 -16.039 -26.867 -5.441 669 HB3 ASP 84 HB3 ASP 84 -15.036 -27.953 -4.483 670 H ASN 85 H ASN 85 -12.207 -28.934 -6.409 671 HA ASN 85 HA ASN 85 -11.905 -31.107 -7.009 672 HB2 ASN 85 HB2 ASN 85 -13.781 -31.260 -5.196 673 HB3 ASN 85 HB3 ASN 85 -14.823 -31.647 -6.563 674 HD21 ASN 85 HD21 ASN 85 -13.987 -33.276 -4.277 675 HD22 ASN 85 HD22 ASN 85 -13.252 -34.687 -4.950 676 HA PRO 86 HA PRO 86 -13.764 -30.176 -11.176 677 HB2 PRO 86 HB2 PRO 86 -11.392 -30.139 -12.495 678 HB3 PRO 86 HB3 PRO 86 -12.075 -28.712 -11.708 679 HG2 PRO 86 HG2 PRO 86 -9.960 -30.589 -10.723 680 HG3 PRO 86 HG3 PRO 86 -10.013 -28.817 -10.637 681 HD2 PRO 86 HD2 PRO 86 -10.641 -30.400 -8.530 682 HD3 PRO 86 HD3 PRO 86 -11.413 -28.825 -8.805 683 H ARG 87 H ARG 87 -14.688 -32.180 -11.452 684 HA ARG 87 HA ARG 87 -13.023 -34.535 -11.750 685 HB2 ARG 87 HB2 ARG 87 -15.311 -34.457 -10.597 686 HB3 ARG 87 HB3 ARG 87 -15.994 -34.385 -12.215 687 HG2 ARG 87 HG2 ARG 87 -15.263 -36.532 -12.751 688 HG3 ARG 87 HG3 ARG 87 -14.099 -36.564 -11.426 689 HD2 ARG 87 HD2 ARG 87 -16.212 -36.328 -9.924 690 HD3 ARG 87 HD3 ARG 87 -17.068 -36.908 -11.352 691 HE ARG 87 HE ARG 87 -14.959 -38.650 -10.926 692 HH11 ARG 87 HH11 ARG 87 -17.821 -37.612 -9.239 693 HH12 ARG 87 HH12 ARG 87 -18.034 -39.115 -8.406 694 HH21 ARG 87 HH21 ARG 87 -15.228 -40.635 -9.836 695 HH22 ARG 87 HH22 ARG 87 -16.557 -40.834 -8.745 696 H THR 88 H THR 88 -11.900 -33.604 -13.644 697 HA THR 88 HA THR 88 -13.476 -33.740 -16.119 698 HB THR 88 HB THR 88 -10.690 -32.638 -15.694 699 HG1 THR 88 HG1 THR 88 -13.232 -31.378 -15.957 700 HG21 THR 88 HG21 THR 88 -12.127 -33.368 -18.069 701 HG22 THR 88 HG22 THR 88 -10.499 -32.706 -17.913 702 HG23 THR 88 HG23 THR 88 -11.885 -31.622 -18.033 703 H ILE 89 H ILE 89 -13.501 -36.106 -15.921 704 HA ILE 89 HA ILE 89 -10.950 -37.426 -16.462 705 HB ILE 89 HB ILE 89 -13.617 -38.784 -16.146 706 HG12 ILE 89 HG12 ILE 89 -13.284 -37.410 -14.165 707 HG13 ILE 89 HG13 ILE 89 -13.021 -39.103 -13.762 708 HG21 ILE 89 HG21 ILE 89 -11.897 -40.529 -15.182 709 HG22 ILE 89 HG22 ILE 89 -12.181 -40.388 -16.916 710 HG23 ILE 89 HG23 ILE 89 -10.766 -39.628 -16.190 711 HD11 ILE 89 HD11 ILE 89 -10.508 -38.383 -14.348 712 HD12 ILE 89 HD12 ILE 89 -11.141 -36.842 -13.770 713 HD13 ILE 89 HD13 ILE 89 -11.209 -38.267 -12.733 714 H VAL 90 H VAL 90 -10.786 -38.992 -18.201 715 HA VAL 90 HA VAL 90 -11.415 -37.989 -20.698 716 HB VAL 90 HB VAL 90 -11.030 -40.378 -21.515 717 HG11 VAL 90 HG11 VAL 90 -8.832 -39.911 -21.593 718 HG12 VAL 90 HG12 VAL 90 -9.311 -38.398 -20.821 719 HG13 VAL 90 HG13 VAL 90 -8.702 -39.735 -19.844 720 HG21 VAL 90 HG21 VAL 90 -11.747 -41.249 -19.170 721 HG22 VAL 90 HG22 VAL 90 -10.450 -42.064 -20.044 722 HG23 VAL 90 HG23 VAL 90 -10.064 -40.939 -18.743 723 HA PRO 91 HA PRO 91 -15.598 -39.003 -21.557 724 HB2 PRO 91 HB2 PRO 91 -15.484 -39.554 -24.213 725 HB3 PRO 91 HB3 PRO 91 -15.328 -37.917 -23.563 726 HG2 PRO 91 HG2 PRO 91 -13.190 -39.813 -24.452 727 HG3 PRO 91 HG3 PRO 91 -13.337 -38.072 -24.753 728 HD2 PRO 91 HD2 PRO 91 -11.708 -39.087 -22.843 729 HD3 PRO 91 HD3 PRO 91 -12.514 -37.514 -22.673 730 H LYS 92 H LYS 92 -16.701 -40.778 -21.048 731 HA LYS 92 HA LYS 92 -15.823 -43.359 -22.158 732 HB2 LYS 92 HB2 LYS 92 -16.576 -44.402 -20.002 733 HB3 LYS 92 HB3 LYS 92 -15.143 -43.393 -19.866 734 HG2 LYS 92 HG2 LYS 92 -16.537 -41.559 -19.011 735 HG3 LYS 92 HG3 LYS 92 -17.950 -42.614 -19.102 736 HD2 LYS 92 HD2 LYS 92 -17.139 -44.025 -17.408 737 HD3 LYS 92 HD3 LYS 92 -15.501 -43.379 -17.537 738 HE2 LYS 92 HE2 LYS 92 -16.266 -42.353 -15.617 739 HE3 LYS 92 HE3 LYS 92 -16.624 -41.137 -16.843 740 HZ1 LYS 92 HZ1 LYS 92 -18.858 -41.536 -16.721 741 HZ2 LYS 92 HZ2 LYS 92 -18.419 -41.833 -15.115 742 HZ3 LYS 92 HZ3 LYS 92 -18.675 -43.127 -16.174 743 H SER 93 H SER 93 -17.371 -44.525 -23.117 744 HA SER 93 HA SER 93 -20.101 -43.481 -23.052 745 HB2 SER 93 HB2 SER 93 -18.900 -45.579 -24.873 746 HB3 SER 93 HB3 SER 93 -20.476 -44.812 -25.057 747 HG SER 93 HG SER 93 -19.524 -42.955 -25.648 748 H TYR 94 H TYR 94 -18.765 -46.774 -23.306 749 HA TYR 94 HA TYR 94 -19.995 -47.703 -20.924 750 HB2 TYR 94 HB2 TYR 94 -21.647 -49.233 -22.023 751 HB3 TYR 94 HB3 TYR 94 -22.063 -47.527 -22.135 752 HD1 TYR 94 HD2 TYR 94 -21.739 -46.324 -24.295 753 HD2 TYR 94 HD1 TYR 94 -21.252 -50.537 -23.971 754 HE1 TYR 94 HE2 TYR 94 -21.930 -46.527 -26.739 755 HE2 TYR 94 HE1 TYR 94 -21.440 -50.753 -26.414 756 HH TYR 94 HH TYR 94 -22.697 -49.031 -28.322 757 H ALA 95 H ALA 95 -18.879 -49.419 -20.259 758 HA ALA 95 HA ALA 95 -16.823 -50.547 -21.855 759 HB1 ALA 95 HB1 ALA 95 -17.882 -51.722 -19.298 760 HB2 ALA 95 HB2 ALA 95 -16.252 -51.838 -19.965 761 HB3 ALA 95 HB3 ALA 95 -16.840 -50.299 -19.336 762 H ASP 96 H ASP 96 -16.764 -52.351 -23.064 763 HA ASP 96 HA ASP 96 -18.481 -54.571 -22.752 764 HB2 ASP 96 HB2 ASP 96 -20.035 -54.344 -24.477 765 HB3 ASP 96 HB3 ASP 96 -19.999 -52.730 -23.773 766 H ASN 97 H ASN 97 -18.153 -56.206 -24.433 767 HA ASN 97 HA ASN 97 -15.578 -55.819 -25.812 768 HB2 ASN 97 HB2 ASN 97 -15.306 -57.468 -24.098 769 HB3 ASN 97 HB3 ASN 97 -16.785 -58.296 -24.576 770 HD21 ASN 97 HD21 ASN 97 -16.352 -60.156 -25.489 771 HD22 ASN 97 HD22 ASN 97 -15.059 -60.480 -26.589 772 H PHE 98 H PHE 98 -15.411 -56.313 -27.942 773 HA PHE 98 HA PHE 98 -17.909 -57.017 -29.314 774 HB2 PHE 98 HB2 PHE 98 -16.856 -56.057 -31.327 775 HB3 PHE 98 HB3 PHE 98 -16.913 -54.897 -30.003 776 HD1 PHE 98 HD2 PHE 98 -14.711 -57.168 -31.898 777 HD2 PHE 98 HD1 PHE 98 -14.939 -53.978 -29.089 778 HE1 PHE 98 HE2 PHE 98 -12.288 -56.810 -32.115 779 HE2 PHE 98 HE1 PHE 98 -12.515 -53.615 -29.302 780 HZ PHE 98 HZ PHE 98 -11.186 -55.032 -30.815 781 H THR 99 H THR 99 -17.865 -58.506 -31.081 782 HA THR 99 HA THR 99 -15.523 -60.206 -31.371 783 HB THR 99 HB THR 99 -18.117 -61.591 -30.780 784 HG1 THR 99 HG1 THR 99 -17.747 -61.497 -28.641 785 HG21 THR 99 HG21 THR 99 -16.845 -63.487 -30.594 786 HG22 THR 99 HG22 THR 99 -15.421 -62.608 -30.038 787 HG23 THR 99 HG23 THR 99 -15.860 -62.585 -31.745 788 H LYS 100 H LYS 100 -15.308 -60.907 -33.407 789 HA LYS 100 HA LYS 100 -17.680 -60.918 -35.147 790 HB2 LYS 100 HB2 LYS 100 -16.186 -58.877 -35.448 791 HB3 LYS 100 HB3 LYS 100 -14.962 -59.981 -36.060 792 HG2 LYS 100 HG2 LYS 100 -16.001 -59.154 -37.971 793 HG3 LYS 100 HG3 LYS 100 -16.738 -60.740 -37.733 794 HD2 LYS 100 HD2 LYS 100 -18.604 -59.560 -36.513 795 HD3 LYS 100 HD3 LYS 100 -17.904 -58.040 -37.075 796 HE2 LYS 100 HE2 LYS 100 -18.489 -60.207 -39.044 797 HE3 LYS 100 HE3 LYS 100 -19.811 -59.213 -38.433 798 HZ1 LYS 100 HZ1 LYS 100 -19.215 -57.909 -40.147 799 HZ2 LYS 100 HZ2 LYS 100 -17.635 -58.507 -40.220 800 HZ3 LYS 100 HZ3 LYS 100 -18.044 -57.336 -39.068 801 HA PRO 101 HA PRO 101 -15.311 -64.928 -35.346 802 HB2 PRO 101 HB2 PRO 101 -17.486 -66.515 -34.991 803 HB3 PRO 101 HB3 PRO 101 -16.543 -65.859 -33.647 804 HG2 PRO 101 HG2 PRO 101 -19.125 -64.882 -34.804 805 HG3 PRO 101 HG3 PRO 101 -18.651 -65.040 -33.103 806 HD2 PRO 101 HD2 PRO 101 -18.604 -62.672 -34.415 807 HD3 PRO 101 HD3 PRO 101 -17.453 -63.071 -33.124 808 H ARG 102 H ARG 102 -15.316 -66.429 -37.045 809 HA ARG 102 HA ARG 102 -16.755 -65.539 -39.413 810 HB2 ARG 102 HB2 ARG 102 -15.223 -66.848 -40.673 811 HB3 ARG 102 HB3 ARG 102 -14.283 -66.057 -39.417 812 HG2 ARG 102 HG2 ARG 102 -14.686 -68.269 -38.104 813 HG3 ARG 102 HG3 ARG 102 -15.012 -68.932 -39.707 814 HD2 ARG 102 HD2 ARG 102 -12.844 -68.410 -40.473 815 HD3 ARG 102 HD3 ARG 102 -12.529 -67.355 -39.097 816 HE ARG 102 HE ARG 102 -11.889 -69.187 -37.890 817 HH11 ARG 102 HH11 ARG 102 -13.689 -70.239 -40.679 818 HH12 ARG 102 HH12 ARG 102 -13.362 -71.920 -40.418 819 HH21 ARG 102 HH21 ARG 102 -11.451 -71.397 -37.536 820 HH22 ARG 102 HH22 ARG 102 -12.089 -72.579 -38.629 821 H ASP 103 H ASP 103 -18.004 -66.928 -40.726 822 HA ASP 103 HA ASP 103 -18.999 -69.345 -39.364 823 HB2 ASP 103 HB2 ASP 103 -21.225 -68.837 -39.924 824 HB3 ASP 103 HB3 ASP 103 -20.559 -67.301 -39.378 825 H MET 104 H MET 104 -20.110 -70.872 -40.883 826 HA MET 104 HA MET 104 -18.489 -71.125 -43.302 827 HB2 MET 104 HB2 MET 104 -18.588 -73.044 -41.770 828 HB3 MET 104 HB3 MET 104 -20.334 -73.113 -41.964 829 HG2 MET 104 HG2 MET 104 -19.712 -73.330 -44.508 830 HG3 MET 104 HG3 MET 104 -18.179 -73.900 -43.851 831 HE1 MET 104 HE1 MET 104 -19.424 -75.411 -45.703 832 HE2 MET 104 HE2 MET 104 -19.674 -77.046 -45.092 833 HE3 MET 104 HE3 MET 104 -21.060 -76.000 -45.409 Start of MODEL 9 1 H1 MET 1 H MET 1 -3.693 -10.232 -2.916 2 HA MET 1 HA MET 1 -6.178 -9.039 -1.903 3 HB2 MET 1 HB2 MET 1 -3.382 -8.141 -1.424 4 HB3 MET 1 HB3 MET 1 -4.595 -6.900 -1.712 5 HG2 MET 1 HG2 MET 1 -4.625 -7.082 0.575 6 HG3 MET 1 HG3 MET 1 -5.946 -8.149 0.107 7 HE1 MET 1 HE1 MET 1 -6.308 -10.163 0.654 8 HE2 MET 1 HE2 MET 1 -5.115 -11.296 0.019 9 HE3 MET 1 HE3 MET 1 -5.391 -11.188 1.759 10 H GLN 2 H GLN 2 -7.207 -7.701 -3.301 11 HA GLN 2 HA GLN 2 -5.890 -6.463 -5.519 12 HB2 GLN 2 HB2 GLN 2 -6.070 -8.751 -6.384 13 HB3 GLN 2 HB3 GLN 2 -7.801 -8.738 -6.078 14 HG2 GLN 2 HG2 GLN 2 -8.242 -7.330 -7.837 15 HG3 GLN 2 HG3 GLN 2 -6.619 -6.643 -7.834 16 HE21 GLN 2 HE21 GLN 2 -4.961 -7.721 -8.881 17 HE22 GLN 2 HE22 GLN 2 -5.253 -9.006 -9.998 18 H GLU 3 H GLU 3 -6.958 -4.663 -6.056 19 HA GLU 3 HA GLU 3 -9.792 -4.449 -6.091 20 HB2 GLU 3 HB2 GLU 3 -9.533 -4.384 -3.674 21 HB3 GLU 3 HB3 GLU 3 -8.334 -3.106 -3.810 22 HG2 GLU 3 HG2 GLU 3 -9.979 -1.562 -4.610 23 HG3 GLU 3 HG3 GLU 3 -11.194 -2.835 -4.699 24 H GLN 4 H GLN 4 -10.216 -3.041 -7.649 25 HA GLN 4 HA GLN 4 -8.374 -0.777 -8.043 26 HB2 GLN 4 HB2 GLN 4 -9.579 -2.639 -10.070 27 HB3 GLN 4 HB3 GLN 4 -9.078 -1.016 -10.522 28 HG2 GLN 4 HG2 GLN 4 -7.320 -3.159 -9.353 29 HG3 GLN 4 HG3 GLN 4 -7.345 -2.624 -11.032 30 HE21 GLN 4 HE21 GLN 4 -6.105 -2.089 -7.913 31 HE22 GLN 4 HE22 GLN 4 -5.188 -0.668 -8.263 32 H VAL 5 H VAL 5 -9.500 0.862 -9.638 33 HA VAL 5 HA VAL 5 -12.324 1.165 -8.878 34 HB VAL 5 HB VAL 5 -11.996 3.572 -8.533 35 HG11 VAL 5 HG11 VAL 5 -11.514 1.604 -6.761 36 HG12 VAL 5 HG12 VAL 5 -9.975 2.464 -6.695 37 HG13 VAL 5 HG13 VAL 5 -11.479 3.318 -6.351 38 HG21 VAL 5 HG21 VAL 5 -9.171 3.644 -8.138 39 HG22 VAL 5 HG22 VAL 5 -9.507 3.077 -9.775 40 HG23 VAL 5 HG23 VAL 5 -10.163 4.619 -9.223 41 H SER 6 H SER 6 -10.905 0.315 -11.354 42 HA SER 6 HA SER 6 -11.681 2.489 -13.174 43 HB2 SER 6 HB2 SER 6 -9.825 0.134 -13.482 44 HB3 SER 6 HB3 SER 6 -10.419 1.030 -14.880 45 HG SER 6 HG SER 6 -9.001 2.505 -14.452 46 H ASN 7 H ASN 7 -11.647 -1.071 -13.385 47 HA ASN 7 HA ASN 7 -14.385 -0.934 -14.465 48 HB2 ASN 7 HB2 ASN 7 -11.999 -2.497 -15.364 49 HB3 ASN 7 HB3 ASN 7 -13.603 -3.187 -15.590 50 HD21 ASN 7 HD21 ASN 7 -11.269 -1.142 -16.845 51 HD22 ASN 7 HD22 ASN 7 -12.218 -0.394 -18.081 52 H VAL 8 H VAL 8 -15.817 -2.609 -13.912 53 HA VAL 8 HA VAL 8 -15.505 -3.624 -11.276 54 HB VAL 8 HB VAL 8 -17.628 -4.864 -11.755 55 HG11 VAL 8 HG11 VAL 8 -17.756 -2.680 -10.784 56 HG12 VAL 8 HG12 VAL 8 -17.523 -1.912 -12.355 57 HG13 VAL 8 HG13 VAL 8 -19.008 -2.804 -12.019 58 HG21 VAL 8 HG21 VAL 8 -17.137 -5.122 -14.208 59 HG22 VAL 8 HG22 VAL 8 -18.772 -4.583 -13.822 60 HG23 VAL 8 HG23 VAL 8 -17.576 -3.424 -14.399 61 H ARG 9 H ARG 9 -16.036 -6.028 -10.854 62 HA ARG 9 HA ARG 9 -14.454 -7.713 -12.679 63 HB2 ARG 9 HB2 ARG 9 -14.462 -7.839 -9.658 64 HB3 ARG 9 HB3 ARG 9 -13.577 -8.917 -10.728 65 HG2 ARG 9 HG2 ARG 9 -11.986 -7.362 -11.214 66 HG3 ARG 9 HG3 ARG 9 -13.085 -6.002 -10.975 67 HD2 ARG 9 HD2 ARG 9 -12.384 -7.685 -8.625 68 HD3 ARG 9 HD3 ARG 9 -11.170 -6.565 -9.241 69 HE ARG 9 HE ARG 9 -13.462 -5.080 -9.009 70 HH11 ARG 9 HH11 ARG 9 -11.499 -6.994 -6.865 71 HH12 ARG 9 HH12 ARG 9 -11.875 -6.046 -5.464 72 HH21 ARG 9 HH21 ARG 9 -13.964 -3.824 -7.173 73 HH22 ARG 9 HH22 ARG 9 -13.277 -4.244 -5.639 74 H ALA 10 H ALA 10 -15.126 -9.839 -12.944 75 HA ALA 10 HA ALA 10 -17.865 -10.376 -12.019 76 HB1 ALA 10 HB1 ALA 10 -17.215 -12.244 -13.985 77 HB2 ALA 10 HB2 ALA 10 -18.244 -10.822 -14.161 78 HB3 ALA 10 HB3 ALA 10 -16.527 -10.720 -14.545 79 H ARG 11 H ARG 11 -18.110 -11.808 -10.445 80 HA ARG 11 HA ARG 11 -15.953 -13.717 -9.905 81 HB2 ARG 11 HB2 ARG 11 -18.291 -12.824 -8.212 82 HB3 ARG 11 HB3 ARG 11 -17.112 -14.032 -7.719 83 HG2 ARG 11 HG2 ARG 11 -15.341 -12.382 -7.806 84 HG3 ARG 11 HG3 ARG 11 -16.480 -11.165 -8.385 85 HD2 ARG 11 HD2 ARG 11 -17.788 -11.549 -6.266 86 HD3 ARG 11 HD3 ARG 11 -16.429 -12.516 -5.696 87 HE ARG 11 HE ARG 11 -16.556 -9.646 -5.900 88 HH11 ARG 11 HH11 ARG 11 -14.478 -12.433 -5.725 89 HH12 ARG 11 HH12 ARG 11 -13.123 -11.547 -5.108 90 HH21 ARG 11 HH21 ARG 11 -14.778 -8.468 -5.089 91 HH22 ARG 11 HH22 ARG 11 -13.296 -9.292 -4.747 92 H ILE 12 H ILE 12 -16.242 -15.506 -11.106 93 HA ILE 12 HA ILE 12 -18.923 -16.635 -11.390 94 HB ILE 12 HB ILE 12 -16.329 -17.468 -12.693 95 HG12 ILE 12 HG12 ILE 12 -18.679 -16.135 -14.024 96 HG13 ILE 12 HG13 ILE 12 -17.382 -15.196 -13.292 97 HG21 ILE 12 HG21 ILE 12 -19.153 -18.446 -13.003 98 HG22 ILE 12 HG22 ILE 12 -17.918 -18.704 -14.233 99 HG23 ILE 12 HG23 ILE 12 -17.706 -19.377 -12.618 100 HD11 ILE 12 HD11 ILE 12 -17.089 -17.195 -15.520 101 HD12 ILE 12 HD12 ILE 12 -17.030 -15.439 -15.669 102 HD13 ILE 12 HD13 ILE 12 -15.772 -16.291 -14.773 103 H TYR 13 H TYR 13 -19.533 -18.586 -10.571 104 HA TYR 13 HA TYR 13 -17.556 -20.216 -9.163 105 HB2 TYR 13 HB2 TYR 13 -18.369 -18.807 -7.399 106 HB3 TYR 13 HB3 TYR 13 -20.039 -19.050 -7.898 107 HD1 TYR 13 HD1 TYR 13 -17.075 -20.984 -6.707 108 HD2 TYR 13 HD2 TYR 13 -21.315 -20.641 -6.801 109 HE1 TYR 13 HE1 TYR 13 -17.256 -22.878 -5.150 110 HE2 TYR 13 HE2 TYR 13 -21.508 -22.534 -5.242 111 HH TYR 13 HH TYR 13 -19.340 -23.576 -3.334 112 H LYS 14 H LYS 14 -18.108 -22.385 -8.959 113 HA LYS 14 HA LYS 14 -20.425 -23.214 -10.575 114 HB2 LYS 14 HB2 LYS 14 -17.964 -23.852 -11.173 115 HB3 LYS 14 HB3 LYS 14 -18.143 -25.034 -9.884 116 HG2 LYS 14 HG2 LYS 14 -20.239 -25.806 -11.111 117 HG3 LYS 14 HG3 LYS 14 -19.647 -24.848 -12.471 118 HD2 LYS 14 HD2 LYS 14 -18.814 -26.984 -12.899 119 HD3 LYS 14 HD3 LYS 14 -17.448 -26.148 -12.157 120 HE2 LYS 14 HE2 LYS 14 -17.426 -28.114 -10.978 121 HE3 LYS 14 HE3 LYS 14 -18.463 -27.133 -9.943 122 HZ1 LYS 14 HZ1 LYS 14 -20.372 -28.202 -10.739 123 HZ2 LYS 14 HZ2 LYS 14 -19.262 -29.451 -10.480 124 HZ3 LYS 14 HZ3 LYS 14 -19.561 -28.897 -12.050 125 HA PRO 15 HA PRO 15 -21.700 -24.413 -6.349 126 HB2 PRO 15 HB2 PRO 15 -24.355 -24.205 -6.874 127 HB3 PRO 15 HB3 PRO 15 -23.352 -22.819 -6.430 128 HG2 PRO 15 HG2 PRO 15 -24.262 -23.710 -9.140 129 HG3 PRO 15 HG3 PRO 15 -24.200 -22.072 -8.463 130 HD2 PRO 15 HD2 PRO 15 -22.311 -23.020 -10.156 131 HD3 PRO 15 HD3 PRO 15 -21.942 -21.852 -8.870 132 H ALA 16 H ALA 16 -22.964 -26.235 -5.599 133 HA ALA 16 HA ALA 16 -22.858 -28.458 -7.475 134 HB1 ALA 16 HB1 ALA 16 -23.656 -28.697 -4.598 135 HB2 ALA 16 HB2 ALA 16 -22.857 -29.878 -5.636 136 HB3 ALA 16 HB3 ALA 16 -21.968 -28.470 -5.055 137 H LYS 17 H LYS 17 -24.656 -30.087 -7.384 138 HA LYS 17 HA LYS 17 -27.116 -28.807 -8.051 139 HB2 LYS 17 HB2 LYS 17 -27.952 -31.112 -8.393 140 HB3 LYS 17 HB3 LYS 17 -26.435 -30.811 -9.229 141 HG2 LYS 17 HG2 LYS 17 -25.217 -32.138 -7.758 142 HG3 LYS 17 HG3 LYS 17 -26.471 -32.078 -6.517 143 HD2 LYS 17 HD2 LYS 17 -27.085 -33.317 -9.164 144 HD3 LYS 17 HD3 LYS 17 -26.148 -34.228 -7.978 145 HE2 LYS 17 HE2 LYS 17 -27.905 -34.132 -6.388 146 HE3 LYS 17 HE3 LYS 17 -28.785 -32.931 -7.332 147 HZ1 LYS 17 HZ1 LYS 17 -28.313 -35.759 -8.106 148 HZ2 LYS 17 HZ2 LYS 17 -29.105 -34.611 -9.061 149 HZ3 LYS 17 HZ3 LYS 17 -29.781 -35.097 -7.589 150 H SER 18 H SER 18 -29.211 -29.942 -7.135 151 HA SER 18 HA SER 18 -29.054 -30.404 -4.267 152 HB2 SER 18 HB2 SER 18 -29.265 -27.997 -4.320 153 HB3 SER 18 HB3 SER 18 -30.597 -28.096 -5.472 154 HG SER 18 HG SER 18 -30.565 -28.845 -2.747 155 H THR 19 H THR 19 -31.119 -31.128 -3.359 156 HA THR 19 HA THR 19 -32.667 -32.600 -5.375 157 HB THR 19 HB THR 19 -32.896 -33.164 -2.446 158 HG1 THR 19 HG1 THR 19 -30.954 -34.038 -2.352 159 HG21 THR 19 HG21 THR 19 -33.975 -34.282 -4.723 160 HG22 THR 19 HG22 THR 19 -33.895 -35.047 -3.137 161 HG23 THR 19 HG23 THR 19 -32.642 -35.369 -4.336 162 H MET 20 H MET 20 -34.816 -32.311 -5.622 163 HA MET 20 HA MET 20 -36.829 -31.248 -5.540 164 HB2 MET 20 HB2 MET 20 -36.691 -32.630 -3.336 165 HB3 MET 20 HB3 MET 20 -36.522 -31.061 -2.561 166 HG2 MET 20 HG2 MET 20 -38.650 -30.388 -3.732 167 HG3 MET 20 HG3 MET 20 -38.837 -32.084 -4.175 168 HE1 MET 20 HE1 MET 20 -40.370 -33.426 -3.023 169 HE2 MET 20 HE2 MET 20 -41.124 -33.056 -1.473 170 HE3 MET 20 HE3 MET 20 -41.330 -31.958 -2.839 171 H GLN 21 H GLN 21 -35.031 -29.476 -6.285 172 HA GLN 21 HA GLN 21 -35.500 -27.095 -4.616 173 HB2 GLN 21 HB2 GLN 21 -33.101 -27.882 -5.027 174 HB3 GLN 21 HB3 GLN 21 -33.333 -27.364 -6.691 175 HG2 GLN 21 HG2 GLN 21 -33.805 -25.512 -4.384 176 HG3 GLN 21 HG3 GLN 21 -32.203 -25.744 -5.082 177 HE21 GLN 21 HE21 GLN 21 -31.888 -25.189 -7.299 178 HE22 GLN 21 HE22 GLN 21 -32.885 -23.993 -8.049 179 H SER 22 H SER 22 -37.533 -26.677 -5.570 180 HA SER 22 HA SER 22 -37.403 -25.781 -8.375 181 HB2 SER 22 HB2 SER 22 -39.824 -26.198 -8.498 182 HB3 SER 22 HB3 SER 22 -38.951 -27.663 -8.048 183 HG SER 22 HG SER 22 -40.684 -26.081 -6.544 184 H GLY 23 H GLY 23 -38.402 -23.824 -8.939 185 HA2 GLY 23 HA2 GLY 23 -39.621 -22.172 -6.906 186 HA3 GLY 23 HA3 GLY 23 -38.019 -21.635 -7.394 187 H HIS 24 H HIS 24 -37.687 -20.924 -9.546 188 HA HIS 24 HA HIS 24 -40.180 -20.181 -10.931 189 HB2 HIS 24 HB2 HIS 24 -37.654 -18.656 -10.426 190 HB3 HIS 24 HB3 HIS 24 -38.590 -18.308 -11.878 191 HD1 HIS 24 HD1 HIS 24 -38.161 -16.921 -8.752 192 HD2 HIS 24 HD2 HIS 24 -41.559 -18.081 -10.843 193 HE1 HIS 24 HE1 HIS 24 -40.058 -15.628 -7.725 194 H SER 25 H SER 25 -36.863 -21.284 -11.284 195 HA SER 25 HA SER 25 -37.534 -22.504 -13.825 196 HB2 SER 25 HB2 SER 25 -35.172 -20.623 -13.703 197 HB3 SER 25 HB3 SER 25 -35.823 -21.445 -15.120 198 HG SER 25 HG SER 25 -36.411 -19.066 -14.430 199 H LYS 26 H LYS 26 -36.382 -24.329 -14.211 200 HA LYS 26 HA LYS 26 -34.418 -25.086 -12.165 201 HB2 LYS 26 HB2 LYS 26 -36.544 -26.469 -12.703 202 HB3 LYS 26 HB3 LYS 26 -35.662 -26.982 -14.136 203 HG2 LYS 26 HG2 LYS 26 -35.101 -28.662 -12.710 204 HG3 LYS 26 HG3 LYS 26 -33.788 -27.534 -12.367 205 HD2 LYS 26 HD2 LYS 26 -34.950 -26.714 -10.413 206 HD3 LYS 26 HD3 LYS 26 -36.355 -27.712 -10.790 207 HE2 LYS 26 HE2 LYS 26 -33.618 -28.855 -10.281 208 HE3 LYS 26 HE3 LYS 26 -34.803 -28.598 -9.001 209 HZ1 LYS 26 HZ1 LYS 26 -35.438 -30.665 -9.524 210 HZ2 LYS 26 HZ2 LYS 26 -34.718 -30.629 -11.054 211 HZ3 LYS 26 HZ3 LYS 26 -36.243 -29.937 -10.822 212 H LEU 27 H LEU 27 -33.555 -23.349 -14.185 213 HA LEU 27 HA LEU 27 -31.705 -25.101 -15.663 214 HB2 LEU 27 HB2 LEU 27 -33.208 -22.683 -16.597 215 HB3 LEU 27 HB3 LEU 27 -31.692 -23.157 -17.360 216 HG LEU 27 HG LEU 27 -32.977 -25.482 -17.555 217 HD11 LEU 27 HD11 LEU 27 -35.251 -25.386 -17.644 218 HD12 LEU 27 HD12 LEU 27 -35.276 -23.673 -18.062 219 HD13 LEU 27 HD13 LEU 27 -34.961 -24.169 -16.399 220 HD21 LEU 27 HD21 LEU 27 -33.667 -24.767 -19.826 221 HD22 LEU 27 HD22 LEU 27 -32.011 -24.314 -19.422 222 HD23 LEU 27 HD23 LEU 27 -33.294 -23.103 -19.379 223 H LYS 28 H LYS 28 -30.527 -24.639 -13.559 224 HA LYS 28 HA LYS 28 -28.759 -22.354 -14.011 225 HB2 LYS 28 HB2 LYS 28 -30.554 -21.769 -12.308 226 HB3 LYS 28 HB3 LYS 28 -29.829 -22.982 -11.260 227 HG2 LYS 28 HG2 LYS 28 -27.948 -21.013 -12.352 228 HG3 LYS 28 HG3 LYS 28 -29.172 -20.358 -11.264 229 HD2 LYS 28 HD2 LYS 28 -27.745 -22.840 -10.453 230 HD3 LYS 28 HD3 LYS 28 -26.876 -21.306 -10.357 231 HE2 LYS 28 HE2 LYS 28 -29.615 -21.638 -9.176 232 HE3 LYS 28 HE3 LYS 28 -28.169 -22.105 -8.285 233 HZ1 LYS 28 HZ1 LYS 28 -28.742 -19.398 -9.361 234 HZ2 LYS 28 HZ2 LYS 28 -27.342 -19.842 -8.523 235 HZ3 LYS 28 HZ3 LYS 28 -28.839 -19.859 -7.736 236 H ALA 29 H ALA 29 -26.696 -22.950 -13.901 237 HA ALA 29 HA ALA 29 -25.976 -25.271 -12.243 238 HB1 ALA 29 HB1 ALA 29 -25.097 -26.435 -13.941 239 HB2 ALA 29 HB2 ALA 29 -26.090 -25.399 -14.968 240 HB3 ALA 29 HB3 ALA 29 -24.396 -24.999 -14.689 241 H TRP 30 H TRP 30 -24.886 -22.358 -13.922 242 HA TRP 30 HA TRP 30 -22.575 -22.240 -12.100 243 HB2 TRP 30 HB2 TRP 30 -22.992 -21.084 -14.856 244 HB3 TRP 30 HB3 TRP 30 -21.665 -20.591 -13.808 245 HD1 TRP 30 HD1 TRP 30 -22.966 -23.689 -15.697 246 HE1 TRP 30 HE1 TRP 30 -20.983 -25.280 -16.099 247 HE3 TRP 30 HE3 TRP 30 -19.383 -21.209 -13.025 248 HZ2 TRP 30 HZ2 TRP 30 -18.260 -25.459 -15.377 249 HZ3 TRP 30 HZ3 TRP 30 -17.114 -22.157 -12.930 250 HH2 TRP 30 HH2 TRP 30 -16.567 -24.239 -14.082 251 H LYS 31 H LYS 31 -21.951 -20.114 -11.311 252 HA LYS 31 HA LYS 31 -24.216 -18.239 -11.132 253 HB2 LYS 31 HB2 LYS 31 -22.548 -19.443 -8.972 254 HB3 LYS 31 HB3 LYS 31 -23.074 -17.776 -8.776 255 HG2 LYS 31 HG2 LYS 31 -25.387 -18.440 -8.958 256 HG3 LYS 31 HG3 LYS 31 -24.910 -20.108 -9.286 257 HD2 LYS 31 HD2 LYS 31 -25.409 -20.185 -7.030 258 HD3 LYS 31 HD3 LYS 31 -23.664 -19.918 -7.009 259 HE2 LYS 31 HE2 LYS 31 -23.892 -17.682 -6.404 260 HE3 LYS 31 HE3 LYS 31 -25.566 -17.605 -6.950 261 HZ1 LYS 31 HZ1 LYS 31 -26.011 -19.267 -5.091 262 HZ2 LYS 31 HZ2 LYS 31 -25.709 -17.664 -4.644 263 HZ3 LYS 31 HZ3 LYS 31 -24.493 -18.828 -4.486 264 H LEU 32 H LEU 32 -23.674 -16.025 -10.855 265 HA LEU 32 HA LEU 32 -20.869 -15.288 -11.190 266 HB2 LEU 32 HB2 LEU 32 -21.843 -15.518 -13.453 267 HB3 LEU 32 HB3 LEU 32 -23.047 -14.304 -13.028 268 HG LEU 32 HG LEU 32 -21.049 -13.569 -14.444 269 HD11 LEU 32 HD11 LEU 32 -22.666 -12.239 -12.708 270 HD12 LEU 32 HD12 LEU 32 -21.500 -11.475 -13.788 271 HD13 LEU 32 HD13 LEU 32 -21.066 -11.799 -12.109 272 HD21 LEU 32 HD21 LEU 32 -18.967 -13.429 -13.566 273 HD22 LEU 32 HD22 LEU 32 -19.540 -14.791 -12.603 274 HD23 LEU 32 HD23 LEU 32 -19.555 -13.162 -11.924 275 H GLU 33 H GLU 33 -20.334 -13.456 -10.141 276 HA GLU 33 HA GLU 33 -22.493 -11.682 -9.235 277 HB2 GLU 33 HB2 GLU 33 -22.043 -13.060 -7.332 278 HB3 GLU 33 HB3 GLU 33 -20.306 -12.886 -7.542 279 HG2 GLU 33 HG2 GLU 33 -21.044 -11.540 -5.693 280 HG3 GLU 33 HG3 GLU 33 -20.499 -10.497 -7.005 281 H PHE 34 H PHE 34 -22.048 -9.891 -10.374 282 HA PHE 34 HA PHE 34 -19.310 -9.035 -10.795 283 HB2 PHE 34 HB2 PHE 34 -20.360 -7.199 -12.112 284 HB3 PHE 34 HB3 PHE 34 -20.838 -8.803 -12.655 285 HD1 PHE 34 HD1 PHE 34 -21.939 -5.803 -10.831 286 HD2 PHE 34 HD2 PHE 34 -23.098 -9.522 -12.545 287 HE1 PHE 34 HE1 PHE 34 -24.305 -5.173 -10.590 288 HE2 PHE 34 HE2 PHE 34 -25.465 -8.898 -12.308 289 HZ PHE 34 HZ PHE 34 -26.072 -6.720 -11.330 290 H GLU 35 H GLU 35 -18.316 -7.317 -9.855 291 HA GLU 35 HA GLU 35 -19.194 -6.454 -7.322 292 HB2 GLU 35 HB2 GLU 35 -16.972 -5.702 -9.164 293 HB3 GLU 35 HB3 GLU 35 -17.343 -4.624 -7.825 294 HG2 GLU 35 HG2 GLU 35 -16.641 -7.542 -7.601 295 HG3 GLU 35 HG3 GLU 35 -15.574 -6.185 -7.246 296 HA PRO 36 HA PRO 36 -21.738 -2.964 -8.087 297 HB2 PRO 36 HB2 PRO 36 -20.945 -1.229 -6.156 298 HB3 PRO 36 HB3 PRO 36 -21.879 -2.689 -5.810 299 HG2 PRO 36 HG2 PRO 36 -18.935 -2.220 -5.551 300 HG3 PRO 36 HG3 PRO 36 -20.037 -3.054 -4.440 301 HD2 PRO 36 HD2 PRO 36 -18.414 -4.383 -6.153 302 HD3 PRO 36 HD3 PRO 36 -20.007 -5.001 -5.673 303 H SER 37 H SER 37 -21.778 -1.184 -9.353 304 HA SER 37 HA SER 37 -19.187 0.032 -10.045 305 HB2 SER 37 HB2 SER 37 -20.255 -1.096 -11.932 306 HB3 SER 37 HB3 SER 37 -21.727 -0.159 -11.683 307 HG SER 37 HG SER 37 -19.240 1.094 -12.146 308 H CYS 38 H CYS 38 -22.567 1.083 -10.406 309 HA CYS 38 HA CYS 38 -22.281 3.231 -8.537 310 HB2 CYS 38 HB2 CYS 38 -22.450 5.082 -10.098 311 HB3 CYS 38 HB3 CYS 38 -21.014 4.133 -10.466 312 HG CYS 38 HG CYS 38 -22.644 2.685 -12.495 313 H THR 39 H THR 39 -24.245 4.607 -8.470 314 HA THR 39 HA THR 39 -26.577 3.003 -8.568 315 HB THR 39 HB THR 39 -26.576 6.008 -8.331 316 HG1 THR 39 HG1 THR 39 -25.140 5.446 -6.780 317 HG21 THR 39 HG21 THR 39 -28.348 3.857 -7.165 318 HG22 THR 39 HG22 THR 39 -28.762 4.934 -8.499 319 HG23 THR 39 HG23 THR 39 -28.514 5.590 -6.882 320 H GLN 40 H GLN 40 -28.027 2.704 -10.135 321 HA GLN 40 HA GLN 40 -27.604 3.824 -12.727 322 HB2 GLN 40 HB2 GLN 40 -28.510 1.514 -12.229 323 HB3 GLN 40 HB3 GLN 40 -30.027 2.288 -11.795 324 HG2 GLN 40 HG2 GLN 40 -30.326 1.600 -13.998 325 HG3 GLN 40 HG3 GLN 40 -29.974 3.324 -14.118 326 HE21 GLN 40 HE21 GLN 40 -29.313 3.062 -16.267 327 HE22 GLN 40 HE22 GLN 40 -27.784 2.362 -16.665 328 H TYR 41 H TYR 41 -28.919 5.231 -13.894 329 HA TYR 41 HA TYR 41 -30.303 7.189 -12.273 330 HB2 TYR 41 HB2 TYR 41 -29.959 7.184 -15.274 331 HB3 TYR 41 HB3 TYR 41 -30.337 8.560 -14.244 332 HD1 TYR 41 HD2 TYR 41 -28.575 9.369 -12.617 333 HD2 TYR 41 HD1 TYR 41 -27.727 6.580 -15.716 334 HE1 TYR 41 HE2 TYR 41 -26.177 9.881 -12.414 335 HE2 TYR 41 HE1 TYR 41 -25.327 7.083 -15.520 336 HH TYR 41 HH TYR 41 -23.753 8.046 -14.154 337 H THR 42 H THR 42 -32.444 7.966 -12.782 338 HA THR 42 HA THR 42 -34.366 5.941 -12.920 339 HB THR 42 HB THR 42 -35.968 7.904 -13.435 340 HG1 THR 42 HG1 THR 42 -34.879 9.623 -14.048 341 HG21 THR 42 HG21 THR 42 -35.237 6.858 -11.152 342 HG22 THR 42 HG22 THR 42 -36.125 8.382 -11.179 343 HG23 THR 42 HG23 THR 42 -34.377 8.384 -10.949 344 H GLU 43 H GLU 43 -36.252 6.076 -14.564 345 HA GLU 43 HA GLU 43 -35.251 6.472 -17.291 346 HB2 GLU 43 HB2 GLU 43 -36.188 3.925 -16.067 347 HB3 GLU 43 HB3 GLU 43 -36.653 4.250 -17.730 348 HG2 GLU 43 HG2 GLU 43 -34.200 4.659 -18.193 349 HG3 GLU 43 HG3 GLU 43 -33.888 3.971 -16.600 350 HA PRO 44 HA PRO 44 -39.193 8.175 -18.183 351 HB2 PRO 44 HB2 PRO 44 -39.645 7.313 -20.718 352 HB3 PRO 44 HB3 PRO 44 -38.443 8.548 -20.324 353 HG2 PRO 44 HG2 PRO 44 -38.057 5.623 -20.837 354 HG3 PRO 44 HG3 PRO 44 -37.091 6.996 -21.407 355 HD2 PRO 44 HD2 PRO 44 -36.339 5.457 -19.310 356 HD3 PRO 44 HD3 PRO 44 -35.954 7.188 -19.411 357 H LEU 45 H LEU 45 -38.768 4.753 -18.302 358 HA LEU 45 HA LEU 45 -41.686 4.362 -18.226 359 HB2 LEU 45 HB2 LEU 45 -41.063 1.950 -18.780 360 HB3 LEU 45 HB3 LEU 45 -40.921 3.153 -20.060 361 HG LEU 45 HG LEU 45 -38.450 3.253 -19.510 362 HD11 LEU 45 HD11 LEU 45 -37.770 0.914 -18.500 363 HD12 LEU 45 HD12 LEU 45 -39.331 1.071 -17.696 364 HD13 LEU 45 HD13 LEU 45 -38.093 2.306 -17.466 365 HD21 LEU 45 HD21 LEU 45 -39.404 0.555 -20.441 366 HD22 LEU 45 HD22 LEU 45 -37.939 1.417 -20.915 367 HD23 LEU 45 HD23 LEU 45 -39.519 2.013 -21.429 368 H MET 46 H MET 46 -39.952 5.116 -15.985 369 HA MET 46 HA MET 46 -39.337 2.962 -14.317 370 HB2 MET 46 HB2 MET 46 -39.399 4.585 -12.480 371 HB3 MET 46 HB3 MET 46 -38.557 5.237 -13.879 372 HG2 MET 46 HG2 MET 46 -40.733 6.365 -14.496 373 HG3 MET 46 HG3 MET 46 -41.309 5.911 -12.893 374 HE1 MET 46 HE1 MET 46 -41.009 8.855 -14.276 375 HE2 MET 46 HE2 MET 46 -39.600 9.778 -13.755 376 HE3 MET 46 HE3 MET 46 -39.425 8.514 -14.974 377 H ASN 47 H ASN 47 -40.442 2.075 -12.515 378 HA ASN 47 HA ASN 47 -43.307 1.843 -12.958 379 HB2 ASN 47 HB2 ASN 47 -41.823 -0.159 -12.572 380 HB3 ASN 47 HB3 ASN 47 -41.618 0.394 -10.913 381 HD21 ASN 47 HD21 ASN 47 -43.163 -0.024 -9.444 382 HD22 ASN 47 HD22 ASN 47 -44.635 -0.861 -9.787 383 H TRP 48 H TRP 48 -44.682 3.132 -11.944 384 HA TRP 48 HA TRP 48 -43.863 4.625 -9.605 385 HB2 TRP 48 HB2 TRP 48 -46.151 4.714 -11.507 386 HB3 TRP 48 HB3 TRP 48 -46.413 5.364 -9.891 387 HD1 TRP 48 HD1 TRP 48 -43.964 5.849 -12.859 388 HE1 TRP 48 HE1 TRP 48 -43.215 8.311 -12.872 389 HE3 TRP 48 HE3 TRP 48 -46.328 7.440 -8.614 390 HZ2 TRP 48 HZ2 TRP 48 -43.577 10.622 -11.292 391 HZ3 TRP 48 HZ3 TRP 48 -46.075 9.790 -7.934 392 HH2 TRP 48 HH2 TRP 48 -44.727 11.347 -9.247 393 H THR 49 H THR 49 -45.090 4.676 -7.630 394 HA THR 49 HA THR 49 -46.116 3.732 -5.829 395 HB THR 49 HB THR 49 -47.573 1.824 -7.635 396 HG1 THR 49 HG1 THR 49 -48.738 3.418 -8.456 397 HG21 THR 49 HG21 THR 49 -49.396 2.236 -6.022 398 HG22 THR 49 HG22 THR 49 -48.333 3.317 -5.121 399 HG23 THR 49 HG23 THR 49 -47.948 1.601 -5.244 400 H GLY 50 H GLY 50 -43.606 2.775 -6.441 401 HA2 GLY 50 HA2 GLY 50 -43.855 -0.058 -5.647 402 HA3 GLY 50 HA3 GLY 50 -42.657 0.462 -6.822 403 H SER 51 H SER 51 -40.946 -0.303 -5.556 404 HA SER 51 HA SER 51 -40.582 0.661 -2.863 405 HB2 SER 51 HB2 SER 51 -38.471 -0.701 -4.527 406 HB3 SER 51 HB3 SER 51 -38.671 -0.722 -2.775 407 HG SER 51 HG SER 51 -39.587 -2.580 -3.253 408 H HIS 52 H HIS 52 -38.340 1.592 -2.312 409 HA HIS 52 HA HIS 52 -37.977 3.958 -3.977 410 HB2 HIS 52 HB2 HIS 52 -36.710 4.857 -2.086 411 HB3 HIS 52 HB3 HIS 52 -38.280 4.264 -1.556 412 HD1 HIS 52 HD1 HIS 52 -38.292 2.545 0.266 413 HD2 HIS 52 HD2 HIS 52 -34.516 3.096 -1.379 414 HE1 HIS 52 HE1 HIS 52 -36.724 1.229 1.726 415 H ASP 53 H ASP 53 -35.890 4.685 -4.637 416 HA ASP 53 HA ASP 53 -34.249 2.596 -5.665 417 HB2 ASP 53 HB2 ASP 53 -32.846 4.424 -6.543 418 HB3 ASP 53 HB3 ASP 53 -34.553 4.683 -6.897 419 H THR 54 H THR 54 -32.191 1.970 -5.092 420 HA THR 54 HA THR 54 -30.638 3.242 -3.090 421 HB THR 54 HB THR 54 -32.424 2.278 -1.643 422 HG1 THR 54 HG1 THR 54 -30.938 1.851 -0.157 423 HG21 THR 54 HG21 THR 54 -32.948 0.062 -1.576 424 HG22 THR 54 HG22 THR 54 -31.322 -0.449 -2.028 425 HG23 THR 54 HG23 THR 54 -32.433 0.150 -3.259 426 H LYS 55 H LYS 55 -28.730 1.901 -2.460 427 HA LYS 55 HA LYS 55 -27.889 0.304 -4.763 428 HB2 LYS 55 HB2 LYS 55 -26.396 1.697 -2.551 429 HB3 LYS 55 HB3 LYS 55 -25.605 0.531 -3.604 430 HG2 LYS 55 HG2 LYS 55 -26.292 1.916 -5.552 431 HG3 LYS 55 HG3 LYS 55 -26.904 3.121 -4.417 432 HD2 LYS 55 HD2 LYS 55 -24.076 2.128 -4.256 433 HD3 LYS 55 HD3 LYS 55 -24.527 3.424 -5.367 434 HE2 LYS 55 HE2 LYS 55 -23.922 4.645 -3.525 435 HE3 LYS 55 HE3 LYS 55 -25.646 4.440 -3.219 436 HZ1 LYS 55 HZ1 LYS 55 -23.953 2.339 -2.169 437 HZ2 LYS 55 HZ2 LYS 55 -25.262 3.136 -1.453 438 HZ3 LYS 55 HZ3 LYS 55 -23.730 3.855 -1.451 439 H GLN 56 H GLN 56 -27.912 -1.836 -4.658 440 HA GLN 56 HA GLN 56 -27.236 -3.178 -2.161 441 HB2 GLN 56 HB2 GLN 56 -29.897 -3.282 -3.494 442 HB3 GLN 56 HB3 GLN 56 -29.265 -4.774 -2.809 443 HG2 GLN 56 HG2 GLN 56 -28.866 -3.290 -0.698 444 HG3 GLN 56 HG3 GLN 56 -30.087 -2.259 -1.444 445 HE21 GLN 56 HE21 GLN 56 -30.948 -3.037 0.793 446 HE22 GLN 56 HE22 GLN 56 -32.008 -4.399 0.723 447 H GLN 57 H GLN 57 -25.843 -4.762 -2.556 448 HA GLN 57 HA GLN 57 -24.879 -5.416 -5.066 449 HB2 GLN 57 HB2 GLN 57 -24.184 -6.039 -2.492 450 HB3 GLN 57 HB3 GLN 57 -24.710 -7.599 -3.108 451 HG2 GLN 57 HG2 GLN 57 -23.164 -7.107 -5.096 452 HG3 GLN 57 HG3 GLN 57 -22.465 -5.866 -4.057 453 HE21 GLN 57 HE21 GLN 57 -23.593 -9.198 -3.567 454 HE22 GLN 57 HE22 GLN 57 -22.144 -9.757 -2.812 455 H VAL 58 H VAL 58 -25.547 -6.688 -6.671 456 HA VAL 58 HA VAL 58 -27.658 -8.666 -6.103 457 HB VAL 58 HB VAL 58 -28.689 -8.191 -8.252 458 HG11 VAL 58 HG11 VAL 58 -29.946 -6.680 -7.222 459 HG12 VAL 58 HG12 VAL 58 -28.668 -6.464 -6.025 460 HG13 VAL 58 HG13 VAL 58 -28.712 -5.445 -7.464 461 HG21 VAL 58 HG21 VAL 58 -27.752 -5.842 -9.207 462 HG22 VAL 58 HG22 VAL 58 -26.258 -6.573 -8.622 463 HG23 VAL 58 HG23 VAL 58 -27.249 -7.422 -9.808 464 H CYS 59 H CYS 59 -27.400 -10.653 -6.970 465 HA CYS 59 HA CYS 59 -25.111 -11.049 -8.783 466 HB2 CYS 59 HB2 CYS 59 -24.627 -13.138 -7.713 467 HB3 CYS 59 HB3 CYS 59 -24.765 -11.919 -6.453 468 HG CYS 59 HG CYS 59 -26.713 -14.599 -7.063 469 H LEU 60 H LEU 60 -25.284 -12.789 -10.301 470 HA LEU 60 HA LEU 60 -28.049 -13.652 -10.828 471 HB2 LEU 60 HB2 LEU 60 -27.880 -13.187 -13.093 472 HB3 LEU 60 HB3 LEU 60 -27.117 -11.795 -12.327 473 HG LEU 60 HG LEU 60 -24.951 -13.340 -12.765 474 HD11 LEU 60 HD11 LEU 60 -27.050 -14.466 -14.386 475 HD12 LEU 60 HD12 LEU 60 -25.397 -15.026 -14.137 476 HD13 LEU 60 HD13 LEU 60 -25.743 -13.834 -15.389 477 HD21 LEU 60 HD21 LEU 60 -24.465 -11.891 -14.615 478 HD22 LEU 60 HD22 LEU 60 -25.334 -10.964 -13.390 479 HD23 LEU 60 HD23 LEU 60 -26.176 -11.525 -14.836 480 H SER 61 H SER 61 -28.067 -15.512 -12.466 481 HA SER 61 HA SER 61 -25.801 -17.323 -11.952 482 HB2 SER 61 HB2 SER 61 -28.534 -18.476 -12.242 483 HB3 SER 61 HB3 SER 61 -27.166 -19.050 -11.290 484 HG SER 61 HG SER 61 -29.234 -17.691 -10.431 485 H PHE 62 H PHE 62 -25.134 -18.592 -13.631 486 HA PHE 62 HA PHE 62 -26.436 -18.086 -16.221 487 HB2 PHE 62 HB2 PHE 62 -23.575 -18.542 -15.443 488 HB3 PHE 62 HB3 PHE 62 -24.110 -18.902 -17.081 489 HD1 PHE 62 HD1 PHE 62 -25.193 -17.046 -18.420 490 HD2 PHE 62 HD2 PHE 62 -23.061 -16.360 -14.801 491 HE1 PHE 62 HE1 PHE 62 -24.927 -14.676 -19.029 492 HE2 PHE 62 HE2 PHE 62 -22.793 -13.990 -15.402 493 HZ PHE 62 HZ PHE 62 -23.728 -13.145 -17.518 494 H THR 63 H THR 63 -26.417 -19.838 -17.789 495 HA THR 63 HA THR 63 -27.123 -22.348 -16.540 496 HB THR 63 HB THR 63 -27.013 -22.077 -19.505 497 HG1 THR 63 HG1 THR 63 -29.138 -20.935 -18.007 498 HG21 THR 63 HG21 THR 63 -28.080 -24.023 -19.169 499 HG22 THR 63 HG22 THR 63 -29.477 -23.031 -18.755 500 HG23 THR 63 HG23 THR 63 -28.423 -23.644 -17.482 501 H THR 64 H THR 64 -24.699 -21.193 -18.859 502 HA THR 64 HA THR 64 -23.162 -23.655 -18.341 503 HB THR 64 HB THR 64 -22.154 -23.043 -20.706 504 HG1 THR 64 HG1 THR 64 -23.503 -21.931 -21.996 505 HG21 THR 64 HG21 THR 64 -24.835 -24.395 -20.365 506 HG22 THR 64 HG22 THR 64 -23.257 -25.155 -20.151 507 HG23 THR 64 HG23 THR 64 -23.754 -24.585 -21.744 508 H ARG 65 H ARG 65 -20.861 -23.449 -18.382 509 HA ARG 65 HA ARG 65 -19.835 -21.303 -16.971 510 HB2 ARG 65 HB2 ARG 65 -18.773 -23.567 -17.276 511 HB3 ARG 65 HB3 ARG 65 -18.245 -23.033 -18.867 512 HG2 ARG 65 HG2 ARG 65 -17.222 -21.037 -17.491 513 HG3 ARG 65 HG3 ARG 65 -17.294 -22.213 -16.176 514 HD2 ARG 65 HD2 ARG 65 -16.185 -23.789 -17.962 515 HD3 ARG 65 HD3 ARG 65 -15.691 -22.260 -18.687 516 HE ARG 65 HE ARG 65 -15.030 -22.119 -16.002 517 HH11 ARG 65 HH11 ARG 65 -14.188 -24.066 -18.762 518 HH12 ARG 65 HH12 ARG 65 -12.585 -24.406 -18.197 519 HH21 ARG 65 HH21 ARG 65 -12.924 -22.559 -15.248 520 HH22 ARG 65 HH22 ARG 65 -11.867 -23.549 -16.198 521 H GLU 66 H GLU 66 -19.490 -21.948 -20.461 522 HA GLU 66 HA GLU 66 -18.065 -19.684 -21.161 523 HB2 GLU 66 HB2 GLU 66 -19.952 -21.482 -22.606 524 HB3 GLU 66 HB3 GLU 66 -19.495 -19.973 -23.384 525 HG2 GLU 66 HG2 GLU 66 -17.488 -21.948 -22.337 526 HG3 GLU 66 HG3 GLU 66 -18.120 -21.990 -23.982 527 H LEU 67 H LEU 67 -21.436 -20.019 -20.374 528 HA LEU 67 HA LEU 67 -22.387 -17.621 -21.513 529 HB2 LEU 67 HB2 LEU 67 -23.512 -19.734 -20.213 530 HB3 LEU 67 HB3 LEU 67 -23.647 -18.462 -19.001 531 HG LEU 67 HG LEU 67 -24.897 -17.081 -20.590 532 HD11 LEU 67 HD11 LEU 67 -24.382 -19.397 -22.425 533 HD12 LEU 67 HD12 LEU 67 -24.096 -17.679 -22.701 534 HD13 LEU 67 HD13 LEU 67 -25.744 -18.303 -22.669 535 HD21 LEU 67 HD21 LEU 67 -26.527 -18.117 -19.454 536 HD22 LEU 67 HD22 LEU 67 -25.775 -19.704 -19.626 537 HD23 LEU 67 HD23 LEU 67 -26.756 -19.045 -20.937 538 H ALA 68 H ALA 68 -20.806 -18.344 -18.470 539 HA ALA 68 HA ALA 68 -21.319 -15.799 -17.273 540 HB1 ALA 68 HB1 ALA 68 -18.970 -17.259 -16.311 541 HB2 ALA 68 HB2 ALA 68 -20.391 -16.686 -15.436 542 HB3 ALA 68 HB3 ALA 68 -20.459 -18.205 -16.328 543 H ILE 69 H ILE 69 -18.455 -17.264 -18.797 544 HA ILE 69 HA ILE 69 -16.828 -14.960 -18.570 545 HB ILE 69 HB ILE 69 -16.605 -17.261 -20.515 546 HG12 ILE 69 HG12 ILE 69 -14.638 -17.651 -18.709 547 HG13 ILE 69 HG13 ILE 69 -15.833 -16.870 -17.678 548 HG21 ILE 69 HG21 ILE 69 -14.892 -14.899 -19.959 549 HG22 ILE 69 HG22 ILE 69 -14.102 -16.440 -20.289 550 HG23 ILE 69 HG23 ILE 69 -15.202 -15.742 -21.477 551 HD11 ILE 69 HD11 ILE 69 -17.091 -18.891 -19.270 552 HD12 ILE 69 HD12 ILE 69 -15.701 -19.560 -18.413 553 HD13 ILE 69 HD13 ILE 69 -16.983 -18.748 -17.515 554 H ALA 70 H ALA 70 -19.111 -16.063 -20.985 555 HA ALA 70 HA ALA 70 -18.358 -14.328 -23.077 556 HB1 ALA 70 HB1 ALA 70 -20.838 -15.859 -22.421 557 HB2 ALA 70 HB2 ALA 70 -20.847 -14.691 -23.743 558 HB3 ALA 70 HB3 ALA 70 -19.725 -16.051 -23.775 559 H TYR 71 H TYR 71 -20.167 -13.833 -20.166 560 HA TYR 71 HA TYR 71 -21.437 -11.402 -21.040 561 HB2 TYR 71 HB2 TYR 71 -22.438 -12.871 -19.311 562 HB3 TYR 71 HB3 TYR 71 -21.096 -12.492 -18.237 563 HD1 TYR 71 HD2 TYR 71 -23.312 -10.419 -20.426 564 HD2 TYR 71 HD1 TYR 71 -21.787 -11.125 -16.518 565 HE1 TYR 71 HE2 TYR 71 -24.535 -8.451 -19.601 566 HE2 TYR 71 HE1 TYR 71 -23.007 -9.159 -15.681 567 HH TYR 71 HH TYR 71 -24.354 -6.836 -17.699 568 H ALA 72 H ALA 72 -18.803 -12.194 -18.779 569 HA ALA 72 HA ALA 72 -18.118 -9.536 -18.162 570 HB1 ALA 72 HB1 ALA 72 -15.777 -10.942 -17.856 571 HB2 ALA 72 HB2 ALA 72 -17.040 -10.760 -16.639 572 HB3 ALA 72 HB3 ALA 72 -17.015 -12.185 -17.677 573 H VAL 73 H VAL 73 -16.512 -11.833 -20.371 574 HA VAL 73 HA VAL 73 -14.590 -10.149 -21.411 575 HB VAL 73 HB VAL 73 -16.099 -12.306 -22.895 576 HG11 VAL 73 HG11 VAL 73 -14.024 -12.418 -24.275 577 HG12 VAL 73 HG12 VAL 73 -14.946 -10.927 -24.475 578 HG13 VAL 73 HG13 VAL 73 -13.483 -10.936 -23.491 579 HG21 VAL 73 HG21 VAL 73 -14.902 -12.883 -20.706 580 HG22 VAL 73 HG22 VAL 73 -14.506 -13.843 -22.131 581 HG23 VAL 73 HG23 VAL 73 -13.408 -12.573 -21.592 582 H ALA 74 H ALA 74 -18.002 -10.312 -22.142 583 HA ALA 74 HA ALA 74 -18.142 -9.002 -24.568 584 HB1 ALA 74 HB1 ALA 74 -20.361 -8.913 -24.200 585 HB2 ALA 74 HB2 ALA 74 -19.973 -9.918 -22.805 586 HB3 ALA 74 HB3 ALA 74 -20.174 -8.178 -22.609 587 H HIS 75 H HIS 75 -17.469 -7.703 -21.398 588 HA HIS 75 HA HIS 75 -17.148 -5.039 -22.614 589 HB2 HIS 75 HB2 HIS 75 -19.088 -5.333 -20.950 590 HB3 HIS 75 HB3 HIS 75 -17.842 -5.456 -19.713 591 HD1 HIS 75 HD1 HIS 75 -18.752 -3.017 -22.497 592 HD2 HIS 75 HD2 HIS 75 -17.251 -3.061 -18.623 593 HE1 HIS 75 HE1 HIS 75 -18.470 -0.601 -21.858 594 H LYS 76 H LYS 76 -15.251 -7.295 -22.174 595 HA LYS 76 HA LYS 76 -13.130 -7.669 -21.430 596 HB2 LYS 76 HB2 LYS 76 -13.063 -4.645 -21.422 597 HB3 LYS 76 HB3 LYS 76 -11.654 -5.696 -21.387 598 HG2 LYS 76 HG2 LYS 76 -13.653 -5.842 -23.614 599 HG3 LYS 76 HG3 LYS 76 -12.335 -4.667 -23.624 600 HD2 LYS 76 HD2 LYS 76 -10.692 -6.382 -23.612 601 HD3 LYS 76 HD3 LYS 76 -11.895 -7.624 -23.254 602 HE2 LYS 76 HE2 LYS 76 -11.139 -7.604 -25.623 603 HE3 LYS 76 HE3 LYS 76 -12.877 -7.385 -25.427 604 HZ1 LYS 76 HZ1 LYS 76 -11.278 -4.959 -25.526 605 HZ2 LYS 76 HZ2 LYS 76 -12.792 -5.286 -26.205 606 HZ3 LYS 76 HZ3 LYS 76 -11.386 -5.834 -26.970 607 H ILE 77 H ILE 77 -14.712 -8.156 -19.408 608 HA ILE 77 HA ILE 77 -13.700 -6.632 -17.104 609 HB ILE 77 HB ILE 77 -16.074 -8.494 -17.253 610 HG12 ILE 77 HG12 ILE 77 -16.086 -5.500 -16.873 611 HG13 ILE 77 HG13 ILE 77 -16.232 -6.255 -18.457 612 HG21 ILE 77 HG21 ILE 77 -15.736 -8.640 -15.043 613 HG22 ILE 77 HG22 ILE 77 -14.629 -7.267 -15.026 614 HG23 ILE 77 HG23 ILE 77 -16.372 -6.996 -14.994 615 HD11 ILE 77 HD11 ILE 77 -18.123 -6.502 -16.134 616 HD12 ILE 77 HD12 ILE 77 -18.414 -5.715 -17.685 617 HD13 ILE 77 HD13 ILE 77 -18.234 -7.468 -17.606 618 H ASP 78 H ASP 78 -12.694 -7.648 -15.404 619 HA ASP 78 HA ASP 78 -11.322 -10.076 -15.988 620 HB2 ASP 78 HB2 ASP 78 -11.516 -8.527 -13.396 621 HB3 ASP 78 HB3 ASP 78 -10.373 -9.826 -13.723 622 H TYR 79 H TYR 79 -12.476 -11.908 -16.076 623 HA TYR 79 HA TYR 79 -14.460 -12.443 -13.984 624 HB2 TYR 79 HB2 TYR 79 -15.248 -14.248 -15.453 625 HB3 TYR 79 HB3 TYR 79 -15.231 -12.702 -16.294 626 HD1 TYR 79 HD2 TYR 79 -13.598 -15.984 -16.003 627 HD2 TYR 79 HD1 TYR 79 -13.760 -12.319 -18.158 628 HE1 TYR 79 HE2 TYR 79 -12.231 -16.980 -17.789 629 HE2 TYR 79 HE1 TYR 79 -12.394 -13.304 -19.950 630 HH TYR 79 HH TYR 79 -10.767 -16.287 -19.591 631 H THR 80 H THR 80 -14.235 -14.050 -12.527 632 HA THR 80 HA THR 80 -11.822 -15.733 -12.728 633 HB THR 80 HB THR 80 -11.490 -14.140 -10.945 634 HG1 THR 80 HG1 THR 80 -11.498 -15.732 -9.127 635 HG21 THR 80 HG21 THR 80 -14.005 -15.176 -9.643 636 HG22 THR 80 HG22 THR 80 -13.949 -13.696 -10.600 637 HG23 THR 80 HG23 THR 80 -12.994 -13.829 -9.124 638 H VAL 81 H VAL 81 -12.240 -17.828 -12.886 639 HA VAL 81 HA VAL 81 -14.903 -18.828 -12.283 640 HB VAL 81 HB VAL 81 -14.053 -20.964 -13.257 641 HG11 VAL 81 HG11 VAL 81 -14.063 -18.384 -14.752 642 HG12 VAL 81 HG12 VAL 81 -13.626 -19.870 -15.598 643 HG13 VAL 81 HG13 VAL 81 -15.202 -19.728 -14.818 644 HG21 VAL 81 HG21 VAL 81 -11.544 -19.681 -12.876 645 HG22 VAL 81 HG22 VAL 81 -11.869 -21.314 -13.459 646 HG23 VAL 81 HG23 VAL 81 -11.761 -19.976 -14.601 647 H LEU 82 H LEU 82 -15.414 -19.736 -10.412 648 HA LEU 82 HA LEU 82 -13.246 -20.751 -8.699 649 HB2 LEU 82 HB2 LEU 82 -16.003 -19.774 -7.972 650 HB3 LEU 82 HB3 LEU 82 -14.836 -20.439 -6.832 651 HG LEU 82 HG LEU 82 -14.300 -17.967 -8.467 652 HD11 LEU 82 HD11 LEU 82 -16.172 -17.348 -7.200 653 HD12 LEU 82 HD12 LEU 82 -14.788 -16.795 -6.259 654 HD13 LEU 82 HD13 LEU 82 -15.636 -18.269 -5.795 655 HD21 LEU 82 HD21 LEU 82 -12.707 -17.589 -6.529 656 HD22 LEU 82 HD22 LEU 82 -12.287 -18.881 -7.654 657 HD23 LEU 82 HD23 LEU 82 -13.003 -19.271 -6.089 658 H GLN 83 H GLN 83 -13.056 -22.886 -8.934 659 HA GLN 83 HA GLN 83 -15.512 -24.501 -9.096 660 HB2 GLN 83 HB2 GLN 83 -13.964 -26.281 -10.016 661 HB3 GLN 83 HB3 GLN 83 -14.217 -24.879 -11.047 662 HG2 GLN 83 HG2 GLN 83 -11.893 -24.856 -9.202 663 HG3 GLN 83 HG3 GLN 83 -11.821 -25.892 -10.626 664 HE21 GLN 83 HE21 GLN 83 -12.286 -24.837 -12.709 665 HE22 GLN 83 HE22 GLN 83 -11.751 -23.211 -12.939 666 H ASP 84 H ASP 84 -15.384 -26.661 -8.066 667 HA ASP 84 HA ASP 84 -14.873 -26.502 -5.352 668 HB2 ASP 84 HB2 ASP 84 -16.339 -28.206 -6.112 669 HB3 ASP 84 HB3 ASP 84 -15.118 -28.882 -7.188 670 H ASN 85 H ASN 85 -12.902 -28.176 -7.809 671 HA ASN 85 HA ASN 85 -10.563 -27.768 -6.070 672 HB2 ASN 85 HB2 ASN 85 -11.673 -30.285 -7.098 673 HB3 ASN 85 HB3 ASN 85 -9.951 -30.087 -7.410 674 HD21 ASN 85 HD21 ASN 85 -9.202 -31.572 -5.990 675 HD22 ASN 85 HD22 ASN 85 -9.383 -31.445 -4.276 676 HA PRO 86 HA PRO 86 -8.432 -26.234 -9.584 677 HB2 PRO 86 HB2 PRO 86 -5.934 -27.247 -9.255 678 HB3 PRO 86 HB3 PRO 86 -6.591 -25.959 -8.236 679 HG2 PRO 86 HG2 PRO 86 -6.393 -28.895 -7.686 680 HG3 PRO 86 HG3 PRO 86 -6.053 -27.530 -6.607 681 HD2 PRO 86 HD2 PRO 86 -8.367 -28.930 -6.498 682 HD3 PRO 86 HD3 PRO 86 -8.280 -27.199 -6.117 683 H ARG 87 H ARG 87 -6.905 -26.936 -11.423 684 HA ARG 87 HA ARG 87 -7.338 -29.720 -12.220 685 HB2 ARG 87 HB2 ARG 87 -9.049 -27.896 -13.159 686 HB3 ARG 87 HB3 ARG 87 -7.748 -27.649 -14.317 687 HG2 ARG 87 HG2 ARG 87 -7.914 -30.322 -14.401 688 HG3 ARG 87 HG3 ARG 87 -9.583 -29.931 -13.981 689 HD2 ARG 87 HD2 ARG 87 -8.446 -28.258 -16.101 690 HD3 ARG 87 HD3 ARG 87 -8.562 -29.969 -16.513 691 HE ARG 87 HE ARG 87 -10.993 -29.135 -15.384 692 HH11 ARG 87 HH11 ARG 87 -9.083 -28.696 -18.262 693 HH12 ARG 87 HH12 ARG 87 -10.450 -28.388 -19.280 694 HH21 ARG 87 HH21 ARG 87 -12.801 -28.730 -16.714 695 HH22 ARG 87 HH22 ARG 87 -12.565 -28.407 -18.399 696 H THR 88 H THR 88 -5.770 -30.564 -13.560 697 HA THR 88 HA THR 88 -3.346 -28.939 -13.801 698 HB THR 88 HB THR 88 -3.141 -31.129 -12.681 699 HG1 THR 88 HG1 THR 88 -1.441 -31.919 -14.248 700 HG21 THR 88 HG21 THR 88 -4.041 -32.999 -13.501 701 HG22 THR 88 HG22 THR 88 -3.228 -32.775 -15.050 702 HG23 THR 88 HG23 THR 88 -4.792 -32.015 -14.757 703 H ILE 89 H ILE 89 -2.155 -28.837 -15.746 704 HA ILE 89 HA ILE 89 -3.783 -29.318 -18.152 705 HB ILE 89 HB ILE 89 -2.333 -27.572 -19.226 706 HG12 ILE 89 HG12 ILE 89 -1.566 -26.850 -16.398 707 HG13 ILE 89 HG13 ILE 89 -0.524 -27.804 -17.447 708 HG21 ILE 89 HG21 ILE 89 -3.822 -25.958 -18.682 709 HG22 ILE 89 HG22 ILE 89 -4.631 -27.303 -17.881 710 HG23 ILE 89 HG23 ILE 89 -3.618 -26.202 -16.946 711 HD11 ILE 89 HD11 ILE 89 -1.545 -25.163 -18.378 712 HD12 ILE 89 HD12 ILE 89 -0.181 -25.246 -17.264 713 HD13 ILE 89 HD13 ILE 89 -0.081 -26.029 -18.840 714 H VAL 90 H VAL 90 -2.436 -29.629 -20.173 715 HA VAL 90 HA VAL 90 0.031 -31.131 -19.636 716 HB VAL 90 HB VAL 90 -0.717 -32.788 -21.406 717 HG11 VAL 90 HG11 VAL 90 -1.612 -32.574 -18.617 718 HG12 VAL 90 HG12 VAL 90 -2.503 -33.739 -19.600 719 HG13 VAL 90 HG13 VAL 90 -0.752 -33.876 -19.438 720 HG21 VAL 90 HG21 VAL 90 -3.535 -32.267 -20.761 721 HG22 VAL 90 HG22 VAL 90 -2.777 -31.070 -21.810 722 HG23 VAL 90 HG23 VAL 90 -2.791 -32.769 -22.280 723 HA PRO 91 HA PRO 91 0.492 -28.095 -23.129 724 HB2 PRO 91 HB2 PRO 91 2.840 -27.067 -22.236 725 HB3 PRO 91 HB3 PRO 91 1.265 -26.460 -21.713 726 HG2 PRO 91 HG2 PRO 91 3.122 -28.355 -20.326 727 HG3 PRO 91 HG3 PRO 91 2.198 -27.001 -19.652 728 HD2 PRO 91 HD2 PRO 91 1.393 -29.574 -19.414 729 HD3 PRO 91 HD3 PRO 91 0.248 -28.224 -19.538 730 H LYS 92 H LYS 92 1.795 -28.343 -24.911 731 HA LYS 92 HA LYS 92 3.866 -30.434 -24.750 732 HB2 LYS 92 HB2 LYS 92 3.266 -31.113 -27.023 733 HB3 LYS 92 HB3 LYS 92 1.887 -31.252 -25.941 734 HG2 LYS 92 HG2 LYS 92 2.195 -28.729 -27.469 735 HG3 LYS 92 HG3 LYS 92 1.689 -30.175 -28.346 736 HD2 LYS 92 HD2 LYS 92 0.321 -29.528 -25.784 737 HD3 LYS 92 HD3 LYS 92 -0.065 -28.555 -27.205 738 HE2 LYS 92 HE2 LYS 92 -0.159 -31.566 -27.158 739 HE3 LYS 92 HE3 LYS 92 -1.556 -30.539 -26.835 740 HZ1 LYS 92 HZ1 LYS 92 -0.250 -31.149 -29.347 741 HZ2 LYS 92 HZ2 LYS 92 -0.683 -29.527 -29.147 742 HZ3 LYS 92 HZ3 LYS 92 -1.860 -30.736 -29.035 743 H SER 93 H SER 93 5.378 -30.312 -26.715 744 HA SER 93 HA SER 93 5.771 -27.781 -27.967 745 HB2 SER 93 HB2 SER 93 6.746 -26.851 -26.110 746 HB3 SER 93 HB3 SER 93 7.258 -28.411 -25.465 747 HG SER 93 HG SER 93 9.027 -27.164 -26.213 748 H TYR 94 H TYR 94 7.154 -27.925 -29.683 749 HA TYR 94 HA TYR 94 9.075 -30.047 -29.922 750 HB2 TYR 94 HB2 TYR 94 7.135 -31.348 -30.492 751 HB3 TYR 94 HB3 TYR 94 6.556 -30.101 -31.590 752 HD1 TYR 94 HD2 TYR 94 9.948 -31.608 -31.222 753 HD2 TYR 94 HD1 TYR 94 6.539 -31.054 -33.707 754 HE1 TYR 94 HE2 TYR 94 11.133 -32.701 -33.080 755 HE2 TYR 94 HE1 TYR 94 7.715 -32.145 -35.572 756 HH TYR 94 HH TYR 94 10.221 -32.491 -36.218 757 H ALA 95 H ALA 95 10.734 -29.006 -30.787 758 HA ALA 95 HA ALA 95 10.648 -26.567 -32.113 759 HB1 ALA 95 HB1 ALA 95 12.633 -27.997 -31.095 760 HB2 ALA 95 HB2 ALA 95 12.850 -28.439 -32.789 761 HB3 ALA 95 HB3 ALA 95 12.910 -26.744 -32.305 762 H ASP 96 H ASP 96 10.351 -25.939 -34.172 763 HA ASP 96 HA ASP 96 9.327 -27.854 -36.058 764 HB2 ASP 96 HB2 ASP 96 8.361 -25.588 -35.847 765 HB3 ASP 96 HB3 ASP 96 9.881 -24.901 -36.411 766 H ASN 97 H ASN 97 10.174 -28.331 -38.111 767 HA ASN 97 HA ASN 97 12.986 -28.661 -38.191 768 HB2 ASN 97 HB2 ASN 97 11.592 -30.269 -39.309 769 HB3 ASN 97 HB3 ASN 97 10.859 -29.017 -40.308 770 HD21 ASN 97 HD21 ASN 97 11.467 -29.405 -42.315 771 HD22 ASN 97 HD22 ASN 97 13.088 -29.693 -42.841 772 H PHE 98 H PHE 98 14.493 -27.248 -38.758 773 HA PHE 98 HA PHE 98 13.755 -25.057 -40.583 774 HB2 PHE 98 HB2 PHE 98 15.389 -23.639 -39.376 775 HB3 PHE 98 HB3 PHE 98 14.066 -24.168 -38.342 776 HD1 PHE 98 HD2 PHE 98 14.441 -25.772 -36.562 777 HD2 PHE 98 HD1 PHE 98 17.637 -24.429 -39.032 778 HE1 PHE 98 HE2 PHE 98 16.063 -26.671 -34.946 779 HE2 PHE 98 HE1 PHE 98 19.264 -25.327 -37.420 780 HZ PHE 98 HZ PHE 98 18.479 -26.449 -35.373 781 H THR 99 H THR 99 15.535 -24.179 -41.854 782 HA THR 99 HA THR 99 17.924 -25.804 -42.112 783 HB THR 99 HB THR 99 16.242 -26.972 -43.531 784 HG1 THR 99 HG1 THR 99 17.654 -27.135 -45.283 785 HG21 THR 99 HG21 THR 99 15.606 -24.332 -44.326 786 HG22 THR 99 HG22 THR 99 14.868 -25.839 -44.869 787 HG23 THR 99 HG23 THR 99 16.243 -25.165 -45.743 788 H LYS 100 H LYS 100 19.426 -24.895 -43.763 789 HA LYS 100 HA LYS 100 19.315 -21.982 -43.656 790 HB2 LYS 100 HB2 LYS 100 21.377 -22.978 -42.897 791 HB3 LYS 100 HB3 LYS 100 21.531 -23.901 -44.386 792 HG2 LYS 100 HG2 LYS 100 21.706 -21.718 -45.607 793 HG3 LYS 100 HG3 LYS 100 21.803 -20.928 -44.032 794 HD2 LYS 100 HD2 LYS 100 23.703 -22.729 -43.648 795 HD3 LYS 100 HD3 LYS 100 23.774 -22.680 -45.411 796 HE2 LYS 100 HE2 LYS 100 25.338 -21.083 -44.675 797 HE3 LYS 100 HE3 LYS 100 23.929 -20.157 -45.187 798 HZ1 LYS 100 HZ1 LYS 100 23.377 -19.634 -43.032 799 HZ2 LYS 100 HZ2 LYS 100 25.066 -19.616 -42.947 800 HZ3 LYS 100 HZ3 LYS 100 24.204 -20.952 -42.369 801 HA PRO 101 HA PRO 101 18.078 -21.615 -47.875 802 HB2 PRO 101 HB2 PRO 101 18.815 -19.032 -48.267 803 HB3 PRO 101 HB3 PRO 101 17.393 -19.492 -47.324 804 HG2 PRO 101 HG2 PRO 101 20.126 -18.716 -46.377 805 HG3 PRO 101 HG3 PRO 101 18.542 -18.236 -45.740 806 HD2 PRO 101 HD2 PRO 101 20.051 -20.166 -44.589 807 HD3 PRO 101 HD3 PRO 101 18.276 -20.202 -44.568 808 H ARG 102 H ARG 102 19.122 -20.399 -49.917 809 HA ARG 102 HA ARG 102 21.885 -21.400 -50.107 810 HB2 ARG 102 HB2 ARG 102 19.964 -22.424 -51.527 811 HB3 ARG 102 HB3 ARG 102 20.106 -20.953 -52.482 812 HG2 ARG 102 HG2 ARG 102 22.579 -22.493 -51.918 813 HG3 ARG 102 HG3 ARG 102 21.435 -23.144 -53.094 814 HD2 ARG 102 HD2 ARG 102 22.404 -20.304 -53.219 815 HD3 ARG 102 HD3 ARG 102 23.299 -21.626 -53.966 816 HE ARG 102 HE ARG 102 20.555 -21.602 -54.752 817 HH11 ARG 102 HH11 ARG 102 23.660 -20.141 -55.341 818 HH12 ARG 102 HH12 ARG 102 23.288 -19.700 -56.975 819 HH21 ARG 102 HH21 ARG 102 20.053 -21.027 -56.901 820 HH22 ARG 102 HH22 ARG 102 21.236 -20.205 -57.861 821 H ASP 103 H ASP 103 23.422 -19.930 -50.366 822 HA ASP 103 HA ASP 103 22.677 -17.296 -51.457 823 HB2 ASP 103 HB2 ASP 103 25.016 -17.808 -49.624 824 HB3 ASP 103 HB3 ASP 103 24.277 -16.264 -50.039 825 H MET 104 H MET 104 24.781 -16.118 -52.253 826 HA MET 104 HA MET 104 25.757 -17.656 -54.451 827 HB2 MET 104 HB2 MET 104 25.307 -15.105 -54.307 828 HB3 MET 104 HB3 MET 104 26.916 -15.019 -53.601 829 HG2 MET 104 HG2 MET 104 27.799 -16.156 -55.624 830 HG3 MET 104 HG3 MET 104 26.188 -16.050 -56.330 831 HE1 MET 104 HE1 MET 104 29.297 -15.095 -56.573 832 HE2 MET 104 HE2 MET 104 29.256 -13.580 -57.475 833 HE3 MET 104 HE3 MET 104 29.551 -13.564 -55.735 Start of MODEL 10 1 H1 MET 1 H MET 1 4.069 -4.917 -9.991 2 HA MET 1 HA MET 1 4.978 -2.301 -10.982 3 HB2 MET 1 HB2 MET 1 5.391 -5.060 -12.147 4 HB3 MET 1 HB3 MET 1 5.976 -3.562 -12.860 5 HG2 MET 1 HG2 MET 1 6.764 -4.534 -10.126 6 HG3 MET 1 HG3 MET 1 7.680 -4.866 -11.594 7 HE1 MET 1 HE1 MET 1 8.640 -1.887 -8.798 8 HE2 MET 1 HE2 MET 1 8.180 -3.590 -8.803 9 HE3 MET 1 HE3 MET 1 9.710 -3.088 -9.524 10 H GLN 2 H GLN 2 2.909 -5.066 -11.804 11 HA GLN 2 HA GLN 2 1.797 -4.006 -14.145 12 HB2 GLN 2 HB2 GLN 2 0.742 -5.998 -12.143 13 HB3 GLN 2 HB3 GLN 2 -0.129 -5.585 -13.614 14 HG2 GLN 2 HG2 GLN 2 1.975 -6.245 -14.868 15 HG3 GLN 2 HG3 GLN 2 2.530 -6.945 -13.347 16 HE21 GLN 2 HE21 GLN 2 1.309 -8.666 -12.427 17 HE22 GLN 2 HE22 GLN 2 0.332 -9.681 -13.428 18 H GLU 3 H GLU 3 -0.435 -3.258 -14.462 19 HA GLU 3 HA GLU 3 -1.475 -1.732 -12.172 20 HB2 GLU 3 HB2 GLU 3 -0.994 -0.739 -14.980 21 HB3 GLU 3 HB3 GLU 3 -2.060 0.084 -13.850 22 HG2 GLU 3 HG2 GLU 3 0.838 -0.489 -13.290 23 HG3 GLU 3 HG3 GLU 3 0.251 1.014 -14.000 24 H GLN 4 H GLN 4 -3.636 -1.799 -11.906 25 HA GLN 4 HA GLN 4 -5.152 -3.487 -13.735 26 HB2 GLN 4 HB2 GLN 4 -5.771 -2.386 -10.993 27 HB3 GLN 4 HB3 GLN 4 -6.916 -3.326 -11.940 28 HG2 GLN 4 HG2 GLN 4 -4.968 -5.062 -12.026 29 HG3 GLN 4 HG3 GLN 4 -4.398 -4.189 -10.605 30 HE21 GLN 4 HE21 GLN 4 -5.841 -6.881 -11.338 31 HE22 GLN 4 HE22 GLN 4 -6.993 -7.032 -10.059 32 H VAL 5 H VAL 5 -5.882 -2.389 -15.458 33 HA VAL 5 HA VAL 5 -7.115 0.246 -15.030 34 HB VAL 5 HB VAL 5 -6.978 0.472 -17.516 35 HG11 VAL 5 HG11 VAL 5 -5.172 1.127 -15.720 36 HG12 VAL 5 HG12 VAL 5 -4.215 -0.093 -16.562 37 HG13 VAL 5 HG13 VAL 5 -4.843 1.299 -17.444 38 HG21 VAL 5 HG21 VAL 5 -4.959 -1.637 -17.753 39 HG22 VAL 5 HG22 VAL 5 -6.604 -2.228 -17.518 40 HG23 VAL 5 HG23 VAL 5 -6.238 -1.158 -18.871 41 H SER 6 H SER 6 -8.619 -1.886 -14.175 42 HA SER 6 HA SER 6 -10.671 -2.150 -16.274 43 HB2 SER 6 HB2 SER 6 -10.045 -4.349 -15.841 44 HB3 SER 6 HB3 SER 6 -9.755 -4.036 -14.129 45 HG SER 6 HG SER 6 -11.663 -4.944 -13.972 46 H ASN 7 H ASN 7 -12.883 -2.038 -15.624 47 HA ASN 7 HA ASN 7 -13.311 -0.104 -13.516 48 HB2 ASN 7 HB2 ASN 7 -15.167 -1.366 -15.541 49 HB3 ASN 7 HB3 ASN 7 -15.697 -0.196 -14.335 50 HD21 ASN 7 HD21 ASN 7 -15.233 -0.338 -17.411 51 HD22 ASN 7 HD22 ASN 7 -14.500 1.190 -17.747 52 H VAL 8 H VAL 8 -15.127 -3.057 -14.342 53 HA VAL 8 HA VAL 8 -15.323 -3.624 -11.455 54 HB VAL 8 HB VAL 8 -17.469 -4.676 -11.851 55 HG11 VAL 8 HG11 VAL 8 -18.528 -2.722 -11.671 56 HG12 VAL 8 HG12 VAL 8 -16.963 -1.962 -11.969 57 HG13 VAL 8 HG13 VAL 8 -18.079 -2.240 -13.307 58 HG21 VAL 8 HG21 VAL 8 -18.551 -4.584 -14.051 59 HG22 VAL 8 HG22 VAL 8 -17.082 -3.895 -14.740 60 HG23 VAL 8 HG23 VAL 8 -17.066 -5.536 -14.094 61 H ARG 9 H ARG 9 -16.063 -6.074 -11.211 62 HA ARG 9 HA ARG 9 -14.482 -7.763 -13.012 63 HB2 ARG 9 HB2 ARG 9 -14.304 -7.827 -9.993 64 HB3 ARG 9 HB3 ARG 9 -13.529 -8.969 -11.084 65 HG2 ARG 9 HG2 ARG 9 -12.097 -7.273 -11.958 66 HG3 ARG 9 HG3 ARG 9 -12.981 -6.011 -11.098 67 HD2 ARG 9 HD2 ARG 9 -10.879 -6.560 -9.974 68 HD3 ARG 9 HD3 ARG 9 -12.272 -6.950 -8.966 69 HE ARG 9 HE ARG 9 -11.447 -9.207 -10.472 70 HH11 ARG 9 HH11 ARG 9 -10.601 -7.278 -7.700 71 HH12 ARG 9 HH12 ARG 9 -9.793 -8.574 -6.881 72 HH21 ARG 9 HH21 ARG 9 -10.385 -10.921 -9.405 73 HH22 ARG 9 HH22 ARG 9 -9.669 -10.645 -7.852 74 H ALA 10 H ALA 10 -15.185 -9.894 -13.191 75 HA ALA 10 HA ALA 10 -17.899 -10.355 -12.170 76 HB1 ALA 10 HB1 ALA 10 -16.499 -11.026 -14.651 77 HB2 ALA 10 HB2 ALA 10 -17.470 -12.341 -13.987 78 HB3 ALA 10 HB3 ALA 10 -18.219 -10.785 -14.346 79 H ARG 11 H ARG 11 -18.299 -11.884 -10.702 80 HA ARG 11 HA ARG 11 -16.099 -13.683 -9.953 81 HB2 ARG 11 HB2 ARG 11 -17.132 -12.068 -8.260 82 HB3 ARG 11 HB3 ARG 11 -18.555 -13.100 -8.308 83 HG2 ARG 11 HG2 ARG 11 -16.875 -15.004 -7.771 84 HG3 ARG 11 HG3 ARG 11 -15.832 -13.684 -7.239 85 HD2 ARG 11 HD2 ARG 11 -18.653 -14.107 -6.269 86 HD3 ARG 11 HD3 ARG 11 -17.222 -14.708 -5.432 87 HE ARG 11 HE ARG 11 -16.852 -11.986 -5.835 88 HH11 ARG 11 HH11 ARG 11 -19.032 -14.082 -4.109 89 HH12 ARG 11 HH12 ARG 11 -19.354 -12.932 -2.854 90 HH21 ARG 11 HH21 ARG 11 -17.267 -10.463 -4.188 91 HH22 ARG 11 HH22 ARG 11 -18.349 -10.873 -2.901 92 H ILE 12 H ILE 12 -16.313 -15.517 -11.103 93 HA ILE 12 HA ILE 12 -18.974 -16.759 -11.269 94 HB ILE 12 HB ILE 12 -16.501 -17.383 -12.887 95 HG12 ILE 12 HG12 ILE 12 -19.022 -16.009 -13.818 96 HG13 ILE 12 HG13 ILE 12 -17.599 -15.125 -13.278 97 HG21 ILE 12 HG21 ILE 12 -17.683 -19.346 -12.972 98 HG22 ILE 12 HG22 ILE 12 -19.241 -18.544 -12.773 99 HG23 ILE 12 HG23 ILE 12 -18.406 -18.476 -14.326 100 HD11 ILE 12 HD11 ILE 12 -16.330 -16.448 -15.050 101 HD12 ILE 12 HD12 ILE 12 -17.919 -16.866 -15.691 102 HD13 ILE 12 HD13 ILE 12 -17.422 -15.176 -15.597 103 H TYR 13 H TYR 13 -19.371 -18.323 -9.864 104 HA TYR 13 HA TYR 13 -17.228 -20.206 -9.184 105 HB2 TYR 13 HB2 TYR 13 -17.987 -20.186 -6.808 106 HB3 TYR 13 HB3 TYR 13 -17.264 -18.666 -7.326 107 HD1 TYR 13 HD1 TYR 13 -18.795 -16.739 -7.915 108 HD2 TYR 13 HD2 TYR 13 -20.179 -20.252 -5.952 109 HE1 TYR 13 HE1 TYR 13 -20.800 -15.525 -7.169 110 HE2 TYR 13 HE2 TYR 13 -22.189 -19.047 -5.203 111 HH TYR 13 HH TYR 13 -22.511 -15.966 -4.985 112 H LYS 14 H LYS 14 -17.935 -22.285 -8.575 113 HA LYS 14 HA LYS 14 -20.739 -22.849 -9.284 114 HB2 LYS 14 HB2 LYS 14 -19.280 -23.817 -10.927 115 HB3 LYS 14 HB3 LYS 14 -18.249 -24.511 -9.682 116 HG2 LYS 14 HG2 LYS 14 -19.652 -26.205 -10.719 117 HG3 LYS 14 HG3 LYS 14 -20.047 -26.010 -9.010 118 HD2 LYS 14 HD2 LYS 14 -21.975 -24.647 -9.591 119 HD3 LYS 14 HD3 LYS 14 -21.561 -24.759 -11.303 120 HE2 LYS 14 HE2 LYS 14 -22.257 -26.932 -11.467 121 HE3 LYS 14 HE3 LYS 14 -21.906 -27.287 -9.776 122 HZ1 LYS 14 HZ1 LYS 14 -24.366 -26.663 -10.904 123 HZ2 LYS 14 HZ2 LYS 14 -23.944 -25.349 -9.927 124 HZ3 LYS 14 HZ3 LYS 14 -24.012 -26.905 -9.268 125 HA PRO 15 HA PRO 15 -20.475 -23.963 -4.857 126 HB2 PRO 15 HB2 PRO 15 -23.104 -23.490 -4.373 127 HB3 PRO 15 HB3 PRO 15 -21.882 -22.213 -4.369 128 HG2 PRO 15 HG2 PRO 15 -23.806 -22.988 -6.529 129 HG3 PRO 15 HG3 PRO 15 -23.345 -21.369 -5.968 130 HD2 PRO 15 HD2 PRO 15 -22.312 -22.484 -8.209 131 HD3 PRO 15 HD3 PRO 15 -21.387 -21.369 -7.183 132 H ALA 16 H ALA 16 -20.791 -25.953 -4.051 133 HA ALA 16 HA ALA 16 -21.958 -27.991 -5.669 134 HB1 ALA 16 HB1 ALA 16 -20.004 -28.249 -4.075 135 HB2 ALA 16 HB2 ALA 16 -21.196 -28.277 -2.774 136 HB3 ALA 16 HB3 ALA 16 -21.228 -29.517 -4.028 137 H LYS 17 H LYS 17 -23.858 -29.099 -5.425 138 HA LYS 17 HA LYS 17 -25.643 -28.394 -3.226 139 HB2 LYS 17 HB2 LYS 17 -26.167 -27.852 -6.127 140 HB3 LYS 17 HB3 LYS 17 -27.507 -28.225 -5.051 141 HG2 LYS 17 HG2 LYS 17 -25.535 -26.038 -4.465 142 HG3 LYS 17 HG3 LYS 17 -26.990 -25.777 -5.431 143 HD2 LYS 17 HD2 LYS 17 -28.403 -26.132 -3.636 144 HD3 LYS 17 HD3 LYS 17 -27.206 -27.077 -2.748 145 HE2 LYS 17 HE2 LYS 17 -27.252 -25.073 -1.581 146 HE3 LYS 17 HE3 LYS 17 -25.871 -24.867 -2.657 147 HZ1 LYS 17 HZ1 LYS 17 -28.501 -23.577 -2.740 148 HZ2 LYS 17 HZ2 LYS 17 -27.690 -23.836 -4.202 149 HZ3 LYS 17 HZ3 LYS 17 -26.965 -22.910 -2.986 150 H SER 18 H SER 18 -27.009 -30.018 -2.629 151 HA SER 18 HA SER 18 -26.823 -32.514 -4.186 152 HB2 SER 18 HB2 SER 18 -25.801 -32.390 -1.813 153 HB3 SER 18 HB3 SER 18 -27.471 -32.411 -1.247 154 HG SER 18 HG SER 18 -27.752 -34.400 -2.240 155 H THR 19 H THR 19 -28.766 -30.373 -4.557 156 HA THR 19 HA THR 19 -31.236 -31.743 -3.720 157 HB THR 19 HB THR 19 -31.152 -28.910 -4.723 158 HG1 THR 19 HG1 THR 19 -31.165 -28.442 -2.346 159 HG21 THR 19 HG21 THR 19 -33.362 -29.448 -4.578 160 HG22 THR 19 HG22 THR 19 -33.099 -28.979 -2.899 161 HG23 THR 19 HG23 THR 19 -33.092 -30.684 -3.350 162 H MET 20 H MET 20 -30.783 -33.204 -5.575 163 HA MET 20 HA MET 20 -30.865 -32.257 -8.242 164 HB2 MET 20 HB2 MET 20 -30.014 -34.510 -7.444 165 HB3 MET 20 HB3 MET 20 -31.697 -35.003 -7.310 166 HG2 MET 20 HG2 MET 20 -32.038 -34.798 -9.640 167 HG3 MET 20 HG3 MET 20 -30.503 -33.961 -9.859 168 HE1 MET 20 HE1 MET 20 -29.887 -35.323 -11.758 169 HE2 MET 20 HE2 MET 20 -29.398 -37.018 -11.741 170 HE3 MET 20 HE3 MET 20 -31.110 -36.593 -11.796 171 H GLN 21 H GLN 21 -32.574 -30.965 -8.726 172 HA GLN 21 HA GLN 21 -35.222 -31.376 -7.851 173 HB2 GLN 21 HB2 GLN 21 -33.930 -29.699 -9.959 174 HB3 GLN 21 HB3 GLN 21 -35.680 -29.871 -9.968 175 HG2 GLN 21 HG2 GLN 21 -35.393 -29.241 -7.418 176 HG3 GLN 21 HG3 GLN 21 -33.916 -28.493 -8.026 177 HE21 GLN 21 HE21 GLN 21 -34.556 -26.405 -7.702 178 HE22 GLN 21 HE22 GLN 21 -35.826 -25.651 -8.598 179 H SER 22 H SER 22 -37.088 -31.927 -9.161 180 HA SER 22 HA SER 22 -36.467 -34.120 -11.009 181 HB2 SER 22 HB2 SER 22 -38.988 -33.488 -9.458 182 HB3 SER 22 HB3 SER 22 -38.827 -34.830 -10.590 183 HG SER 22 HG SER 22 -36.973 -35.458 -9.213 184 H GLY 23 H GLY 23 -38.507 -34.436 -12.584 185 HA2 GLY 23 HA2 GLY 23 -39.775 -33.600 -14.326 186 HA3 GLY 23 HA3 GLY 23 -39.608 -31.997 -13.624 187 H HIS 24 H HIS 24 -37.607 -30.830 -14.026 188 HA HIS 24 HA HIS 24 -36.662 -31.331 -16.736 189 HB2 HIS 24 HB2 HIS 24 -36.377 -28.979 -14.865 190 HB3 HIS 24 HB3 HIS 24 -35.564 -29.064 -16.426 191 HD1 HIS 24 HD1 HIS 24 -36.802 -27.364 -17.764 192 HD2 HIS 24 HD2 HIS 24 -39.358 -29.951 -15.752 193 HE1 HIS 24 HE1 HIS 24 -39.111 -26.804 -18.589 194 H SER 25 H SER 25 -34.442 -31.395 -17.292 195 HA SER 25 HA SER 25 -32.703 -32.272 -15.080 196 HB2 SER 25 HB2 SER 25 -31.618 -33.783 -16.567 197 HB3 SER 25 HB3 SER 25 -33.347 -33.989 -16.844 198 HG SER 25 HG SER 25 -32.974 -33.485 -18.837 199 H LYS 26 H LYS 26 -32.924 -29.567 -15.627 200 HA LYS 26 HA LYS 26 -30.201 -28.879 -16.087 201 HB2 LYS 26 HB2 LYS 26 -30.711 -27.332 -18.039 202 HB3 LYS 26 HB3 LYS 26 -30.647 -29.051 -18.403 203 HG2 LYS 26 HG2 LYS 26 -32.904 -29.199 -18.776 204 HG3 LYS 26 HG3 LYS 26 -33.275 -27.812 -17.750 205 HD2 LYS 26 HD2 LYS 26 -33.645 -27.099 -19.975 206 HD3 LYS 26 HD3 LYS 26 -32.107 -26.384 -19.485 207 HE2 LYS 26 HE2 LYS 26 -32.085 -29.035 -20.842 208 HE3 LYS 26 HE3 LYS 26 -32.384 -27.594 -21.812 209 HZ1 LYS 26 HZ1 LYS 26 -30.225 -27.179 -21.806 210 HZ2 LYS 26 HZ2 LYS 26 -29.937 -28.575 -20.896 211 HZ3 LYS 26 HZ3 LYS 26 -30.208 -27.097 -20.116 212 H LEU 27 H LEU 27 -29.716 -26.936 -15.182 213 HA LEU 27 HA LEU 27 -31.590 -24.828 -14.847 214 HB2 LEU 27 HB2 LEU 27 -31.391 -25.016 -12.249 215 HB3 LEU 27 HB3 LEU 27 -32.646 -25.892 -13.123 216 HG LEU 27 HG LEU 27 -31.410 -27.951 -12.934 217 HD11 LEU 27 HD11 LEU 27 -29.290 -26.371 -11.487 218 HD12 LEU 27 HD12 LEU 27 -29.156 -26.970 -13.140 219 HD13 LEU 27 HD13 LEU 27 -29.288 -28.108 -11.799 220 HD21 LEU 27 HD21 LEU 27 -31.027 -27.240 -10.170 221 HD22 LEU 27 HD22 LEU 27 -32.246 -28.282 -10.903 222 HD23 LEU 27 HD23 LEU 27 -32.520 -26.543 -10.796 223 H LYS 28 H LYS 28 -30.666 -23.216 -13.105 224 HA LYS 28 HA LYS 28 -28.214 -22.302 -13.987 225 HB2 LYS 28 HB2 LYS 28 -28.175 -21.004 -11.793 226 HB3 LYS 28 HB3 LYS 28 -29.579 -20.772 -12.826 227 HG2 LYS 28 HG2 LYS 28 -30.993 -21.823 -11.383 228 HG3 LYS 28 HG3 LYS 28 -29.728 -22.866 -10.728 229 HD2 LYS 28 HD2 LYS 28 -29.032 -21.301 -9.215 230 HD3 LYS 28 HD3 LYS 28 -29.510 -19.943 -10.235 231 HE2 LYS 28 HE2 LYS 28 -31.160 -19.774 -8.692 232 HE3 LYS 28 HE3 LYS 28 -31.927 -20.967 -9.739 233 HZ1 LYS 28 HZ1 LYS 28 -32.013 -21.574 -7.378 234 HZ2 LYS 28 HZ2 LYS 28 -30.323 -21.618 -7.326 235 HZ3 LYS 28 HZ3 LYS 28 -31.168 -22.716 -8.297 236 H ALA 29 H ALA 29 -26.246 -23.127 -13.811 237 HA ALA 29 HA ALA 29 -25.638 -24.866 -11.516 238 HB1 ALA 29 HB1 ALA 29 -24.564 -26.241 -12.902 239 HB2 ALA 29 HB2 ALA 29 -25.326 -25.342 -14.215 240 HB3 ALA 29 HB3 ALA 29 -23.700 -24.915 -13.680 241 H TRP 30 H TRP 30 -24.135 -22.405 -13.609 242 HA TRP 30 HA TRP 30 -22.069 -21.923 -11.623 243 HB2 TRP 30 HB2 TRP 30 -22.576 -20.877 -14.401 244 HB3 TRP 30 HB3 TRP 30 -21.343 -20.173 -13.359 245 HD1 TRP 30 HD1 TRP 30 -22.018 -23.143 -15.587 246 HE1 TRP 30 HE1 TRP 30 -19.904 -24.605 -15.723 247 HE3 TRP 30 HE3 TRP 30 -19.256 -20.926 -11.899 248 HZ2 TRP 30 HZ2 TRP 30 -17.398 -24.795 -14.438 249 HZ3 TRP 30 HZ3 TRP 30 -17.011 -21.808 -11.415 250 HH2 TRP 30 HH2 TRP 30 -16.103 -23.703 -12.660 251 H LYS 31 H LYS 31 -21.670 -19.865 -10.681 252 HA LYS 31 HA LYS 31 -24.052 -18.133 -10.551 253 HB2 LYS 31 HB2 LYS 31 -22.076 -18.605 -8.315 254 HB3 LYS 31 HB3 LYS 31 -23.581 -17.699 -8.227 255 HG2 LYS 31 HG2 LYS 31 -23.306 -20.666 -8.665 256 HG3 LYS 31 HG3 LYS 31 -23.834 -19.863 -7.183 257 HD2 LYS 31 HD2 LYS 31 -25.689 -18.838 -8.615 258 HD3 LYS 31 HD3 LYS 31 -25.252 -20.043 -9.828 259 HE2 LYS 31 HE2 LYS 31 -25.749 -20.930 -7.026 260 HE3 LYS 31 HE3 LYS 31 -27.128 -20.520 -8.044 261 HZ1 LYS 31 HZ1 LYS 31 -26.446 -22.908 -8.077 262 HZ2 LYS 31 HZ2 LYS 31 -25.025 -22.440 -8.866 263 HZ3 LYS 31 HZ3 LYS 31 -26.527 -22.176 -9.600 264 H LEU 32 H LEU 32 -23.690 -16.213 -11.428 265 HA LEU 32 HA LEU 32 -20.948 -15.167 -11.487 266 HB2 LEU 32 HB2 LEU 32 -22.083 -15.416 -13.642 267 HB3 LEU 32 HB3 LEU 32 -23.373 -14.354 -13.083 268 HG LEU 32 HG LEU 32 -21.571 -13.401 -14.657 269 HD11 LEU 32 HD11 LEU 32 -21.895 -11.788 -12.165 270 HD12 LEU 32 HD12 LEU 32 -23.306 -12.205 -13.136 271 HD13 LEU 32 HD13 LEU 32 -21.986 -11.280 -13.852 272 HD21 LEU 32 HD21 LEU 32 -20.010 -12.802 -12.211 273 HD22 LEU 32 HD22 LEU 32 -19.482 -12.953 -13.888 274 HD23 LEU 32 HD23 LEU 32 -19.806 -14.399 -12.931 275 H GLU 33 H GLU 33 -20.393 -13.384 -10.392 276 HA GLU 33 HA GLU 33 -22.496 -11.616 -9.378 277 HB2 GLU 33 HB2 GLU 33 -20.589 -13.230 -7.770 278 HB3 GLU 33 HB3 GLU 33 -20.888 -11.581 -7.237 279 HG2 GLU 33 HG2 GLU 33 -23.193 -13.370 -7.847 280 HG3 GLU 33 HG3 GLU 33 -22.327 -13.544 -6.321 281 H PHE 34 H PHE 34 -21.985 -9.806 -10.457 282 HA PHE 34 HA PHE 34 -19.224 -9.031 -10.859 283 HB2 PHE 34 HB2 PHE 34 -20.160 -7.155 -12.137 284 HB3 PHE 34 HB3 PHE 34 -20.851 -8.687 -12.661 285 HD1 PHE 34 HD1 PHE 34 -21.494 -5.583 -10.802 286 HD2 PHE 34 HD2 PHE 34 -23.171 -9.152 -12.404 287 HE1 PHE 34 HE1 PHE 34 -23.754 -4.683 -10.434 288 HE2 PHE 34 HE2 PHE 34 -25.434 -8.257 -12.040 289 HZ PHE 34 HZ PHE 34 -25.728 -6.019 -11.055 290 H GLU 35 H GLU 35 -18.154 -7.392 -9.861 291 HA GLU 35 HA GLU 35 -19.105 -6.546 -7.308 292 HB2 GLU 35 HB2 GLU 35 -16.633 -6.149 -8.914 293 HB3 GLU 35 HB3 GLU 35 -16.963 -4.984 -7.640 294 HG2 GLU 35 HG2 GLU 35 -17.127 -6.840 -6.027 295 HG3 GLU 35 HG3 GLU 35 -16.698 -7.964 -7.316 296 HA PRO 36 HA PRO 36 -21.034 -2.708 -8.197 297 HB2 PRO 36 HB2 PRO 36 -20.180 -1.138 -6.154 298 HB3 PRO 36 HB3 PRO 36 -21.345 -2.449 -5.935 299 HG2 PRO 36 HG2 PRO 36 -18.399 -2.424 -5.401 300 HG3 PRO 36 HG3 PRO 36 -19.709 -3.103 -4.417 301 HD2 PRO 36 HD2 PRO 36 -18.145 -4.630 -6.015 302 HD3 PRO 36 HD3 PRO 36 -19.848 -5.015 -5.697 303 H SER 37 H SER 37 -20.726 -0.683 -9.123 304 HA SER 37 HA SER 37 -17.967 -0.120 -9.945 305 HB2 SER 37 HB2 SER 37 -19.909 -0.439 -11.619 306 HB3 SER 37 HB3 SER 37 -20.421 1.173 -11.117 307 HG SER 37 HG SER 37 -19.086 1.449 -12.852 308 H CYS 38 H CYS 38 -17.858 2.428 -10.536 309 HA CYS 38 HA CYS 38 -18.213 3.751 -7.956 310 HB2 CYS 38 HB2 CYS 38 -15.979 3.839 -8.902 311 HB3 CYS 38 HB3 CYS 38 -16.603 4.524 -10.397 312 HG CYS 38 HG CYS 38 -16.498 6.992 -9.683 313 H THR 39 H THR 39 -18.689 4.523 -11.405 314 HA THR 39 HA THR 39 -20.171 6.872 -10.976 315 HB THR 39 HB THR 39 -20.925 6.624 -13.320 316 HG1 THR 39 HG1 THR 39 -20.649 4.770 -14.390 317 HG21 THR 39 HG21 THR 39 -18.440 7.202 -12.452 318 HG22 THR 39 HG22 THR 39 -18.911 7.245 -14.152 319 HG23 THR 39 HG23 THR 39 -18.085 5.829 -13.501 320 H GLN 40 H GLN 40 -22.455 7.229 -11.438 321 HA GLN 40 HA GLN 40 -24.090 5.233 -10.125 322 HB2 GLN 40 HB2 GLN 40 -24.190 7.795 -9.787 323 HB3 GLN 40 HB3 GLN 40 -25.106 7.811 -11.287 324 HG2 GLN 40 HG2 GLN 40 -26.750 7.756 -9.667 325 HG3 GLN 40 HG3 GLN 40 -26.606 6.064 -10.144 326 HE21 GLN 40 HE21 GLN 40 -27.649 5.719 -8.051 327 HE22 GLN 40 HE22 GLN 40 -26.662 5.633 -6.637 328 H TYR 41 H TYR 41 -26.007 4.341 -11.007 329 HA TYR 41 HA TYR 41 -25.789 3.807 -13.853 330 HB2 TYR 41 HB2 TYR 41 -26.244 2.058 -12.013 331 HB3 TYR 41 HB3 TYR 41 -27.891 2.678 -12.018 332 HD1 TYR 41 HD1 TYR 41 -25.431 1.879 -14.723 333 HD2 TYR 41 HD2 TYR 41 -29.306 1.213 -13.096 334 HE1 TYR 41 HE1 TYR 41 -25.969 0.412 -16.622 335 HE2 TYR 41 HE2 TYR 41 -29.854 -0.257 -14.991 336 HH TYR 41 HH TYR 41 -28.093 -1.746 -16.735 337 H THR 42 H THR 42 -27.803 3.759 -15.177 338 HA THR 42 HA THR 42 -28.959 6.288 -15.351 339 HB THR 42 HB THR 42 -30.355 3.851 -16.418 340 HG1 THR 42 HG1 THR 42 -28.321 3.424 -17.089 341 HG21 THR 42 HG21 THR 42 -30.808 5.343 -18.315 342 HG22 THR 42 HG22 THR 42 -29.906 6.631 -17.512 343 HG23 THR 42 HG23 THR 42 -31.401 6.023 -16.800 344 H GLU 43 H GLU 43 -31.056 7.058 -14.915 345 HA GLU 43 HA GLU 43 -32.127 6.270 -12.424 346 HB2 GLU 43 HB2 GLU 43 -32.873 8.217 -14.546 347 HB3 GLU 43 HB3 GLU 43 -34.117 7.765 -13.390 348 HG2 GLU 43 HG2 GLU 43 -33.177 9.645 -12.437 349 HG3 GLU 43 HG3 GLU 43 -32.358 8.327 -11.600 350 HA PRO 44 HA PRO 44 -35.080 3.172 -13.384 351 HB2 PRO 44 HB2 PRO 44 -37.176 3.845 -11.795 352 HB3 PRO 44 HB3 PRO 44 -35.667 3.176 -11.163 353 HG2 PRO 44 HG2 PRO 44 -36.576 6.026 -11.274 354 HG3 PRO 44 HG3 PRO 44 -35.769 5.159 -9.953 355 HD2 PRO 44 HD2 PRO 44 -34.442 6.819 -11.629 356 HD3 PRO 44 HD3 PRO 44 -33.685 5.385 -10.909 357 H LEU 45 H LEU 45 -36.879 2.708 -14.639 358 HA LEU 45 HA LEU 45 -38.326 5.019 -15.751 359 HB2 LEU 45 HB2 LEU 45 -38.301 4.017 -17.924 360 HB3 LEU 45 HB3 LEU 45 -36.646 4.120 -17.327 361 HG LEU 45 HG LEU 45 -38.156 1.568 -16.990 362 HD11 LEU 45 HD11 LEU 45 -36.853 1.103 -19.297 363 HD12 LEU 45 HD12 LEU 45 -37.338 2.780 -19.547 364 HD13 LEU 45 HD13 LEU 45 -38.557 1.553 -19.207 365 HD21 LEU 45 HD21 LEU 45 -36.168 0.929 -16.244 366 HD22 LEU 45 HD22 LEU 45 -35.492 2.516 -16.612 367 HD23 LEU 45 HD23 LEU 45 -35.482 1.246 -17.837 368 H MET 46 H MET 46 -40.433 4.441 -16.729 369 HA MET 46 HA MET 46 -41.959 2.857 -14.924 370 HB2 MET 46 HB2 MET 46 -43.867 3.436 -16.337 371 HB3 MET 46 HB3 MET 46 -42.885 4.855 -15.999 372 HG2 MET 46 HG2 MET 46 -41.775 4.432 -18.243 373 HG3 MET 46 HG3 MET 46 -43.087 3.296 -18.552 374 HE1 MET 46 HE1 MET 46 -45.835 5.360 -19.853 375 HE2 MET 46 HE2 MET 46 -44.746 3.997 -20.114 376 HE3 MET 46 HE3 MET 46 -45.722 4.078 -18.646 377 H ASN 47 H ASN 47 -43.656 1.284 -15.948 378 HA ASN 47 HA ASN 47 -42.741 -0.308 -18.147 379 HB2 ASN 47 HB2 ASN 47 -41.333 -0.961 -16.050 380 HB3 ASN 47 HB3 ASN 47 -42.804 -1.778 -15.531 381 HD21 ASN 47 HD21 ASN 47 -41.376 -3.664 -15.658 382 HD22 ASN 47 HD22 ASN 47 -41.214 -4.474 -17.176 383 H TRP 48 H TRP 48 -44.183 -2.154 -18.566 384 HA TRP 48 HA TRP 48 -46.846 -1.745 -17.369 385 HB2 TRP 48 HB2 TRP 48 -47.778 -2.443 -19.588 386 HB3 TRP 48 HB3 TRP 48 -46.905 -0.914 -19.625 387 HD1 TRP 48 HD1 TRP 48 -46.479 -4.599 -20.673 388 HE1 TRP 48 HE1 TRP 48 -44.753 -4.699 -22.580 389 HE3 TRP 48 HE3 TRP 48 -45.026 0.302 -20.709 390 HZ2 TRP 48 HZ2 TRP 48 -43.005 -2.934 -23.920 391 HZ3 TRP 48 HZ3 TRP 48 -43.321 1.015 -22.333 392 HH2 TRP 48 HH2 TRP 48 -42.332 -0.571 -23.905 393 H THR 49 H THR 49 -44.659 -3.640 -16.684 394 HA THR 49 HA THR 49 -45.315 -6.234 -17.594 395 HB THR 49 HB THR 49 -44.172 -6.834 -15.271 396 HG1 THR 49 HG1 THR 49 -43.866 -4.967 -14.259 397 HG21 THR 49 HG21 THR 49 -43.104 -7.381 -17.313 398 HG22 THR 49 HG22 THR 49 -41.939 -6.420 -16.403 399 HG23 THR 49 HG23 THR 49 -42.851 -5.684 -17.721 400 H GLY 50 H GLY 50 -45.898 -7.977 -15.842 401 HA2 GLY 50 HA2 GLY 50 -48.600 -7.586 -15.160 402 HA3 GLY 50 HA3 GLY 50 -47.589 -8.913 -14.606 403 H SER 51 H SER 51 -46.776 -8.891 -12.560 404 HA SER 51 HA SER 51 -47.227 -6.484 -10.938 405 HB2 SER 51 HB2 SER 51 -47.777 -9.199 -9.781 406 HB3 SER 51 HB3 SER 51 -48.363 -7.623 -9.247 407 HG SER 51 HG SER 51 -50.069 -8.518 -10.264 408 H HIS 52 H HIS 52 -44.833 -6.542 -11.624 409 HA HIS 52 HA HIS 52 -43.189 -8.364 -10.080 410 HB2 HIS 52 HB2 HIS 52 -42.546 -6.140 -12.015 411 HB3 HIS 52 HB3 HIS 52 -41.303 -7.011 -11.123 412 HD1 HIS 52 HD1 HIS 52 -42.762 -9.843 -11.443 413 HD2 HIS 52 HD2 HIS 52 -41.811 -7.176 -14.483 414 HE1 HIS 52 HE1 HIS 52 -42.629 -11.230 -13.537 415 H ASP 53 H ASP 53 -42.835 -7.979 -8.002 416 HA ASP 53 HA ASP 53 -43.316 -5.521 -6.720 417 HB2 ASP 53 HB2 ASP 53 -42.137 -6.572 -4.776 418 HB3 ASP 53 HB3 ASP 53 -43.428 -7.562 -5.453 419 H THR 54 H THR 54 -41.906 -3.982 -5.857 420 HA THR 54 HA THR 54 -39.711 -3.279 -7.474 421 HB THR 54 HB THR 54 -39.913 -2.202 -4.697 422 HG1 THR 54 HG1 THR 54 -42.023 -2.026 -5.094 423 HG21 THR 54 HG21 THR 54 -39.883 -0.202 -6.686 424 HG22 THR 54 HG22 THR 54 -38.740 -1.443 -7.198 425 HG23 THR 54 HG23 THR 54 -38.568 -0.684 -5.616 426 H LYS 55 H LYS 55 -38.055 -4.711 -7.573 427 HA LYS 55 HA LYS 55 -36.265 -4.841 -5.340 428 HB2 LYS 55 HB2 LYS 55 -37.826 -6.637 -4.729 429 HB3 LYS 55 HB3 LYS 55 -37.566 -7.401 -6.291 430 HG2 LYS 55 HG2 LYS 55 -35.063 -7.399 -5.551 431 HG3 LYS 55 HG3 LYS 55 -35.751 -7.239 -3.933 432 HD2 LYS 55 HD2 LYS 55 -36.505 -9.393 -5.906 433 HD3 LYS 55 HD3 LYS 55 -35.322 -9.594 -4.611 434 HE2 LYS 55 HE2 LYS 55 -37.012 -9.188 -2.943 435 HE3 LYS 55 HE3 LYS 55 -38.201 -8.801 -4.185 436 HZ1 LYS 55 HZ1 LYS 55 -38.257 -11.026 -4.900 437 HZ2 LYS 55 HZ2 LYS 55 -38.326 -11.099 -3.212 438 HZ3 LYS 55 HZ3 LYS 55 -36.878 -11.445 -4.015 439 H GLN 56 H GLN 56 -34.304 -4.658 -6.184 440 HA GLN 56 HA GLN 56 -33.880 -5.435 -8.971 441 HB2 GLN 56 HB2 GLN 56 -32.026 -3.875 -7.169 442 HB3 GLN 56 HB3 GLN 56 -31.927 -4.028 -8.919 443 HG2 GLN 56 HG2 GLN 56 -34.166 -2.883 -9.029 444 HG3 GLN 56 HG3 GLN 56 -33.978 -2.537 -7.311 445 HE21 GLN 56 HE21 GLN 56 -33.095 -0.665 -6.828 446 HE22 GLN 56 HE22 GLN 56 -32.067 0.273 -7.852 447 H GLN 57 H GLN 57 -32.639 -7.105 -9.561 448 HA GLN 57 HA GLN 57 -31.507 -8.780 -7.478 449 HB2 GLN 57 HB2 GLN 57 -32.766 -9.945 -9.132 450 HB3 GLN 57 HB3 GLN 57 -31.898 -9.157 -10.443 451 HG2 GLN 57 HG2 GLN 57 -31.079 -11.363 -10.319 452 HG3 GLN 57 HG3 GLN 57 -29.828 -10.324 -9.639 453 HE21 GLN 57 HE21 GLN 57 -32.814 -11.689 -8.300 454 HE22 GLN 57 HE22 GLN 57 -32.056 -12.479 -6.961 455 H VAL 58 H VAL 58 -29.412 -8.922 -6.986 456 HA VAL 58 HA VAL 58 -27.508 -7.410 -8.635 457 HB VAL 58 HB VAL 58 -26.013 -7.558 -6.630 458 HG11 VAL 58 HG11 VAL 58 -28.676 -6.189 -6.527 459 HG12 VAL 58 HG12 VAL 58 -27.501 -5.989 -5.225 460 HG13 VAL 58 HG13 VAL 58 -27.086 -5.507 -6.872 461 HG21 VAL 58 HG21 VAL 58 -26.984 -8.192 -4.488 462 HG22 VAL 58 HG22 VAL 58 -28.496 -8.625 -5.285 463 HG23 VAL 58 HG23 VAL 58 -27.028 -9.546 -5.616 464 H CYS 59 H CYS 59 -28.159 -10.572 -7.278 465 HA CYS 59 HA CYS 59 -25.627 -11.660 -8.169 466 HB2 CYS 59 HB2 CYS 59 -26.999 -12.362 -6.077 467 HB3 CYS 59 HB3 CYS 59 -27.951 -13.307 -7.216 468 HG CYS 59 HG CYS 59 -25.641 -14.539 -5.660 469 H LEU 60 H LEU 60 -25.356 -13.197 -9.799 470 HA LEU 60 HA LEU 60 -27.621 -13.495 -11.658 471 HB2 LEU 60 HB2 LEU 60 -25.056 -12.262 -12.093 472 HB3 LEU 60 HB3 LEU 60 -25.262 -13.648 -13.162 473 HG LEU 60 HG LEU 60 -27.257 -11.399 -12.957 474 HD11 LEU 60 HD11 LEU 60 -26.295 -10.486 -14.968 475 HD12 LEU 60 HD12 LEU 60 -25.085 -11.768 -15.014 476 HD13 LEU 60 HD13 LEU 60 -25.056 -10.574 -13.715 477 HD21 LEU 60 HD21 LEU 60 -28.355 -13.214 -13.890 478 HD22 LEU 60 HD22 LEU 60 -26.911 -13.792 -14.719 479 HD23 LEU 60 HD23 LEU 60 -27.751 -12.358 -15.308 480 H SER 61 H SER 61 -27.541 -15.389 -13.019 481 HA SER 61 HA SER 61 -25.744 -17.516 -12.105 482 HB2 SER 61 HB2 SER 61 -28.220 -18.775 -12.535 483 HB3 SER 61 HB3 SER 61 -27.394 -18.549 -10.994 484 HG SER 61 HG SER 61 -29.660 -17.662 -11.364 485 H PHE 62 H PHE 62 -25.174 -18.986 -13.655 486 HA PHE 62 HA PHE 62 -26.431 -18.723 -16.299 487 HB2 PHE 62 HB2 PHE 62 -23.484 -18.685 -15.655 488 HB3 PHE 62 HB3 PHE 62 -24.098 -19.038 -17.267 489 HD1 PHE 62 HD1 PHE 62 -25.277 -17.306 -18.550 490 HD2 PHE 62 HD2 PHE 62 -23.471 -16.470 -14.788 491 HE1 PHE 62 HE1 PHE 62 -25.386 -14.897 -19.038 492 HE2 PHE 62 HE2 PHE 62 -23.578 -14.060 -15.269 493 HZ PHE 62 HZ PHE 62 -24.537 -13.270 -17.395 494 H THR 63 H THR 63 -26.565 -20.588 -17.512 495 HA THR 63 HA THR 63 -26.544 -23.042 -16.070 496 HB THR 63 HB THR 63 -26.706 -22.941 -19.062 497 HG1 THR 63 HG1 THR 63 -28.700 -22.086 -17.213 498 HG21 THR 63 HG21 THR 63 -27.848 -24.627 -16.860 499 HG22 THR 63 HG22 THR 63 -26.931 -25.125 -18.281 500 HG23 THR 63 HG23 THR 63 -28.603 -24.591 -18.453 501 H THR 64 H THR 64 -24.587 -21.793 -18.765 502 HA THR 64 HA THR 64 -22.586 -23.872 -18.155 503 HB THR 64 HB THR 64 -21.889 -23.109 -20.656 504 HG1 THR 64 HG1 THR 64 -23.558 -21.898 -21.286 505 HG21 THR 64 HG21 THR 64 -22.781 -25.183 -21.408 506 HG22 THR 64 HG22 THR 64 -24.019 -25.181 -20.152 507 HG23 THR 64 HG23 THR 64 -22.325 -25.412 -19.720 508 H ARG 65 H ARG 65 -20.355 -23.125 -19.161 509 HA ARG 65 HA ARG 65 -19.613 -20.772 -17.693 510 HB2 ARG 65 HB2 ARG 65 -17.787 -22.185 -19.608 511 HB3 ARG 65 HB3 ARG 65 -17.398 -21.389 -18.089 512 HG2 ARG 65 HG2 ARG 65 -17.310 -23.446 -17.242 513 HG3 ARG 65 HG3 ARG 65 -19.074 -23.389 -17.279 514 HD2 ARG 65 HD2 ARG 65 -18.609 -24.164 -19.798 515 HD3 ARG 65 HD3 ARG 65 -17.177 -24.842 -19.023 516 HE ARG 65 HE ARG 65 -19.897 -25.732 -18.729 517 HH11 ARG 65 HH11 ARG 65 -16.730 -25.657 -17.286 518 HH12 ARG 65 HH12 ARG 65 -16.993 -27.072 -16.321 519 HH21 ARG 65 HH21 ARG 65 -20.255 -27.596 -17.464 520 HH22 ARG 65 HH22 ARG 65 -18.998 -28.174 -16.424 521 H GLU 66 H GLU 66 -19.625 -21.688 -21.130 522 HA GLU 66 HA GLU 66 -18.573 -19.405 -22.245 523 HB2 GLU 66 HB2 GLU 66 -19.467 -21.622 -23.326 524 HB3 GLU 66 HB3 GLU 66 -20.947 -20.698 -23.532 525 HG2 GLU 66 HG2 GLU 66 -19.709 -20.523 -25.543 526 HG3 GLU 66 HG3 GLU 66 -19.612 -18.963 -24.727 527 H LEU 67 H LEU 67 -21.732 -19.893 -20.855 528 HA LEU 67 HA LEU 67 -22.845 -17.459 -21.909 529 HB2 LEU 67 HB2 LEU 67 -23.905 -19.748 -20.870 530 HB3 LEU 67 HB3 LEU 67 -24.102 -18.621 -19.530 531 HG LEU 67 HG LEU 67 -25.375 -17.117 -20.990 532 HD11 LEU 67 HD11 LEU 67 -24.473 -17.534 -23.133 533 HD12 LEU 67 HD12 LEU 67 -26.152 -18.069 -23.192 534 HD13 LEU 67 HD13 LEU 67 -24.854 -19.254 -23.041 535 HD21 LEU 67 HD21 LEU 67 -27.195 -19.039 -21.537 536 HD22 LEU 67 HD22 LEU 67 -26.949 -18.335 -19.938 537 HD23 LEU 67 HD23 LEU 67 -26.187 -19.872 -20.353 538 H ALA 68 H ALA 68 -21.389 -18.512 -18.879 539 HA ALA 68 HA ALA 68 -21.951 -16.112 -17.447 540 HB1 ALA 68 HB1 ALA 68 -21.053 -17.169 -15.681 541 HB2 ALA 68 HB2 ALA 68 -21.123 -18.591 -16.722 542 HB3 ALA 68 HB3 ALA 68 -19.622 -17.676 -16.580 543 H ILE 69 H ILE 69 -18.808 -17.413 -18.536 544 HA ILE 69 HA ILE 69 -17.293 -15.146 -18.140 545 HB ILE 69 HB ILE 69 -16.986 -17.222 -20.310 546 HG12 ILE 69 HG12 ILE 69 -15.008 -17.644 -18.473 547 HG13 ILE 69 HG13 ILE 69 -16.325 -17.092 -17.443 548 HG21 ILE 69 HG21 ILE 69 -14.540 -16.431 -20.161 549 HG22 ILE 69 HG22 ILE 69 -15.686 -15.449 -21.073 550 HG23 ILE 69 HG23 ILE 69 -15.214 -14.967 -19.444 551 HD11 ILE 69 HD11 ILE 69 -17.495 -18.980 -17.720 552 HD12 ILE 69 HD12 ILE 69 -17.069 -19.118 -19.426 553 HD13 ILE 69 HD13 ILE 69 -15.933 -19.653 -18.187 554 H ALA 70 H ALA 70 -19.474 -15.896 -20.766 555 HA ALA 70 HA ALA 70 -18.686 -14.115 -22.716 556 HB1 ALA 70 HB1 ALA 70 -21.302 -15.271 -21.916 557 HB2 ALA 70 HB2 ALA 70 -21.299 -13.943 -23.075 558 HB3 ALA 70 HB3 ALA 70 -20.412 -15.425 -23.430 559 H TYR 71 H TYR 71 -20.815 -13.486 -19.939 560 HA TYR 71 HA TYR 71 -21.504 -10.867 -20.462 561 HB2 TYR 71 HB2 TYR 71 -22.418 -12.210 -18.598 562 HB3 TYR 71 HB3 TYR 71 -20.885 -12.055 -17.749 563 HD1 TYR 71 HD2 TYR 71 -23.692 -10.052 -19.144 564 HD2 TYR 71 HD1 TYR 71 -20.495 -10.229 -16.342 565 HE1 TYR 71 HE2 TYR 71 -24.476 -7.955 -18.126 566 HE2 TYR 71 HE1 TYR 71 -21.272 -8.134 -15.314 567 HH TYR 71 HH TYR 71 -23.019 -6.000 -16.585 568 H ALA 72 H ALA 72 -18.674 -12.030 -18.641 569 HA ALA 72 HA ALA 72 -17.566 -9.490 -18.144 570 HB1 ALA 72 HB1 ALA 72 -16.343 -10.797 -16.831 571 HB2 ALA 72 HB2 ALA 72 -16.820 -12.239 -17.729 572 HB3 ALA 72 HB3 ALA 72 -15.434 -11.287 -18.262 573 H VAL 73 H VAL 73 -16.650 -11.936 -20.576 574 HA VAL 73 HA VAL 73 -14.697 -10.515 -21.906 575 HB VAL 73 HB VAL 73 -16.716 -12.399 -23.132 576 HG11 VAL 73 HG11 VAL 73 -15.022 -12.746 -24.875 577 HG12 VAL 73 HG12 VAL 73 -15.588 -11.075 -24.833 578 HG13 VAL 73 HG13 VAL 73 -14.020 -11.494 -24.140 579 HG21 VAL 73 HG21 VAL 73 -15.121 -14.140 -22.740 580 HG22 VAL 73 HG22 VAL 73 -13.931 -12.987 -22.139 581 HG23 VAL 73 HG23 VAL 73 -15.399 -13.301 -21.214 582 H ALA 74 H ALA 74 -18.167 -10.167 -22.077 583 HA ALA 74 HA ALA 74 -18.500 -8.792 -24.447 584 HB1 ALA 74 HB1 ALA 74 -20.248 -9.550 -22.722 585 HB2 ALA 74 HB2 ALA 74 -19.975 -7.979 -21.967 586 HB3 ALA 74 HB3 ALA 74 -20.558 -8.069 -23.629 587 H HIS 75 H HIS 75 -17.297 -7.620 -21.359 588 HA HIS 75 HA HIS 75 -16.622 -5.070 -22.668 589 HB2 HIS 75 HB2 HIS 75 -18.506 -5.060 -20.864 590 HB3 HIS 75 HB3 HIS 75 -17.176 -5.222 -19.722 591 HD1 HIS 75 HD1 HIS 75 -16.421 -3.051 -18.840 592 HD2 HIS 75 HD2 HIS 75 -17.901 -2.702 -22.706 593 HE1 HIS 75 HE1 HIS 75 -16.257 -0.606 -19.405 594 H LYS 76 H LYS 76 -15.101 -7.589 -22.243 595 HA LYS 76 HA LYS 76 -13.035 -8.289 -21.585 596 HB2 LYS 76 HB2 LYS 76 -12.603 -6.132 -22.951 597 HB3 LYS 76 HB3 LYS 76 -12.249 -5.394 -21.394 598 HG2 LYS 76 HG2 LYS 76 -10.154 -6.032 -21.971 599 HG3 LYS 76 HG3 LYS 76 -10.675 -7.513 -21.165 600 HD2 LYS 76 HD2 LYS 76 -11.232 -7.237 -24.072 601 HD3 LYS 76 HD3 LYS 76 -9.565 -7.538 -23.575 602 HE2 LYS 76 HE2 LYS 76 -10.590 -9.431 -22.140 603 HE3 LYS 76 HE3 LYS 76 -11.995 -9.249 -23.189 604 HZ1 LYS 76 HZ1 LYS 76 -9.717 -9.356 -24.803 605 HZ2 LYS 76 HZ2 LYS 76 -10.973 -10.482 -24.695 606 HZ3 LYS 76 HZ3 LYS 76 -9.614 -10.634 -23.699 607 H ILE 77 H ILE 77 -14.790 -8.222 -19.488 608 HA ILE 77 HA ILE 77 -13.473 -6.893 -17.255 609 HB ILE 77 HB ILE 77 -15.965 -8.600 -17.301 610 HG12 ILE 77 HG12 ILE 77 -15.820 -5.618 -16.908 611 HG13 ILE 77 HG13 ILE 77 -15.948 -6.326 -18.513 612 HG21 ILE 77 HG21 ILE 77 -15.580 -8.739 -15.100 613 HG22 ILE 77 HG22 ILE 77 -14.374 -7.454 -15.133 614 HG23 ILE 77 HG23 ILE 77 -16.089 -7.052 -15.054 615 HD11 ILE 77 HD11 ILE 77 -18.067 -5.568 -17.143 616 HD12 ILE 77 HD12 ILE 77 -18.100 -6.979 -18.202 617 HD13 ILE 77 HD13 ILE 77 -17.905 -7.187 -16.461 618 H ASP 78 H ASP 78 -12.450 -7.924 -15.583 619 HA ASP 78 HA ASP 78 -11.275 -10.458 -16.145 620 HB2 ASP 78 HB2 ASP 78 -10.266 -8.512 -14.809 621 HB3 ASP 78 HB3 ASP 78 -11.237 -9.093 -13.459 622 H TYR 79 H TYR 79 -12.465 -12.255 -16.065 623 HA TYR 79 HA TYR 79 -14.441 -12.565 -13.918 624 HB2 TYR 79 HB2 TYR 79 -15.336 -14.419 -15.271 625 HB3 TYR 79 HB3 TYR 79 -15.285 -12.915 -16.184 626 HD1 TYR 79 HD1 TYR 79 -13.693 -12.625 -18.016 627 HD2 TYR 79 HD2 TYR 79 -13.927 -16.289 -15.866 628 HE1 TYR 79 HE1 TYR 79 -12.415 -13.744 -19.794 629 HE2 TYR 79 HE2 TYR 79 -12.648 -17.418 -17.637 630 HH TYR 79 HH TYR 79 -11.443 -17.136 -19.503 631 H THR 80 H THR 80 -14.143 -13.953 -12.296 632 HA THR 80 HA THR 80 -11.772 -15.690 -12.393 633 HB THR 80 HB THR 80 -11.726 -14.084 -10.565 634 HG1 THR 80 HG1 THR 80 -10.783 -15.750 -9.655 635 HG21 THR 80 HG21 THR 80 -14.135 -13.729 -10.317 636 HG22 THR 80 HG22 THR 80 -13.397 -14.151 -8.772 637 HG23 THR 80 HG23 THR 80 -14.314 -15.359 -9.672 638 H VAL 81 H VAL 81 -11.949 -17.849 -12.215 639 HA VAL 81 HA VAL 81 -14.657 -18.958 -11.922 640 HB VAL 81 HB VAL 81 -13.631 -21.032 -12.944 641 HG11 VAL 81 HG11 VAL 81 -13.329 -19.666 -15.248 642 HG12 VAL 81 HG12 VAL 81 -14.896 -20.041 -14.528 643 HG13 VAL 81 HG13 VAL 81 -14.162 -18.456 -14.272 644 HG21 VAL 81 HG21 VAL 81 -11.501 -19.589 -14.264 645 HG22 VAL 81 HG22 VAL 81 -11.255 -19.651 -12.519 646 HG23 VAL 81 HG23 VAL 81 -11.460 -21.145 -13.435 647 H LEU 82 H LEU 82 -15.066 -19.635 -9.924 648 HA LEU 82 HA LEU 82 -12.899 -20.909 -8.393 649 HB2 LEU 82 HB2 LEU 82 -15.478 -19.807 -7.304 650 HB3 LEU 82 HB3 LEU 82 -14.052 -20.302 -6.396 651 HG LEU 82 HG LEU 82 -14.072 -17.965 -8.295 652 HD11 LEU 82 HD11 LEU 82 -14.001 -16.765 -5.937 653 HD12 LEU 82 HD12 LEU 82 -14.939 -18.181 -5.466 654 HD13 LEU 82 HD13 LEU 82 -15.521 -17.127 -6.754 655 HD21 LEU 82 HD21 LEU 82 -12.222 -18.297 -5.986 656 HD22 LEU 82 HD22 LEU 82 -11.968 -17.483 -7.531 657 HD23 LEU 82 HD23 LEU 82 -11.935 -19.245 -7.445 658 H GLN 83 H GLN 83 -12.984 -23.045 -8.301 659 HA GLN 83 HA GLN 83 -15.624 -24.353 -8.373 660 HB2 GLN 83 HB2 GLN 83 -13.032 -25.576 -9.317 661 HB3 GLN 83 HB3 GLN 83 -14.659 -26.204 -9.545 662 HG2 GLN 83 HG2 GLN 83 -15.176 -24.266 -10.974 663 HG3 GLN 83 HG3 GLN 83 -13.509 -23.720 -10.795 664 HE21 GLN 83 HE21 GLN 83 -11.837 -24.969 -11.717 665 HE22 GLN 83 HE22 GLN 83 -12.153 -26.061 -13.018 666 H ASP 84 H ASP 84 -16.082 -25.881 -6.864 667 HA ASP 84 HA ASP 84 -13.956 -26.730 -5.035 668 HB2 ASP 84 HB2 ASP 84 -14.852 -24.956 -3.779 669 HB3 ASP 84 HB3 ASP 84 -16.501 -25.320 -4.277 670 H ASN 85 H ASN 85 -14.034 -28.841 -4.608 671 HA ASN 85 HA ASN 85 -14.701 -31.017 -4.665 672 HB2 ASN 85 HB2 ASN 85 -16.235 -29.960 -2.885 673 HB3 ASN 85 HB3 ASN 85 -17.496 -30.043 -4.111 674 HD21 ASN 85 HD21 ASN 85 -14.947 -32.136 -2.795 675 HD22 ASN 85 HD22 ASN 85 -15.940 -33.543 -2.657 676 HA PRO 86 HA PRO 86 -16.379 -30.525 -8.969 677 HB2 PRO 86 HB2 PRO 86 -14.394 -31.946 -10.156 678 HB3 PRO 86 HB3 PRO 86 -14.274 -30.212 -9.834 679 HG2 PRO 86 HG2 PRO 86 -13.149 -32.508 -8.278 680 HG3 PRO 86 HG3 PRO 86 -12.387 -30.964 -8.702 681 HD2 PRO 86 HD2 PRO 86 -13.447 -31.442 -6.257 682 HD3 PRO 86 HD3 PRO 86 -13.446 -29.829 -6.998 683 H ARG 87 H ARG 87 -17.849 -31.931 -9.694 684 HA ARG 87 HA ARG 87 -17.444 -34.799 -9.191 685 HB2 ARG 87 HB2 ARG 87 -19.019 -33.829 -7.515 686 HB3 ARG 87 HB3 ARG 87 -20.076 -33.356 -8.838 687 HG2 ARG 87 HG2 ARG 87 -20.642 -35.554 -9.339 688 HG3 ARG 87 HG3 ARG 87 -19.245 -36.208 -8.482 689 HD2 ARG 87 HD2 ARG 87 -20.225 -35.957 -6.416 690 HD3 ARG 87 HD3 ARG 87 -21.281 -34.653 -6.959 691 HE ARG 87 HE ARG 87 -22.195 -36.785 -8.339 692 HH11 ARG 87 HH11 ARG 87 -21.533 -36.242 -4.965 693 HH12 ARG 87 HH12 ARG 87 -22.758 -37.338 -4.415 694 HH21 ARG 87 HH21 ARG 87 -23.811 -38.229 -7.627 695 HH22 ARG 87 HH22 ARG 87 -24.052 -38.468 -5.929 696 H THR 88 H THR 88 -17.964 -36.121 -10.850 697 HA THR 88 HA THR 88 -19.725 -35.295 -12.973 698 HB THR 88 HB THR 88 -17.649 -34.159 -13.650 699 HG1 THR 88 HG1 THR 88 -18.047 -36.401 -15.346 700 HG21 THR 88 HG21 THR 88 -16.321 -36.771 -14.177 701 HG22 THR 88 HG22 THR 88 -16.263 -36.120 -12.539 702 HG23 THR 88 HG23 THR 88 -15.612 -35.184 -13.884 703 H ILE 89 H ILE 89 -20.603 -37.018 -13.993 704 HA ILE 89 HA ILE 89 -19.265 -39.603 -13.910 705 HB ILE 89 HB ILE 89 -21.352 -40.720 -13.079 706 HG12 ILE 89 HG12 ILE 89 -22.082 -37.940 -12.139 707 HG13 ILE 89 HG13 ILE 89 -22.837 -38.745 -13.510 708 HG21 ILE 89 HG21 ILE 89 -19.237 -39.992 -11.719 709 HG22 ILE 89 HG22 ILE 89 -20.376 -38.902 -10.929 710 HG23 ILE 89 HG23 ILE 89 -20.652 -40.643 -10.892 711 HD11 ILE 89 HD11 ILE 89 -24.243 -39.794 -12.169 712 HD12 ILE 89 HD12 ILE 89 -22.913 -40.458 -11.220 713 HD13 ILE 89 HD13 ILE 89 -23.580 -38.875 -10.818 714 H VAL 90 H VAL 90 -20.542 -41.269 -15.151 715 HA VAL 90 HA VAL 90 -22.132 -40.023 -17.292 716 HB VAL 90 HB VAL 90 -20.102 -42.210 -17.743 717 HG11 VAL 90 HG11 VAL 90 -22.258 -41.693 -19.236 718 HG12 VAL 90 HG12 VAL 90 -21.141 -40.519 -19.935 719 HG13 VAL 90 HG13 VAL 90 -20.726 -42.234 -19.921 720 HG21 VAL 90 HG21 VAL 90 -19.894 -39.234 -18.050 721 HG22 VAL 90 HG22 VAL 90 -18.782 -40.343 -17.248 722 HG23 VAL 90 HG23 VAL 90 -18.900 -40.331 -19.008 723 HA PRO 91 HA PRO 91 -24.348 -43.653 -15.405 724 HB2 PRO 91 HB2 PRO 91 -26.728 -42.372 -15.148 725 HB3 PRO 91 HB3 PRO 91 -25.464 -42.310 -13.914 726 HG2 PRO 91 HG2 PRO 91 -26.147 -40.304 -16.030 727 HG3 PRO 91 HG3 PRO 91 -25.745 -40.037 -14.324 728 HD2 PRO 91 HD2 PRO 91 -23.948 -39.678 -16.318 729 HD3 PRO 91 HD3 PRO 91 -23.478 -40.232 -14.697 730 H LYS 92 H LYS 92 -25.661 -45.056 -16.500 731 HA LYS 92 HA LYS 92 -26.245 -44.384 -19.273 732 HB2 LYS 92 HB2 LYS 92 -25.156 -46.587 -18.343 733 HB3 LYS 92 HB3 LYS 92 -26.826 -47.058 -18.058 734 HG2 LYS 92 HG2 LYS 92 -25.846 -46.117 -20.736 735 HG3 LYS 92 HG3 LYS 92 -25.792 -47.809 -20.236 736 HD2 LYS 92 HD2 LYS 92 -28.319 -47.405 -19.672 737 HD3 LYS 92 HD3 LYS 92 -28.150 -46.070 -20.814 738 HE2 LYS 92 HE2 LYS 92 -28.802 -47.766 -22.218 739 HE3 LYS 92 HE3 LYS 92 -27.048 -47.902 -22.324 740 HZ1 LYS 92 HZ1 LYS 92 -28.788 -49.532 -20.552 741 HZ2 LYS 92 HZ2 LYS 92 -27.110 -49.679 -20.705 742 HZ3 LYS 92 HZ3 LYS 92 -28.115 -50.057 -22.013 743 H SER 93 H SER 93 -28.037 -43.047 -19.140 744 HA SER 93 HA SER 93 -30.302 -43.437 -17.571 745 HB2 SER 93 HB2 SER 93 -31.454 -42.118 -19.498 746 HB3 SER 93 HB3 SER 93 -30.166 -41.334 -18.583 747 HG SER 93 HG SER 93 -30.269 -41.688 -21.171 748 H TYR 94 H TYR 94 -31.780 -44.984 -17.560 749 HA TYR 94 HA TYR 94 -32.825 -46.088 -20.008 750 HB2 TYR 94 HB2 TYR 94 -30.757 -47.441 -19.556 751 HB3 TYR 94 HB3 TYR 94 -31.498 -47.969 -18.049 752 HD1 TYR 94 HD1 TYR 94 -32.541 -47.695 -21.635 753 HD2 TYR 94 HD2 TYR 94 -32.390 -50.085 -18.119 754 HE1 TYR 94 HE1 TYR 94 -33.667 -49.523 -22.836 755 HE2 TYR 94 HE2 TYR 94 -33.513 -51.920 -19.311 756 HH TYR 94 HH TYR 94 -33.628 -52.447 -22.188 757 H ALA 95 H ALA 95 -34.932 -45.964 -19.644 758 HA ALA 95 HA ALA 95 -36.184 -45.722 -17.179 759 HB1 ALA 95 HB1 ALA 95 -37.641 -45.074 -18.768 760 HB2 ALA 95 HB2 ALA 95 -37.055 -46.255 -19.940 761 HB3 ALA 95 HB3 ALA 95 -38.180 -46.751 -18.675 762 H ASP 96 H ASP 96 -37.664 -47.203 -16.099 763 HA ASP 96 HA ASP 96 -36.896 -50.030 -16.393 764 HB2 ASP 96 HB2 ASP 96 -36.992 -50.267 -13.943 765 HB3 ASP 96 HB3 ASP 96 -35.759 -49.110 -14.435 766 H ASN 97 H ASN 97 -38.585 -51.265 -16.843 767 HA ASN 97 HA ASN 97 -40.705 -52.074 -16.977 768 HB2 ASN 97 HB2 ASN 97 -40.399 -51.854 -14.420 769 HB3 ASN 97 HB3 ASN 97 -41.435 -50.437 -14.561 770 HD21 ASN 97 HD21 ASN 97 -42.161 -52.591 -13.032 771 HD22 ASN 97 HD22 ASN 97 -43.509 -53.389 -13.761 772 H PHE 98 H PHE 98 -39.994 -49.581 -18.303 773 HA PHE 98 HA PHE 98 -42.569 -48.165 -18.310 774 HB2 PHE 98 HB2 PHE 98 -40.498 -46.819 -17.946 775 HB3 PHE 98 HB3 PHE 98 -39.948 -47.300 -19.547 776 HD1 PHE 98 HD1 PHE 98 -42.958 -45.794 -17.935 777 HD2 PHE 98 HD2 PHE 98 -40.320 -45.843 -21.275 778 HE1 PHE 98 HE1 PHE 98 -44.173 -43.895 -18.918 779 HE2 PHE 98 HE2 PHE 98 -41.530 -43.942 -22.262 780 HZ PHE 98 HZ PHE 98 -43.459 -42.965 -21.084 781 H THR 99 H THR 99 -43.948 -48.920 -19.770 782 HA THR 99 HA THR 99 -42.960 -49.446 -22.488 783 HB THR 99 HB THR 99 -44.604 -51.330 -22.663 784 HG1 THR 99 HG1 THR 99 -45.867 -51.712 -21.017 785 HG21 THR 99 HG21 THR 99 -42.433 -52.102 -22.463 786 HG22 THR 99 HG22 THR 99 -43.205 -52.865 -21.074 787 HG23 THR 99 HG23 THR 99 -42.226 -51.416 -20.853 788 H LYS 100 H LYS 100 -44.211 -48.671 -24.104 789 HA LYS 100 HA LYS 100 -46.927 -47.764 -23.489 790 HB2 LYS 100 HB2 LYS 100 -45.048 -45.923 -23.342 791 HB3 LYS 100 HB3 LYS 100 -45.162 -45.963 -25.097 792 HG2 LYS 100 HG2 LYS 100 -47.612 -45.625 -23.416 793 HG3 LYS 100 HG3 LYS 100 -46.572 -44.251 -23.793 794 HD2 LYS 100 HD2 LYS 100 -47.768 -46.086 -25.867 795 HD3 LYS 100 HD3 LYS 100 -48.492 -44.558 -25.363 796 HE2 LYS 100 HE2 LYS 100 -46.158 -43.569 -25.942 797 HE3 LYS 100 HE3 LYS 100 -45.960 -45.050 -26.879 798 HZ1 LYS 100 HZ1 LYS 100 -46.828 -43.394 -28.314 799 HZ2 LYS 100 HZ2 LYS 100 -48.048 -42.972 -27.221 800 HZ3 LYS 100 HZ3 LYS 100 -48.091 -44.474 -28.000 801 HA PRO 101 HA PRO 101 -46.592 -50.029 -27.529 802 HB2 PRO 101 HB2 PRO 101 -48.740 -51.626 -27.078 803 HB3 PRO 101 HB3 PRO 101 -47.110 -52.035 -26.533 804 HG2 PRO 101 HG2 PRO 101 -49.377 -50.832 -24.992 805 HG3 PRO 101 HG3 PRO 101 -48.246 -52.108 -24.505 806 HD2 PRO 101 HD2 PRO 101 -47.974 -49.536 -23.703 807 HD3 PRO 101 HD3 PRO 101 -46.582 -50.604 -23.973 808 H ARG 102 H ARG 102 -48.374 -50.319 -29.179 809 HA ARG 102 HA ARG 102 -50.116 -47.958 -29.098 810 HB2 ARG 102 HB2 ARG 102 -48.432 -48.319 -30.982 811 HB3 ARG 102 HB3 ARG 102 -49.472 -49.629 -31.523 812 HG2 ARG 102 HG2 ARG 102 -50.095 -47.789 -32.817 813 HG3 ARG 102 HG3 ARG 102 -51.344 -47.908 -31.577 814 HD2 ARG 102 HD2 ARG 102 -49.884 -46.239 -30.262 815 HD3 ARG 102 HD3 ARG 102 -49.099 -45.936 -31.811 816 HE ARG 102 HE ARG 102 -51.924 -45.743 -32.035 817 HH11 ARG 102 HH11 ARG 102 -49.110 -44.039 -30.897 818 HH12 ARG 102 HH12 ARG 102 -49.817 -42.470 -31.095 819 HH21 ARG 102 HH21 ARG 102 -52.867 -43.683 -32.301 820 HH22 ARG 102 HH22 ARG 102 -51.955 -42.269 -31.893 821 H ASP 103 H ASP 103 -52.039 -48.484 -28.252 822 HA ASP 103 HA ASP 103 -53.570 -50.596 -29.572 823 HB2 ASP 103 HB2 ASP 103 -54.222 -51.685 -27.591 824 HB3 ASP 103 HB3 ASP 103 -52.488 -51.436 -27.399 825 H MET 104 H MET 104 -55.764 -50.218 -29.679 826 HA MET 104 HA MET 104 -56.575 -47.489 -29.105 827 HB2 MET 104 HB2 MET 104 -58.037 -49.717 -30.533 828 HB3 MET 104 HB3 MET 104 -58.588 -48.051 -30.415 829 HG2 MET 104 HG2 MET 104 -56.788 -47.273 -31.749 830 HG3 MET 104 HG3 MET 104 -55.979 -48.836 -31.679 831 HE1 MET 104 HE1 MET 104 -56.869 -50.195 -34.957 832 HE2 MET 104 HE2 MET 104 -55.743 -48.941 -34.435 833 HE3 MET 104 HE3 MET 104 -55.983 -50.380 -33.443 Start of MODEL 11 1 H1 MET 1 H MET 1 -2.891 -4.622 4.025 2 HA MET 1 HA MET 1 -1.114 -3.258 2.280 3 HB2 MET 1 HB2 MET 1 -0.173 -5.552 2.127 4 HB3 MET 1 HB3 MET 1 -1.734 -6.127 1.555 5 HG2 MET 1 HG2 MET 1 -1.552 -4.921 -0.459 6 HG3 MET 1 HG3 MET 1 -0.197 -3.971 0.145 7 HE1 MET 1 HE1 MET 1 2.135 -5.686 1.109 8 HE2 MET 1 HE2 MET 1 2.860 -5.993 -0.468 9 HE3 MET 1 HE3 MET 1 2.094 -4.438 -0.137 10 H GLN 2 H GLN 2 -2.303 -2.085 0.912 11 HA GLN 2 HA GLN 2 -5.057 -2.975 0.359 12 HB2 GLN 2 HB2 GLN 2 -5.752 -0.642 0.345 13 HB3 GLN 2 HB3 GLN 2 -5.006 -1.047 1.886 14 HG2 GLN 2 HG2 GLN 2 -4.061 0.988 1.446 15 HG3 GLN 2 HG3 GLN 2 -2.849 -0.105 0.779 16 HE21 GLN 2 HE21 GLN 2 -2.043 1.369 -0.672 17 HE22 GLN 2 HE22 GLN 2 -2.927 1.906 -2.056 18 H GLU 3 H GLU 3 -5.988 -1.995 -1.646 19 HA GLU 3 HA GLU 3 -4.017 -1.288 -3.677 20 HB2 GLU 3 HB2 GLU 3 -5.669 -3.782 -3.670 21 HB3 GLU 3 HB3 GLU 3 -5.318 -2.994 -5.203 22 HG2 GLU 3 HG2 GLU 3 -3.176 -3.757 -3.243 23 HG3 GLU 3 HG3 GLU 3 -3.757 -4.846 -4.500 24 H GLN 4 H GLN 4 -5.329 -1.026 -5.877 25 HA GLN 4 HA GLN 4 -7.808 0.433 -5.243 26 HB2 GLN 4 HB2 GLN 4 -7.217 2.097 -6.921 27 HB3 GLN 4 HB3 GLN 4 -5.960 1.991 -5.695 28 HG2 GLN 4 HG2 GLN 4 -4.459 0.979 -7.131 29 HG3 GLN 4 HG3 GLN 4 -5.725 0.425 -8.227 30 HE21 GLN 4 HE21 GLN 4 -3.704 1.544 -9.434 31 HE22 GLN 4 HE22 GLN 4 -4.050 3.155 -9.951 32 H VAL 5 H VAL 5 -9.358 0.589 -6.976 33 HA VAL 5 HA VAL 5 -9.015 -1.364 -9.140 34 HB VAL 5 HB VAL 5 -11.533 -1.201 -7.482 35 HG11 VAL 5 HG11 VAL 5 -10.675 -2.760 -9.872 36 HG12 VAL 5 HG12 VAL 5 -11.781 -3.507 -8.716 37 HG13 VAL 5 HG13 VAL 5 -12.227 -2.001 -9.518 38 HG21 VAL 5 HG21 VAL 5 -10.712 -3.620 -6.891 39 HG22 VAL 5 HG22 VAL 5 -9.123 -2.942 -7.245 40 HG23 VAL 5 HG23 VAL 5 -10.125 -2.227 -5.983 41 H SER 6 H SER 6 -10.001 -0.836 -11.047 42 HA SER 6 HA SER 6 -11.345 1.785 -11.118 43 HB2 SER 6 HB2 SER 6 -9.494 2.138 -12.444 44 HB3 SER 6 HB3 SER 6 -9.404 0.452 -12.953 45 HG SER 6 HG SER 6 -10.482 1.001 -14.657 46 H ASN 7 H ASN 7 -11.173 -0.929 -13.410 47 HA ASN 7 HA ASN 7 -13.936 -0.620 -14.107 48 HB2 ASN 7 HB2 ASN 7 -11.884 -2.707 -14.870 49 HB3 ASN 7 HB3 ASN 7 -13.514 -2.643 -15.532 50 HD21 ASN 7 HD21 ASN 7 -10.501 -2.016 -16.320 51 HD22 ASN 7 HD22 ASN 7 -10.696 -0.635 -17.339 52 H VAL 8 H VAL 8 -15.388 -2.596 -14.164 53 HA VAL 8 HA VAL 8 -15.752 -3.528 -11.494 54 HB VAL 8 HB VAL 8 -17.660 -4.792 -12.389 55 HG11 VAL 8 HG11 VAL 8 -17.329 -1.925 -13.215 56 HG12 VAL 8 HG12 VAL 8 -18.848 -2.791 -13.453 57 HG13 VAL 8 HG13 VAL 8 -18.195 -2.583 -11.827 58 HG21 VAL 8 HG21 VAL 8 -16.807 -3.763 -15.093 59 HG22 VAL 8 HG22 VAL 8 -16.586 -5.422 -14.536 60 HG23 VAL 8 HG23 VAL 8 -18.211 -4.768 -14.734 61 H ARG 9 H ARG 9 -16.447 -6.034 -11.398 62 HA ARG 9 HA ARG 9 -14.433 -7.687 -12.717 63 HB2 ARG 9 HB2 ARG 9 -13.330 -7.056 -10.664 64 HB3 ARG 9 HB3 ARG 9 -14.756 -7.469 -9.722 65 HG2 ARG 9 HG2 ARG 9 -13.690 -9.659 -11.354 66 HG3 ARG 9 HG3 ARG 9 -12.615 -9.087 -10.077 67 HD2 ARG 9 HD2 ARG 9 -15.498 -9.855 -9.652 68 HD3 ARG 9 HD3 ARG 9 -14.136 -10.943 -9.391 69 HE ARG 9 HE ARG 9 -15.036 -8.881 -7.644 70 HH11 ARG 9 HH11 ARG 9 -12.199 -10.575 -8.738 71 HH12 ARG 9 HH12 ARG 9 -11.308 -10.294 -7.279 72 HH21 ARG 9 HH21 ARG 9 -13.875 -8.504 -5.718 73 HH22 ARG 9 HH22 ARG 9 -12.263 -9.117 -5.561 74 H ALA 10 H ALA 10 -14.999 -9.846 -12.925 75 HA ALA 10 HA ALA 10 -17.787 -10.465 -12.204 76 HB1 ALA 10 HB1 ALA 10 -16.287 -10.779 -14.640 77 HB2 ALA 10 HB2 ALA 10 -16.925 -12.332 -14.096 78 HB3 ALA 10 HB3 ALA 10 -18.017 -10.971 -14.354 79 H ARG 11 H ARG 11 -18.156 -12.015 -10.762 80 HA ARG 11 HA ARG 11 -15.935 -13.805 -10.041 81 HB2 ARG 11 HB2 ARG 11 -17.297 -12.149 -8.400 82 HB3 ARG 11 HB3 ARG 11 -18.290 -13.594 -8.258 83 HG2 ARG 11 HG2 ARG 11 -16.779 -13.826 -6.526 84 HG3 ARG 11 HG3 ARG 11 -16.063 -14.809 -7.805 85 HD2 ARG 11 HD2 ARG 11 -14.698 -12.780 -8.431 86 HD3 ARG 11 HD3 ARG 11 -15.275 -12.036 -6.940 87 HE ARG 11 HE ARG 11 -13.242 -14.022 -7.191 88 HH11 ARG 11 HH11 ARG 11 -15.751 -12.820 -5.097 89 HH12 ARG 11 HH12 ARG 11 -14.999 -13.401 -3.648 90 HH21 ARG 11 HH21 ARG 11 -12.243 -14.792 -5.290 91 HH22 ARG 11 HH22 ARG 11 -13.004 -14.521 -3.759 92 H ILE 12 H ILE 12 -16.164 -15.614 -11.227 93 HA ILE 12 HA ILE 12 -18.818 -16.783 -11.584 94 HB ILE 12 HB ILE 12 -16.160 -17.607 -12.760 95 HG12 ILE 12 HG12 ILE 12 -18.470 -16.386 -14.249 96 HG13 ILE 12 HG13 ILE 12 -17.277 -15.371 -13.448 97 HG21 ILE 12 HG21 ILE 12 -18.950 -18.652 -13.149 98 HG22 ILE 12 HG22 ILE 12 -17.667 -18.913 -14.329 99 HG23 ILE 12 HG23 ILE 12 -17.499 -19.543 -12.690 100 HD11 ILE 12 HD11 ILE 12 -16.676 -15.589 -15.743 101 HD12 ILE 12 HD12 ILE 12 -15.516 -16.507 -14.783 102 HD13 ILE 12 HD13 ILE 12 -16.795 -17.346 -15.661 103 H TYR 13 H TYR 13 -19.421 -18.764 -10.800 104 HA TYR 13 HA TYR 13 -17.494 -20.291 -9.215 105 HB2 TYR 13 HB2 TYR 13 -18.496 -18.915 -7.538 106 HB3 TYR 13 HB3 TYR 13 -20.109 -19.191 -8.183 107 HD1 TYR 13 HD1 TYR 13 -17.280 -21.415 -7.152 108 HD2 TYR 13 HD2 TYR 13 -21.405 -20.449 -6.759 109 HE1 TYR 13 HE1 TYR 13 -17.569 -23.306 -5.605 110 HE2 TYR 13 HE2 TYR 13 -21.704 -22.336 -5.209 111 HH TYR 13 HH TYR 13 -19.460 -23.761 -3.588 112 H LYS 14 H LYS 14 -17.687 -22.417 -9.519 113 HA LYS 14 HA LYS 14 -19.733 -23.410 -11.285 114 HB2 LYS 14 HB2 LYS 14 -18.498 -25.430 -11.343 115 HB3 LYS 14 HB3 LYS 14 -17.304 -24.139 -11.289 116 HG2 LYS 14 HG2 LYS 14 -17.060 -24.510 -8.862 117 HG3 LYS 14 HG3 LYS 14 -18.186 -25.865 -8.984 118 HD2 LYS 14 HD2 LYS 14 -15.624 -25.673 -10.561 119 HD3 LYS 14 HD3 LYS 14 -15.755 -26.494 -9.004 120 HE2 LYS 14 HE2 LYS 14 -17.669 -27.814 -10.090 121 HE3 LYS 14 HE3 LYS 14 -17.045 -27.201 -11.621 122 HZ1 LYS 14 HZ1 LYS 14 -15.085 -28.372 -11.389 123 HZ2 LYS 14 HZ2 LYS 14 -16.216 -29.458 -10.754 124 HZ3 LYS 14 HZ3 LYS 14 -15.245 -28.544 -9.713 125 HA PRO 15 HA PRO 15 -22.597 -24.956 -8.336 126 HB2 PRO 15 HB2 PRO 15 -23.528 -27.155 -9.627 127 HB3 PRO 15 HB3 PRO 15 -23.942 -25.507 -10.115 128 HG2 PRO 15 HG2 PRO 15 -21.891 -27.363 -11.260 129 HG3 PRO 15 HG3 PRO 15 -23.036 -26.303 -12.103 130 HD2 PRO 15 HD2 PRO 15 -20.432 -25.647 -11.748 131 HD3 PRO 15 HD3 PRO 15 -21.726 -24.431 -11.792 132 H ALA 16 H ALA 16 -22.996 -26.648 -6.832 133 HA ALA 16 HA ALA 16 -20.668 -28.007 -5.954 134 HB1 ALA 16 HB1 ALA 16 -21.975 -27.577 -4.156 135 HB2 ALA 16 HB2 ALA 16 -23.477 -27.790 -5.058 136 HB3 ALA 16 HB3 ALA 16 -22.571 -29.199 -4.507 137 H LYS 17 H LYS 17 -20.552 -30.358 -5.545 138 HA LYS 17 HA LYS 17 -21.127 -31.805 -7.965 139 HB2 LYS 17 HB2 LYS 17 -19.870 -33.619 -6.953 140 HB3 LYS 17 HB3 LYS 17 -19.004 -32.103 -6.740 141 HG2 LYS 17 HG2 LYS 17 -19.894 -31.966 -4.437 142 HG3 LYS 17 HG3 LYS 17 -20.640 -33.550 -4.667 143 HD2 LYS 17 HD2 LYS 17 -18.525 -34.607 -4.893 144 HD3 LYS 17 HD3 LYS 17 -17.690 -33.058 -5.025 145 HE2 LYS 17 HE2 LYS 17 -19.273 -33.664 -2.569 146 HE3 LYS 17 HE3 LYS 17 -17.681 -34.395 -2.771 147 HZ1 LYS 17 HZ1 LYS 17 -17.088 -32.478 -1.747 148 HZ2 LYS 17 HZ2 LYS 17 -18.403 -31.597 -2.345 149 HZ3 LYS 17 HZ3 LYS 17 -17.070 -31.908 -3.340 150 H SER 18 H SER 18 -22.324 -31.758 -4.661 151 HA SER 18 HA SER 18 -24.286 -33.834 -5.367 152 HB2 SER 18 HB2 SER 18 -22.814 -34.259 -3.381 153 HB3 SER 18 HB3 SER 18 -23.546 -32.858 -2.599 154 HG SER 18 HG SER 18 -24.547 -35.388 -2.978 155 H THR 19 H THR 19 -25.591 -32.297 -6.512 156 HA THR 19 HA THR 19 -26.895 -30.252 -4.867 157 HB THR 19 HB THR 19 -26.010 -29.565 -7.079 158 HG1 THR 19 HG1 THR 19 -27.671 -28.234 -7.304 159 HG21 THR 19 HG21 THR 19 -26.822 -30.393 -9.104 160 HG22 THR 19 HG22 THR 19 -28.237 -31.125 -8.347 161 HG23 THR 19 HG23 THR 19 -26.643 -31.844 -8.118 162 H MET 20 H MET 20 -27.494 -33.017 -4.406 163 HA MET 20 HA MET 20 -30.199 -33.301 -5.501 164 HB2 MET 20 HB2 MET 20 -28.295 -35.233 -4.202 165 HB3 MET 20 HB3 MET 20 -30.002 -35.612 -4.385 166 HG2 MET 20 HG2 MET 20 -29.869 -35.648 -6.712 167 HG3 MET 20 HG3 MET 20 -28.337 -34.779 -6.727 168 HE1 MET 20 HE1 MET 20 -26.602 -36.865 -8.146 169 HE2 MET 20 HE2 MET 20 -26.395 -35.538 -7.004 170 HE3 MET 20 HE3 MET 20 -25.688 -37.116 -6.659 171 H GLN 21 H GLN 21 -30.567 -31.375 -3.945 172 HA GLN 21 HA GLN 21 -31.125 -32.347 -1.230 173 HB2 GLN 21 HB2 GLN 21 -31.058 -29.501 -2.244 174 HB3 GLN 21 HB3 GLN 21 -31.246 -30.005 -0.571 175 HG2 GLN 21 HG2 GLN 21 -28.817 -30.333 -2.311 176 HG3 GLN 21 HG3 GLN 21 -28.997 -29.287 -0.904 177 HE21 GLN 21 HE21 GLN 21 -29.351 -30.344 1.170 178 HE22 GLN 21 HE22 GLN 21 -28.618 -31.881 1.461 179 H SER 22 H SER 22 -32.593 -30.339 -3.782 180 HA SER 22 HA SER 22 -35.238 -31.107 -2.732 181 HB2 SER 22 HB2 SER 22 -34.295 -28.583 -4.083 182 HB3 SER 22 HB3 SER 22 -36.005 -29.006 -4.006 183 HG SER 22 HG SER 22 -34.230 -28.564 -1.840 184 H GLY 23 H GLY 23 -34.099 -29.778 -5.835 185 HA2 GLY 23 HA2 GLY 23 -34.797 -32.207 -7.241 186 HA3 GLY 23 HA3 GLY 23 -35.896 -30.867 -7.533 187 H HIS 24 H HIS 24 -35.073 -31.328 -9.777 188 HA HIS 24 HA HIS 24 -32.648 -29.728 -10.264 189 HB2 HIS 24 HB2 HIS 24 -33.560 -32.241 -11.669 190 HB3 HIS 24 HB3 HIS 24 -32.319 -31.171 -12.316 191 HD1 HIS 24 HD1 HIS 24 -32.649 -34.139 -10.391 192 HD2 HIS 24 HD2 HIS 24 -30.127 -30.840 -10.249 193 HE1 HIS 24 HE1 HIS 24 -30.646 -34.881 -9.063 194 H SER 25 H SER 25 -32.738 -28.219 -11.869 195 HA SER 25 HA SER 25 -35.163 -28.085 -13.514 196 HB2 SER 25 HB2 SER 25 -34.056 -25.832 -11.825 197 HB3 SER 25 HB3 SER 25 -35.268 -25.613 -13.088 198 HG SER 25 HG SER 25 -36.742 -26.470 -11.834 199 H LYS 26 H LYS 26 -34.831 -26.006 -15.037 200 HA LYS 26 HA LYS 26 -32.081 -26.119 -16.086 201 HB2 LYS 26 HB2 LYS 26 -34.655 -26.223 -17.668 202 HB3 LYS 26 HB3 LYS 26 -33.061 -26.008 -18.380 203 HG2 LYS 26 HG2 LYS 26 -32.383 -28.190 -17.474 204 HG3 LYS 26 HG3 LYS 26 -34.009 -28.405 -16.821 205 HD2 LYS 26 HD2 LYS 26 -34.691 -27.906 -19.328 206 HD3 LYS 26 HD3 LYS 26 -33.057 -28.500 -19.639 207 HE2 LYS 26 HE2 LYS 26 -35.067 -29.998 -17.972 208 HE3 LYS 26 HE3 LYS 26 -34.899 -30.228 -19.712 209 HZ1 LYS 26 HZ1 LYS 26 -33.248 -31.197 -17.573 210 HZ2 LYS 26 HZ2 LYS 26 -32.355 -30.453 -18.802 211 HZ3 LYS 26 HZ3 LYS 26 -33.382 -31.746 -19.168 212 H LEU 27 H LEU 27 -32.946 -24.131 -14.368 213 HA LEU 27 HA LEU 27 -33.513 -21.827 -16.095 214 HB2 LEU 27 HB2 LEU 27 -33.624 -22.164 -13.105 215 HB3 LEU 27 HB3 LEU 27 -33.879 -20.629 -13.933 216 HG LEU 27 HG LEU 27 -35.589 -23.013 -14.552 217 HD11 LEU 27 HD11 LEU 27 -37.063 -22.563 -12.816 218 HD12 LEU 27 HD12 LEU 27 -36.361 -20.977 -12.496 219 HD13 LEU 27 HD13 LEU 27 -35.483 -22.439 -12.043 220 HD21 LEU 27 HD21 LEU 27 -37.128 -21.408 -15.350 221 HD22 LEU 27 HD22 LEU 27 -35.552 -20.925 -15.976 222 HD23 LEU 27 HD23 LEU 27 -36.248 -20.078 -14.594 223 H LYS 28 H LYS 28 -31.088 -23.245 -14.049 224 HA LYS 28 HA LYS 28 -29.007 -21.693 -15.130 225 HB2 LYS 28 HB2 LYS 28 -28.368 -20.409 -13.106 226 HB3 LYS 28 HB3 LYS 28 -29.891 -19.875 -13.804 227 HG2 LYS 28 HG2 LYS 28 -30.495 -19.924 -11.621 228 HG3 LYS 28 HG3 LYS 28 -30.874 -21.595 -12.047 229 HD2 LYS 28 HD2 LYS 28 -29.119 -22.439 -10.863 230 HD3 LYS 28 HD3 LYS 28 -28.112 -21.015 -11.134 231 HE2 LYS 28 HE2 LYS 28 -29.074 -19.843 -9.387 232 HE3 LYS 28 HE3 LYS 28 -30.550 -20.808 -9.418 233 HZ1 LYS 28 HZ1 LYS 28 -28.281 -22.413 -8.820 234 HZ2 LYS 28 HZ2 LYS 28 -29.704 -22.200 -7.932 235 HZ3 LYS 28 HZ3 LYS 28 -28.411 -21.130 -7.726 236 H ALA 29 H ALA 29 -26.933 -22.310 -14.344 237 HA ALA 29 HA ALA 29 -26.936 -24.571 -12.462 238 HB1 ALA 29 HB1 ALA 29 -24.942 -24.814 -14.574 239 HB2 ALA 29 HB2 ALA 29 -26.065 -26.012 -13.930 240 HB3 ALA 29 HB3 ALA 29 -26.601 -24.878 -15.170 241 H TRP 30 H TRP 30 -24.974 -22.144 -14.152 242 HA TRP 30 HA TRP 30 -22.941 -22.329 -12.054 243 HB2 TRP 30 HB2 TRP 30 -23.003 -21.139 -14.808 244 HB3 TRP 30 HB3 TRP 30 -21.794 -20.603 -13.645 245 HD1 TRP 30 HD1 TRP 30 -23.002 -23.947 -15.207 246 HE1 TRP 30 HE1 TRP 30 -20.955 -25.488 -15.449 247 HE3 TRP 30 HE3 TRP 30 -19.470 -20.952 -13.042 248 HZ2 TRP 30 HZ2 TRP 30 -18.207 -25.440 -14.808 249 HZ3 TRP 30 HZ3 TRP 30 -17.156 -21.774 -12.895 250 HH2 TRP 30 HH2 TRP 30 -16.539 -23.972 -13.760 251 H LYS 31 H LYS 31 -22.118 -20.381 -11.054 252 HA LYS 31 HA LYS 31 -24.219 -18.342 -10.732 253 HB2 LYS 31 HB2 LYS 31 -22.210 -19.492 -8.822 254 HB3 LYS 31 HB3 LYS 31 -22.905 -17.904 -8.531 255 HG2 LYS 31 HG2 LYS 31 -24.367 -19.169 -7.345 256 HG3 LYS 31 HG3 LYS 31 -25.165 -19.220 -8.918 257 HD2 LYS 31 HD2 LYS 31 -24.570 -21.404 -9.301 258 HD3 LYS 31 HD3 LYS 31 -23.132 -21.303 -8.284 259 HE2 LYS 31 HE2 LYS 31 -24.529 -21.290 -6.289 260 HE3 LYS 31 HE3 LYS 31 -25.981 -21.334 -7.289 261 HZ1 LYS 31 HZ1 LYS 31 -25.777 -23.532 -6.888 262 HZ2 LYS 31 HZ2 LYS 31 -24.106 -23.466 -6.640 263 HZ3 LYS 31 HZ3 LYS 31 -24.728 -23.468 -8.214 264 H LEU 32 H LEU 32 -23.731 -16.205 -10.940 265 HA LEU 32 HA LEU 32 -20.933 -15.465 -11.423 266 HB2 LEU 32 HB2 LEU 32 -22.162 -15.842 -13.576 267 HB3 LEU 32 HB3 LEU 32 -23.224 -14.509 -13.128 268 HG LEU 32 HG LEU 32 -21.369 -13.989 -14.773 269 HD11 LEU 32 HD11 LEU 32 -20.802 -12.115 -12.652 270 HD12 LEU 32 HD12 LEU 32 -22.524 -12.486 -12.741 271 HD13 LEU 32 HD13 LEU 32 -21.678 -11.877 -14.164 272 HD21 LEU 32 HD21 LEU 32 -19.186 -14.064 -14.197 273 HD22 LEU 32 HD22 LEU 32 -19.754 -15.309 -13.084 274 HD23 LEU 32 HD23 LEU 32 -19.504 -13.660 -12.509 275 H GLU 33 H GLU 33 -20.331 -13.672 -10.384 276 HA GLU 33 HA GLU 33 -22.427 -11.831 -9.443 277 HB2 GLU 33 HB2 GLU 33 -19.958 -12.489 -7.845 278 HB3 GLU 33 HB3 GLU 33 -21.393 -11.623 -7.315 279 HG2 GLU 33 HG2 GLU 33 -21.335 -14.532 -8.076 280 HG3 GLU 33 HG3 GLU 33 -21.235 -13.919 -6.426 281 H PHE 34 H PHE 34 -22.120 -10.113 -10.734 282 HA PHE 34 HA PHE 34 -19.390 -9.160 -11.210 283 HB2 PHE 34 HB2 PHE 34 -20.311 -7.842 -13.017 284 HB3 PHE 34 HB3 PHE 34 -20.894 -9.496 -13.165 285 HD1 PHE 34 HD1 PHE 34 -23.220 -10.037 -12.785 286 HD2 PHE 34 HD2 PHE 34 -21.806 -6.038 -12.432 287 HE1 PHE 34 HE1 PHE 34 -25.538 -9.216 -12.841 288 HE2 PHE 34 HE2 PHE 34 -24.122 -5.211 -12.486 289 HZ PHE 34 HZ PHE 34 -25.992 -6.800 -12.690 290 H GLU 35 H GLU 35 -18.634 -7.303 -10.375 291 HA GLU 35 HA GLU 35 -19.967 -6.061 -8.225 292 HB2 GLU 35 HB2 GLU 35 -17.452 -5.599 -9.731 293 HB3 GLU 35 HB3 GLU 35 -18.086 -4.239 -8.817 294 HG2 GLU 35 HG2 GLU 35 -16.409 -5.680 -7.628 295 HG3 GLU 35 HG3 GLU 35 -17.927 -5.402 -6.777 296 HA PRO 36 HA PRO 36 -22.418 -2.908 -10.037 297 HB2 PRO 36 HB2 PRO 36 -22.030 -0.823 -8.343 298 HB3 PRO 36 HB3 PRO 36 -22.976 -2.252 -7.908 299 HG2 PRO 36 HG2 PRO 36 -20.138 -1.580 -7.231 300 HG3 PRO 36 HG3 PRO 36 -21.402 -2.270 -6.196 301 HD2 PRO 36 HD2 PRO 36 -19.465 -3.781 -7.334 302 HD3 PRO 36 HD3 PRO 36 -21.103 -4.397 -7.034 303 H SER 37 H SER 37 -22.379 -1.033 -11.308 304 HA SER 37 HA SER 37 -19.723 0.142 -11.787 305 HB2 SER 37 HB2 SER 37 -20.745 0.346 -14.244 306 HB3 SER 37 HB3 SER 37 -19.856 -1.085 -13.722 307 HG SER 37 HG SER 37 -21.645 -2.217 -13.751 308 H CYS 38 H CYS 38 -23.039 0.661 -12.987 309 HA CYS 38 HA CYS 38 -23.148 3.263 -11.714 310 HB2 CYS 38 HB2 CYS 38 -22.818 2.891 -14.661 311 HB3 CYS 38 HB3 CYS 38 -23.858 4.190 -14.088 312 HG CYS 38 HG CYS 38 -21.126 4.959 -14.782 313 H THR 39 H THR 39 -25.288 4.365 -12.255 314 HA THR 39 HA THR 39 -27.384 2.431 -11.857 315 HB THR 39 HB THR 39 -27.490 4.463 -10.565 316 HG1 THR 39 HG1 THR 39 -29.578 4.273 -10.789 317 HG21 THR 39 HG21 THR 39 -26.896 6.445 -11.389 318 HG22 THR 39 HG22 THR 39 -28.213 6.381 -12.561 319 HG23 THR 39 HG23 THR 39 -26.641 5.691 -12.961 320 H GLN 40 H GLN 40 -28.624 1.564 -13.379 321 HA GLN 40 HA GLN 40 -29.196 3.059 -15.820 322 HB2 GLN 40 HB2 GLN 40 -28.105 0.240 -15.865 323 HB3 GLN 40 HB3 GLN 40 -28.625 1.172 -17.262 324 HG2 GLN 40 HG2 GLN 40 -26.838 2.781 -16.863 325 HG3 GLN 40 HG3 GLN 40 -26.320 1.859 -15.453 326 HE21 GLN 40 HE21 GLN 40 -25.076 2.558 -18.122 327 HE22 GLN 40 HE22 GLN 40 -24.491 1.046 -18.721 328 H TYR 41 H TYR 41 -30.878 1.914 -17.159 329 HA TYR 41 HA TYR 41 -32.689 0.334 -15.457 330 HB2 TYR 41 HB2 TYR 41 -33.293 2.757 -17.129 331 HB3 TYR 41 HB3 TYR 41 -34.547 1.574 -16.777 332 HD1 TYR 41 HD1 TYR 41 -32.157 3.934 -15.212 333 HD2 TYR 41 HD2 TYR 41 -35.643 1.552 -14.686 334 HE1 TYR 41 HE1 TYR 41 -32.569 5.026 -13.047 335 HE2 TYR 41 HE2 TYR 41 -36.065 2.639 -12.521 336 HH TYR 41 HH TYR 41 -34.229 3.956 -10.735 337 H THR 42 H THR 42 -32.028 -1.578 -16.469 338 HA THR 42 HA THR 42 -32.603 -1.809 -19.341 339 HB THR 42 HB THR 42 -31.206 -3.711 -19.428 340 HG1 THR 42 HG1 THR 42 -31.223 -3.674 -16.574 341 HG21 THR 42 HG21 THR 42 -29.964 -1.741 -17.504 342 HG22 THR 42 HG22 THR 42 -29.942 -1.642 -19.264 343 HG23 THR 42 HG23 THR 42 -29.079 -2.942 -18.443 344 H GLU 43 H GLU 43 -34.383 -1.997 -16.762 345 HA GLU 43 HA GLU 43 -35.417 -4.617 -16.673 346 HB2 GLU 43 HB2 GLU 43 -35.832 -3.079 -14.859 347 HB3 GLU 43 HB3 GLU 43 -36.669 -1.969 -15.936 348 HG2 GLU 43 HG2 GLU 43 -38.366 -3.772 -16.320 349 HG3 GLU 43 HG3 GLU 43 -37.582 -4.685 -15.032 350 HA PRO 44 HA PRO 44 -37.722 -4.797 -20.431 351 HB2 PRO 44 HB2 PRO 44 -39.330 -6.888 -19.792 352 HB3 PRO 44 HB3 PRO 44 -37.621 -7.080 -20.196 353 HG2 PRO 44 HG2 PRO 44 -38.934 -6.991 -17.507 354 HG3 PRO 44 HG3 PRO 44 -37.655 -8.072 -18.092 355 HD2 PRO 44 HD2 PRO 44 -37.143 -5.919 -16.532 356 HD3 PRO 44 HD3 PRO 44 -36.003 -6.498 -17.762 357 H LEU 45 H LEU 45 -39.698 -4.168 -21.256 358 HA LEU 45 HA LEU 45 -41.682 -3.246 -19.282 359 HB2 LEU 45 HB2 LEU 45 -42.320 -1.586 -21.087 360 HB3 LEU 45 HB3 LEU 45 -40.788 -1.316 -20.258 361 HG LEU 45 HG LEU 45 -39.701 -2.476 -22.260 362 HD11 LEU 45 HD11 LEU 45 -41.099 -2.126 -24.366 363 HD12 LEU 45 HD12 LEU 45 -42.491 -2.060 -23.286 364 HD13 LEU 45 HD13 LEU 45 -41.495 -3.513 -23.350 365 HD21 LEU 45 HD21 LEU 45 -39.271 -0.438 -23.158 366 HD22 LEU 45 HD22 LEU 45 -40.075 0.103 -21.684 367 HD23 LEU 45 HD23 LEU 45 -40.971 0.027 -23.203 368 H MET 46 H MET 46 -41.503 -5.861 -20.622 369 HA MET 46 HA MET 46 -44.033 -5.774 -22.131 370 HB2 MET 46 HB2 MET 46 -43.322 -7.677 -23.392 371 HB3 MET 46 HB3 MET 46 -42.019 -6.497 -23.438 372 HG2 MET 46 HG2 MET 46 -41.167 -7.877 -21.359 373 HG3 MET 46 HG3 MET 46 -42.142 -9.142 -22.101 374 HE1 MET 46 HE1 MET 46 -39.173 -9.056 -21.384 375 HE2 MET 46 HE2 MET 46 -39.362 -10.501 -22.377 376 HE3 MET 46 HE3 MET 46 -38.107 -9.323 -22.764 377 H ASN 47 H ASN 47 -43.638 -5.980 -19.222 378 HA ASN 47 HA ASN 47 -44.452 -8.727 -18.652 379 HB2 ASN 47 HB2 ASN 47 -42.726 -7.628 -17.231 380 HB3 ASN 47 HB3 ASN 47 -43.937 -6.453 -16.725 381 HD21 ASN 47 HD21 ASN 47 -44.016 -6.969 -14.603 382 HD22 ASN 47 HD22 ASN 47 -44.563 -8.492 -13.999 383 H TRP 48 H TRP 48 -46.445 -8.035 -20.002 384 HA TRP 48 HA TRP 48 -48.393 -6.304 -19.088 385 HB2 TRP 48 HB2 TRP 48 -48.340 -7.703 -21.243 386 HB3 TRP 48 HB3 TRP 48 -49.066 -8.987 -20.280 387 HD1 TRP 48 HD1 TRP 48 -51.632 -8.934 -20.028 388 HE1 TRP 48 HE1 TRP 48 -53.491 -7.270 -20.660 389 HE3 TRP 48 HE3 TRP 48 -48.727 -4.980 -21.463 390 HZ2 TRP 48 HZ2 TRP 48 -53.697 -4.630 -21.638 391 HZ3 TRP 48 HZ3 TRP 48 -49.833 -2.923 -22.235 392 HH2 TRP 48 HH2 TRP 48 -52.267 -2.754 -22.320 393 H THR 49 H THR 49 -48.094 -9.777 -18.343 394 HA THR 49 HA THR 49 -50.139 -9.584 -16.303 395 HB THR 49 HB THR 49 -48.392 -11.990 -16.750 396 HG1 THR 49 HG1 THR 49 -49.231 -12.214 -18.671 397 HG21 THR 49 HG21 THR 49 -51.289 -12.234 -16.293 398 HG22 THR 49 HG22 THR 49 -50.380 -11.523 -14.960 399 HG23 THR 49 HG23 THR 49 -49.947 -13.120 -15.569 400 H GLY 50 H GLY 50 -49.424 -8.388 -14.596 401 HA2 GLY 50 HA2 GLY 50 -48.340 -9.092 -12.394 402 HA3 GLY 50 HA3 GLY 50 -46.873 -9.197 -13.355 403 H SER 51 H SER 51 -47.709 -7.472 -11.030 404 HA SER 51 HA SER 51 -47.945 -4.806 -11.992 405 HB2 SER 51 HB2 SER 51 -47.883 -4.144 -9.753 406 HB3 SER 51 HB3 SER 51 -48.527 -5.782 -9.647 407 HG SER 51 HG SER 51 -46.911 -6.131 -8.360 408 H HIS 52 H HIS 52 -46.283 -3.109 -11.323 409 HA HIS 52 HA HIS 52 -43.850 -3.664 -12.682 410 HB2 HIS 52 HB2 HIS 52 -44.795 -1.300 -11.061 411 HB3 HIS 52 HB3 HIS 52 -43.212 -1.350 -11.833 412 HD1 HIS 52 HD1 HIS 52 -45.198 0.796 -12.672 413 HD2 HIS 52 HD2 HIS 52 -44.898 -2.904 -14.538 414 HE1 HIS 52 HE1 HIS 52 -46.147 1.127 -14.977 415 H ASP 53 H ASP 53 -41.953 -4.365 -11.936 416 HA ASP 53 HA ASP 53 -41.715 -4.984 -9.107 417 HB2 ASP 53 HB2 ASP 53 -39.985 -5.655 -11.492 418 HB3 ASP 53 HB3 ASP 53 -39.594 -6.129 -9.842 419 H THR 54 H THR 54 -39.593 -3.445 -11.529 420 HA THR 54 HA THR 54 -37.991 -1.837 -11.343 421 HB THR 54 HB THR 54 -39.411 -0.712 -8.951 422 HG1 THR 54 HG1 THR 54 -40.380 -0.956 -11.586 423 HG21 THR 54 HG21 THR 54 -38.727 1.028 -11.189 424 HG22 THR 54 HG22 THR 54 -37.332 0.176 -10.529 425 HG23 THR 54 HG23 THR 54 -38.330 1.179 -9.478 426 H LYS 55 H LYS 55 -37.339 -4.220 -10.088 427 HA LYS 55 HA LYS 55 -35.710 -3.248 -7.836 428 HB2 LYS 55 HB2 LYS 55 -37.534 -4.619 -6.951 429 HB3 LYS 55 HB3 LYS 55 -37.094 -5.930 -8.036 430 HG2 LYS 55 HG2 LYS 55 -35.160 -6.430 -6.851 431 HG3 LYS 55 HG3 LYS 55 -35.124 -4.854 -6.057 432 HD2 LYS 55 HD2 LYS 55 -35.892 -6.176 -4.344 433 HD3 LYS 55 HD3 LYS 55 -37.418 -5.658 -5.063 434 HE2 LYS 55 HE2 LYS 55 -37.856 -7.719 -5.954 435 HE3 LYS 55 HE3 LYS 55 -36.149 -8.139 -6.097 436 HZ1 LYS 55 HZ1 LYS 55 -36.036 -8.792 -3.913 437 HZ2 LYS 55 HZ2 LYS 55 -37.607 -9.276 -4.306 438 HZ3 LYS 55 HZ3 LYS 55 -37.356 -7.850 -3.431 439 H GLN 56 H GLN 56 -33.595 -3.719 -7.946 440 HA GLN 56 HA GLN 56 -32.703 -5.390 -10.190 441 HB2 GLN 56 HB2 GLN 56 -31.295 -3.227 -8.622 442 HB3 GLN 56 HB3 GLN 56 -30.497 -4.235 -9.822 443 HG2 GLN 56 HG2 GLN 56 -31.875 -3.367 -11.568 444 HG3 GLN 56 HG3 GLN 56 -32.881 -2.500 -10.409 445 HE21 GLN 56 HE21 GLN 56 -32.136 -0.605 -9.502 446 HE22 GLN 56 HE22 GLN 56 -30.755 0.239 -10.106 447 H GLN 57 H GLN 57 -30.422 -6.378 -9.704 448 HA GLN 57 HA GLN 57 -30.180 -7.372 -6.983 449 HB2 GLN 57 HB2 GLN 57 -30.290 -9.695 -7.565 450 HB3 GLN 57 HB3 GLN 57 -31.755 -8.922 -8.157 451 HG2 GLN 57 HG2 GLN 57 -30.448 -8.717 -10.383 452 HG3 GLN 57 HG3 GLN 57 -29.419 -9.970 -9.691 453 HE21 GLN 57 HE21 GLN 57 -30.709 -11.844 -8.730 454 HE22 GLN 57 HE22 GLN 57 -32.008 -12.442 -9.700 455 H VAL 58 H VAL 58 -28.193 -8.696 -6.702 456 HA VAL 58 HA VAL 58 -26.077 -7.699 -8.487 457 HB VAL 58 HB VAL 58 -25.972 -7.065 -6.060 458 HG11 VAL 58 HG11 VAL 58 -25.058 -9.855 -5.497 459 HG12 VAL 58 HG12 VAL 58 -25.604 -8.607 -4.375 460 HG13 VAL 58 HG13 VAL 58 -26.770 -9.447 -5.399 461 HG21 VAL 58 HG21 VAL 58 -23.864 -6.752 -6.713 462 HG22 VAL 58 HG22 VAL 58 -23.505 -8.328 -6.007 463 HG23 VAL 58 HG23 VAL 58 -23.887 -8.198 -7.723 464 H CYS 59 H CYS 59 -27.441 -10.571 -7.024 465 HA CYS 59 HA CYS 59 -25.347 -12.296 -8.026 466 HB2 CYS 59 HB2 CYS 59 -28.005 -13.112 -6.845 467 HB3 CYS 59 HB3 CYS 59 -26.551 -14.092 -6.982 468 HG CYS 59 HG CYS 59 -27.388 -11.820 -4.661 469 H LEU 60 H LEU 60 -25.267 -12.943 -10.063 470 HA LEU 60 HA LEU 60 -27.797 -13.250 -11.543 471 HB2 LEU 60 HB2 LEU 60 -26.700 -11.481 -12.586 472 HB3 LEU 60 HB3 LEU 60 -25.115 -12.227 -12.391 473 HG LEU 60 HG LEU 60 -25.668 -13.856 -14.132 474 HD11 LEU 60 HD11 LEU 60 -27.765 -13.138 -15.531 475 HD12 LEU 60 HD12 LEU 60 -28.317 -12.504 -13.979 476 HD13 LEU 60 HD13 LEU 60 -27.929 -14.217 -14.145 477 HD21 LEU 60 HD21 LEU 60 -24.532 -12.114 -15.089 478 HD22 LEU 60 HD22 LEU 60 -25.765 -10.928 -14.662 479 HD23 LEU 60 HD23 LEU 60 -26.039 -12.042 -16.002 480 H SER 61 H SER 61 -28.256 -15.228 -12.242 481 HA SER 61 HA SER 61 -26.187 -17.291 -12.064 482 HB2 SER 61 HB2 SER 61 -29.091 -17.832 -12.621 483 HB3 SER 61 HB3 SER 61 -27.901 -18.871 -11.836 484 HG SER 61 HG SER 61 -27.895 -17.216 -10.129 485 H PHE 62 H PHE 62 -25.883 -18.822 -13.757 486 HA PHE 62 HA PHE 62 -26.903 -18.038 -16.392 487 HB2 PHE 62 HB2 PHE 62 -24.038 -18.214 -15.541 488 HB3 PHE 62 HB3 PHE 62 -24.471 -18.648 -17.192 489 HD1 PHE 62 HD1 PHE 62 -26.110 -16.861 -18.336 490 HD2 PHE 62 HD2 PHE 62 -23.375 -16.057 -15.176 491 HE1 PHE 62 HE1 PHE 62 -26.080 -14.484 -18.972 492 HE2 PHE 62 HE2 PHE 62 -23.342 -13.679 -15.805 493 HZ PHE 62 HZ PHE 62 -24.697 -12.890 -17.704 494 H THR 63 H THR 63 -26.713 -19.722 -18.012 495 HA THR 63 HA THR 63 -27.485 -22.251 -17.041 496 HB THR 63 HB THR 63 -26.405 -22.087 -19.802 497 HG1 THR 63 HG1 THR 63 -28.403 -20.399 -18.770 498 HG21 THR 63 HG21 THR 63 -28.773 -23.270 -18.402 499 HG22 THR 63 HG22 THR 63 -27.560 -24.060 -19.411 500 HG23 THR 63 HG23 THR 63 -28.801 -23.048 -20.151 501 H THR 64 H THR 64 -24.503 -21.255 -18.724 502 HA THR 64 HA THR 64 -23.069 -23.375 -17.291 503 HB THR 64 HB THR 64 -21.791 -23.915 -19.362 504 HG1 THR 64 HG1 THR 64 -22.327 -23.013 -21.246 505 HG21 THR 64 HG21 THR 64 -24.722 -24.443 -19.111 506 HG22 THR 64 HG22 THR 64 -23.362 -25.547 -18.908 507 HG23 THR 64 HG23 THR 64 -23.850 -25.037 -20.524 508 H ARG 65 H ARG 65 -20.656 -23.110 -17.525 509 HA ARG 65 HA ARG 65 -19.835 -20.635 -16.599 510 HB2 ARG 65 HB2 ARG 65 -17.508 -21.426 -17.294 511 HB3 ARG 65 HB3 ARG 65 -18.402 -22.455 -16.183 512 HG2 ARG 65 HG2 ARG 65 -18.962 -23.979 -17.943 513 HG3 ARG 65 HG3 ARG 65 -18.276 -22.896 -19.158 514 HD2 ARG 65 HD2 ARG 65 -16.488 -24.262 -18.922 515 HD3 ARG 65 HD3 ARG 65 -16.138 -23.179 -17.576 516 HE ARG 65 HE ARG 65 -16.544 -24.906 -16.131 517 HH11 ARG 65 HH11 ARG 65 -17.856 -25.706 -19.254 518 HH12 ARG 65 HH12 ARG 65 -18.245 -27.337 -18.818 519 HH21 ARG 65 HH21 ARG 65 -17.050 -27.050 -15.544 520 HH22 ARG 65 HH22 ARG 65 -17.787 -28.100 -16.706 521 H GLU 66 H GLU 66 -19.808 -21.900 -19.902 522 HA GLU 66 HA GLU 66 -18.372 -19.929 -21.189 523 HB2 GLU 66 HB2 GLU 66 -20.702 -21.613 -22.070 524 HB3 GLU 66 HB3 GLU 66 -19.971 -20.440 -23.156 525 HG2 GLU 66 HG2 GLU 66 -17.835 -21.560 -22.988 526 HG3 GLU 66 HG3 GLU 66 -18.500 -22.698 -21.817 527 H LEU 67 H LEU 67 -21.704 -19.869 -20.080 528 HA LEU 67 HA LEU 67 -22.469 -17.488 -21.411 529 HB2 LEU 67 HB2 LEU 67 -23.669 -19.386 -19.720 530 HB3 LEU 67 HB3 LEU 67 -23.856 -17.826 -18.921 531 HG LEU 67 HG LEU 67 -25.816 -18.213 -20.208 532 HD11 LEU 67 HD11 LEU 67 -24.562 -15.944 -20.330 533 HD12 LEU 67 HD12 LEU 67 -25.927 -16.244 -21.404 534 HD13 LEU 67 HD13 LEU 67 -24.279 -16.394 -22.011 535 HD21 LEU 67 HD21 LEU 67 -23.888 -19.004 -22.356 536 HD22 LEU 67 HD22 LEU 67 -25.510 -18.445 -22.767 537 HD23 LEU 67 HD23 LEU 67 -25.299 -19.869 -21.745 538 H ALA 68 H ALA 68 -21.039 -18.147 -18.256 539 HA ALA 68 HA ALA 68 -21.264 -15.522 -17.226 540 HB1 ALA 68 HB1 ALA 68 -18.994 -17.223 -16.364 541 HB2 ALA 68 HB2 ALA 68 -20.154 -16.303 -15.404 542 HB3 ALA 68 HB3 ALA 68 -20.625 -17.849 -16.111 543 H ILE 69 H ILE 69 -18.372 -17.215 -18.462 544 HA ILE 69 HA ILE 69 -16.671 -15.022 -18.507 545 HB ILE 69 HB ILE 69 -16.675 -17.398 -20.372 546 HG12 ILE 69 HG12 ILE 69 -14.607 -17.642 -18.527 547 HG13 ILE 69 HG13 ILE 69 -15.956 -17.037 -17.573 548 HG21 ILE 69 HG21 ILE 69 -14.877 -15.082 -20.087 549 HG22 ILE 69 HG22 ILE 69 -14.091 -16.656 -20.189 550 HG23 ILE 69 HG23 ILE 69 -15.173 -16.126 -21.477 551 HD11 ILE 69 HD11 ILE 69 -16.943 -19.019 -17.587 552 HD12 ILE 69 HD12 ILE 69 -16.789 -19.159 -19.338 553 HD13 ILE 69 HD13 ILE 69 -15.462 -19.665 -18.293 554 H ALA 70 H ALA 70 -19.036 -16.092 -20.877 555 HA ALA 70 HA ALA 70 -18.234 -14.355 -22.968 556 HB1 ALA 70 HB1 ALA 70 -20.798 -15.815 -22.396 557 HB2 ALA 70 HB2 ALA 70 -20.586 -14.793 -23.818 558 HB3 ALA 70 HB3 ALA 70 -19.554 -16.204 -23.585 559 H TYR 71 H TYR 71 -20.103 -13.905 -20.095 560 HA TYR 71 HA TYR 71 -21.417 -11.504 -20.987 561 HB2 TYR 71 HB2 TYR 71 -22.512 -12.879 -19.322 562 HB3 TYR 71 HB3 TYR 71 -21.130 -12.738 -18.242 563 HD1 TYR 71 HD1 TYR 71 -24.012 -10.962 -19.683 564 HD2 TYR 71 HD2 TYR 71 -20.798 -10.771 -16.900 565 HE1 TYR 71 HE1 TYR 71 -25.027 -8.971 -18.656 566 HE2 TYR 71 HE2 TYR 71 -21.805 -8.780 -15.866 567 HH TYR 71 HH TYR 71 -24.028 -6.915 -17.250 568 H ALA 72 H ALA 72 -18.728 -12.275 -18.801 569 HA ALA 72 HA ALA 72 -18.136 -9.589 -18.124 570 HB1 ALA 72 HB1 ALA 72 -16.552 -10.462 -16.789 571 HB2 ALA 72 HB2 ALA 72 -17.347 -11.992 -17.166 572 HB3 ALA 72 HB3 ALA 72 -15.906 -11.503 -18.059 573 H VAL 73 H VAL 73 -16.473 -11.850 -20.329 574 HA VAL 73 HA VAL 73 -14.569 -10.129 -21.343 575 HB VAL 73 HB VAL 73 -16.026 -12.307 -22.846 576 HG11 VAL 73 HG11 VAL 73 -13.456 -10.849 -23.422 577 HG12 VAL 73 HG12 VAL 73 -13.902 -12.376 -24.185 578 HG13 VAL 73 HG13 VAL 73 -14.897 -10.941 -24.432 579 HG21 VAL 73 HG21 VAL 73 -13.326 -12.844 -21.892 580 HG22 VAL 73 HG22 VAL 73 -14.475 -12.547 -20.588 581 HG23 VAL 73 HG23 VAL 73 -14.788 -13.823 -21.764 582 H ALA 74 H ALA 74 -17.967 -10.381 -22.143 583 HA ALA 74 HA ALA 74 -18.092 -9.043 -24.552 584 HB1 ALA 74 HB1 ALA 74 -20.375 -8.439 -23.957 585 HB2 ALA 74 HB2 ALA 74 -20.022 -10.100 -23.481 586 HB3 ALA 74 HB3 ALA 74 -20.047 -8.822 -22.267 587 H HIS 75 H HIS 75 -17.512 -7.768 -21.357 588 HA HIS 75 HA HIS 75 -17.292 -5.070 -22.524 589 HB2 HIS 75 HB2 HIS 75 -18.408 -5.961 -19.884 590 HB3 HIS 75 HB3 HIS 75 -17.721 -4.348 -20.052 591 HD1 HIS 75 HD1 HIS 75 -20.543 -6.484 -21.347 592 HD2 HIS 75 HD2 HIS 75 -19.325 -2.511 -21.337 593 HE1 HIS 75 HE1 HIS 75 -22.491 -5.181 -22.259 594 H LYS 76 H LYS 76 -15.305 -7.272 -22.151 595 HA LYS 76 HA LYS 76 -13.159 -7.579 -21.448 596 HB2 LYS 76 HB2 LYS 76 -13.355 -4.583 -21.654 597 HB3 LYS 76 HB3 LYS 76 -11.851 -5.374 -21.199 598 HG2 LYS 76 HG2 LYS 76 -13.224 -6.320 -23.653 599 HG3 LYS 76 HG3 LYS 76 -12.411 -4.753 -23.705 600 HD2 LYS 76 HD2 LYS 76 -10.651 -6.070 -24.292 601 HD3 LYS 76 HD3 LYS 76 -10.479 -6.173 -22.539 602 HE2 LYS 76 HE2 LYS 76 -11.304 -8.321 -22.452 603 HE3 LYS 76 HE3 LYS 76 -12.218 -8.144 -23.948 604 HZ1 LYS 76 HZ1 LYS 76 -9.506 -7.847 -24.550 605 HZ2 LYS 76 HZ2 LYS 76 -10.551 -9.089 -25.026 606 HZ3 LYS 76 HZ3 LYS 76 -9.662 -9.234 -23.593 607 H ILE 77 H ILE 77 -14.678 -8.152 -19.405 608 HA ILE 77 HA ILE 77 -13.653 -6.632 -17.102 609 HB ILE 77 HB ILE 77 -16.023 -8.500 -17.224 610 HG12 ILE 77 HG12 ILE 77 -16.056 -5.513 -16.807 611 HG13 ILE 77 HG13 ILE 77 -16.194 -6.239 -18.404 612 HG21 ILE 77 HG21 ILE 77 -14.822 -6.884 -14.993 613 HG22 ILE 77 HG22 ILE 77 -16.489 -7.457 -14.957 614 HG23 ILE 77 HG23 ILE 77 -15.160 -8.614 -15.036 615 HD11 ILE 77 HD11 ILE 77 -18.073 -6.628 -16.088 616 HD12 ILE 77 HD12 ILE 77 -18.377 -5.701 -17.559 617 HD13 ILE 77 HD13 ILE 77 -18.195 -7.454 -17.641 618 H ASP 78 H ASP 78 -12.614 -7.665 -15.431 619 HA ASP 78 HA ASP 78 -11.260 -10.093 -16.072 620 HB2 ASP 78 HB2 ASP 78 -11.307 -8.267 -13.690 621 HB3 ASP 78 HB3 ASP 78 -10.506 -9.833 -13.591 622 H TYR 79 H TYR 79 -12.415 -11.926 -16.123 623 HA TYR 79 HA TYR 79 -14.346 -12.453 -13.982 624 HB2 TYR 79 HB2 TYR 79 -15.145 -14.285 -15.432 625 HB3 TYR 79 HB3 TYR 79 -15.195 -12.727 -16.249 626 HD1 TYR 79 HD1 TYR 79 -13.679 -12.237 -18.091 627 HD2 TYR 79 HD2 TYR 79 -13.603 -16.016 -16.138 628 HE1 TYR 79 HE1 TYR 79 -12.357 -13.163 -19.948 629 HE2 TYR 79 HE2 TYR 79 -12.280 -16.953 -17.988 630 HH TYR 79 HH TYR 79 -10.605 -15.809 -19.817 631 H THR 80 H THR 80 -13.990 -13.932 -12.449 632 HA THR 80 HA THR 80 -11.591 -15.625 -12.707 633 HB THR 80 HB THR 80 -11.323 -14.038 -10.901 634 HG1 THR 80 HG1 THR 80 -10.411 -15.887 -10.242 635 HG21 THR 80 HG21 THR 80 -14.103 -14.459 -10.525 636 HG22 THR 80 HG22 THR 80 -13.049 -13.314 -9.695 637 HG23 THR 80 HG23 THR 80 -13.285 -14.932 -9.036 638 H VAL 81 H VAL 81 -11.898 -17.749 -12.788 639 HA VAL 81 HA VAL 81 -14.552 -18.832 -12.324 640 HB VAL 81 HB VAL 81 -12.064 -20.274 -13.249 641 HG11 VAL 81 HG11 VAL 81 -14.818 -21.090 -12.702 642 HG12 VAL 81 HG12 VAL 81 -14.227 -21.578 -14.292 643 HG13 VAL 81 HG13 VAL 81 -13.352 -22.061 -12.839 644 HG21 VAL 81 HG21 VAL 81 -12.594 -18.490 -14.797 645 HG22 VAL 81 HG22 VAL 81 -13.016 -20.046 -15.514 646 HG23 VAL 81 HG23 VAL 81 -14.279 -19.006 -14.856 647 H LEU 82 H LEU 82 -15.121 -19.477 -10.361 648 HA LEU 82 HA LEU 82 -13.058 -20.404 -8.497 649 HB2 LEU 82 HB2 LEU 82 -15.004 -18.611 -8.094 650 HB3 LEU 82 HB3 LEU 82 -15.865 -20.074 -7.620 651 HG LEU 82 HG LEU 82 -13.201 -19.380 -6.426 652 HD11 LEU 82 HD11 LEU 82 -14.341 -17.445 -5.867 653 HD12 LEU 82 HD12 LEU 82 -14.687 -18.502 -4.500 654 HD13 LEU 82 HD13 LEU 82 -15.897 -18.268 -5.761 655 HD21 LEU 82 HD21 LEU 82 -13.544 -21.193 -5.191 656 HD22 LEU 82 HD22 LEU 82 -14.928 -21.563 -6.221 657 HD23 LEU 82 HD23 LEU 82 -15.157 -20.644 -4.732 658 H GLN 83 H GLN 83 -12.762 -22.513 -8.289 659 HA GLN 83 HA GLN 83 -15.082 -24.299 -8.607 660 HB2 GLN 83 HB2 GLN 83 -13.466 -26.000 -9.503 661 HB3 GLN 83 HB3 GLN 83 -13.733 -24.614 -10.552 662 HG2 GLN 83 HG2 GLN 83 -11.639 -23.650 -9.923 663 HG3 GLN 83 HG3 GLN 83 -11.392 -24.879 -8.684 664 HE21 GLN 83 HE21 GLN 83 -11.179 -24.106 -12.027 665 HE22 GLN 83 HE22 GLN 83 -10.420 -25.570 -12.542 666 H ASP 84 H ASP 84 -15.275 -25.981 -7.175 667 HA ASP 84 HA ASP 84 -13.506 -25.850 -4.840 668 HB2 ASP 84 HB2 ASP 84 -16.110 -25.653 -4.754 669 HB3 ASP 84 HB3 ASP 84 -16.069 -27.407 -4.910 670 H ASN 85 H ASN 85 -12.487 -27.652 -4.007 671 HA ASN 85 HA ASN 85 -11.388 -29.642 -4.060 672 HB2 ASN 85 HB2 ASN 85 -13.776 -30.449 -3.867 673 HB3 ASN 85 HB3 ASN 85 -13.762 -30.682 -5.613 674 HD21 ASN 85 HD21 ASN 85 -14.304 -32.894 -4.707 675 HD22 ASN 85 HD22 ASN 85 -12.971 -33.961 -4.447 676 HA PRO 86 HA PRO 86 -10.043 -28.776 -8.434 677 HB2 PRO 86 HB2 PRO 86 -7.495 -28.108 -7.777 678 HB3 PRO 86 HB3 PRO 86 -8.819 -26.938 -7.797 679 HG2 PRO 86 HG2 PRO 86 -7.608 -28.387 -5.475 680 HG3 PRO 86 HG3 PRO 86 -8.090 -26.686 -5.604 681 HD2 PRO 86 HD2 PRO 86 -9.621 -28.543 -4.365 682 HD3 PRO 86 HD3 PRO 86 -10.315 -27.156 -5.229 683 H ARG 87 H ARG 87 -8.957 -30.203 -9.721 684 HA ARG 87 HA ARG 87 -7.423 -32.337 -8.396 685 HB2 ARG 87 HB2 ARG 87 -9.478 -32.653 -10.590 686 HB3 ARG 87 HB3 ARG 87 -8.384 -33.927 -10.069 687 HG2 ARG 87 HG2 ARG 87 -10.454 -32.576 -8.350 688 HG3 ARG 87 HG3 ARG 87 -10.593 -34.178 -9.076 689 HD2 ARG 87 HD2 ARG 87 -8.539 -33.312 -7.045 690 HD3 ARG 87 HD3 ARG 87 -9.940 -34.336 -6.735 691 HE ARG 87 HE ARG 87 -8.637 -35.686 -8.670 692 HH11 ARG 87 HH11 ARG 87 -7.605 -34.314 -5.641 693 HH12 ARG 87 HH12 ARG 87 -6.361 -35.491 -5.382 694 HH21 ARG 87 HH21 ARG 87 -7.003 -37.242 -8.340 695 HH22 ARG 87 HH22 ARG 87 -6.019 -37.156 -6.919 696 H THR 88 H THR 88 -5.441 -32.552 -9.185 697 HA THR 88 HA THR 88 -4.598 -31.050 -11.478 698 HB THR 88 HB THR 88 -3.042 -33.078 -9.859 699 HG1 THR 88 HG1 THR 88 -3.911 -31.110 -8.768 700 HG21 THR 88 HG21 THR 88 -2.403 -31.471 -12.202 701 HG22 THR 88 HG22 THR 88 -1.522 -32.817 -11.482 702 HG23 THR 88 HG23 THR 88 -1.298 -31.183 -10.858 703 H ILE 89 H ILE 89 -5.156 -31.750 -13.445 704 HA ILE 89 HA ILE 89 -5.011 -34.628 -14.021 705 HB ILE 89 HB ILE 89 -6.310 -34.074 -16.072 706 HG12 ILE 89 HG12 ILE 89 -6.646 -31.358 -14.786 707 HG13 ILE 89 HG13 ILE 89 -5.585 -31.675 -16.154 708 HG21 ILE 89 HG21 ILE 89 -7.527 -33.298 -13.426 709 HG22 ILE 89 HG22 ILE 89 -8.446 -33.660 -14.887 710 HG23 ILE 89 HG23 ILE 89 -7.462 -34.913 -14.132 711 HD11 ILE 89 HD11 ILE 89 -8.513 -31.432 -16.040 712 HD12 ILE 89 HD12 ILE 89 -7.382 -31.003 -17.323 713 HD13 ILE 89 HD13 ILE 89 -7.879 -32.681 -17.110 714 H VAL 90 H VAL 90 -4.382 -35.100 -16.372 715 HA VAL 90 HA VAL 90 -2.196 -33.340 -17.250 716 HB VAL 90 HB VAL 90 -1.097 -35.116 -16.065 717 HG11 VAL 90 HG11 VAL 90 -3.245 -36.697 -17.094 718 HG12 VAL 90 HG12 VAL 90 -1.707 -37.439 -17.540 719 HG13 VAL 90 HG13 VAL 90 -2.066 -37.101 -15.847 720 HG21 VAL 90 HG21 VAL 90 0.458 -35.590 -17.651 721 HG22 VAL 90 HG22 VAL 90 -0.742 -36.117 -18.832 722 HG23 VAL 90 HG23 VAL 90 -0.470 -34.396 -18.558 723 HA PRO 91 HA PRO 91 -5.027 -34.369 -20.763 724 HB2 PRO 91 HB2 PRO 91 -5.030 -31.854 -21.786 725 HB3 PRO 91 HB3 PRO 91 -6.138 -32.373 -20.510 726 HG2 PRO 91 HG2 PRO 91 -3.583 -30.829 -20.287 727 HG3 PRO 91 HG3 PRO 91 -5.128 -30.563 -19.457 728 HD2 PRO 91 HD2 PRO 91 -3.030 -31.798 -18.272 729 HD3 PRO 91 HD3 PRO 91 -4.717 -32.209 -17.897 730 H LYS 92 H LYS 92 -3.584 -35.596 -21.924 731 HA LYS 92 HA LYS 92 -1.079 -34.821 -22.856 732 HB2 LYS 92 HB2 LYS 92 -1.358 -36.650 -24.532 733 HB3 LYS 92 HB3 LYS 92 -1.712 -37.138 -22.880 734 HG2 LYS 92 HG2 LYS 92 -4.146 -36.735 -23.416 735 HG3 LYS 92 HG3 LYS 92 -3.653 -36.594 -25.105 736 HD2 LYS 92 HD2 LYS 92 -2.482 -38.878 -24.674 737 HD3 LYS 92 HD3 LYS 92 -3.589 -38.981 -23.303 738 HE2 LYS 92 HE2 LYS 92 -5.459 -39.077 -24.652 739 HE3 LYS 92 HE3 LYS 92 -4.653 -38.282 -26.004 740 HZ1 LYS 92 HZ1 LYS 92 -3.653 -40.899 -25.164 741 HZ2 LYS 92 HZ2 LYS 92 -3.724 -40.216 -26.710 742 HZ3 LYS 92 HZ3 LYS 92 -5.122 -40.853 -26.002 743 H SER 93 H SER 93 -0.329 -33.901 -24.734 744 HA SER 93 HA SER 93 -2.155 -32.132 -26.086 745 HB2 SER 93 HB2 SER 93 -0.240 -31.135 -27.058 746 HB3 SER 93 HB3 SER 93 0.267 -31.606 -25.436 747 HG SER 93 HG SER 93 1.850 -32.379 -26.697 748 H TYR 94 H TYR 94 -2.790 -32.186 -28.214 749 HA TYR 94 HA TYR 94 -1.801 -34.082 -30.097 750 HB2 TYR 94 HB2 TYR 94 -3.349 -35.392 -28.452 751 HB3 TYR 94 HB3 TYR 94 -4.655 -34.600 -29.327 752 HD1 TYR 94 HD1 TYR 94 -1.646 -36.731 -29.849 753 HD2 TYR 94 HD2 TYR 94 -5.447 -35.512 -31.323 754 HE1 TYR 94 HE1 TYR 94 -1.518 -38.461 -31.592 755 HE2 TYR 94 HE2 TYR 94 -5.330 -37.240 -33.069 756 HH TYR 94 HH TYR 94 -4.234 -39.238 -33.613 757 H ALA 95 H ALA 95 -2.099 -33.258 -32.062 758 HA ALA 95 HA ALA 95 -3.988 -31.045 -32.372 759 HB1 ALA 95 HB1 ALA 95 -1.652 -31.950 -34.044 760 HB2 ALA 95 HB2 ALA 95 -2.743 -30.643 -34.509 761 HB3 ALA 95 HB3 ALA 95 -1.768 -30.501 -33.045 762 H ASP 96 H ASP 96 -5.504 -30.959 -34.043 763 HA ASP 96 HA ASP 96 -5.865 -33.254 -35.774 764 HB2 ASP 96 HB2 ASP 96 -7.049 -33.604 -33.456 765 HB3 ASP 96 HB3 ASP 96 -8.243 -32.492 -34.119 766 H ASN 97 H ASN 97 -7.139 -32.825 -37.573 767 HA ASN 97 HA ASN 97 -7.287 -30.113 -38.372 768 HB2 ASN 97 HB2 ASN 97 -8.263 -32.695 -39.564 769 HB3 ASN 97 HB3 ASN 97 -8.665 -31.150 -40.309 770 HD21 ASN 97 HD21 ASN 97 -7.207 -33.079 -41.628 771 HD22 ASN 97 HD22 ASN 97 -5.590 -32.514 -41.857 772 H PHE 98 H PHE 98 -8.679 -28.725 -37.495 773 HA PHE 98 HA PHE 98 -11.167 -29.489 -36.351 774 HB2 PHE 98 HB2 PHE 98 -9.770 -27.490 -35.683 775 HB3 PHE 98 HB3 PHE 98 -10.335 -26.699 -37.151 776 HD1 PHE 98 HD1 PHE 98 -11.555 -28.310 -34.034 777 HD2 PHE 98 HD2 PHE 98 -12.326 -25.509 -37.145 778 HE1 PHE 98 HE1 PHE 98 -13.564 -27.541 -32.839 779 HE2 PHE 98 HE2 PHE 98 -14.335 -24.735 -35.955 780 HZ PHE 98 HZ PHE 98 -14.955 -25.750 -33.799 781 H THR 99 H THR 99 -13.076 -29.775 -37.288 782 HA THR 99 HA THR 99 -13.454 -29.693 -40.059 783 HB THR 99 HB THR 99 -15.947 -29.789 -39.444 784 HG1 THR 99 HG1 THR 99 -16.162 -30.429 -37.143 785 HG21 THR 99 HG21 THR 99 -15.475 -31.945 -39.762 786 HG22 THR 99 HG22 THR 99 -15.140 -32.074 -38.035 787 HG23 THR 99 HG23 THR 99 -13.831 -31.724 -39.165 788 H LYS 100 H LYS 100 -13.826 -28.069 -41.408 789 HA LYS 100 HA LYS 100 -15.001 -25.587 -40.340 790 HB2 LYS 100 HB2 LYS 100 -12.510 -25.496 -40.900 791 HB3 LYS 100 HB3 LYS 100 -12.988 -25.670 -42.583 792 HG2 LYS 100 HG2 LYS 100 -14.221 -23.610 -42.503 793 HG3 LYS 100 HG3 LYS 100 -13.930 -23.461 -40.768 794 HD2 LYS 100 HD2 LYS 100 -12.373 -22.021 -41.804 795 HD3 LYS 100 HD3 LYS 100 -11.455 -23.452 -41.330 796 HE2 LYS 100 HE2 LYS 100 -12.655 -23.341 -44.056 797 HE3 LYS 100 HE3 LYS 100 -11.198 -22.404 -43.729 798 HZ1 LYS 100 HZ1 LYS 100 -11.543 -25.276 -43.936 799 HZ2 LYS 100 HZ2 LYS 100 -10.522 -24.759 -42.690 800 HZ3 LYS 100 HZ3 LYS 100 -10.195 -24.318 -44.291 801 HA PRO 101 HA PRO 101 -17.555 -27.262 -43.858 802 HB2 PRO 101 HB2 PRO 101 -19.932 -27.033 -42.566 803 HB3 PRO 101 HB3 PRO 101 -18.904 -28.466 -42.441 804 HG2 PRO 101 HG2 PRO 101 -19.187 -26.166 -40.546 805 HG3 PRO 101 HG3 PRO 101 -19.089 -27.901 -40.192 806 HD2 PRO 101 HD2 PRO 101 -16.967 -26.238 -39.934 807 HD3 PRO 101 HD3 PRO 101 -16.794 -27.941 -40.404 808 H ARG 102 H ARG 102 -19.408 -26.159 -44.941 809 HA ARG 102 HA ARG 102 -19.278 -23.246 -44.511 810 HB2 ARG 102 HB2 ARG 102 -18.248 -24.174 -46.645 811 HB3 ARG 102 HB3 ARG 102 -19.881 -24.601 -47.136 812 HG2 ARG 102 HG2 ARG 102 -20.527 -22.398 -47.383 813 HG3 ARG 102 HG3 ARG 102 -19.252 -21.800 -46.319 814 HD2 ARG 102 HD2 ARG 102 -17.581 -22.434 -48.021 815 HD3 ARG 102 HD3 ARG 102 -18.890 -22.939 -49.088 816 HE ARG 102 HE ARG 102 -19.410 -20.315 -48.366 817 HH11 ARG 102 HH11 ARG 102 -16.941 -22.081 -50.069 818 HH12 ARG 102 HH12 ARG 102 -16.517 -20.753 -51.099 819 HH21 ARG 102 HH21 ARG 102 -18.861 -18.559 -49.716 820 HH22 ARG 102 HH22 ARG 102 -17.610 -18.750 -50.896 821 H ASP 103 H ASP 103 -21.108 -22.389 -43.807 822 HA ASP 103 HA ASP 103 -23.639 -23.040 -44.973 823 HB2 ASP 103 HB2 ASP 103 -23.053 -24.815 -43.098 824 HB3 ASP 103 HB3 ASP 103 -23.597 -23.528 -42.027 825 H MET 104 H MET 104 -24.916 -21.295 -44.912 826 HA MET 104 HA MET 104 -25.694 -19.214 -44.437 827 HB2 MET 104 HB2 MET 104 -24.521 -19.582 -41.682 828 HB3 MET 104 HB3 MET 104 -25.861 -18.544 -42.147 829 HG2 MET 104 HG2 MET 104 -27.045 -20.706 -42.837 830 HG3 MET 104 HG3 MET 104 -25.799 -21.525 -41.899 831 HE1 MET 104 HE1 MET 104 -29.666 -20.348 -40.520 832 HE2 MET 104 HE2 MET 104 -29.040 -18.877 -41.267 833 HE3 MET 104 HE3 MET 104 -29.001 -20.403 -42.153 Start of MODEL 12 1 H1 MET 1 H MET 1 -2.291 -9.914 -0.838 2 HA MET 1 HA MET 1 -2.474 -11.404 -2.987 3 HB2 MET 1 HB2 MET 1 -4.089 -12.902 -1.870 4 HB3 MET 1 HB3 MET 1 -2.824 -12.352 -0.781 5 HG2 MET 1 HG2 MET 1 -4.597 -12.037 0.579 6 HG3 MET 1 HG3 MET 1 -4.628 -10.483 -0.249 7 HE1 MET 1 HE1 MET 1 -7.102 -13.835 0.247 8 HE2 MET 1 HE2 MET 1 -7.022 -14.119 -1.491 9 HE3 MET 1 HE3 MET 1 -5.538 -14.056 -0.539 10 H GLN 2 H GLN 2 -4.905 -9.086 -2.097 11 HA GLN 2 HA GLN 2 -6.839 -10.007 -4.024 12 HB2 GLN 2 HB2 GLN 2 -7.393 -8.816 -1.859 13 HB3 GLN 2 HB3 GLN 2 -6.795 -7.342 -2.610 14 HG2 GLN 2 HG2 GLN 2 -8.523 -7.310 -4.189 15 HG3 GLN 2 HG3 GLN 2 -8.960 -8.988 -3.867 16 HE21 GLN 2 HE21 GLN 2 -8.431 -6.153 -1.800 17 HE22 GLN 2 HE22 GLN 2 -9.961 -6.237 -0.999 18 H GLU 3 H GLU 3 -7.192 -9.265 -6.050 19 HA GLU 3 HA GLU 3 -5.104 -7.680 -7.265 20 HB2 GLU 3 HB2 GLU 3 -6.421 -9.752 -8.226 21 HB3 GLU 3 HB3 GLU 3 -7.565 -8.520 -8.738 22 HG2 GLU 3 HG2 GLU 3 -5.913 -7.430 -10.065 23 HG3 GLU 3 HG3 GLU 3 -4.637 -8.455 -9.412 24 H GLN 4 H GLN 4 -5.157 -5.553 -7.515 25 HA GLN 4 HA GLN 4 -7.588 -4.090 -6.919 26 HB2 GLN 4 HB2 GLN 4 -4.786 -3.153 -7.548 27 HB3 GLN 4 HB3 GLN 4 -6.118 -2.087 -7.129 28 HG2 GLN 4 HG2 GLN 4 -6.228 -2.906 -4.933 29 HG3 GLN 4 HG3 GLN 4 -5.225 -4.303 -5.320 30 HE21 GLN 4 HE21 GLN 4 -4.583 -2.812 -3.173 31 HE22 GLN 4 HE22 GLN 4 -3.150 -1.895 -3.475 32 H VAL 5 H VAL 5 -8.711 -2.781 -8.319 33 HA VAL 5 HA VAL 5 -7.844 -2.221 -10.975 34 HB VAL 5 HB VAL 5 -8.428 -4.580 -11.303 35 HG11 VAL 5 HG11 VAL 5 -10.510 -5.502 -10.833 36 HG12 VAL 5 HG12 VAL 5 -10.204 -4.471 -9.433 37 HG13 VAL 5 HG13 VAL 5 -11.291 -3.926 -10.711 38 HG21 VAL 5 HG21 VAL 5 -9.171 -2.463 -12.857 39 HG22 VAL 5 HG22 VAL 5 -9.266 -4.156 -13.341 40 HG23 VAL 5 HG23 VAL 5 -10.691 -3.344 -12.692 41 H SER 6 H SER 6 -9.132 -0.697 -11.990 42 HA SER 6 HA SER 6 -10.835 0.828 -10.291 43 HB2 SER 6 HB2 SER 6 -9.916 1.038 -13.129 44 HB3 SER 6 HB3 SER 6 -11.292 2.010 -12.611 45 HG SER 6 HG SER 6 -8.644 2.041 -11.619 46 H ASN 7 H ASN 7 -11.578 -0.549 -13.497 47 HA ASN 7 HA ASN 7 -14.343 -0.360 -13.282 48 HB2 ASN 7 HB2 ASN 7 -12.873 -2.506 -14.822 49 HB3 ASN 7 HB3 ASN 7 -14.464 -1.837 -15.171 50 HD21 ASN 7 HD21 ASN 7 -11.532 -1.902 -16.351 51 HD22 ASN 7 HD22 ASN 7 -11.386 -0.311 -17.009 52 H VAL 8 H VAL 8 -15.830 -2.348 -13.353 53 HA VAL 8 HA VAL 8 -15.576 -3.701 -10.844 54 HB VAL 8 HB VAL 8 -17.713 -4.721 -11.352 55 HG11 VAL 8 HG11 VAL 8 -17.561 -1.819 -12.152 56 HG12 VAL 8 HG12 VAL 8 -19.056 -2.670 -11.756 57 HG13 VAL 8 HG13 VAL 8 -17.803 -2.465 -10.530 58 HG21 VAL 8 HG21 VAL 8 -18.830 -4.371 -13.497 59 HG22 VAL 8 HG22 VAL 8 -17.405 -3.531 -14.108 60 HG23 VAL 8 HG23 VAL 8 -17.312 -5.245 -13.706 61 H ARG 9 H ARG 9 -16.318 -6.178 -10.968 62 HA ARG 9 HA ARG 9 -14.794 -7.591 -13.022 63 HB2 ARG 9 HB2 ARG 9 -13.567 -8.917 -11.420 64 HB3 ARG 9 HB3 ARG 9 -13.256 -7.214 -11.111 65 HG2 ARG 9 HG2 ARG 9 -15.014 -7.326 -9.319 66 HG3 ARG 9 HG3 ARG 9 -15.024 -9.075 -9.549 67 HD2 ARG 9 HD2 ARG 9 -12.497 -7.555 -8.982 68 HD3 ARG 9 HD3 ARG 9 -13.545 -8.135 -7.689 69 HE ARG 9 HE ARG 9 -12.884 -10.209 -9.526 70 HH11 ARG 9 HH11 ARG 9 -11.670 -8.374 -6.828 71 HH12 ARG 9 HH12 ARG 9 -10.587 -9.620 -6.300 72 HH21 ARG 9 HH21 ARG 9 -11.463 -11.856 -8.840 73 HH22 ARG 9 HH22 ARG 9 -10.470 -11.600 -7.446 74 H ALA 10 H ALA 10 -15.311 -9.855 -13.172 75 HA ALA 10 HA ALA 10 -18.024 -10.420 -12.198 76 HB1 ALA 10 HB1 ALA 10 -17.441 -12.374 -14.039 77 HB2 ALA 10 HB2 ALA 10 -18.333 -10.887 -14.358 78 HB3 ALA 10 HB3 ALA 10 -16.601 -10.961 -14.680 79 H ARG 11 H ARG 11 -18.260 -11.792 -10.571 80 HA ARG 11 HA ARG 11 -16.051 -13.591 -9.891 81 HB2 ARG 11 HB2 ARG 11 -18.509 -12.897 -8.274 82 HB3 ARG 11 HB3 ARG 11 -17.108 -13.800 -7.712 83 HG2 ARG 11 HG2 ARG 11 -15.820 -11.624 -8.406 84 HG3 ARG 11 HG3 ARG 11 -17.412 -10.885 -8.212 85 HD2 ARG 11 HD2 ARG 11 -16.194 -12.637 -6.097 86 HD3 ARG 11 HD3 ARG 11 -15.866 -10.907 -6.179 87 HE ARG 11 HE ARG 11 -18.596 -11.110 -6.231 88 HH11 ARG 11 HH11 ARG 11 -16.064 -12.160 -4.082 89 HH12 ARG 11 HH12 ARG 11 -17.053 -12.066 -2.662 90 HH21 ARG 11 HH21 ARG 11 -19.906 -10.983 -4.368 91 HH22 ARG 11 HH22 ARG 11 -19.238 -11.397 -2.826 92 H ILE 12 H ILE 12 -16.225 -15.436 -11.030 93 HA ILE 12 HA ILE 12 -18.852 -16.733 -11.219 94 HB ILE 12 HB ILE 12 -16.313 -17.383 -12.719 95 HG12 ILE 12 HG12 ILE 12 -18.803 -16.036 -13.772 96 HG13 ILE 12 HG13 ILE 12 -17.384 -15.146 -13.229 97 HG21 ILE 12 HG21 ILE 12 -19.083 -18.511 -12.764 98 HG22 ILE 12 HG22 ILE 12 -18.067 -18.572 -14.204 99 HG23 ILE 12 HG23 ILE 12 -17.534 -19.354 -12.715 100 HD11 ILE 12 HD11 ILE 12 -17.276 -15.321 -15.591 101 HD12 ILE 12 HD12 ILE 12 -16.056 -16.408 -14.926 102 HD13 ILE 12 HD13 ILE 12 -17.577 -17.058 -15.537 103 H TYR 13 H TYR 13 -19.251 -18.698 -10.336 104 HA TYR 13 HA TYR 13 -17.156 -20.416 -9.388 105 HB2 TYR 13 HB2 TYR 13 -17.812 -20.353 -7.013 106 HB3 TYR 13 HB3 TYR 13 -17.189 -18.799 -7.558 107 HD1 TYR 13 HD1 TYR 13 -18.743 -16.904 -7.925 108 HD2 TYR 13 HD2 TYR 13 -20.066 -20.588 -6.256 109 HE1 TYR 13 HE1 TYR 13 -20.783 -15.796 -7.114 110 HE2 TYR 13 HE2 TYR 13 -22.111 -19.490 -5.442 111 HH TYR 13 HH TYR 13 -22.718 -16.044 -6.061 112 H LYS 14 H LYS 14 -17.869 -22.489 -8.956 113 HA LYS 14 HA LYS 14 -20.733 -22.971 -9.461 114 HB2 LYS 14 HB2 LYS 14 -19.410 -23.817 -11.292 115 HB3 LYS 14 HB3 LYS 14 -18.328 -24.651 -10.183 116 HG2 LYS 14 HG2 LYS 14 -20.292 -26.034 -9.461 117 HG3 LYS 14 HG3 LYS 14 -21.198 -25.307 -10.790 118 HD2 LYS 14 HD2 LYS 14 -19.711 -26.234 -12.409 119 HD3 LYS 14 HD3 LYS 14 -18.581 -26.754 -11.158 120 HE2 LYS 14 HE2 LYS 14 -21.401 -27.778 -11.453 121 HE3 LYS 14 HE3 LYS 14 -19.972 -28.594 -12.085 122 HZ1 LYS 14 HZ1 LYS 14 -19.192 -28.356 -9.615 123 HZ2 LYS 14 HZ2 LYS 14 -20.200 -29.630 -10.084 124 HZ3 LYS 14 HZ3 LYS 14 -20.854 -28.277 -9.309 125 HA PRO 15 HA PRO 15 -20.920 -24.749 -5.427 126 HB2 PRO 15 HB2 PRO 15 -23.236 -26.133 -5.726 127 HB3 PRO 15 HB3 PRO 15 -23.184 -24.375 -5.541 128 HG2 PRO 15 HG2 PRO 15 -23.462 -26.011 -8.033 129 HG3 PRO 15 HG3 PRO 15 -24.326 -24.537 -7.560 130 HD2 PRO 15 HD2 PRO 15 -22.250 -24.513 -9.297 131 HD3 PRO 15 HD3 PRO 15 -22.589 -23.162 -8.196 132 H ALA 16 H ALA 16 -21.189 -26.918 -4.390 133 HA ALA 16 HA ALA 16 -20.023 -29.016 -6.102 134 HB1 ALA 16 HB1 ALA 16 -18.549 -29.544 -4.492 135 HB2 ALA 16 HB2 ALA 16 -18.893 -27.921 -3.893 136 HB3 ALA 16 HB3 ALA 16 -19.723 -29.313 -3.197 137 H LYS 17 H LYS 17 -20.502 -31.266 -5.362 138 HA LYS 17 HA LYS 17 -23.271 -31.722 -5.322 139 HB2 LYS 17 HB2 LYS 17 -21.302 -33.271 -6.040 140 HB3 LYS 17 HB3 LYS 17 -21.303 -33.771 -4.355 141 HG2 LYS 17 HG2 LYS 17 -23.783 -34.256 -4.670 142 HG3 LYS 17 HG3 LYS 17 -23.471 -34.099 -6.400 143 HD2 LYS 17 HD2 LYS 17 -21.974 -35.977 -4.576 144 HD3 LYS 17 HD3 LYS 17 -23.377 -36.445 -5.540 145 HE2 LYS 17 HE2 LYS 17 -21.674 -37.061 -6.946 146 HE3 LYS 17 HE3 LYS 17 -21.974 -35.417 -7.504 147 HZ1 LYS 17 HZ1 LYS 17 -19.920 -34.842 -6.959 148 HZ2 LYS 17 HZ2 LYS 17 -19.584 -36.461 -6.605 149 HZ3 LYS 17 HZ3 LYS 17 -20.103 -35.416 -5.378 150 H SER 18 H SER 18 -24.677 -31.563 -3.715 151 HA SER 18 HA SER 18 -23.802 -31.185 -1.005 152 HB2 SER 18 HB2 SER 18 -26.665 -31.583 -1.852 153 HB3 SER 18 HB3 SER 18 -26.038 -30.626 -0.510 154 HG SER 18 HG SER 18 -26.184 -29.036 -1.875 155 H THR 19 H THR 19 -25.194 -32.388 0.738 156 HA THR 19 HA THR 19 -25.228 -35.262 0.095 157 HB THR 19 HB THR 19 -23.212 -34.709 1.415 158 HG1 THR 19 HG1 THR 19 -23.950 -36.745 1.801 159 HG21 THR 19 HG21 THR 19 -24.560 -32.827 2.660 160 HG22 THR 19 HG22 THR 19 -23.248 -33.678 3.474 161 HG23 THR 19 HG23 THR 19 -24.921 -34.130 3.792 162 H MET 20 H MET 20 -27.398 -33.278 0.216 163 HA MET 20 HA MET 20 -28.885 -34.142 2.587 164 HB2 MET 20 HB2 MET 20 -28.806 -31.724 2.067 165 HB3 MET 20 HB3 MET 20 -29.594 -32.044 0.528 166 HG2 MET 20 HG2 MET 20 -31.258 -31.262 2.010 167 HG3 MET 20 HG3 MET 20 -31.517 -32.994 1.812 168 HE1 MET 20 HE1 MET 20 -30.650 -30.098 3.734 169 HE2 MET 20 HE2 MET 20 -31.870 -30.553 4.923 170 HE3 MET 20 HE3 MET 20 -30.160 -30.594 5.354 171 H GLN 21 H GLN 21 -28.927 -34.288 -0.920 172 HA GLN 21 HA GLN 21 -30.165 -35.495 -2.400 173 HB2 GLN 21 HB2 GLN 21 -30.279 -37.239 0.049 174 HB3 GLN 21 HB3 GLN 21 -31.063 -37.713 -1.451 175 HG2 GLN 21 HG2 GLN 21 -29.016 -38.773 -1.573 176 HG3 GLN 21 HG3 GLN 21 -28.765 -37.313 -2.530 177 HE21 GLN 21 HE21 GLN 21 -27.767 -39.138 0.157 178 HE22 GLN 21 HE22 GLN 21 -26.561 -38.052 0.748 179 H SER 22 H SER 22 -31.486 -33.404 -0.829 180 HA SER 22 HA SER 22 -34.156 -34.344 -0.292 181 HB2 SER 22 HB2 SER 22 -34.498 -31.715 -0.198 182 HB3 SER 22 HB3 SER 22 -33.680 -32.574 1.107 183 HG SER 22 HG SER 22 -32.533 -30.705 0.368 184 H GLY 23 H GLY 23 -32.910 -31.842 -2.519 185 HA2 GLY 23 HA2 GLY 23 -34.879 -32.771 -4.505 186 HA3 GLY 23 HA3 GLY 23 -34.770 -31.064 -4.102 187 H HIS 24 H HIS 24 -34.485 -31.519 -6.654 188 HA HIS 24 HA HIS 24 -31.642 -31.042 -7.125 189 HB2 HIS 24 HB2 HIS 24 -33.244 -33.006 -8.777 190 HB3 HIS 24 HB3 HIS 24 -31.557 -32.565 -9.021 191 HD1 HIS 24 HD1 HIS 24 -29.897 -33.311 -7.029 192 HD2 HIS 24 HD2 HIS 24 -33.641 -35.110 -7.092 193 HE1 HIS 24 HE1 HIS 24 -29.688 -35.348 -5.568 194 H SER 25 H SER 25 -31.293 -30.283 -9.442 195 HA SER 25 HA SER 25 -33.448 -29.229 -10.939 196 HB2 SER 25 HB2 SER 25 -33.166 -26.847 -10.495 197 HB3 SER 25 HB3 SER 25 -33.584 -27.687 -9.002 198 HG SER 25 HG SER 25 -31.234 -26.412 -9.727 199 H LYS 26 H LYS 26 -32.785 -28.612 -12.941 200 HA LYS 26 HA LYS 26 -29.875 -28.462 -13.387 201 HB2 LYS 26 HB2 LYS 26 -32.004 -29.630 -15.189 202 HB3 LYS 26 HB3 LYS 26 -30.314 -29.430 -15.636 203 HG2 LYS 26 HG2 LYS 26 -29.601 -31.097 -14.200 204 HG3 LYS 26 HG3 LYS 26 -31.052 -30.996 -13.201 205 HD2 LYS 26 HD2 LYS 26 -31.037 -31.969 -16.054 206 HD3 LYS 26 HD3 LYS 26 -30.921 -33.033 -14.650 207 HE2 LYS 26 HE2 LYS 26 -33.079 -31.900 -13.857 208 HE3 LYS 26 HE3 LYS 26 -33.213 -31.293 -15.507 209 HZ1 LYS 26 HZ1 LYS 26 -33.315 -34.085 -14.558 210 HZ2 LYS 26 HZ2 LYS 26 -32.929 -33.732 -16.167 211 HZ3 LYS 26 HZ3 LYS 26 -34.422 -33.255 -15.531 212 H LEU 27 H LEU 27 -31.618 -26.241 -12.826 213 HA LEU 27 HA LEU 27 -31.894 -24.896 -15.407 214 HB2 LEU 27 HB2 LEU 27 -32.929 -24.403 -12.653 215 HB3 LEU 27 HB3 LEU 27 -32.816 -23.055 -13.783 216 HG LEU 27 HG LEU 27 -34.212 -24.524 -15.363 217 HD11 LEU 27 HD11 LEU 27 -34.419 -26.029 -12.788 218 HD12 LEU 27 HD12 LEU 27 -34.198 -26.639 -14.426 219 HD13 LEU 27 HD13 LEU 27 -35.767 -26.008 -13.925 220 HD21 LEU 27 HD21 LEU 27 -36.323 -23.899 -14.058 221 HD22 LEU 27 HD22 LEU 27 -35.222 -22.597 -14.510 222 HD23 LEU 27 HD23 LEU 27 -35.224 -23.218 -12.858 223 H LYS 28 H LYS 28 -30.136 -24.679 -12.366 224 HA LYS 28 HA LYS 28 -28.358 -22.695 -13.621 225 HB2 LYS 28 HB2 LYS 28 -29.049 -22.772 -10.682 226 HB3 LYS 28 HB3 LYS 28 -28.085 -21.560 -11.514 227 HG2 LYS 28 HG2 LYS 28 -29.983 -20.704 -12.651 228 HG3 LYS 28 HG3 LYS 28 -30.984 -22.063 -12.132 229 HD2 LYS 28 HD2 LYS 28 -31.259 -21.231 -10.024 230 HD3 LYS 28 HD3 LYS 28 -29.693 -20.416 -10.024 231 HE2 LYS 28 HE2 LYS 28 -31.215 -18.659 -10.113 232 HE3 LYS 28 HE3 LYS 28 -30.742 -18.871 -11.798 233 HZ1 LYS 28 HZ1 LYS 28 -33.165 -18.605 -11.452 234 HZ2 LYS 28 HZ2 LYS 28 -33.179 -20.065 -10.599 235 HZ3 LYS 28 HZ3 LYS 28 -32.753 -20.047 -12.236 236 H ALA 29 H ALA 29 -26.325 -23.363 -13.772 237 HA ALA 29 HA ALA 29 -25.417 -25.508 -11.965 238 HB1 ALA 29 HB1 ALA 29 -25.499 -25.477 -14.754 239 HB2 ALA 29 HB2 ALA 29 -23.801 -25.251 -14.335 240 HB3 ALA 29 HB3 ALA 29 -24.681 -26.650 -13.721 241 H TRP 30 H TRP 30 -24.413 -22.585 -13.700 242 HA TRP 30 HA TRP 30 -22.142 -22.345 -11.841 243 HB2 TRP 30 HB2 TRP 30 -22.522 -21.385 -14.671 244 HB3 TRP 30 HB3 TRP 30 -21.281 -20.703 -13.623 245 HD1 TRP 30 HD1 TRP 30 -22.239 -24.001 -15.356 246 HE1 TRP 30 HE1 TRP 30 -20.131 -25.467 -15.532 247 HE3 TRP 30 HE3 TRP 30 -19.018 -21.120 -12.625 248 HZ2 TRP 30 HZ2 TRP 30 -17.456 -25.409 -14.630 249 HZ3 TRP 30 HZ3 TRP 30 -16.703 -21.896 -12.329 250 HH2 TRP 30 HH2 TRP 30 -15.939 -23.997 -13.311 251 H LYS 31 H LYS 31 -21.759 -20.395 -10.799 252 HA LYS 31 HA LYS 31 -24.031 -18.519 -10.817 253 HB2 LYS 31 HB2 LYS 31 -23.314 -19.899 -8.696 254 HB3 LYS 31 HB3 LYS 31 -22.071 -18.662 -8.560 255 HG2 LYS 31 HG2 LYS 31 -23.529 -17.073 -7.920 256 HG3 LYS 31 HG3 LYS 31 -24.812 -17.673 -8.974 257 HD2 LYS 31 HD2 LYS 31 -25.167 -19.551 -7.398 258 HD3 LYS 31 HD3 LYS 31 -23.956 -18.842 -6.326 259 HE2 LYS 31 HE2 LYS 31 -25.961 -18.072 -5.442 260 HE3 LYS 31 HE3 LYS 31 -25.422 -16.723 -6.441 261 HZ1 LYS 31 HZ1 LYS 31 -27.036 -18.594 -7.888 262 HZ2 LYS 31 HZ2 LYS 31 -27.196 -16.916 -7.747 263 HZ3 LYS 31 HZ3 LYS 31 -27.857 -17.931 -6.566 264 H LEU 32 H LEU 32 -23.666 -16.329 -10.945 265 HA LEU 32 HA LEU 32 -20.888 -15.428 -11.240 266 HB2 LEU 32 HB2 LEU 32 -21.776 -15.819 -13.478 267 HB3 LEU 32 HB3 LEU 32 -23.153 -14.777 -13.122 268 HG LEU 32 HG LEU 32 -21.211 -13.856 -14.554 269 HD11 LEU 32 HD11 LEU 32 -21.769 -11.697 -13.927 270 HD12 LEU 32 HD12 LEU 32 -21.925 -12.121 -12.223 271 HD13 LEU 32 HD13 LEU 32 -23.157 -12.635 -13.376 272 HD21 LEU 32 HD21 LEU 32 -19.623 -14.658 -12.578 273 HD22 LEU 32 HD22 LEU 32 -19.979 -13.037 -11.983 274 HD23 LEU 32 HD23 LEU 32 -19.250 -13.252 -13.575 275 H GLU 33 H GLU 33 -20.468 -13.658 -10.093 276 HA GLU 33 HA GLU 33 -22.685 -11.851 -9.412 277 HB2 GLU 33 HB2 GLU 33 -22.134 -13.392 -7.510 278 HB3 GLU 33 HB3 GLU 33 -20.523 -12.689 -7.476 279 HG2 GLU 33 HG2 GLU 33 -21.489 -11.412 -5.884 280 HG3 GLU 33 HG3 GLU 33 -21.916 -10.443 -7.293 281 H PHE 34 H PHE 34 -22.195 -10.041 -10.476 282 HA PHE 34 HA PHE 34 -19.442 -9.214 -10.839 283 HB2 PHE 34 HB2 PHE 34 -20.440 -7.351 -12.148 284 HB3 PHE 34 HB3 PHE 34 -20.952 -8.937 -12.711 285 HD1 PHE 34 HD2 PHE 34 -21.997 -5.935 -10.855 286 HD2 PHE 34 HD1 PHE 34 -23.228 -9.597 -12.641 287 HE1 PHE 34 HE2 PHE 34 -24.350 -5.251 -10.629 288 HE2 PHE 34 HE1 PHE 34 -25.583 -8.919 -12.418 289 HZ PHE 34 HZ PHE 34 -26.146 -6.743 -11.409 290 H GLU 35 H GLU 35 -18.441 -7.508 -9.878 291 HA GLU 35 HA GLU 35 -19.266 -6.695 -7.328 292 HB2 GLU 35 HB2 GLU 35 -17.079 -6.039 -9.175 293 HB3 GLU 35 HB3 GLU 35 -17.511 -4.733 -8.081 294 HG2 GLU 35 HG2 GLU 35 -15.690 -6.300 -7.310 295 HG3 GLU 35 HG3 GLU 35 -17.011 -6.008 -6.179 296 HA PRO 36 HA PRO 36 -21.957 -3.283 -7.919 297 HB2 PRO 36 HB2 PRO 36 -21.154 -1.562 -5.980 298 HB3 PRO 36 HB3 PRO 36 -22.024 -3.062 -5.634 299 HG2 PRO 36 HG2 PRO 36 -19.089 -2.493 -5.471 300 HG3 PRO 36 HG3 PRO 36 -20.120 -3.389 -4.341 301 HD2 PRO 36 HD2 PRO 36 -18.516 -4.623 -6.141 302 HD3 PRO 36 HD3 PRO 36 -20.068 -5.308 -5.617 303 H SER 37 H SER 37 -22.111 -1.033 -8.533 304 HA SER 37 HA SER 37 -19.710 0.437 -9.147 305 HB2 SER 37 HB2 SER 37 -20.873 0.512 -11.648 306 HB3 SER 37 HB3 SER 37 -19.449 -0.432 -11.212 307 HG SER 37 HG SER 37 -22.150 -1.294 -11.260 308 H CYS 38 H CYS 38 -20.182 2.464 -8.659 309 HA CYS 38 HA CYS 38 -22.879 3.366 -8.375 310 HB2 CYS 38 HB2 CYS 38 -20.216 4.771 -8.161 311 HB3 CYS 38 HB3 CYS 38 -21.751 5.591 -7.903 312 HG CYS 38 HG CYS 38 -21.122 5.199 -5.365 313 H THR 39 H THR 39 -24.125 3.918 -10.026 314 HA THR 39 HA THR 39 -22.895 5.319 -12.311 315 HB THR 39 HB THR 39 -24.853 4.388 -13.648 316 HG1 THR 39 HG1 THR 39 -25.870 2.570 -12.778 317 HG21 THR 39 HG21 THR 39 -23.102 2.171 -12.650 318 HG22 THR 39 HG22 THR 39 -22.404 3.527 -13.536 319 HG23 THR 39 HG23 THR 39 -23.635 2.520 -14.294 320 H GLN 40 H GLN 40 -24.451 6.708 -13.529 321 HA GLN 40 HA GLN 40 -26.413 7.943 -11.711 322 HB2 GLN 40 HB2 GLN 40 -24.229 9.232 -12.179 323 HB3 GLN 40 HB3 GLN 40 -24.889 9.494 -13.788 324 HG2 GLN 40 HG2 GLN 40 -26.980 10.325 -12.415 325 HG3 GLN 40 HG3 GLN 40 -25.757 10.597 -11.174 326 HE21 GLN 40 HE21 GLN 40 -27.031 12.751 -12.008 327 HE22 GLN 40 HE22 GLN 40 -26.048 13.716 -13.050 328 H TYR 41 H TYR 41 -26.830 5.895 -13.743 329 HA TYR 41 HA TYR 41 -28.831 7.325 -15.329 330 HB2 TYR 41 HB2 TYR 41 -26.662 5.543 -16.409 331 HB3 TYR 41 HB3 TYR 41 -28.184 5.744 -17.269 332 HD1 TYR 41 HD1 TYR 41 -28.897 8.358 -17.451 333 HD2 TYR 41 HD2 TYR 41 -24.924 6.873 -17.113 334 HE1 TYR 41 HE1 TYR 41 -28.044 10.421 -18.486 335 HE2 TYR 41 HE2 TYR 41 -24.060 8.932 -18.145 336 HH TYR 41 HH TYR 41 -25.894 11.050 -19.835 337 H THR 42 H THR 42 -30.676 6.158 -15.779 338 HA THR 42 HA THR 42 -30.962 3.666 -14.264 339 HB THR 42 HB THR 42 -32.561 5.501 -13.788 340 HG1 THR 42 HG1 THR 42 -34.049 4.018 -13.445 341 HG21 THR 42 HG21 THR 42 -33.969 4.995 -16.358 342 HG22 THR 42 HG22 THR 42 -32.573 6.073 -16.381 343 HG23 THR 42 HG23 THR 42 -33.952 6.436 -15.342 344 H GLU 43 H GLU 43 -31.801 1.791 -15.170 345 HA GLU 43 HA GLU 43 -32.498 1.707 -17.974 346 HB2 GLU 43 HB2 GLU 43 -30.786 -0.091 -18.437 347 HB3 GLU 43 HB3 GLU 43 -30.147 1.538 -18.265 348 HG2 GLU 43 HG2 GLU 43 -29.175 1.085 -16.218 349 HG3 GLU 43 HG3 GLU 43 -30.223 -0.299 -15.912 350 HA PRO 44 HA PRO 44 -34.643 -1.344 -15.187 351 HB2 PRO 44 HB2 PRO 44 -37.153 -0.642 -15.946 352 HB3 PRO 44 HB3 PRO 44 -36.283 0.168 -14.637 353 HG2 PRO 44 HG2 PRO 44 -36.637 1.018 -17.485 354 HG3 PRO 44 HG3 PRO 44 -36.741 1.990 -16.007 355 HD2 PRO 44 HD2 PRO 44 -34.544 1.976 -17.588 356 HD3 PRO 44 HD3 PRO 44 -34.452 2.195 -15.828 357 H LEU 45 H LEU 45 -35.567 -3.286 -15.808 358 HA LEU 45 HA LEU 45 -35.879 -3.703 -18.708 359 HB2 LEU 45 HB2 LEU 45 -33.857 -4.744 -17.393 360 HB3 LEU 45 HB3 LEU 45 -35.066 -5.928 -16.899 361 HG LEU 45 HG LEU 45 -35.504 -6.235 -19.411 362 HD11 LEU 45 HD11 LEU 45 -33.764 -4.129 -19.635 363 HD12 LEU 45 HD12 LEU 45 -34.205 -5.242 -20.931 364 HD13 LEU 45 HD13 LEU 45 -32.738 -5.519 -19.991 365 HD21 LEU 45 HD21 LEU 45 -32.768 -7.126 -18.601 366 HD22 LEU 45 HD22 LEU 45 -34.023 -8.010 -19.469 367 HD23 LEU 45 HD23 LEU 45 -34.188 -7.717 -17.737 368 H MET 46 H MET 46 -37.961 -3.996 -19.142 369 HA MET 46 HA MET 46 -39.892 -4.783 -17.231 370 HB2 MET 46 HB2 MET 46 -40.169 -3.469 -19.462 371 HB3 MET 46 HB3 MET 46 -40.322 -5.063 -20.188 372 HG2 MET 46 HG2 MET 46 -42.341 -5.468 -19.222 373 HG3 MET 46 HG3 MET 46 -42.000 -4.454 -17.823 374 HE1 MET 46 HE1 MET 46 -44.947 -4.314 -19.460 375 HE2 MET 46 HE2 MET 46 -44.390 -3.714 -17.899 376 HE3 MET 46 HE3 MET 46 -45.095 -2.600 -19.070 377 H ASN 47 H ASN 47 -38.371 -6.526 -19.930 378 HA ASN 47 HA ASN 47 -39.746 -8.959 -19.502 379 HB2 ASN 47 HB2 ASN 47 -37.268 -8.181 -21.005 380 HB3 ASN 47 HB3 ASN 47 -37.679 -9.882 -20.811 381 HD21 ASN 47 HD21 ASN 47 -38.663 -6.833 -22.180 382 HD22 ASN 47 HD22 ASN 47 -39.803 -7.481 -23.304 383 H TRP 48 H TRP 48 -39.525 -10.382 -17.916 384 HA TRP 48 HA TRP 48 -37.001 -11.208 -16.905 385 HB2 TRP 48 HB2 TRP 48 -37.507 -8.936 -15.750 386 HB3 TRP 48 HB3 TRP 48 -38.691 -9.852 -14.822 387 HD1 TRP 48 HD1 TRP 48 -37.729 -10.469 -12.545 388 HE1 TRP 48 HE1 TRP 48 -35.435 -11.202 -11.637 389 HE3 TRP 48 HE3 TRP 48 -35.041 -10.290 -16.890 390 HZ2 TRP 48 HZ2 TRP 48 -32.831 -11.647 -12.631 391 HZ3 TRP 48 HZ3 TRP 48 -32.655 -10.884 -16.826 392 HH2 TRP 48 HH2 TRP 48 -31.574 -11.547 -14.739 393 H THR 49 H THR 49 -37.146 -13.170 -15.924 394 HA THR 49 HA THR 49 -39.695 -14.503 -16.026 395 HB THR 49 HB THR 49 -37.194 -15.694 -14.855 396 HG1 THR 49 HG1 THR 49 -37.857 -15.445 -17.619 397 HG21 THR 49 HG21 THR 49 -38.808 -17.296 -14.646 398 HG22 THR 49 HG22 THR 49 -38.297 -17.639 -16.299 399 HG23 THR 49 HG23 THR 49 -39.748 -16.681 -16.006 400 H GLY 50 H GLY 50 -41.132 -14.490 -14.433 401 HA2 GLY 50 HA2 GLY 50 -41.738 -15.099 -12.194 402 HA3 GLY 50 HA3 GLY 50 -40.156 -14.552 -11.658 403 H SER 51 H SER 51 -43.349 -13.819 -11.615 404 HA SER 51 HA SER 51 -43.251 -10.986 -11.995 405 HB2 SER 51 HB2 SER 51 -45.326 -12.701 -10.608 406 HB3 SER 51 HB3 SER 51 -45.533 -11.007 -11.050 407 HG SER 51 HG SER 51 -45.017 -13.130 -12.865 408 H HIS 52 H HIS 52 -42.692 -13.144 -9.338 409 HA HIS 52 HA HIS 52 -43.125 -11.524 -7.141 410 HB2 HIS 52 HB2 HIS 52 -42.403 -13.971 -7.192 411 HB3 HIS 52 HB3 HIS 52 -40.755 -13.376 -7.376 412 HD1 HIS 52 HD1 HIS 52 -43.489 -12.135 -5.042 413 HD2 HIS 52 HD2 HIS 52 -39.673 -13.773 -4.923 414 HE1 HIS 52 HE1 HIS 52 -42.823 -12.110 -2.617 415 H ASP 53 H ASP 53 -40.524 -11.451 -9.468 416 HA ASP 53 HA ASP 53 -39.383 -9.136 -8.045 417 HB2 ASP 53 HB2 ASP 53 -37.967 -11.288 -9.623 418 HB3 ASP 53 HB3 ASP 53 -37.201 -9.773 -9.151 419 H THR 54 H THR 54 -39.194 -7.289 -9.163 420 HA THR 54 HA THR 54 -39.589 -7.388 -12.081 421 HB THR 54 HB THR 54 -40.833 -5.245 -11.920 422 HG1 THR 54 HG1 THR 54 -41.019 -4.268 -10.049 423 HG21 THR 54 HG21 THR 54 -42.912 -6.204 -11.339 424 HG22 THR 54 HG22 THR 54 -42.165 -7.325 -10.200 425 HG23 THR 54 HG23 THR 54 -41.929 -7.541 -11.934 426 H LYS 55 H LYS 55 -37.157 -7.175 -10.377 427 HA LYS 55 HA LYS 55 -36.081 -4.750 -11.626 428 HB2 LYS 55 HB2 LYS 55 -34.769 -4.281 -9.565 429 HB3 LYS 55 HB3 LYS 55 -36.503 -4.092 -9.346 430 HG2 LYS 55 HG2 LYS 55 -36.502 -6.444 -8.406 431 HG3 LYS 55 HG3 LYS 55 -34.742 -6.320 -8.373 432 HD2 LYS 55 HD2 LYS 55 -35.424 -5.678 -6.222 433 HD3 LYS 55 HD3 LYS 55 -35.094 -4.157 -7.057 434 HE2 LYS 55 HE2 LYS 55 -37.364 -3.665 -7.300 435 HE3 LYS 55 HE3 LYS 55 -37.852 -5.334 -7.009 436 HZ1 LYS 55 HZ1 LYS 55 -36.752 -4.859 -4.696 437 HZ2 LYS 55 HZ2 LYS 55 -38.350 -4.400 -5.008 438 HZ3 LYS 55 HZ3 LYS 55 -37.110 -3.252 -5.087 439 H GLN 56 H GLN 56 -33.548 -4.783 -11.190 440 HA GLN 56 HA GLN 56 -32.653 -7.445 -12.046 441 HB2 GLN 56 HB2 GLN 56 -31.311 -4.757 -12.382 442 HB3 GLN 56 HB3 GLN 56 -30.702 -6.287 -12.998 443 HG2 GLN 56 HG2 GLN 56 -32.512 -6.485 -14.527 444 HG3 GLN 56 HG3 GLN 56 -33.357 -5.124 -13.791 445 HE21 GLN 56 HE21 GLN 56 -32.461 -3.013 -14.050 446 HE22 GLN 56 HE22 GLN 56 -31.466 -2.650 -15.414 447 H GLN 57 H GLN 57 -32.073 -8.563 -10.271 448 HA GLN 57 HA GLN 57 -30.928 -7.423 -7.951 449 HB2 GLN 57 HB2 GLN 57 -31.385 -10.182 -8.969 450 HB3 GLN 57 HB3 GLN 57 -30.223 -9.977 -7.665 451 HG2 GLN 57 HG2 GLN 57 -31.843 -9.144 -6.199 452 HG3 GLN 57 HG3 GLN 57 -32.988 -8.836 -7.503 453 HE21 GLN 57 HE21 GLN 57 -31.375 -11.366 -5.672 454 HE22 GLN 57 HE22 GLN 57 -32.585 -12.574 -5.918 455 H VAL 58 H VAL 58 -28.774 -8.042 -7.074 456 HA VAL 58 HA VAL 58 -26.735 -7.367 -8.987 457 HB VAL 58 HB VAL 58 -26.372 -8.147 -6.093 458 HG11 VAL 58 HG11 VAL 58 -24.213 -8.001 -6.617 459 HG12 VAL 58 HG12 VAL 58 -24.572 -7.345 -8.215 460 HG13 VAL 58 HG13 VAL 58 -24.469 -6.268 -6.822 461 HG21 VAL 58 HG21 VAL 58 -27.035 -5.501 -7.355 462 HG22 VAL 58 HG22 VAL 58 -27.870 -6.330 -6.041 463 HG23 VAL 58 HG23 VAL 58 -26.277 -5.627 -5.768 464 H CYS 59 H CYS 59 -27.917 -10.257 -7.476 465 HA CYS 59 HA CYS 59 -25.581 -11.823 -8.157 466 HB2 CYS 59 HB2 CYS 59 -28.264 -12.822 -7.193 467 HB3 CYS 59 HB3 CYS 59 -26.724 -13.673 -7.135 468 HG CYS 59 HG CYS 59 -26.855 -13.096 -4.570 469 H LEU 60 H LEU 60 -25.315 -13.076 -9.911 470 HA LEU 60 HA LEU 60 -27.583 -13.306 -11.779 471 HB2 LEU 60 HB2 LEU 60 -24.784 -12.475 -12.187 472 HB3 LEU 60 HB3 LEU 60 -25.446 -13.566 -13.403 473 HG LEU 60 HG LEU 60 -26.595 -10.883 -12.638 474 HD11 LEU 60 HD11 LEU 60 -24.730 -10.306 -13.844 475 HD12 LEU 60 HD12 LEU 60 -25.915 -10.505 -15.135 476 HD13 LEU 60 HD13 LEU 60 -24.754 -11.789 -14.800 477 HD21 LEU 60 HD21 LEU 60 -27.876 -11.334 -14.823 478 HD22 LEU 60 HD22 LEU 60 -28.413 -12.149 -13.353 479 HD23 LEU 60 HD23 LEU 60 -27.456 -13.025 -14.550 480 H SER 61 H SER 61 -27.833 -15.239 -12.901 481 HA SER 61 HA SER 61 -26.127 -17.470 -12.010 482 HB2 SER 61 HB2 SER 61 -28.263 -17.581 -10.821 483 HB3 SER 61 HB3 SER 61 -29.136 -17.503 -12.352 484 HG SER 61 HG SER 61 -27.287 -19.547 -11.683 485 H PHE 62 H PHE 62 -25.431 -18.832 -13.556 486 HA PHE 62 HA PHE 62 -26.640 -18.643 -16.229 487 HB2 PHE 62 HB2 PHE 62 -23.695 -18.549 -15.560 488 HB3 PHE 62 HB3 PHE 62 -24.318 -18.828 -17.183 489 HD1 PHE 62 HD1 PHE 62 -25.511 -17.047 -18.377 490 HD2 PHE 62 HD2 PHE 62 -23.710 -16.379 -14.578 491 HE1 PHE 62 HE1 PHE 62 -25.647 -14.617 -18.743 492 HE2 PHE 62 HE2 PHE 62 -23.845 -13.948 -14.938 493 HZ PHE 62 HZ PHE 62 -24.815 -13.065 -17.022 494 H THR 63 H THR 63 -27.063 -20.550 -17.146 495 HA THR 63 HA THR 63 -26.824 -22.961 -15.749 496 HB THR 63 HB THR 63 -27.049 -22.878 -18.746 497 HG1 THR 63 HG1 THR 63 -29.141 -22.215 -18.569 498 HG21 THR 63 HG21 THR 63 -27.178 -25.080 -18.119 499 HG22 THR 63 HG22 THR 63 -28.878 -24.629 -17.980 500 HG23 THR 63 HG23 THR 63 -27.864 -24.704 -16.539 501 H THR 64 H THR 64 -24.924 -21.716 -18.486 502 HA THR 64 HA THR 64 -22.887 -23.763 -17.890 503 HB THR 64 HB THR 64 -22.185 -22.985 -20.370 504 HG1 THR 64 HG1 THR 64 -23.900 -22.391 -21.556 505 HG21 THR 64 HG21 THR 64 -23.098 -25.029 -21.158 506 HG22 THR 64 HG22 THR 64 -24.373 -25.012 -19.940 507 HG23 THR 64 HG23 THR 64 -22.700 -25.294 -19.461 508 H ARG 65 H ARG 65 -20.703 -23.160 -17.912 509 HA ARG 65 HA ARG 65 -20.091 -20.667 -16.815 510 HB2 ARG 65 HB2 ARG 65 -17.722 -21.272 -17.262 511 HB3 ARG 65 HB3 ARG 65 -18.631 -22.553 -16.471 512 HG2 ARG 65 HG2 ARG 65 -17.687 -23.850 -18.034 513 HG3 ARG 65 HG3 ARG 65 -18.979 -23.228 -19.062 514 HD2 ARG 65 HD2 ARG 65 -17.148 -22.818 -20.382 515 HD3 ARG 65 HD3 ARG 65 -17.272 -21.291 -19.507 516 HE ARG 65 HE ARG 65 -15.587 -23.111 -18.132 517 HH11 ARG 65 HH11 ARG 65 -15.685 -20.988 -20.890 518 HH12 ARG 65 HH12 ARG 65 -13.975 -20.713 -20.902 519 HH21 ARG 65 HH21 ARG 65 -13.334 -22.757 -18.138 520 HH22 ARG 65 HH22 ARG 65 -12.639 -21.720 -19.338 521 H GLU 66 H GLU 66 -19.812 -21.837 -20.146 522 HA GLU 66 HA GLU 66 -18.476 -19.719 -21.305 523 HB2 GLU 66 HB2 GLU 66 -19.455 -21.970 -22.291 524 HB3 GLU 66 HB3 GLU 66 -20.781 -20.921 -22.773 525 HG2 GLU 66 HG2 GLU 66 -18.914 -19.429 -23.765 526 HG3 GLU 66 HG3 GLU 66 -17.930 -20.887 -23.657 527 H LEU 67 H LEU 67 -21.786 -19.908 -20.228 528 HA LEU 67 HA LEU 67 -22.726 -17.601 -21.602 529 HB2 LEU 67 HB2 LEU 67 -23.879 -19.620 -20.153 530 HB3 LEU 67 HB3 LEU 67 -24.048 -18.236 -19.073 531 HG LEU 67 HG LEU 67 -25.232 -17.016 -20.851 532 HD11 LEU 67 HD11 LEU 67 -26.032 -18.357 -22.813 533 HD12 LEU 67 HD12 LEU 67 -24.843 -19.582 -22.375 534 HD13 LEU 67 HD13 LEU 67 -24.313 -17.962 -22.827 535 HD21 LEU 67 HD21 LEU 67 -27.075 -19.066 -20.985 536 HD22 LEU 67 HD22 LEU 67 -26.949 -17.858 -19.706 537 HD23 LEU 67 HD23 LEU 67 -26.160 -19.425 -19.519 538 H ALA 68 H ALA 68 -21.340 -18.173 -18.411 539 HA ALA 68 HA ALA 68 -21.789 -15.562 -17.399 540 HB1 ALA 68 HB1 ALA 68 -20.933 -17.925 -16.328 541 HB2 ALA 68 HB2 ALA 68 -19.457 -16.956 -16.322 542 HB3 ALA 68 HB3 ALA 68 -20.905 -16.364 -15.506 543 H ILE 69 H ILE 69 -18.729 -17.089 -18.425 544 HA ILE 69 HA ILE 69 -17.151 -14.817 -18.404 545 HB ILE 69 HB ILE 69 -16.938 -17.160 -20.300 546 HG12 ILE 69 HG12 ILE 69 -14.985 -17.365 -18.331 547 HG13 ILE 69 HG13 ILE 69 -16.417 -16.837 -17.453 548 HG21 ILE 69 HG21 ILE 69 -14.432 -16.406 -20.080 549 HG22 ILE 69 HG22 ILE 69 -15.506 -15.646 -21.253 550 HG23 ILE 69 HG23 ILE 69 -15.162 -14.841 -19.723 551 HD11 ILE 69 HD11 ILE 69 -17.206 -18.889 -19.231 552 HD12 ILE 69 HD12 ILE 69 -15.759 -19.428 -18.378 553 HD13 ILE 69 HD13 ILE 69 -17.176 -18.907 -17.467 554 H ALA 70 H ALA 70 -19.375 -15.960 -20.868 555 HA ALA 70 HA ALA 70 -18.590 -14.357 -23.009 556 HB1 ALA 70 HB1 ALA 70 -20.126 -15.925 -23.646 557 HB2 ALA 70 HB2 ALA 70 -21.130 -15.686 -22.217 558 HB3 ALA 70 HB3 ALA 70 -21.169 -14.509 -23.529 559 H TYR 71 H TYR 71 -20.287 -13.552 -20.095 560 HA TYR 71 HA TYR 71 -21.332 -11.056 -21.073 561 HB2 TYR 71 HB2 TYR 71 -22.521 -12.229 -19.308 562 HB3 TYR 71 HB3 TYR 71 -21.103 -12.166 -18.269 563 HD1 TYR 71 HD1 TYR 71 -22.573 -9.473 -20.376 564 HD2 TYR 71 HD2 TYR 71 -21.791 -10.889 -16.441 565 HE1 TYR 71 HE1 TYR 71 -23.351 -7.328 -19.457 566 HE2 TYR 71 HE2 TYR 71 -22.567 -8.748 -15.511 567 HH TYR 71 HH TYR 71 -22.682 -6.158 -16.702 568 H ALA 72 H ALA 72 -18.851 -11.924 -18.661 569 HA ALA 72 HA ALA 72 -17.883 -9.356 -18.196 570 HB1 ALA 72 HB1 ALA 72 -16.726 -12.089 -17.895 571 HB2 ALA 72 HB2 ALA 72 -15.693 -10.679 -17.663 572 HB3 ALA 72 HB3 ALA 72 -17.129 -10.895 -16.662 573 H VAL 73 H VAL 73 -16.562 -11.828 -20.405 574 HA VAL 73 HA VAL 73 -14.501 -10.362 -21.509 575 HB VAL 73 HB VAL 73 -16.263 -12.363 -22.930 576 HG11 VAL 73 HG11 VAL 73 -14.262 -12.701 -24.369 577 HG12 VAL 73 HG12 VAL 73 -15.005 -11.110 -24.546 578 HG13 VAL 73 HG13 VAL 73 -13.526 -11.295 -23.602 579 HG21 VAL 73 HG21 VAL 73 -14.773 -14.044 -22.215 580 HG22 VAL 73 HG22 VAL 73 -13.590 -12.867 -21.647 581 HG23 VAL 73 HG23 VAL 73 -15.111 -13.077 -20.780 582 H ALA 74 H ALA 74 -17.931 -10.224 -22.210 583 HA ALA 74 HA ALA 74 -17.927 -8.868 -24.628 584 HB1 ALA 74 HB1 ALA 74 -20.142 -8.712 -24.324 585 HB2 ALA 74 HB2 ALA 74 -19.851 -9.702 -22.894 586 HB3 ALA 74 HB3 ALA 74 -19.972 -7.950 -22.743 587 H HIS 75 H HIS 75 -17.141 -7.730 -21.447 588 HA HIS 75 HA HIS 75 -16.705 -5.037 -22.558 589 HB2 HIS 75 HB2 HIS 75 -17.972 -5.855 -19.970 590 HB3 HIS 75 HB3 HIS 75 -17.086 -4.336 -20.057 591 HD1 HIS 75 HD1 HIS 75 -18.778 -2.542 -20.216 592 HD2 HIS 75 HD2 HIS 75 -19.746 -5.796 -22.611 593 HE1 HIS 75 HE1 HIS 75 -20.858 -1.867 -21.457 594 H LYS 76 H LYS 76 -14.922 -7.387 -22.237 595 HA LYS 76 HA LYS 76 -12.820 -7.902 -21.524 596 HB2 LYS 76 HB2 LYS 76 -12.684 -5.499 -22.651 597 HB3 LYS 76 HB3 LYS 76 -12.239 -5.022 -21.018 598 HG2 LYS 76 HG2 LYS 76 -10.209 -5.421 -22.093 599 HG3 LYS 76 HG3 LYS 76 -10.492 -6.875 -21.132 600 HD2 LYS 76 HD2 LYS 76 -9.816 -7.706 -23.204 601 HD3 LYS 76 HD3 LYS 76 -11.576 -7.820 -23.267 602 HE2 LYS 76 HE2 LYS 76 -10.993 -6.904 -25.333 603 HE3 LYS 76 HE3 LYS 76 -11.494 -5.511 -24.375 604 HZ1 LYS 76 HZ1 LYS 76 -9.506 -4.923 -25.480 605 HZ2 LYS 76 HZ2 LYS 76 -8.727 -6.355 -25.025 606 HZ3 LYS 76 HZ3 LYS 76 -9.084 -5.180 -23.862 607 H ILE 77 H ILE 77 -14.891 -7.772 -19.496 608 HA ILE 77 HA ILE 77 -13.701 -6.615 -17.139 609 HB ILE 77 HB ILE 77 -16.073 -8.467 -17.398 610 HG12 ILE 77 HG12 ILE 77 -16.081 -5.487 -16.918 611 HG13 ILE 77 HG13 ILE 77 -16.202 -6.190 -18.527 612 HG21 ILE 77 HG21 ILE 77 -16.503 -7.169 -15.103 613 HG22 ILE 77 HG22 ILE 77 -15.638 -8.702 -15.187 614 HG23 ILE 77 HG23 ILE 77 -14.740 -7.187 -15.089 615 HD11 ILE 77 HD11 ILE 77 -18.365 -5.528 -17.416 616 HD12 ILE 77 HD12 ILE 77 -18.283 -7.174 -18.045 617 HD13 ILE 77 HD13 ILE 77 -18.107 -6.880 -16.315 618 H ASP 78 H ASP 78 -12.625 -7.637 -15.519 619 HA ASP 78 HA ASP 78 -11.336 -10.107 -16.124 620 HB2 ASP 78 HB2 ASP 78 -11.385 -8.577 -13.514 621 HB3 ASP 78 HB3 ASP 78 -10.245 -9.844 -13.956 622 H TYR 79 H TYR 79 -12.495 -11.932 -16.108 623 HA TYR 79 HA TYR 79 -14.442 -12.367 -13.959 624 HB2 TYR 79 HB2 TYR 79 -15.301 -14.195 -15.351 625 HB3 TYR 79 HB3 TYR 79 -15.259 -12.683 -16.251 626 HD1 TYR 79 HD2 TYR 79 -13.685 -15.986 -15.852 627 HD2 TYR 79 HD1 TYR 79 -13.833 -12.416 -18.162 628 HE1 TYR 79 HE2 TYR 79 -12.375 -17.083 -17.621 629 HE2 TYR 79 HE1 TYR 79 -12.524 -13.503 -19.938 630 HH TYR 79 HH TYR 79 -10.984 -16.550 -19.482 631 H THR 80 H THR 80 -14.244 -13.979 -12.489 632 HA THR 80 HA THR 80 -11.808 -15.634 -12.643 633 HB THR 80 HB THR 80 -11.571 -14.058 -10.833 634 HG1 THR 80 HG1 THR 80 -11.347 -15.570 -9.120 635 HG21 THR 80 HG21 THR 80 -14.051 -13.665 -10.576 636 HG22 THR 80 HG22 THR 80 -13.145 -13.787 -9.067 637 HG23 THR 80 HG23 THR 80 -14.108 -15.152 -9.631 638 H VAL 81 H VAL 81 -12.182 -17.732 -12.858 639 HA VAL 81 HA VAL 81 -14.832 -18.793 -12.242 640 HB VAL 81 HB VAL 81 -12.530 -20.220 -13.575 641 HG11 VAL 81 HG11 VAL 81 -14.050 -21.875 -14.180 642 HG12 VAL 81 HG12 VAL 81 -14.517 -21.485 -12.523 643 HG13 VAL 81 HG13 VAL 81 -15.445 -20.841 -13.878 644 HG21 VAL 81 HG21 VAL 81 -14.043 -19.738 -15.649 645 HG22 VAL 81 HG22 VAL 81 -14.618 -18.387 -14.671 646 HG23 VAL 81 HG23 VAL 81 -12.907 -18.515 -15.081 647 H LEU 82 H LEU 82 -15.200 -19.717 -10.347 648 HA LEU 82 HA LEU 82 -12.937 -20.900 -8.884 649 HB2 LEU 82 HB2 LEU 82 -15.348 -19.401 -8.062 650 HB3 LEU 82 HB3 LEU 82 -14.854 -20.727 -7.012 651 HG LEU 82 HG LEU 82 -12.983 -18.511 -7.819 652 HD11 LEU 82 HD11 LEU 82 -14.146 -18.485 -5.117 653 HD12 LEU 82 HD12 LEU 82 -15.237 -18.020 -6.421 654 HD13 LEU 82 HD13 LEU 82 -13.721 -17.149 -6.188 655 HD21 LEU 82 HD21 LEU 82 -11.718 -20.270 -6.996 656 HD22 LEU 82 HD22 LEU 82 -12.948 -20.743 -5.824 657 HD23 LEU 82 HD23 LEU 82 -11.991 -19.285 -5.559 658 H GLN 83 H GLN 83 -12.853 -23.031 -9.132 659 HA GLN 83 HA GLN 83 -15.359 -24.541 -9.376 660 HB2 GLN 83 HB2 GLN 83 -12.554 -25.008 -10.283 661 HB3 GLN 83 HB3 GLN 83 -13.568 -26.405 -9.952 662 HG2 GLN 83 HG2 GLN 83 -15.194 -25.658 -11.572 663 HG3 GLN 83 HG3 GLN 83 -14.274 -24.182 -11.852 664 HE21 GLN 83 HE21 GLN 83 -13.103 -24.208 -13.618 665 HE22 GLN 83 HE22 GLN 83 -12.398 -25.600 -14.361 666 H ASP 84 H ASP 84 -15.681 -26.458 -8.158 667 HA ASP 84 HA ASP 84 -14.983 -26.247 -5.441 668 HB2 ASP 84 HB2 ASP 84 -17.009 -27.369 -5.976 669 HB3 ASP 84 HB3 ASP 84 -16.187 -28.490 -7.059 670 H ASN 85 H ASN 85 -13.626 -28.121 -8.088 671 HA ASN 85 HA ASN 85 -11.177 -28.497 -6.630 672 HB2 ASN 85 HB2 ASN 85 -13.084 -30.761 -7.067 673 HB3 ASN 85 HB3 ASN 85 -11.354 -31.075 -7.162 674 HD21 ASN 85 HD21 ASN 85 -13.948 -31.058 -5.158 675 HD22 ASN 85 HD22 ASN 85 -13.139 -30.918 -3.637 676 HA PRO 86 HA PRO 86 -10.904 -28.168 -11.272 677 HB2 PRO 86 HB2 PRO 86 -9.160 -26.088 -11.268 678 HB3 PRO 86 HB3 PRO 86 -10.913 -25.871 -11.212 679 HG2 PRO 86 HG2 PRO 86 -8.923 -25.791 -8.978 680 HG3 PRO 86 HG3 PRO 86 -10.300 -24.718 -9.288 681 HD2 PRO 86 HD2 PRO 86 -10.395 -26.724 -7.470 682 HD3 PRO 86 HD3 PRO 86 -11.820 -26.205 -8.394 683 H ARG 87 H ARG 87 -9.000 -28.479 -12.613 684 HA ARG 87 HA ARG 87 -6.625 -29.414 -11.158 685 HB2 ARG 87 HB2 ARG 87 -8.260 -31.274 -11.922 686 HB3 ARG 87 HB3 ARG 87 -7.674 -30.914 -13.540 687 HG2 ARG 87 HG2 ARG 87 -5.730 -31.485 -11.350 688 HG3 ARG 87 HG3 ARG 87 -6.574 -32.808 -12.156 689 HD2 ARG 87 HD2 ARG 87 -5.788 -31.759 -14.340 690 HD3 ARG 87 HD3 ARG 87 -4.710 -30.775 -13.350 691 HE ARG 87 HE ARG 87 -4.217 -33.337 -12.553 692 HH11 ARG 87 HH11 ARG 87 -4.173 -31.655 -15.601 693 HH12 ARG 87 HH12 ARG 87 -2.929 -32.651 -16.281 694 HH21 ARG 87 HH21 ARG 87 -2.579 -34.656 -13.439 695 HH22 ARG 87 HH22 ARG 87 -2.024 -34.358 -15.051 696 H THR 88 H THR 88 -5.469 -27.595 -11.777 697 HA THR 88 HA THR 88 -5.356 -26.591 -14.416 698 HB THR 88 HB THR 88 -3.097 -26.278 -12.459 699 HG1 THR 88 HG1 THR 88 -4.415 -24.471 -11.638 700 HG21 THR 88 HG21 THR 88 -3.792 -25.122 -14.948 701 HG22 THR 88 HG22 THR 88 -2.442 -24.705 -13.892 702 HG23 THR 88 HG23 THR 88 -3.988 -23.876 -13.718 703 H ILE 89 H ILE 89 -4.409 -27.422 -16.149 704 HA ILE 89 HA ILE 89 -2.828 -29.775 -16.044 705 HB ILE 89 HB ILE 89 -2.766 -29.721 -18.374 706 HG12 ILE 89 HG12 ILE 89 -1.694 -27.563 -18.678 707 HG13 ILE 89 HG13 ILE 89 -3.120 -27.655 -19.706 708 HG21 ILE 89 HG21 ILE 89 -5.064 -29.820 -17.397 709 HG22 ILE 89 HG22 ILE 89 -5.227 -28.101 -17.756 710 HG23 ILE 89 HG23 ILE 89 -5.001 -29.258 -19.067 711 HD11 ILE 89 HD11 ILE 89 -2.870 -26.183 -17.096 712 HD12 ILE 89 HD12 ILE 89 -3.000 -25.483 -18.711 713 HD13 ILE 89 HD13 ILE 89 -4.366 -26.355 -18.014 714 H VAL 90 H VAL 90 -0.670 -29.896 -17.212 715 HA VAL 90 HA VAL 90 1.569 -29.473 -17.097 716 HB VAL 90 HB VAL 90 0.662 -26.627 -17.554 717 HG11 VAL 90 HG11 VAL 90 2.898 -26.426 -17.002 718 HG12 VAL 90 HG12 VAL 90 3.320 -27.989 -17.704 719 HG13 VAL 90 HG13 VAL 90 2.968 -26.616 -18.753 720 HG21 VAL 90 HG21 VAL 90 0.398 -28.914 -19.194 721 HG22 VAL 90 HG22 VAL 90 0.064 -27.233 -19.606 722 HG23 VAL 90 HG23 VAL 90 1.667 -27.909 -19.895 723 HA PRO 91 HA PRO 91 1.309 -28.085 -12.675 724 HB2 PRO 91 HB2 PRO 91 2.586 -30.262 -11.676 725 HB3 PRO 91 HB3 PRO 91 0.842 -30.218 -11.961 726 HG2 PRO 91 HG2 PRO 91 3.008 -31.400 -13.655 727 HG3 PRO 91 HG3 PRO 91 1.416 -32.067 -13.249 728 HD2 PRO 91 HD2 PRO 91 1.932 -30.866 -15.620 729 HD3 PRO 91 HD3 PRO 91 0.340 -30.794 -14.841 730 H LYS 92 H LYS 92 2.839 -26.468 -13.542 731 HA LYS 92 HA LYS 92 5.561 -27.076 -12.649 732 HB2 LYS 92 HB2 LYS 92 5.280 -27.233 -15.205 733 HB3 LYS 92 HB3 LYS 92 5.097 -25.485 -15.161 734 HG2 LYS 92 HG2 LYS 92 7.366 -25.974 -15.678 735 HG3 LYS 92 HG3 LYS 92 7.314 -25.354 -14.026 736 HD2 LYS 92 HD2 LYS 92 7.812 -27.402 -13.100 737 HD3 LYS 92 HD3 LYS 92 7.153 -28.300 -14.470 738 HE2 LYS 92 HE2 LYS 92 9.529 -28.540 -14.510 739 HE3 LYS 92 HE3 LYS 92 9.073 -27.469 -15.835 740 HZ1 LYS 92 HZ1 LYS 92 10.927 -26.494 -14.798 741 HZ2 LYS 92 HZ2 LYS 92 10.305 -26.732 -13.244 742 HZ3 LYS 92 HZ3 LYS 92 9.599 -25.589 -14.272 743 H SER 93 H SER 93 6.399 -25.529 -11.392 744 HA SER 93 HA SER 93 4.845 -23.340 -10.544 745 HB2 SER 93 HB2 SER 93 7.717 -24.133 -10.135 746 HB3 SER 93 HB3 SER 93 7.115 -22.593 -9.522 747 HG SER 93 HG SER 93 5.597 -23.721 -8.298 748 H TYR 94 H TYR 94 5.397 -21.058 -10.683 749 HA TYR 94 HA TYR 94 7.181 -20.090 -12.680 750 HB2 TYR 94 HB2 TYR 94 5.364 -20.964 -14.126 751 HB3 TYR 94 HB3 TYR 94 4.227 -19.899 -13.308 752 HD1 TYR 94 HD2 TYR 94 7.214 -19.965 -15.491 753 HD2 TYR 94 HD1 TYR 94 4.033 -17.618 -13.919 754 HE1 TYR 94 HE2 TYR 94 7.756 -18.174 -17.087 755 HE2 TYR 94 HE1 TYR 94 4.564 -15.820 -15.511 756 HH TYR 94 HH TYR 94 5.802 -15.219 -17.264 757 H ALA 95 H ALA 95 7.919 -18.379 -11.619 758 HA ALA 95 HA ALA 95 6.204 -16.855 -9.849 759 HB1 ALA 95 HB1 ALA 95 8.783 -17.516 -9.642 760 HB2 ALA 95 HB2 ALA 95 8.960 -15.936 -10.407 761 HB3 ALA 95 HB3 ALA 95 8.098 -16.083 -8.875 762 H ASP 96 H ASP 96 6.815 -14.332 -9.968 763 HA ASP 96 HA ASP 96 6.683 -13.407 -12.739 764 HB2 ASP 96 HB2 ASP 96 4.347 -13.749 -11.562 765 HB3 ASP 96 HB3 ASP 96 4.750 -12.217 -10.791 766 H ASN 97 H ASN 97 6.901 -11.012 -12.887 767 HA ASN 97 HA ASN 97 8.592 -10.002 -10.694 768 HB2 ASN 97 HB2 ASN 97 9.709 -10.492 -12.936 769 HB3 ASN 97 HB3 ASN 97 8.787 -9.136 -13.579 770 HD21 ASN 97 HD21 ASN 97 9.555 -7.143 -13.321 771 HD22 ASN 97 HD22 ASN 97 10.929 -6.722 -12.361 772 H PHE 98 H PHE 98 7.056 -8.870 -9.564 773 HA PHE 98 HA PHE 98 5.638 -6.740 -11.020 774 HB2 PHE 98 HB2 PHE 98 4.055 -6.723 -9.117 775 HB3 PHE 98 HB3 PHE 98 4.119 -8.288 -9.919 776 HD1 PHE 98 HD1 PHE 98 5.301 -6.412 -6.958 777 HD2 PHE 98 HD2 PHE 98 4.689 -10.230 -8.737 778 HE1 PHE 98 HE1 PHE 98 5.779 -7.491 -4.800 779 HE2 PHE 98 HE2 PHE 98 5.166 -11.315 -6.581 780 HZ PHE 98 HZ PHE 98 5.711 -9.946 -4.608 781 H THR 99 H THR 99 5.083 -4.859 -9.400 782 HA THR 99 HA THR 99 7.542 -4.166 -7.930 783 HB THR 99 HB THR 99 7.022 -1.760 -8.585 784 HG1 THR 99 HG1 THR 99 5.715 -1.491 -10.406 785 HG21 THR 99 HG21 THR 99 7.655 -3.343 -11.036 786 HG22 THR 99 HG22 THR 99 8.733 -3.446 -9.644 787 HG23 THR 99 HG23 THR 99 8.425 -1.887 -10.408 788 H LYS 100 H LYS 100 7.280 -3.432 -5.908 789 HA LYS 100 HA LYS 100 4.672 -2.406 -5.070 790 HB2 LYS 100 HB2 LYS 100 4.672 -4.820 -4.557 791 HB3 LYS 100 HB3 LYS 100 6.143 -4.612 -3.615 792 HG2 LYS 100 HG2 LYS 100 4.583 -4.580 -1.954 793 HG3 LYS 100 HG3 LYS 100 4.685 -2.857 -2.319 794 HD2 LYS 100 HD2 LYS 100 2.382 -3.332 -2.209 795 HD3 LYS 100 HD3 LYS 100 2.755 -3.242 -3.933 796 HE2 LYS 100 HE2 LYS 100 2.875 -5.674 -4.042 797 HE3 LYS 100 HE3 LYS 100 2.551 -5.781 -2.313 798 HZ1 LYS 100 HZ1 LYS 100 0.370 -5.201 -2.593 799 HZ2 LYS 100 HZ2 LYS 100 0.635 -6.051 -4.030 800 HZ3 LYS 100 HZ3 LYS 100 0.644 -4.360 -4.034 801 HA PRO 101 HA PRO 101 8.306 0.024 -3.467 802 HB2 PRO 101 HB2 PRO 101 7.347 2.439 -4.255 803 HB3 PRO 101 HB3 PRO 101 8.318 1.401 -5.307 804 HG2 PRO 101 HG2 PRO 101 5.347 1.762 -5.219 805 HG3 PRO 101 HG3 PRO 101 6.420 1.655 -6.627 806 HD2 PRO 101 HD2 PRO 101 4.941 -0.441 -5.761 807 HD3 PRO 101 HD3 PRO 101 6.529 -0.645 -6.528 808 H ARG 102 H ARG 102 4.824 0.684 -3.357 809 HA ARG 102 HA ARG 102 5.028 1.140 -0.487 810 HB2 ARG 102 HB2 ARG 102 5.238 3.373 -1.607 811 HB3 ARG 102 HB3 ARG 102 3.637 3.126 -2.289 812 HG2 ARG 102 HG2 ARG 102 3.008 2.743 0.249 813 HG3 ARG 102 HG3 ARG 102 4.442 3.741 0.497 814 HD2 ARG 102 HD2 ARG 102 2.131 4.491 -1.288 815 HD3 ARG 102 HD3 ARG 102 2.308 5.024 0.383 816 HE ARG 102 HE ARG 102 4.590 5.626 -1.249 817 HH11 ARG 102 HH11 ARG 102 1.430 6.700 -0.262 818 HH12 ARG 102 HH12 ARG 102 1.750 8.370 -0.594 819 HH21 ARG 102 HH21 ARG 102 5.025 7.820 -1.690 820 HH22 ARG 102 HH22 ARG 102 3.796 9.007 -1.407 821 H ASP 103 H ASP 103 3.233 0.522 0.636 822 HA ASP 103 HA ASP 103 1.269 -1.016 -0.829 823 HB2 ASP 103 HB2 ASP 103 2.116 -2.013 1.182 824 HB3 ASP 103 HB3 ASP 103 1.737 -0.574 2.123 825 H MET 104 H MET 104 0.895 1.343 1.820 826 HA MET 104 HA MET 104 -1.778 1.974 1.018 827 HB2 MET 104 HB2 MET 104 0.097 3.073 3.097 828 HB3 MET 104 HB3 MET 104 -1.455 3.835 2.777 829 HG2 MET 104 HG2 MET 104 -2.565 1.683 3.274 830 HG3 MET 104 HG3 MET 104 -0.994 1.009 3.699 831 HE1 MET 104 HE1 MET 104 -2.425 0.293 5.756 832 HE2 MET 104 HE2 MET 104 -0.814 0.631 6.388 833 HE3 MET 104 HE3 MET 104 -2.239 1.205 7.255 Start of MODEL 13 1 H1 MET 1 H MET 1 -4.712 -5.305 -4.698 2 HA MET 1 HA MET 1 -2.677 -3.251 -4.126 3 HB2 MET 1 HB2 MET 1 -2.434 -6.175 -3.435 4 HB3 MET 1 HB3 MET 1 -1.440 -4.843 -2.863 5 HG2 MET 1 HG2 MET 1 -3.313 -3.964 -1.592 6 HG3 MET 1 HG3 MET 1 -4.345 -5.256 -2.200 7 HE1 MET 1 HE1 MET 1 -4.238 -7.458 0.735 8 HE2 MET 1 HE2 MET 1 -4.977 -5.886 0.437 9 HE3 MET 1 HE3 MET 1 -4.934 -7.097 -0.845 10 H GLN 2 H GLN 2 -3.326 -6.293 -5.822 11 HA GLN 2 HA GLN 2 -1.104 -5.651 -7.647 12 HB2 GLN 2 HB2 GLN 2 -2.142 -8.347 -6.768 13 HB3 GLN 2 HB3 GLN 2 -1.006 -8.124 -8.092 14 HG2 GLN 2 HG2 GLN 2 0.374 -6.835 -6.277 15 HG3 GLN 2 HG3 GLN 2 -0.599 -7.797 -5.165 16 HE21 GLN 2 HE21 GLN 2 -0.159 -9.920 -4.907 17 HE22 GLN 2 HE22 GLN 2 1.134 -10.747 -5.699 18 H GLU 3 H GLU 3 -1.548 -5.488 -9.766 19 HA GLU 3 HA GLU 3 -2.770 -5.275 -11.675 20 HB2 GLU 3 HB2 GLU 3 -3.826 -7.860 -10.556 21 HB3 GLU 3 HB3 GLU 3 -4.409 -7.216 -12.084 22 HG2 GLU 3 HG2 GLU 3 -2.715 -8.793 -12.578 23 HG3 GLU 3 HG3 GLU 3 -2.046 -7.191 -12.885 24 H GLN 4 H GLN 4 -3.641 -3.457 -10.054 25 HA GLN 4 HA GLN 4 -6.422 -3.714 -9.375 26 HB2 GLN 4 HB2 GLN 4 -4.674 -1.248 -9.438 27 HB3 GLN 4 HB3 GLN 4 -6.254 -1.376 -8.677 28 HG2 GLN 4 HG2 GLN 4 -5.368 -3.033 -7.116 29 HG3 GLN 4 HG3 GLN 4 -3.784 -2.897 -7.877 30 HE21 GLN 4 HE21 GLN 4 -5.645 -1.876 -5.360 31 HE22 GLN 4 HE22 GLN 4 -4.795 -0.431 -4.943 32 H VAL 5 H VAL 5 -8.154 -2.533 -10.280 33 HA VAL 5 HA VAL 5 -7.700 -1.242 -12.862 34 HB VAL 5 HB VAL 5 -9.767 -3.420 -12.547 35 HG11 VAL 5 HG11 VAL 5 -10.599 -2.098 -14.219 36 HG12 VAL 5 HG12 VAL 5 -9.003 -1.536 -14.720 37 HG13 VAL 5 HG13 VAL 5 -9.547 -3.155 -15.160 38 HG21 VAL 5 HG21 VAL 5 -6.983 -3.486 -13.660 39 HG22 VAL 5 HG22 VAL 5 -7.759 -4.607 -12.540 40 HG23 VAL 5 HG23 VAL 5 -8.226 -4.596 -14.240 41 H SER 6 H SER 6 -9.331 0.201 -13.484 42 HA SER 6 HA SER 6 -11.001 1.108 -11.270 43 HB2 SER 6 HB2 SER 6 -11.221 3.177 -12.478 44 HB3 SER 6 HB3 SER 6 -9.524 2.702 -12.537 45 HG SER 6 HG SER 6 -9.948 3.158 -14.600 46 H ASN 7 H ASN 7 -11.915 -1.255 -12.307 47 HA ASN 7 HA ASN 7 -14.510 -0.442 -13.332 48 HB2 ASN 7 HB2 ASN 7 -12.678 -2.343 -14.798 49 HB3 ASN 7 HB3 ASN 7 -14.415 -2.281 -15.078 50 HD21 ASN 7 HD21 ASN 7 -15.282 -0.611 -16.224 51 HD22 ASN 7 HD22 ASN 7 -14.331 0.580 -17.037 52 H VAL 8 H VAL 8 -15.999 -2.415 -13.459 53 HA VAL 8 HA VAL 8 -15.872 -3.760 -10.931 54 HB VAL 8 HB VAL 8 -18.008 -4.737 -11.514 55 HG11 VAL 8 HG11 VAL 8 -18.506 -2.095 -12.664 56 HG12 VAL 8 HG12 VAL 8 -19.119 -2.820 -11.176 57 HG13 VAL 8 HG13 VAL 8 -17.526 -2.064 -11.198 58 HG21 VAL 8 HG21 VAL 8 -17.547 -3.591 -14.267 59 HG22 VAL 8 HG22 VAL 8 -17.547 -5.302 -13.837 60 HG23 VAL 8 HG23 VAL 8 -19.033 -4.362 -13.712 61 H ARG 9 H ARG 9 -16.067 -6.093 -10.670 62 HA ARG 9 HA ARG 9 -14.679 -7.584 -12.800 63 HB2 ARG 9 HB2 ARG 9 -13.660 -8.959 -10.987 64 HB3 ARG 9 HB3 ARG 9 -13.139 -7.279 -10.978 65 HG2 ARG 9 HG2 ARG 9 -15.452 -8.031 -9.275 66 HG3 ARG 9 HG3 ARG 9 -13.837 -8.534 -8.768 67 HD2 ARG 9 HD2 ARG 9 -13.230 -6.039 -9.268 68 HD3 ARG 9 HD3 ARG 9 -14.965 -5.786 -9.077 69 HE ARG 9 HE ARG 9 -14.702 -6.048 -6.826 70 HH11 ARG 9 HH11 ARG 9 -11.942 -7.426 -8.439 71 HH12 ARG 9 HH12 ARG 9 -11.080 -7.748 -6.971 72 HH21 ARG 9 HH21 ARG 9 -13.578 -6.468 -4.886 73 HH22 ARG 9 HH22 ARG 9 -12.013 -7.204 -4.951 74 H ALA 10 H ALA 10 -15.199 -9.823 -12.993 75 HA ALA 10 HA ALA 10 -17.915 -10.431 -12.049 76 HB1 ALA 10 HB1 ALA 10 -17.285 -12.321 -13.961 77 HB2 ALA 10 HB2 ALA 10 -18.246 -10.862 -14.210 78 HB3 ALA 10 HB3 ALA 10 -16.517 -10.849 -14.558 79 H ARG 11 H ARG 11 -18.232 -11.996 -10.606 80 HA ARG 11 HA ARG 11 -15.976 -13.767 -9.963 81 HB2 ARG 11 HB2 ARG 11 -18.379 -12.998 -8.297 82 HB3 ARG 11 HB3 ARG 11 -17.101 -14.091 -7.785 83 HG2 ARG 11 HG2 ARG 11 -15.562 -12.040 -8.344 84 HG3 ARG 11 HG3 ARG 11 -17.059 -11.136 -8.107 85 HD2 ARG 11 HD2 ARG 11 -17.279 -12.407 -5.908 86 HD3 ARG 11 HD3 ARG 11 -15.600 -12.889 -6.149 87 HE ARG 11 HE ARG 11 -15.485 -10.211 -6.407 88 HH11 ARG 11 HH11 ARG 11 -16.889 -12.291 -3.993 89 HH12 ARG 11 HH12 ARG 11 -16.655 -11.163 -2.699 90 HH21 ARG 11 HH21 ARG 11 -15.172 -8.718 -4.710 91 HH22 ARG 11 HH22 ARG 11 -15.679 -9.131 -3.107 92 H ILE 12 H ILE 12 -16.181 -15.581 -11.140 93 HA ILE 12 HA ILE 12 -18.824 -16.818 -11.409 94 HB ILE 12 HB ILE 12 -16.229 -17.491 -12.800 95 HG12 ILE 12 HG12 ILE 12 -18.683 -16.303 -14.071 96 HG13 ILE 12 HG13 ILE 12 -17.467 -15.275 -13.320 97 HG21 ILE 12 HG21 ILE 12 -19.016 -18.585 -13.137 98 HG22 ILE 12 HG22 ILE 12 -17.704 -18.850 -14.284 99 HG23 ILE 12 HG23 ILE 12 -17.571 -19.464 -12.636 100 HD11 ILE 12 HD11 ILE 12 -15.774 -16.307 -14.821 101 HD12 ILE 12 HD12 ILE 12 -17.092 -17.142 -15.643 102 HD13 ILE 12 HD13 ILE 12 -17.022 -15.380 -15.653 103 H TYR 13 H TYR 13 -19.351 -18.707 -10.467 104 HA TYR 13 HA TYR 13 -17.248 -20.314 -9.214 105 HB2 TYR 13 HB2 TYR 13 -17.987 -18.943 -7.395 106 HB3 TYR 13 HB3 TYR 13 -19.679 -19.204 -7.806 107 HD1 TYR 13 HD2 TYR 13 -16.713 -21.393 -7.146 108 HD2 TYR 13 HD1 TYR 13 -20.793 -20.533 -6.299 109 HE1 TYR 13 HE2 TYR 13 -16.788 -23.304 -5.599 110 HE2 TYR 13 HE1 TYR 13 -20.879 -22.441 -4.749 111 HH TYR 13 HH TYR 13 -19.700 -24.024 -3.710 112 H LYS 14 H LYS 14 -17.632 -22.483 -9.200 113 HA LYS 14 HA LYS 14 -20.117 -23.365 -10.511 114 HB2 LYS 14 HB2 LYS 14 -18.738 -25.453 -11.021 115 HB3 LYS 14 HB3 LYS 14 -18.308 -23.985 -11.888 116 HG2 LYS 14 HG2 LYS 14 -16.347 -23.697 -10.697 117 HG3 LYS 14 HG3 LYS 14 -16.895 -24.705 -9.355 118 HD2 LYS 14 HD2 LYS 14 -16.640 -25.996 -12.014 119 HD3 LYS 14 HD3 LYS 14 -15.147 -25.567 -11.176 120 HE2 LYS 14 HE2 LYS 14 -16.296 -26.727 -9.140 121 HE3 LYS 14 HE3 LYS 14 -17.288 -27.494 -10.379 122 HZ1 LYS 14 HZ1 LYS 14 -14.687 -27.720 -11.257 123 HZ2 LYS 14 HZ2 LYS 14 -15.655 -28.953 -10.623 124 HZ3 LYS 14 HZ3 LYS 14 -14.623 -28.082 -9.606 125 HA PRO 15 HA PRO 15 -20.631 -24.936 -6.246 126 HB2 PRO 15 HB2 PRO 15 -23.343 -24.888 -6.338 127 HB3 PRO 15 HB3 PRO 15 -22.369 -23.465 -5.948 128 HG2 PRO 15 HG2 PRO 15 -23.640 -24.236 -8.547 129 HG3 PRO 15 HG3 PRO 15 -23.573 -22.648 -7.762 130 HD2 PRO 15 HD2 PRO 15 -21.921 -23.340 -9.793 131 HD3 PRO 15 HD3 PRO 15 -21.426 -22.237 -8.493 132 H ALA 16 H ALA 16 -21.872 -25.973 -9.333 133 HA ALA 16 HA ALA 16 -22.831 -28.515 -8.342 134 HB1 ALA 16 HB1 ALA 16 -24.088 -27.734 -10.139 135 HB2 ALA 16 HB2 ALA 16 -22.658 -27.260 -11.057 136 HB3 ALA 16 HB3 ALA 16 -23.054 -28.967 -10.862 137 H LYS 17 H LYS 17 -21.680 -30.321 -8.152 138 HA LYS 17 HA LYS 17 -18.968 -30.367 -9.286 139 HB2 LYS 17 HB2 LYS 17 -19.279 -30.591 -6.789 140 HB3 LYS 17 HB3 LYS 17 -20.067 -32.132 -7.096 141 HG2 LYS 17 HG2 LYS 17 -17.993 -32.913 -8.208 142 HG3 LYS 17 HG3 LYS 17 -17.218 -31.400 -7.732 143 HD2 LYS 17 HD2 LYS 17 -17.342 -31.928 -5.448 144 HD3 LYS 17 HD3 LYS 17 -18.531 -33.204 -5.721 145 HE2 LYS 17 HE2 LYS 17 -15.823 -33.412 -6.963 146 HE3 LYS 17 HE3 LYS 17 -16.029 -33.803 -5.257 147 HZ1 LYS 17 HZ1 LYS 17 -16.809 -35.776 -5.837 148 HZ2 LYS 17 HZ2 LYS 17 -16.595 -35.406 -7.473 149 HZ3 LYS 17 HZ3 LYS 17 -18.067 -35.061 -6.712 150 H SER 18 H SER 18 -21.808 -32.440 -8.756 151 HA SER 18 HA SER 18 -20.843 -34.189 -10.919 152 HB2 SER 18 HB2 SER 18 -22.587 -35.804 -9.916 153 HB3 SER 18 HB3 SER 18 -21.106 -35.531 -9.001 154 HG SER 18 HG SER 18 -23.517 -35.245 -8.115 155 H THR 19 H THR 19 -22.776 -35.334 -12.047 156 HA THR 19 HA THR 19 -24.249 -33.325 -13.408 157 HB THR 19 HB THR 19 -25.518 -35.508 -14.250 158 HG1 THR 19 HG1 THR 19 -24.711 -37.222 -13.311 159 HG21 THR 19 HG21 THR 19 -22.669 -35.328 -15.109 160 HG22 THR 19 HG22 THR 19 -23.710 -33.923 -15.338 161 HG23 THR 19 HG23 THR 19 -24.133 -35.465 -16.081 162 H MET 20 H MET 20 -26.471 -32.924 -13.441 163 HA MET 20 HA MET 20 -27.850 -33.650 -10.957 164 HB2 MET 20 HB2 MET 20 -27.518 -31.214 -11.799 165 HB3 MET 20 HB3 MET 20 -28.829 -31.590 -12.909 166 HG2 MET 20 HG2 MET 20 -29.863 -30.568 -11.088 167 HG3 MET 20 HG3 MET 20 -30.155 -32.290 -10.859 168 HE1 MET 20 HE1 MET 20 -26.998 -29.717 -9.133 169 HE2 MET 20 HE2 MET 20 -28.373 -29.241 -10.131 170 HE3 MET 20 HE3 MET 20 -28.506 -29.208 -8.371 171 H GLN 21 H GLN 21 -29.349 -35.180 -11.008 172 HA GLN 21 HA GLN 21 -30.605 -35.837 -13.584 173 HB2 GLN 21 HB2 GLN 21 -29.422 -37.716 -12.693 174 HB3 GLN 21 HB3 GLN 21 -30.144 -37.493 -11.104 175 HG2 GLN 21 HG2 GLN 21 -32.228 -38.281 -11.812 176 HG3 GLN 21 HG3 GLN 21 -31.812 -38.105 -13.516 177 HE21 GLN 21 HE21 GLN 21 -32.135 -40.170 -14.154 178 HE22 GLN 21 HE22 GLN 21 -31.217 -41.516 -13.581 179 H SER 22 H SER 22 -31.397 -35.806 -10.105 180 HA SER 22 HA SER 22 -34.211 -35.775 -10.576 181 HB2 SER 22 HB2 SER 22 -32.669 -35.107 -8.057 182 HB3 SER 22 HB3 SER 22 -34.400 -35.422 -8.150 183 HG SER 22 HG SER 22 -33.592 -37.356 -7.634 184 H GLY 23 H GLY 23 -35.675 -34.054 -9.911 185 HA2 GLY 23 HA2 GLY 23 -36.223 -31.799 -9.520 186 HA3 GLY 23 HA3 GLY 23 -34.545 -31.364 -9.814 187 H HIS 24 H HIS 24 -37.508 -30.900 -10.977 188 HA HIS 24 HA HIS 24 -36.776 -31.088 -13.807 189 HB2 HIS 24 HB2 HIS 24 -39.024 -31.925 -12.826 190 HB3 HIS 24 HB3 HIS 24 -39.466 -30.221 -12.783 191 HD1 HIS 24 HD1 HIS 24 -37.704 -32.223 -15.501 192 HD2 HIS 24 HD2 HIS 24 -41.084 -29.877 -14.920 193 HE1 HIS 24 HE1 HIS 24 -38.792 -32.040 -17.761 194 H SER 25 H SER 25 -37.467 -28.795 -11.274 195 HA SER 25 HA SER 25 -37.326 -26.561 -13.163 196 HB2 SER 25 HB2 SER 25 -39.153 -26.576 -11.482 197 HB3 SER 25 HB3 SER 25 -37.946 -26.525 -10.199 198 HG SER 25 HG SER 25 -38.723 -24.536 -12.003 199 H LYS 26 H LYS 26 -35.000 -28.210 -12.451 200 HA LYS 26 HA LYS 26 -33.334 -26.158 -11.146 201 HB2 LYS 26 HB2 LYS 26 -32.932 -29.152 -11.295 202 HB3 LYS 26 HB3 LYS 26 -31.768 -28.022 -10.614 203 HG2 LYS 26 HG2 LYS 26 -34.581 -28.284 -9.591 204 HG3 LYS 26 HG3 LYS 26 -33.230 -29.231 -8.964 205 HD2 LYS 26 HD2 LYS 26 -32.215 -27.398 -8.009 206 HD3 LYS 26 HD3 LYS 26 -32.969 -26.263 -9.131 207 HE2 LYS 26 HE2 LYS 26 -34.025 -25.893 -7.061 208 HE3 LYS 26 HE3 LYS 26 -35.169 -26.846 -8.004 209 HZ1 LYS 26 HZ1 LYS 26 -34.609 -27.471 -5.546 210 HZ2 LYS 26 HZ2 LYS 26 -33.286 -28.252 -6.253 211 HZ3 LYS 26 HZ3 LYS 26 -34.860 -28.678 -6.704 212 H LEU 27 H LEU 27 -32.827 -24.999 -12.998 213 HA LEU 27 HA LEU 27 -31.388 -26.454 -15.109 214 HB2 LEU 27 HB2 LEU 27 -32.461 -23.643 -15.219 215 HB3 LEU 27 HB3 LEU 27 -31.846 -24.607 -16.561 216 HG LEU 27 HG LEU 27 -34.364 -25.221 -15.015 217 HD11 LEU 27 HD11 LEU 27 -34.883 -23.272 -16.172 218 HD12 LEU 27 HD12 LEU 27 -35.395 -24.552 -17.271 219 HD13 LEU 27 HD13 LEU 27 -33.874 -23.705 -17.552 220 HD21 LEU 27 HD21 LEU 27 -32.825 -26.609 -17.103 221 HD22 LEU 27 HD22 LEU 27 -34.562 -26.498 -17.391 222 HD23 LEU 27 HD23 LEU 27 -33.959 -27.245 -15.911 223 H LYS 28 H LYS 28 -31.213 -23.622 -12.995 224 HA LYS 28 HA LYS 28 -28.807 -22.539 -13.814 225 HB2 LYS 28 HB2 LYS 28 -30.138 -21.379 -12.200 226 HB3 LYS 28 HB3 LYS 28 -30.034 -22.716 -11.062 227 HG2 LYS 28 HG2 LYS 28 -27.672 -22.297 -10.737 228 HG3 LYS 28 HG3 LYS 28 -27.715 -21.007 -11.941 229 HD2 LYS 28 HD2 LYS 28 -27.858 -19.853 -9.928 230 HD3 LYS 28 HD3 LYS 28 -29.543 -19.975 -10.436 231 HE2 LYS 28 HE2 LYS 28 -29.582 -20.555 -8.172 232 HE3 LYS 28 HE3 LYS 28 -29.621 -22.103 -9.015 233 HZ1 LYS 28 HZ1 LYS 28 -26.961 -21.177 -8.446 234 HZ2 LYS 28 HZ2 LYS 28 -27.662 -22.690 -8.162 235 HZ3 LYS 28 HZ3 LYS 28 -27.885 -21.434 -7.052 236 H ALA 29 H ALA 29 -26.652 -22.804 -13.189 237 HA ALA 29 HA ALA 29 -25.940 -25.092 -11.537 238 HB1 ALA 29 HB1 ALA 29 -24.271 -25.291 -13.813 239 HB2 ALA 29 HB2 ALA 29 -25.440 -26.464 -13.206 240 HB3 ALA 29 HB3 ALA 29 -25.940 -25.245 -14.379 241 H TRP 30 H TRP 30 -24.831 -22.408 -13.562 242 HA TRP 30 HA TRP 30 -22.426 -22.173 -11.894 243 HB2 TRP 30 HB2 TRP 30 -23.132 -21.146 -14.635 244 HB3 TRP 30 HB3 TRP 30 -21.781 -20.475 -13.726 245 HD1 TRP 30 HD1 TRP 30 -22.937 -23.806 -15.294 246 HE1 TRP 30 HE1 TRP 30 -20.850 -25.231 -15.781 247 HE3 TRP 30 HE3 TRP 30 -19.391 -20.812 -13.149 248 HZ2 TRP 30 HZ2 TRP 30 -18.069 -25.103 -15.318 249 HZ3 TRP 30 HZ3 TRP 30 -17.040 -21.537 -13.213 250 HH2 TRP 30 HH2 TRP 30 -16.395 -23.638 -14.275 251 H LYS 31 H LYS 31 -21.860 -20.210 -10.918 252 HA LYS 31 HA LYS 31 -24.090 -18.307 -10.620 253 HB2 LYS 31 HB2 LYS 31 -23.538 -19.644 -8.580 254 HB3 LYS 31 HB3 LYS 31 -21.934 -18.921 -8.592 255 HG2 LYS 31 HG2 LYS 31 -23.051 -17.614 -7.064 256 HG3 LYS 31 HG3 LYS 31 -23.220 -16.673 -8.547 257 HD2 LYS 31 HD2 LYS 31 -25.332 -18.669 -7.964 258 HD3 LYS 31 HD3 LYS 31 -25.284 -17.228 -6.945 259 HE2 LYS 31 HE2 LYS 31 -25.022 -16.080 -9.354 260 HE3 LYS 31 HE3 LYS 31 -25.937 -17.514 -9.817 261 HZ1 LYS 31 HZ1 LYS 31 -26.871 -15.986 -7.505 262 HZ2 LYS 31 HZ2 LYS 31 -27.758 -16.841 -8.663 263 HZ3 LYS 31 HZ3 LYS 31 -27.122 -15.319 -9.040 264 H LEU 32 H LEU 32 -23.683 -16.143 -10.787 265 HA LEU 32 HA LEU 32 -20.907 -15.294 -11.220 266 HB2 LEU 32 HB2 LEU 32 -22.078 -15.692 -13.395 267 HB3 LEU 32 HB3 LEU 32 -23.213 -14.420 -12.950 268 HG LEU 32 HG LEU 32 -21.356 -13.792 -14.557 269 HD11 LEU 32 HD11 LEU 32 -20.961 -11.933 -12.363 270 HD12 LEU 32 HD12 LEU 32 -22.657 -12.361 -12.592 271 HD13 LEU 32 HD13 LEU 32 -21.730 -11.688 -13.931 272 HD21 LEU 32 HD21 LEU 32 -19.541 -13.351 -12.284 273 HD22 LEU 32 HD22 LEU 32 -19.188 -13.803 -13.953 274 HD23 LEU 32 HD23 LEU 32 -19.717 -15.029 -12.800 275 H GLU 33 H GLU 33 -20.389 -13.505 -10.134 276 HA GLU 33 HA GLU 33 -22.545 -11.696 -9.281 277 HB2 GLU 33 HB2 GLU 33 -21.657 -13.338 -7.481 278 HB3 GLU 33 HB3 GLU 33 -20.225 -12.317 -7.477 279 HG2 GLU 33 HG2 GLU 33 -21.568 -10.392 -6.870 280 HG3 GLU 33 HG3 GLU 33 -23.031 -11.373 -6.934 281 H PHE 34 H PHE 34 -22.153 -9.850 -10.311 282 HA PHE 34 HA PHE 34 -19.413 -9.020 -10.850 283 HB2 PHE 34 HB2 PHE 34 -20.452 -7.256 -12.229 284 HB3 PHE 34 HB3 PHE 34 -21.019 -8.861 -12.681 285 HD1 PHE 34 HD1 PHE 34 -21.923 -5.704 -11.046 286 HD2 PHE 34 HD2 PHE 34 -23.301 -9.504 -12.380 287 HE1 PHE 34 HE1 PHE 34 -24.250 -4.958 -10.757 288 HE2 PHE 34 HE2 PHE 34 -25.630 -8.764 -12.094 289 HZ PHE 34 HZ PHE 34 -26.108 -6.489 -11.282 290 H GLU 35 H GLU 35 -18.408 -7.318 -9.915 291 HA GLU 35 HA GLU 35 -19.209 -6.415 -7.399 292 HB2 GLU 35 HB2 GLU 35 -16.879 -6.370 -8.158 293 HB3 GLU 35 HB3 GLU 35 -17.279 -5.128 -9.337 294 HG2 GLU 35 HG2 GLU 35 -16.426 -3.823 -7.690 295 HG3 GLU 35 HG3 GLU 35 -18.116 -3.847 -7.192 296 HA PRO 36 HA PRO 36 -22.220 -3.334 -8.355 297 HB2 PRO 36 HB2 PRO 36 -22.221 -2.057 -5.959 298 HB3 PRO 36 HB3 PRO 36 -22.975 -3.636 -6.206 299 HG2 PRO 36 HG2 PRO 36 -20.301 -2.977 -5.033 300 HG3 PRO 36 HG3 PRO 36 -21.506 -4.155 -4.480 301 HD2 PRO 36 HD2 PRO 36 -19.317 -4.870 -5.904 302 HD3 PRO 36 HD3 PRO 36 -20.863 -5.731 -6.034 303 H SER 37 H SER 37 -21.916 -1.567 -9.543 304 HA SER 37 HA SER 37 -19.572 0.114 -9.037 305 HB2 SER 37 HB2 SER 37 -20.237 -0.882 -11.358 306 HB3 SER 37 HB3 SER 37 -21.399 0.444 -11.398 307 HG SER 37 HG SER 37 -19.110 0.726 -12.263 308 H CYS 38 H CYS 38 -22.931 0.701 -10.088 309 HA CYS 38 HA CYS 38 -23.085 2.897 -8.147 310 HB2 CYS 38 HB2 CYS 38 -22.530 3.728 -10.482 311 HB3 CYS 38 HB3 CYS 38 -24.119 3.155 -10.972 312 HG CYS 38 HG CYS 38 -23.628 5.491 -8.521 313 H THR 39 H THR 39 -25.102 3.269 -7.274 314 HA THR 39 HA THR 39 -26.922 1.068 -7.334 315 HB THR 39 HB THR 39 -26.562 2.342 -5.273 316 HG1 THR 39 HG1 THR 39 -28.523 1.391 -5.224 317 HG21 THR 39 HG21 THR 39 -27.560 4.594 -5.038 318 HG22 THR 39 HG22 THR 39 -27.892 4.602 -6.771 319 HG23 THR 39 HG23 THR 39 -26.227 4.559 -6.192 320 H GLN 40 H GLN 40 -29.187 1.184 -7.855 321 HA GLN 40 HA GLN 40 -30.903 1.563 -9.301 322 HB2 GLN 40 HB2 GLN 40 -29.854 4.369 -8.952 323 HB3 GLN 40 HB3 GLN 40 -31.297 4.007 -9.889 324 HG2 GLN 40 HG2 GLN 40 -32.497 3.334 -8.021 325 HG3 GLN 40 HG3 GLN 40 -31.042 3.073 -7.062 326 HE21 GLN 40 HE21 GLN 40 -31.523 4.378 -5.373 327 HE22 GLN 40 HE22 GLN 40 -31.705 6.091 -5.496 328 H TYR 41 H TYR 41 -28.502 0.646 -10.447 329 HA TYR 41 HA TYR 41 -27.676 2.082 -12.713 330 HB2 TYR 41 HB2 TYR 41 -26.656 0.030 -13.458 331 HB3 TYR 41 HB3 TYR 41 -26.467 0.138 -11.711 332 HD1 TYR 41 HD1 TYR 41 -27.893 -1.272 -10.230 333 HD2 TYR 41 HD2 TYR 41 -27.874 -1.751 -14.458 334 HE1 TYR 41 HE1 TYR 41 -28.922 -3.491 -9.977 335 HE2 TYR 41 HE2 TYR 41 -28.904 -3.971 -14.217 336 HH TYR 41 HH TYR 41 -28.861 -5.769 -11.836 337 H THR 42 H THR 42 -27.943 1.024 -14.991 338 HA THR 42 HA THR 42 -30.782 1.121 -15.581 339 HB THR 42 HB THR 42 -28.560 0.770 -17.588 340 HG1 THR 42 HG1 THR 42 -29.342 3.027 -16.120 341 HG21 THR 42 HG21 THR 42 -30.120 1.159 -19.160 342 HG22 THR 42 HG22 THR 42 -30.889 2.434 -18.213 343 HG23 THR 42 HG23 THR 42 -31.279 0.744 -17.897 344 H GLU 43 H GLU 43 -31.800 -0.763 -15.169 345 HA GLU 43 HA GLU 43 -30.778 -3.323 -15.260 346 HB2 GLU 43 HB2 GLU 43 -33.207 -4.009 -15.709 347 HB3 GLU 43 HB3 GLU 43 -32.881 -3.081 -14.252 348 HG2 GLU 43 HG2 GLU 43 -33.722 -1.084 -15.246 349 HG3 GLU 43 HG3 GLU 43 -33.847 -1.861 -16.823 350 HA PRO 44 HA PRO 44 -30.254 -4.462 -19.464 351 HB2 PRO 44 HB2 PRO 44 -30.994 -7.073 -19.424 352 HB3 PRO 44 HB3 PRO 44 -29.489 -6.491 -18.704 353 HG2 PRO 44 HG2 PRO 44 -32.098 -7.128 -17.383 354 HG3 PRO 44 HG3 PRO 44 -30.451 -7.519 -16.855 355 HD2 PRO 44 HD2 PRO 44 -31.858 -5.447 -15.824 356 HD3 PRO 44 HD3 PRO 44 -30.091 -5.411 -15.994 357 H LEU 45 H LEU 45 -31.415 -5.648 -21.316 358 HA LEU 45 HA LEU 45 -33.926 -4.404 -21.729 359 HB2 LEU 45 HB2 LEU 45 -32.170 -5.085 -23.456 360 HB3 LEU 45 HB3 LEU 45 -32.856 -6.704 -23.338 361 HG LEU 45 HG LEU 45 -35.039 -5.783 -24.068 362 HD11 LEU 45 HD11 LEU 45 -33.648 -3.294 -23.663 363 HD12 LEU 45 HD12 LEU 45 -35.366 -3.593 -23.927 364 HD13 LEU 45 HD13 LEU 45 -34.282 -3.402 -25.305 365 HD21 LEU 45 HD21 LEU 45 -33.205 -4.917 -26.206 366 HD22 LEU 45 HD22 LEU 45 -34.511 -6.102 -26.237 367 HD23 LEU 45 HD23 LEU 45 -32.937 -6.542 -25.573 368 H MET 46 H MET 46 -35.990 -5.273 -21.860 369 HA MET 46 HA MET 46 -36.686 -7.224 -19.989 370 HB2 MET 46 HB2 MET 46 -38.925 -7.166 -21.031 371 HB3 MET 46 HB3 MET 46 -38.278 -5.555 -20.744 372 HG2 MET 46 HG2 MET 46 -37.510 -5.614 -23.170 373 HG3 MET 46 HG3 MET 46 -38.561 -7.017 -23.343 374 HE1 MET 46 HE1 MET 46 -40.460 -6.798 -24.464 375 HE2 MET 46 HE2 MET 46 -41.574 -5.434 -24.569 376 HE3 MET 46 HE3 MET 46 -40.007 -5.357 -25.378 377 H ASN 47 H ASN 47 -36.793 -9.383 -20.040 378 HA ASN 47 HA ASN 47 -36.669 -10.736 -22.648 379 HB2 ASN 47 HB2 ASN 47 -34.464 -10.604 -21.193 380 HB3 ASN 47 HB3 ASN 47 -35.229 -11.924 -20.313 381 HD21 ASN 47 HD21 ASN 47 -34.425 -10.892 -23.602 382 HD22 ASN 47 HD22 ASN 47 -34.056 -12.473 -24.193 383 H TRP 48 H TRP 48 -38.209 -12.211 -22.904 384 HA TRP 48 HA TRP 48 -39.559 -13.246 -20.498 385 HB2 TRP 48 HB2 TRP 48 -40.824 -11.736 -22.201 386 HB3 TRP 48 HB3 TRP 48 -40.849 -13.181 -23.208 387 HD1 TRP 48 HD1 TRP 48 -41.687 -12.510 -19.464 388 HE1 TRP 48 HE1 TRP 48 -43.916 -13.686 -18.939 389 HE3 TRP 48 HE3 TRP 48 -42.651 -14.512 -24.068 390 HZ2 TRP 48 HZ2 TRP 48 -45.829 -15.256 -20.298 391 HZ3 TRP 48 HZ3 TRP 48 -44.701 -15.838 -24.372 392 HH2 TRP 48 HH2 TRP 48 -46.255 -16.201 -22.524 393 H THR 49 H THR 49 -37.996 -14.027 -23.490 394 HA THR 49 HA THR 49 -38.855 -16.604 -23.984 395 HB THR 49 HB THR 49 -35.933 -16.047 -24.235 396 HG1 THR 49 HG1 THR 49 -36.473 -14.759 -26.130 397 HG21 THR 49 HG21 THR 49 -38.015 -17.623 -25.589 398 HG22 THR 49 HG22 THR 49 -36.288 -17.935 -25.416 399 HG23 THR 49 HG23 THR 49 -36.865 -16.831 -26.665 400 H GLY 50 H GLY 50 -36.686 -15.438 -21.498 401 HA2 GLY 50 HA2 GLY 50 -37.006 -17.741 -19.901 402 HA3 GLY 50 HA3 GLY 50 -35.469 -17.842 -20.749 403 H SER 51 H SER 51 -34.536 -17.810 -18.589 404 HA SER 51 HA SER 51 -33.502 -16.803 -16.827 405 HB2 SER 51 HB2 SER 51 -32.284 -14.883 -17.331 406 HB3 SER 51 HB3 SER 51 -32.617 -15.535 -18.936 407 HG SER 51 HG SER 51 -33.614 -13.747 -19.349 408 H HIS 52 H HIS 52 -36.383 -16.839 -16.807 409 HA HIS 52 HA HIS 52 -37.260 -14.306 -15.736 410 HB2 HIS 52 HB2 HIS 52 -39.416 -15.378 -15.454 411 HB3 HIS 52 HB3 HIS 52 -38.775 -15.776 -17.046 412 HD1 HIS 52 HD1 HIS 52 -39.516 -17.299 -13.701 413 HD2 HIS 52 HD2 HIS 52 -38.246 -18.473 -17.478 414 HE1 HIS 52 HE1 HIS 52 -39.640 -19.811 -13.702 415 H ASP 53 H ASP 53 -36.133 -17.372 -14.518 416 HA ASP 53 HA ASP 53 -37.055 -17.336 -11.914 417 HB2 ASP 53 HB2 ASP 53 -34.440 -18.316 -13.060 418 HB3 ASP 53 HB3 ASP 53 -34.890 -18.565 -11.375 419 H THR 54 H THR 54 -34.176 -15.752 -13.249 420 HA THR 54 HA THR 54 -33.641 -14.468 -10.688 421 HB THR 54 HB THR 54 -32.106 -14.056 -13.251 422 HG1 THR 54 HG1 THR 54 -31.856 -16.103 -11.287 423 HG21 THR 54 HG21 THR 54 -31.836 -12.570 -11.153 424 HG22 THR 54 HG22 THR 54 -30.387 -13.230 -11.911 425 HG23 THR 54 HG23 THR 54 -31.036 -13.976 -10.451 426 H LYS 55 H LYS 55 -34.403 -12.528 -10.189 427 HA LYS 55 HA LYS 55 -34.607 -10.424 -12.136 428 HB2 LYS 55 HB2 LYS 55 -36.721 -11.730 -12.470 429 HB3 LYS 55 HB3 LYS 55 -37.152 -11.362 -10.805 430 HG2 LYS 55 HG2 LYS 55 -38.306 -9.836 -12.216 431 HG3 LYS 55 HG3 LYS 55 -37.033 -8.941 -11.382 432 HD2 LYS 55 HD2 LYS 55 -35.649 -8.963 -13.334 433 HD3 LYS 55 HD3 LYS 55 -36.747 -10.068 -14.165 434 HE2 LYS 55 HE2 LYS 55 -38.503 -8.316 -14.052 435 HE3 LYS 55 HE3 LYS 55 -37.312 -7.218 -13.355 436 HZ1 LYS 55 HZ1 LYS 55 -36.677 -8.537 -15.894 437 HZ2 LYS 55 HZ2 LYS 55 -36.207 -7.015 -15.323 438 HZ3 LYS 55 HZ3 LYS 55 -37.776 -7.250 -15.913 439 H GLN 56 H GLN 56 -34.323 -8.491 -11.188 440 HA GLN 56 HA GLN 56 -33.909 -6.942 -9.575 441 HB2 GLN 56 HB2 GLN 56 -36.438 -7.549 -9.243 442 HB3 GLN 56 HB3 GLN 56 -35.864 -8.296 -7.757 443 HG2 GLN 56 HG2 GLN 56 -36.546 -6.140 -7.155 444 HG3 GLN 56 HG3 GLN 56 -34.785 -6.077 -7.214 445 HE21 GLN 56 HE21 GLN 56 -34.174 -4.174 -7.938 446 HE22 GLN 56 HE22 GLN 56 -34.865 -3.320 -9.271 447 H GLN 57 H GLN 57 -32.331 -9.360 -9.593 448 HA GLN 57 HA GLN 57 -31.562 -9.452 -6.751 449 HB2 GLN 57 HB2 GLN 57 -31.722 -11.640 -8.792 450 HB3 GLN 57 HB3 GLN 57 -30.569 -11.760 -7.469 451 HG2 GLN 57 HG2 GLN 57 -32.506 -11.398 -5.902 452 HG3 GLN 57 HG3 GLN 57 -33.563 -11.602 -7.299 453 HE21 GLN 57 HE21 GLN 57 -34.523 -13.480 -6.738 454 HE22 GLN 57 HE22 GLN 57 -33.687 -14.980 -6.548 455 H VAL 58 H VAL 58 -29.553 -8.820 -6.299 456 HA VAL 58 HA VAL 58 -27.864 -7.659 -8.186 457 HB VAL 58 HB VAL 58 -26.108 -7.749 -6.419 458 HG11 VAL 58 HG11 VAL 58 -27.394 -6.390 -4.755 459 HG12 VAL 58 HG12 VAL 58 -27.584 -5.874 -6.432 460 HG13 VAL 58 HG13 VAL 58 -28.861 -6.802 -5.644 461 HG21 VAL 58 HG21 VAL 58 -26.791 -8.602 -4.185 462 HG22 VAL 58 HG22 VAL 58 -28.217 -9.317 -4.940 463 HG23 VAL 58 HG23 VAL 58 -26.606 -9.868 -5.400 464 H CYS 59 H CYS 59 -27.997 -10.941 -6.953 465 HA CYS 59 HA CYS 59 -25.541 -11.711 -8.272 466 HB2 CYS 59 HB2 CYS 59 -26.041 -13.960 -7.408 467 HB3 CYS 59 HB3 CYS 59 -26.129 -12.747 -6.136 468 HG CYS 59 HG CYS 59 -28.840 -12.736 -5.893 469 H LEU 60 H LEU 60 -25.338 -12.758 -10.178 470 HA LEU 60 HA LEU 60 -27.821 -13.334 -11.657 471 HB2 LEU 60 HB2 LEU 60 -26.833 -11.552 -12.784 472 HB3 LEU 60 HB3 LEU 60 -25.204 -12.175 -12.533 473 HG LEU 60 HG LEU 60 -25.633 -13.938 -14.185 474 HD11 LEU 60 HD11 LEU 60 -27.622 -14.018 -15.481 475 HD12 LEU 60 HD12 LEU 60 -28.234 -12.535 -14.750 476 HD13 LEU 60 HD13 LEU 60 -28.107 -14.005 -13.785 477 HD21 LEU 60 HD21 LEU 60 -25.998 -11.066 -14.958 478 HD22 LEU 60 HD22 LEU 60 -25.952 -12.340 -16.177 479 HD23 LEU 60 HD23 LEU 60 -24.569 -12.087 -15.113 480 H SER 61 H SER 61 -28.131 -15.370 -12.276 481 HA SER 61 HA SER 61 -25.952 -17.285 -11.922 482 HB2 SER 61 HB2 SER 61 -28.872 -17.844 -12.482 483 HB3 SER 61 HB3 SER 61 -27.655 -18.999 -11.935 484 HG SER 61 HG SER 61 -28.888 -16.903 -10.517 485 H PHE 62 H PHE 62 -25.826 -19.095 -13.529 486 HA PHE 62 HA PHE 62 -26.612 -18.391 -16.240 487 HB2 PHE 62 HB2 PHE 62 -23.773 -18.484 -15.276 488 HB3 PHE 62 HB3 PHE 62 -24.152 -18.936 -16.934 489 HD1 PHE 62 HD1 PHE 62 -25.449 -17.237 -18.345 490 HD2 PHE 62 HD2 PHE 62 -23.484 -16.258 -14.699 491 HE1 PHE 62 HE1 PHE 62 -25.434 -14.864 -18.995 492 HE2 PHE 62 HE2 PHE 62 -23.466 -13.882 -15.342 493 HZ PHE 62 HZ PHE 62 -24.442 -13.183 -17.492 494 H THR 63 H THR 63 -26.850 -20.139 -17.574 495 HA THR 63 HA THR 63 -27.160 -22.680 -16.382 496 HB THR 63 HB THR 63 -26.860 -22.613 -19.321 497 HG1 THR 63 HG1 THR 63 -28.934 -21.482 -19.460 498 HG21 THR 63 HG21 THR 63 -29.277 -23.571 -18.949 499 HG22 THR 63 HG22 THR 63 -28.725 -23.745 -17.283 500 HG23 THR 63 HG23 THR 63 -27.860 -24.555 -18.588 501 H THR 64 H THR 64 -24.716 -21.394 -18.618 502 HA THR 64 HA THR 64 -22.904 -23.534 -17.740 503 HB THR 64 HB THR 64 -22.006 -23.414 -20.196 504 HG1 THR 64 HG1 THR 64 -23.706 -23.021 -21.686 505 HG21 THR 64 HG21 THR 64 -22.923 -25.427 -19.157 506 HG22 THR 64 HG22 THR 64 -23.475 -25.279 -20.826 507 HG23 THR 64 HG23 THR 64 -24.560 -24.868 -19.498 508 H ARG 65 H ARG 65 -20.688 -23.014 -17.790 509 HA ARG 65 HA ARG 65 -19.982 -20.457 -17.029 510 HB2 ARG 65 HB2 ARG 65 -17.616 -21.182 -17.679 511 HB3 ARG 65 HB3 ARG 65 -18.465 -22.170 -16.498 512 HG2 ARG 65 HG2 ARG 65 -18.277 -23.969 -17.776 513 HG3 ARG 65 HG3 ARG 65 -18.982 -23.127 -19.158 514 HD2 ARG 65 HD2 ARG 65 -16.957 -22.600 -20.043 515 HD3 ARG 65 HD3 ARG 65 -16.186 -22.451 -18.465 516 HE ARG 65 HE ARG 65 -16.794 -25.142 -18.866 517 HH11 ARG 65 HH11 ARG 65 -14.736 -22.682 -20.221 518 HH12 ARG 65 HH12 ARG 65 -13.520 -23.802 -20.738 519 HH21 ARG 65 HH21 ARG 65 -15.199 -26.625 -19.541 520 HH22 ARG 65 HH22 ARG 65 -13.783 -26.045 -20.352 521 H GLU 66 H GLU 66 -19.999 -21.888 -20.249 522 HA GLU 66 HA GLU 66 -18.602 -19.966 -21.668 523 HB2 GLU 66 HB2 GLU 66 -20.974 -21.646 -22.476 524 HB3 GLU 66 HB3 GLU 66 -20.086 -20.636 -23.608 525 HG2 GLU 66 HG2 GLU 66 -18.922 -22.895 -21.996 526 HG3 GLU 66 HG3 GLU 66 -19.376 -22.972 -23.697 527 H LEU 67 H LEU 67 -21.853 -19.867 -20.395 528 HA LEU 67 HA LEU 67 -22.632 -17.526 -21.863 529 HB2 LEU 67 HB2 LEU 67 -24.021 -19.455 -20.618 530 HB3 LEU 67 HB3 LEU 67 -24.027 -18.227 -19.354 531 HG LEU 67 HG LEU 67 -25.090 -16.648 -20.897 532 HD11 LEU 67 HD11 LEU 67 -24.349 -17.254 -23.026 533 HD12 LEU 67 HD12 LEU 67 -26.056 -17.693 -23.023 534 HD13 LEU 67 HD13 LEU 67 -24.825 -18.938 -22.815 535 HD21 LEU 67 HD21 LEU 67 -26.269 -19.168 -20.009 536 HD22 LEU 67 HD22 LEU 67 -27.150 -18.398 -21.330 537 HD23 LEU 67 HD23 LEU 67 -26.855 -17.513 -19.832 538 H ALA 68 H ALA 68 -21.388 -18.213 -18.638 539 HA ALA 68 HA ALA 68 -21.722 -15.615 -17.576 540 HB1 ALA 68 HB1 ALA 68 -20.866 -16.491 -15.702 541 HB2 ALA 68 HB2 ALA 68 -20.959 -18.030 -16.559 542 HB3 ALA 68 HB3 ALA 68 -19.445 -17.125 -16.532 543 H ILE 69 H ILE 69 -18.672 -17.208 -18.534 544 HA ILE 69 HA ILE 69 -17.050 -14.978 -18.487 545 HB ILE 69 HB ILE 69 -16.871 -17.348 -20.351 546 HG12 ILE 69 HG12 ILE 69 -14.890 -17.491 -18.392 547 HG13 ILE 69 HG13 ILE 69 -16.323 -16.953 -17.523 548 HG21 ILE 69 HG21 ILE 69 -14.336 -16.564 -20.111 549 HG22 ILE 69 HG22 ILE 69 -15.397 -15.967 -21.385 550 HG23 ILE 69 HG23 ILE 69 -15.122 -14.994 -19.940 551 HD11 ILE 69 HD11 ILE 69 -15.697 -19.535 -18.036 552 HD12 ILE 69 HD12 ILE 69 -17.327 -18.941 -17.713 553 HD13 ILE 69 HD13 ILE 69 -16.785 -19.172 -19.375 554 H ALA 70 H ALA 70 -19.243 -16.061 -21.007 555 HA ALA 70 HA ALA 70 -18.367 -14.433 -23.105 556 HB1 ALA 70 HB1 ALA 70 -20.937 -14.587 -23.710 557 HB2 ALA 70 HB2 ALA 70 -19.867 -15.982 -23.844 558 HB3 ALA 70 HB3 ALA 70 -20.913 -15.807 -22.436 559 H TYR 71 H TYR 71 -20.404 -13.738 -20.340 560 HA TYR 71 HA TYR 71 -21.309 -11.199 -21.308 561 HB2 TYR 71 HB2 TYR 71 -22.521 -12.605 -19.611 562 HB3 TYR 71 HB3 TYR 71 -21.270 -12.177 -18.449 563 HD1 TYR 71 HD2 TYR 71 -22.896 -10.017 -21.005 564 HD2 TYR 71 HD1 TYR 71 -22.402 -10.880 -16.868 565 HE1 TYR 71 HE2 TYR 71 -24.132 -7.968 -20.436 566 HE2 TYR 71 HE1 TYR 71 -23.638 -8.834 -16.288 567 HH TYR 71 HH TYR 71 -25.565 -7.221 -18.287 568 H ALA 72 H ALA 72 -18.976 -12.182 -18.801 569 HA ALA 72 HA ALA 72 -18.078 -9.640 -18.101 570 HB1 ALA 72 HB1 ALA 72 -16.200 -11.966 -18.143 571 HB2 ALA 72 HB2 ALA 72 -16.374 -10.687 -16.941 572 HB3 ALA 72 HB3 ALA 72 -17.586 -11.964 -17.052 573 H VAL 73 H VAL 73 -16.698 -11.908 -20.479 574 HA VAL 73 HA VAL 73 -14.593 -10.294 -21.347 575 HB VAL 73 HB VAL 73 -16.160 -12.323 -22.947 576 HG11 VAL 73 HG11 VAL 73 -14.042 -12.483 -24.271 577 HG12 VAL 73 HG12 VAL 73 -14.914 -10.960 -24.459 578 HG13 VAL 73 HG13 VAL 73 -13.480 -11.036 -23.434 579 HG21 VAL 73 HG21 VAL 73 -13.508 -12.777 -21.623 580 HG22 VAL 73 HG22 VAL 73 -15.017 -13.005 -20.739 581 HG23 VAL 73 HG23 VAL 73 -14.688 -13.962 -22.183 582 H ALA 74 H ALA 74 -17.985 -10.284 -22.201 583 HA ALA 74 HA ALA 74 -17.985 -8.873 -24.571 584 HB1 ALA 74 HB1 ALA 74 -19.981 -8.345 -22.388 585 HB2 ALA 74 HB2 ALA 74 -20.227 -8.318 -24.135 586 HB3 ALA 74 HB3 ALA 74 -19.961 -9.852 -23.305 587 H HIS 75 H HIS 75 -17.349 -7.734 -21.336 588 HA HIS 75 HA HIS 75 -16.940 -5.023 -22.418 589 HB2 HIS 75 HB2 HIS 75 -17.991 -5.888 -19.728 590 HB3 HIS 75 HB3 HIS 75 -17.357 -4.269 -20.010 591 HD1 HIS 75 HD1 HIS 75 -19.025 -2.602 -20.761 592 HD2 HIS 75 HD2 HIS 75 -20.242 -6.489 -21.582 593 HE1 HIS 75 HE1 HIS 75 -21.349 -2.396 -21.700 594 H LYS 76 H LYS 76 -15.094 -7.345 -22.158 595 HA LYS 76 HA LYS 76 -12.968 -7.818 -21.490 596 HB2 LYS 76 HB2 LYS 76 -12.681 -4.832 -21.151 597 HB3 LYS 76 HB3 LYS 76 -11.419 -5.995 -21.540 598 HG2 LYS 76 HG2 LYS 76 -13.747 -5.339 -23.332 599 HG3 LYS 76 HG3 LYS 76 -12.138 -4.627 -23.467 600 HD2 LYS 76 HD2 LYS 76 -12.750 -7.577 -23.657 601 HD3 LYS 76 HD3 LYS 76 -12.493 -6.505 -25.036 602 HE2 LYS 76 HE2 LYS 76 -10.245 -5.950 -23.923 603 HE3 LYS 76 HE3 LYS 76 -10.529 -7.390 -22.946 604 HZ1 LYS 76 HZ1 LYS 76 -9.439 -7.278 -25.481 605 HZ2 LYS 76 HZ2 LYS 76 -10.977 -7.953 -25.683 606 HZ3 LYS 76 HZ3 LYS 76 -9.874 -8.666 -24.616 607 H ILE 77 H ILE 77 -14.983 -7.779 -19.422 608 HA ILE 77 HA ILE 77 -13.761 -6.606 -17.082 609 HB ILE 77 HB ILE 77 -16.128 -8.469 -17.297 610 HG12 ILE 77 HG12 ILE 77 -16.103 -5.479 -16.858 611 HG13 ILE 77 HG13 ILE 77 -16.346 -6.228 -18.432 612 HG21 ILE 77 HG21 ILE 77 -15.889 -8.675 -15.092 613 HG22 ILE 77 HG22 ILE 77 -14.658 -7.415 -15.032 614 HG23 ILE 77 HG23 ILE 77 -16.366 -6.980 -14.981 615 HD11 ILE 77 HD11 ILE 77 -18.356 -7.320 -17.613 616 HD12 ILE 77 HD12 ILE 77 -18.105 -6.605 -16.021 617 HD13 ILE 77 HD13 ILE 77 -18.452 -5.572 -17.407 618 H ASP 78 H ASP 78 -12.596 -7.620 -15.533 619 HA ASP 78 HA ASP 78 -11.348 -10.099 -16.176 620 HB2 ASP 78 HB2 ASP 78 -10.184 -8.304 -14.945 621 HB3 ASP 78 HB3 ASP 78 -11.284 -8.532 -13.588 622 H TYR 79 H TYR 79 -12.479 -11.934 -16.085 623 HA TYR 79 HA TYR 79 -14.366 -12.345 -13.879 624 HB2 TYR 79 HB2 TYR 79 -15.216 -14.232 -15.220 625 HB3 TYR 79 HB3 TYR 79 -15.259 -12.720 -16.120 626 HD1 TYR 79 HD1 TYR 79 -13.506 -15.944 -15.759 627 HD2 TYR 79 HD2 TYR 79 -13.970 -12.428 -18.108 628 HE1 TYR 79 HE1 TYR 79 -12.230 -16.999 -17.578 629 HE2 TYR 79 HE2 TYR 79 -12.696 -13.473 -19.934 630 HH TYR 79 HH TYR 79 -11.384 -15.211 -20.505 631 H THR 80 H THR 80 -14.129 -13.939 -12.392 632 HA THR 80 HA THR 80 -11.646 -15.522 -12.536 633 HB THR 80 HB THR 80 -11.430 -14.042 -10.693 634 HG1 THR 80 HG1 THR 80 -10.778 -15.698 -9.563 635 HG21 THR 80 HG21 THR 80 -13.719 -13.301 -10.461 636 HG22 THR 80 HG22 THR 80 -13.148 -13.901 -8.905 637 HG23 THR 80 HG23 THR 80 -14.214 -14.896 -9.895 638 H VAL 81 H VAL 81 -11.780 -17.683 -12.408 639 HA VAL 81 HA VAL 81 -14.446 -18.862 -12.119 640 HB VAL 81 HB VAL 81 -13.354 -20.934 -13.016 641 HG11 VAL 81 HG11 VAL 81 -14.591 -19.607 -14.539 642 HG12 VAL 81 HG12 VAL 81 -13.309 -18.399 -14.636 643 HG13 VAL 81 HG13 VAL 81 -13.070 -19.998 -15.341 644 HG21 VAL 81 HG21 VAL 81 -11.145 -21.088 -13.174 645 HG22 VAL 81 HG22 VAL 81 -11.093 -19.670 -14.223 646 HG23 VAL 81 HG23 VAL 81 -11.000 -19.476 -12.473 647 H LEU 82 H LEU 82 -15.007 -19.726 -10.242 648 HA LEU 82 HA LEU 82 -12.888 -20.655 -8.423 649 HB2 LEU 82 HB2 LEU 82 -15.687 -19.690 -7.869 650 HB3 LEU 82 HB3 LEU 82 -14.637 -20.409 -6.650 651 HG LEU 82 HG LEU 82 -13.983 -17.886 -8.168 652 HD11 LEU 82 HD11 LEU 82 -15.898 -17.377 -6.873 653 HD12 LEU 82 HD12 LEU 82 -14.508 -16.789 -5.962 654 HD13 LEU 82 HD13 LEU 82 -15.296 -18.295 -5.492 655 HD21 LEU 82 HD21 LEU 82 -11.969 -18.738 -7.399 656 HD22 LEU 82 HD22 LEU 82 -12.692 -19.412 -5.940 657 HD23 LEU 82 HD23 LEU 82 -12.462 -17.670 -6.085 658 H GLN 83 H GLN 83 -12.704 -22.767 -8.116 659 HA GLN 83 HA GLN 83 -15.067 -24.467 -8.565 660 HB2 GLN 83 HB2 GLN 83 -13.610 -26.198 -9.463 661 HB3 GLN 83 HB3 GLN 83 -13.439 -24.715 -10.392 662 HG2 GLN 83 HG2 GLN 83 -11.425 -24.247 -8.856 663 HG3 GLN 83 HG3 GLN 83 -11.520 -25.966 -8.473 664 HE21 GLN 83 HE21 GLN 83 -9.473 -24.375 -9.894 665 HE22 GLN 83 HE22 GLN 83 -9.266 -25.158 -11.421 666 H ASP 84 H ASP 84 -15.537 -25.943 -7.032 667 HA ASP 84 HA ASP 84 -14.357 -25.728 -4.477 668 HB2 ASP 84 HB2 ASP 84 -16.734 -26.491 -5.090 669 HB3 ASP 84 HB3 ASP 84 -16.017 -28.074 -5.378 670 H ASN 85 H ASN 85 -12.635 -26.690 -3.623 671 HA ASN 85 HA ASN 85 -10.807 -28.021 -3.378 672 HB2 ASN 85 HB2 ASN 85 -12.712 -29.717 -3.175 673 HB3 ASN 85 HB3 ASN 85 -12.342 -30.168 -4.837 674 HD21 ASN 85 HD21 ASN 85 -10.646 -29.591 -1.772 675 HD22 ASN 85 HD22 ASN 85 -9.589 -30.952 -1.907 676 HA PRO 86 HA PRO 86 -9.573 -27.187 -7.782 677 HB2 PRO 86 HB2 PRO 86 -7.533 -25.515 -7.140 678 HB3 PRO 86 HB3 PRO 86 -9.201 -24.964 -7.341 679 HG2 PRO 86 HG2 PRO 86 -7.697 -25.578 -4.826 680 HG3 PRO 86 HG3 PRO 86 -8.785 -24.223 -5.176 681 HD2 PRO 86 HD2 PRO 86 -9.571 -26.393 -3.760 682 HD3 PRO 86 HD3 PRO 86 -10.679 -25.484 -4.808 683 H ARG 87 H ARG 87 -7.777 -28.005 -8.866 684 HA ARG 87 HA ARG 87 -5.530 -29.058 -7.375 685 HB2 ARG 87 HB2 ARG 87 -7.160 -30.872 -7.172 686 HB3 ARG 87 HB3 ARG 87 -7.371 -30.894 -8.917 687 HG2 ARG 87 HG2 ARG 87 -5.164 -31.704 -9.256 688 HG3 ARG 87 HG3 ARG 87 -4.742 -31.436 -7.564 689 HD2 ARG 87 HD2 ARG 87 -6.163 -33.190 -6.840 690 HD3 ARG 87 HD3 ARG 87 -6.927 -33.316 -8.425 691 HE ARG 87 HE ARG 87 -4.327 -33.868 -8.939 692 HH11 ARG 87 HH11 ARG 87 -6.643 -35.119 -6.661 693 HH12 ARG 87 HH12 ARG 87 -5.943 -36.704 -6.619 694 HH21 ARG 87 HH21 ARG 87 -3.396 -35.949 -8.893 695 HH22 ARG 87 HH22 ARG 87 -4.095 -37.174 -7.890 696 H THR 88 H THR 88 -3.709 -29.072 -8.570 697 HA THR 88 HA THR 88 -3.681 -27.823 -11.102 698 HB THR 88 HB THR 88 -1.492 -29.417 -9.754 699 HG1 THR 88 HG1 THR 88 -2.302 -26.707 -9.638 700 HG21 THR 88 HG21 THR 88 -0.091 -27.783 -11.223 701 HG22 THR 88 HG22 THR 88 -1.557 -27.692 -12.200 702 HG23 THR 88 HG23 THR 88 -0.760 -29.245 -11.947 703 H ILE 89 H ILE 89 -4.060 -28.646 -13.046 704 HA ILE 89 HA ILE 89 -4.432 -31.475 -13.404 705 HB ILE 89 HB ILE 89 -4.449 -29.335 -15.531 706 HG12 ILE 89 HG12 ILE 89 -6.747 -30.380 -13.861 707 HG13 ILE 89 HG13 ILE 89 -6.020 -28.783 -13.712 708 HG21 ILE 89 HG21 ILE 89 -4.759 -32.170 -15.590 709 HG22 ILE 89 HG22 ILE 89 -6.289 -31.415 -16.036 710 HG23 ILE 89 HG23 ILE 89 -4.819 -31.020 -16.926 711 HD11 ILE 89 HD11 ILE 89 -7.720 -28.190 -15.046 712 HD12 ILE 89 HD12 ILE 89 -6.660 -28.779 -16.326 713 HD13 ILE 89 HD13 ILE 89 -7.931 -29.820 -15.685 714 H VAL 90 H VAL 90 -3.181 -32.896 -14.539 715 HA VAL 90 HA VAL 90 -0.539 -31.906 -15.398 716 HB VAL 90 HB VAL 90 0.229 -34.285 -14.990 717 HG11 VAL 90 HG11 VAL 90 0.736 -32.401 -13.484 718 HG12 VAL 90 HG12 VAL 90 -0.737 -32.753 -12.578 719 HG13 VAL 90 HG13 VAL 90 0.576 -33.930 -12.620 720 HG21 VAL 90 HG21 VAL 90 -1.073 -35.829 -13.921 721 HG22 VAL 90 HG22 VAL 90 -2.057 -34.607 -13.116 722 HG23 VAL 90 HG23 VAL 90 -2.321 -34.968 -14.822 723 HA PRO 91 HA PRO 91 -2.755 -33.604 -19.126 724 HB2 PRO 91 HB2 PRO 91 -2.124 -31.521 -20.750 725 HB3 PRO 91 HB3 PRO 91 -3.554 -31.531 -19.711 726 HG2 PRO 91 HG2 PRO 91 -0.895 -30.233 -19.261 727 HG3 PRO 91 HG3 PRO 91 -2.519 -29.589 -18.957 728 HD2 PRO 91 HD2 PRO 91 -0.962 -30.602 -16.987 729 HD3 PRO 91 HD3 PRO 91 -2.734 -30.724 -16.963 730 H LYS 92 H LYS 92 -1.187 -35.243 -19.287 731 HA LYS 92 HA LYS 92 1.512 -34.972 -19.809 732 HB2 LYS 92 HB2 LYS 92 0.543 -37.120 -19.270 733 HB3 LYS 92 HB3 LYS 92 -0.410 -37.108 -20.748 734 HG2 LYS 92 HG2 LYS 92 1.677 -37.186 -22.058 735 HG3 LYS 92 HG3 LYS 92 2.589 -37.291 -20.552 736 HD2 LYS 92 HD2 LYS 92 1.258 -39.351 -20.007 737 HD3 LYS 92 HD3 LYS 92 0.609 -39.281 -21.647 738 HE2 LYS 92 HE2 LYS 92 2.849 -39.479 -22.565 739 HE3 LYS 92 HE3 LYS 92 3.536 -39.467 -20.941 740 HZ1 LYS 92 HZ1 LYS 92 1.527 -41.500 -21.590 741 HZ2 LYS 92 HZ2 LYS 92 2.842 -41.585 -20.530 742 HZ3 LYS 92 HZ3 LYS 92 3.093 -41.699 -22.200 743 H SER 93 H SER 93 2.440 -33.810 -21.357 744 HA SER 93 HA SER 93 1.872 -34.345 -24.122 745 HB2 SER 93 HB2 SER 93 1.231 -31.629 -22.953 746 HB3 SER 93 HB3 SER 93 1.417 -31.934 -24.680 747 HG SER 93 HG SER 93 -0.736 -32.295 -23.175 748 H TYR 94 H TYR 94 3.330 -33.071 -25.571 749 HA TYR 94 HA TYR 94 5.610 -31.787 -24.366 750 HB2 TYR 94 HB2 TYR 94 5.740 -34.594 -25.368 751 HB3 TYR 94 HB3 TYR 94 7.109 -33.535 -25.687 752 HD1 TYR 94 HD1 TYR 94 7.785 -32.095 -23.475 753 HD2 TYR 94 HD2 TYR 94 5.925 -35.921 -23.500 754 HE1 TYR 94 HE1 TYR 94 8.650 -32.523 -21.213 755 HE2 TYR 94 HE2 TYR 94 6.782 -36.360 -21.238 756 HH TYR 94 HH TYR 94 8.871 -34.019 -19.579 757 H ALA 95 H ALA 95 5.907 -30.109 -25.661 758 HA ALA 95 HA ALA 95 5.193 -30.275 -28.477 759 HB1 ALA 95 HB1 ALA 95 5.686 -27.819 -28.454 760 HB2 ALA 95 HB2 ALA 95 4.407 -28.329 -27.350 761 HB3 ALA 95 HB3 ALA 95 6.016 -27.966 -26.727 762 H ASP 96 H ASP 96 6.804 -28.739 -29.843 763 HA ASP 96 HA ASP 96 9.584 -29.378 -29.271 764 HB2 ASP 96 HB2 ASP 96 8.010 -30.549 -31.526 765 HB3 ASP 96 HB3 ASP 96 9.703 -30.146 -31.794 766 H ASN 97 H ASN 97 10.973 -28.499 -31.212 767 HA ASN 97 HA ASN 97 9.823 -26.155 -32.473 768 HB2 ASN 97 HB2 ASN 97 11.664 -24.686 -31.544 769 HB3 ASN 97 HB3 ASN 97 10.411 -25.146 -30.395 770 HD21 ASN 97 HD21 ASN 97 10.881 -26.830 -28.883 771 HD22 ASN 97 HD22 ASN 97 12.513 -27.124 -28.394 772 H PHE 98 H PHE 98 10.411 -26.592 -34.504 773 HA PHE 98 HA PHE 98 13.123 -27.573 -35.029 774 HB2 PHE 98 HB2 PHE 98 10.546 -27.659 -36.553 775 HB3 PHE 98 HB3 PHE 98 12.070 -27.790 -37.425 776 HD1 PHE 98 HD2 PHE 98 13.692 -29.619 -36.707 777 HD2 PHE 98 HD1 PHE 98 9.607 -29.516 -35.517 778 HE1 PHE 98 HE2 PHE 98 13.789 -32.020 -36.177 779 HE2 PHE 98 HE1 PHE 98 9.697 -31.916 -34.984 780 HZ PHE 98 HZ PHE 98 11.790 -33.171 -35.316 781 H THR 99 H THR 99 14.629 -26.189 -35.653 782 HA THR 99 HA THR 99 13.990 -23.478 -36.328 783 HB THR 99 HB THR 99 16.345 -23.079 -36.426 784 HG1 THR 99 HG1 THR 99 17.718 -25.103 -36.165 785 HG21 THR 99 HG21 THR 99 15.109 -24.034 -34.202 786 HG22 THR 99 HG22 THR 99 16.752 -23.394 -34.230 787 HG23 THR 99 HG23 THR 99 16.481 -25.134 -34.327 788 H LYS 100 H LYS 100 15.151 -22.462 -38.272 789 HA LYS 100 HA LYS 100 15.542 -24.063 -40.600 790 HB2 LYS 100 HB2 LYS 100 13.070 -24.108 -40.457 791 HB3 LYS 100 HB3 LYS 100 13.050 -22.351 -40.514 792 HG2 LYS 100 HG2 LYS 100 13.594 -22.276 -42.737 793 HG3 LYS 100 HG3 LYS 100 14.409 -23.841 -42.702 794 HD2 LYS 100 HD2 LYS 100 12.448 -24.280 -43.880 795 HD3 LYS 100 HD3 LYS 100 12.064 -24.807 -42.240 796 HE2 LYS 100 HE2 LYS 100 11.453 -22.004 -43.071 797 HE3 LYS 100 HE3 LYS 100 10.388 -23.312 -43.583 798 HZ1 LYS 100 HZ1 LYS 100 10.788 -23.762 -40.919 799 HZ2 LYS 100 HZ2 LYS 100 9.407 -23.081 -41.619 800 HZ3 LYS 100 HZ3 LYS 100 10.633 -22.080 -41.021 801 HA PRO 101 HA PRO 101 17.506 -19.846 -40.496 802 HB2 PRO 101 HB2 PRO 101 20.026 -20.746 -40.954 803 HB3 PRO 101 HB3 PRO 101 19.327 -20.626 -39.335 804 HG2 PRO 101 HG2 PRO 101 19.598 -23.022 -41.109 805 HG3 PRO 101 HG3 PRO 101 19.895 -22.882 -39.366 806 HD2 PRO 101 HD2 PRO 101 17.616 -23.942 -40.375 807 HD3 PRO 101 HD3 PRO 101 17.655 -23.043 -38.844 808 H ARG 102 H ARG 102 17.548 -18.685 -42.315 809 HA ARG 102 HA ARG 102 18.189 -20.056 -44.842 810 HB2 ARG 102 HB2 ARG 102 16.588 -18.393 -45.906 811 HB3 ARG 102 HB3 ARG 102 15.859 -19.670 -44.941 812 HG2 ARG 102 HG2 ARG 102 16.477 -17.087 -43.610 813 HG3 ARG 102 HG3 ARG 102 15.105 -17.157 -44.717 814 HD2 ARG 102 HD2 ARG 102 14.577 -19.350 -43.324 815 HD3 ARG 102 HD3 ARG 102 15.512 -18.497 -42.096 816 HE ARG 102 HE ARG 102 12.860 -17.890 -42.967 817 HH11 ARG 102 HH11 ARG 102 15.793 -16.506 -41.699 818 HH12 ARG 102 HH12 ARG 102 14.994 -15.151 -40.973 819 HH21 ARG 102 HH21 ARG 102 11.797 -16.110 -42.016 820 HH22 ARG 102 HH22 ARG 102 12.721 -14.927 -41.154 821 H ASP 103 H ASP 103 18.501 -18.199 -46.610 822 HA ASP 103 HA ASP 103 20.748 -16.640 -45.631 823 HB2 ASP 103 HB2 ASP 103 21.268 -16.245 -47.961 824 HB3 ASP 103 HB3 ASP 103 20.911 -17.956 -47.737 825 H MET 104 H MET 104 20.987 -14.381 -46.016 826 HA MET 104 HA MET 104 18.638 -12.860 -46.785 827 HB2 MET 104 HB2 MET 104 18.624 -13.415 -44.233 828 HB3 MET 104 HB3 MET 104 19.874 -12.180 -44.140 829 HG2 MET 104 HG2 MET 104 17.287 -11.597 -45.511 830 HG3 MET 104 HG3 MET 104 17.399 -11.539 -43.754 831 HE1 MET 104 HE1 MET 104 19.711 -9.649 -42.651 832 HE2 MET 104 HE2 MET 104 18.619 -8.290 -42.924 833 HE3 MET 104 HE3 MET 104 17.968 -9.873 -42.495 Start of MODEL 14 1 H1 MET 1 H MET 1 3.979 7.830 -9.216 2 HA MET 1 HA MET 1 2.100 8.912 -11.158 3 HB2 MET 1 HB2 MET 1 4.617 8.962 -11.468 4 HB3 MET 1 HB3 MET 1 4.537 7.221 -11.711 5 HG2 MET 1 HG2 MET 1 3.408 7.421 -13.720 6 HG3 MET 1 HG3 MET 1 2.844 9.050 -13.354 7 HE1 MET 1 HE1 MET 1 5.401 8.495 -16.479 8 HE2 MET 1 HE2 MET 1 5.893 7.183 -15.408 9 HE3 MET 1 HE3 MET 1 4.181 7.470 -15.724 10 H GLN 2 H GLN 2 0.342 7.534 -10.337 11 HA GLN 2 HA GLN 2 0.455 4.859 -11.565 12 HB2 GLN 2 HB2 GLN 2 -0.921 5.631 -8.987 13 HB3 GLN 2 HB3 GLN 2 -1.061 4.063 -9.772 14 HG2 GLN 2 HG2 GLN 2 1.566 5.211 -8.881 15 HG3 GLN 2 HG3 GLN 2 0.552 4.207 -7.846 16 HE21 GLN 2 HE21 GLN 2 0.108 2.039 -8.533 17 HE22 GLN 2 HE22 GLN 2 1.236 1.203 -9.540 18 H GLU 3 H GLU 3 -1.607 4.018 -12.291 19 HA GLU 3 HA GLU 3 -3.543 6.150 -12.918 20 HB2 GLU 3 HB2 GLU 3 -2.464 3.931 -14.635 21 HB3 GLU 3 HB3 GLU 3 -4.021 4.669 -14.985 22 HG2 GLU 3 HG2 GLU 3 -2.268 5.675 -16.318 23 HG3 GLU 3 HG3 GLU 3 -2.950 6.849 -15.193 24 H GLN 4 H GLN 4 -5.758 5.440 -13.240 25 HA GLN 4 HA GLN 4 -6.549 2.811 -12.412 26 HB2 GLN 4 HB2 GLN 4 -5.999 4.206 -10.279 27 HB3 GLN 4 HB3 GLN 4 -7.527 5.008 -10.620 28 HG2 GLN 4 HG2 GLN 4 -8.054 3.324 -9.094 29 HG3 GLN 4 HG3 GLN 4 -8.560 2.692 -10.660 30 HE21 GLN 4 HE21 GLN 4 -5.660 2.766 -8.611 31 HE22 GLN 4 HE22 GLN 4 -5.233 1.112 -8.862 32 H VAL 5 H VAL 5 -8.548 2.314 -13.151 33 HA VAL 5 HA VAL 5 -10.253 4.517 -14.100 34 HB VAL 5 HB VAL 5 -9.833 1.944 -15.622 35 HG11 VAL 5 HG11 VAL 5 -11.262 4.507 -16.314 36 HG12 VAL 5 HG12 VAL 5 -10.998 3.163 -17.426 37 HG13 VAL 5 HG13 VAL 5 -12.003 2.941 -15.993 38 HG21 VAL 5 HG21 VAL 5 -8.884 4.111 -17.124 39 HG22 VAL 5 HG22 VAL 5 -8.192 4.302 -15.513 40 HG23 VAL 5 HG23 VAL 5 -7.939 2.805 -16.410 41 H SER 6 H SER 6 -12.435 4.237 -13.862 42 HA SER 6 HA SER 6 -13.325 2.425 -11.887 43 HB2 SER 6 HB2 SER 6 -14.381 4.630 -12.309 44 HB3 SER 6 HB3 SER 6 -14.989 4.023 -13.849 45 HG SER 6 HG SER 6 -15.899 3.576 -11.297 46 H ASN 7 H ASN 7 -13.196 0.295 -12.319 47 HA ASN 7 HA ASN 7 -14.783 -0.701 -14.580 48 HB2 ASN 7 HB2 ASN 7 -12.011 -1.630 -13.807 49 HB3 ASN 7 HB3 ASN 7 -13.062 -2.488 -14.929 50 HD21 ASN 7 HD21 ASN 7 -14.054 -0.807 -16.595 51 HD22 ASN 7 HD22 ASN 7 -12.859 0.147 -17.400 52 H VAL 8 H VAL 8 -15.514 -2.918 -14.319 53 HA VAL 8 HA VAL 8 -15.826 -3.625 -11.477 54 HB VAL 8 HB VAL 8 -17.868 -4.845 -12.170 55 HG11 VAL 8 HG11 VAL 8 -18.140 -2.040 -13.170 56 HG12 VAL 8 HG12 VAL 8 -19.233 -2.977 -12.150 57 HG13 VAL 8 HG13 VAL 8 -17.726 -2.346 -11.484 58 HG21 VAL 8 HG21 VAL 8 -17.869 -3.443 -14.788 59 HG22 VAL 8 HG22 VAL 8 -16.904 -4.911 -14.636 60 HG23 VAL 8 HG23 VAL 8 -18.638 -4.958 -14.317 61 H ARG 9 H ARG 9 -16.307 -6.044 -11.179 62 HA ARG 9 HA ARG 9 -14.608 -7.661 -12.953 63 HB2 ARG 9 HB2 ARG 9 -14.436 -7.336 -9.985 64 HB3 ARG 9 HB3 ARG 9 -14.033 -8.894 -10.696 65 HG2 ARG 9 HG2 ARG 9 -11.974 -7.935 -10.684 66 HG3 ARG 9 HG3 ARG 9 -12.535 -7.397 -12.268 67 HD2 ARG 9 HD2 ARG 9 -13.342 -5.295 -11.160 68 HD3 ARG 9 HD3 ARG 9 -12.525 -5.833 -9.693 69 HE ARG 9 HE ARG 9 -11.316 -4.670 -12.003 70 HH11 ARG 9 HH11 ARG 9 -10.799 -6.901 -9.381 71 HH12 ARG 9 HH12 ARG 9 -9.077 -6.709 -9.384 72 HH21 ARG 9 HH21 ARG 9 -9.049 -4.409 -12.017 73 HH22 ARG 9 HH22 ARG 9 -8.083 -5.290 -10.884 74 H ALA 10 H ALA 10 -15.155 -9.860 -13.110 75 HA ALA 10 HA ALA 10 -17.906 -10.453 -12.256 76 HB1 ALA 10 HB1 ALA 10 -16.376 -11.000 -14.685 77 HB2 ALA 10 HB2 ALA 10 -17.277 -12.389 -14.079 78 HB3 ALA 10 HB3 ALA 10 -18.119 -10.882 -14.442 79 H ARG 11 H ARG 11 -18.295 -12.025 -10.832 80 HA ARG 11 HA ARG 11 -16.046 -13.750 -10.042 81 HB2 ARG 11 HB2 ARG 11 -18.295 -12.498 -8.548 82 HB3 ARG 11 HB3 ARG 11 -17.737 -14.073 -8.003 83 HG2 ARG 11 HG2 ARG 11 -16.430 -12.708 -6.730 84 HG3 ARG 11 HG3 ARG 11 -15.379 -12.930 -8.130 85 HD2 ARG 11 HD2 ARG 11 -16.272 -10.818 -9.072 86 HD3 ARG 11 HD3 ARG 11 -17.203 -10.589 -7.593 87 HE ARG 11 HE ARG 11 -14.507 -10.951 -6.916 88 HH11 ARG 11 HH11 ARG 11 -16.576 -8.635 -8.489 89 HH12 ARG 11 HH12 ARG 11 -15.594 -7.272 -8.063 90 HH21 ARG 11 HH21 ARG 11 -13.205 -9.166 -6.349 91 HH22 ARG 11 HH22 ARG 11 -13.677 -7.575 -6.846 92 H ILE 12 H ILE 12 -16.199 -15.604 -11.158 93 HA ILE 12 HA ILE 12 -18.824 -16.843 -11.533 94 HB ILE 12 HB ILE 12 -16.145 -17.581 -12.717 95 HG12 ILE 12 HG12 ILE 12 -18.490 -16.502 -14.246 96 HG13 ILE 12 HG13 ILE 12 -17.411 -15.397 -13.402 97 HG21 ILE 12 HG21 ILE 12 -18.685 -18.982 -12.600 98 HG22 ILE 12 HG22 ILE 12 -18.136 -18.719 -14.255 99 HG23 ILE 12 HG23 ILE 12 -17.096 -19.560 -13.105 100 HD11 ILE 12 HD11 ILE 12 -15.540 -16.161 -14.696 101 HD12 ILE 12 HD12 ILE 12 -16.532 -17.404 -15.462 102 HD13 ILE 12 HD13 ILE 12 -16.851 -15.698 -15.782 103 H TYR 13 H TYR 13 -19.488 -18.397 -10.219 104 HA TYR 13 HA TYR 13 -17.463 -19.956 -8.748 105 HB2 TYR 13 HB2 TYR 13 -20.257 -19.251 -7.828 106 HB3 TYR 13 HB3 TYR 13 -19.059 -20.156 -6.912 107 HD1 TYR 13 HD1 TYR 13 -16.694 -18.815 -6.770 108 HD2 TYR 13 HD2 TYR 13 -20.543 -17.056 -7.206 109 HE1 TYR 13 HE1 TYR 13 -15.837 -16.718 -5.813 110 HE2 TYR 13 HE2 TYR 13 -19.697 -14.953 -6.251 111 HH TYR 13 HH TYR 13 -17.950 -13.889 -5.401 112 H LYS 14 H LYS 14 -17.626 -22.142 -8.741 113 HA LYS 14 HA LYS 14 -19.771 -23.304 -10.386 114 HB2 LYS 14 HB2 LYS 14 -17.268 -23.522 -11.023 115 HB3 LYS 14 HB3 LYS 14 -17.195 -24.698 -9.717 116 HG2 LYS 14 HG2 LYS 14 -19.181 -24.907 -11.958 117 HG3 LYS 14 HG3 LYS 14 -17.560 -25.600 -12.053 118 HD2 LYS 14 HD2 LYS 14 -18.159 -26.724 -9.805 119 HD3 LYS 14 HD3 LYS 14 -19.827 -26.335 -10.232 120 HE2 LYS 14 HE2 LYS 14 -19.793 -27.716 -12.109 121 HE3 LYS 14 HE3 LYS 14 -18.032 -27.751 -12.169 122 HZ1 LYS 14 HZ1 LYS 14 -17.924 -29.255 -10.428 123 HZ2 LYS 14 HZ2 LYS 14 -19.264 -29.803 -11.302 124 HZ3 LYS 14 HZ3 LYS 14 -19.488 -28.913 -9.880 125 HA PRO 15 HA PRO 15 -20.846 -24.789 -6.196 126 HB2 PRO 15 HB2 PRO 15 -23.497 -25.010 -6.734 127 HB3 PRO 15 HB3 PRO 15 -22.738 -23.486 -6.256 128 HG2 PRO 15 HG2 PRO 15 -23.478 -24.458 -8.989 129 HG3 PRO 15 HG3 PRO 15 -23.691 -22.847 -8.278 130 HD2 PRO 15 HD2 PRO 15 -21.666 -23.434 -9.977 131 HD3 PRO 15 HD3 PRO 15 -21.499 -22.249 -8.665 132 H ALA 16 H ALA 16 -21.527 -26.836 -5.478 133 HA ALA 16 HA ALA 16 -21.630 -28.888 -7.591 134 HB1 ALA 16 HB1 ALA 16 -20.627 -30.432 -6.033 135 HB2 ALA 16 HB2 ALA 16 -19.635 -28.976 -6.134 136 HB3 ALA 16 HB3 ALA 16 -20.692 -29.228 -4.745 137 H LYS 17 H LYS 17 -22.979 -30.737 -7.233 138 HA LYS 17 HA LYS 17 -25.569 -30.120 -6.374 139 HB2 LYS 17 HB2 LYS 17 -25.944 -32.614 -6.527 140 HB3 LYS 17 HB3 LYS 17 -25.298 -31.855 -7.975 141 HG2 LYS 17 HG2 LYS 17 -23.181 -32.775 -7.660 142 HG3 LYS 17 HG3 LYS 17 -23.493 -33.139 -5.961 143 HD2 LYS 17 HD2 LYS 17 -23.658 -35.222 -6.977 144 HD3 LYS 17 HD3 LYS 17 -25.341 -34.700 -6.877 145 HE2 LYS 17 HE2 LYS 17 -23.789 -34.011 -9.319 146 HE3 LYS 17 HE3 LYS 17 -24.316 -35.681 -9.109 147 HZ1 LYS 17 HZ1 LYS 17 -26.308 -35.082 -9.824 148 HZ2 LYS 17 HZ2 LYS 17 -25.819 -33.469 -9.966 149 HZ3 LYS 17 HZ3 LYS 17 -26.480 -34.027 -8.511 150 H SER 18 H SER 18 -26.762 -30.701 -4.563 151 HA SER 18 HA SER 18 -25.175 -31.567 -2.235 152 HB2 SER 18 HB2 SER 18 -25.713 -29.317 -1.793 153 HB3 SER 18 HB3 SER 18 -27.336 -29.481 -2.463 154 HG SER 18 HG SER 18 -27.364 -29.456 -0.182 155 H THR 19 H THR 19 -26.248 -32.841 -0.652 156 HA THR 19 HA THR 19 -27.780 -34.932 -1.625 157 HB THR 19 HB THR 19 -28.276 -35.500 0.728 158 HG1 THR 19 HG1 THR 19 -26.873 -33.129 1.428 159 HG21 THR 19 HG21 THR 19 -25.434 -34.554 0.338 160 HG22 THR 19 HG22 THR 19 -26.089 -36.071 -0.278 161 HG23 THR 19 HG23 THR 19 -25.984 -35.798 1.461 162 H MET 20 H MET 20 -28.842 -31.998 0.061 163 HA MET 20 HA MET 20 -31.632 -32.737 -0.475 164 HB2 MET 20 HB2 MET 20 -30.754 -32.025 1.860 165 HB3 MET 20 HB3 MET 20 -30.776 -30.395 1.200 166 HG2 MET 20 HG2 MET 20 -33.123 -30.484 0.846 167 HG3 MET 20 HG3 MET 20 -33.172 -32.208 1.208 168 HE1 MET 20 HE1 MET 20 -35.074 -31.861 3.842 169 HE2 MET 20 HE2 MET 20 -34.134 -32.955 2.826 170 HE3 MET 20 HE3 MET 20 -33.701 -32.735 4.522 171 H GLN 21 H GLN 21 -32.185 -32.078 -2.467 172 HA GLN 21 HA GLN 21 -31.175 -29.605 -3.572 173 HB2 GLN 21 HB2 GLN 21 -32.830 -31.876 -4.572 174 HB3 GLN 21 HB3 GLN 21 -32.946 -30.333 -5.408 175 HG2 GLN 21 HG2 GLN 21 -31.283 -31.299 -6.612 176 HG3 GLN 21 HG3 GLN 21 -30.320 -30.498 -5.370 177 HE21 GLN 21 HE21 GLN 21 -29.088 -32.451 -6.603 178 HE22 GLN 21 HE22 GLN 21 -29.000 -33.883 -5.641 179 H SER 22 H SER 22 -34.515 -30.833 -3.398 180 HA SER 22 HA SER 22 -36.500 -29.784 -3.025 181 HB2 SER 22 HB2 SER 22 -34.977 -27.813 -1.322 182 HB3 SER 22 HB3 SER 22 -36.645 -28.352 -1.136 183 HG SER 22 HG SER 22 -35.923 -29.903 0.063 184 H GLY 23 H GLY 23 -34.952 -28.966 -5.305 185 HA2 GLY 23 HA2 GLY 23 -36.303 -26.442 -5.824 186 HA3 GLY 23 HA3 GLY 23 -34.548 -26.399 -5.919 187 H HIS 24 H HIS 24 -33.830 -28.634 -7.167 188 HA HIS 24 HA HIS 24 -33.569 -29.537 -9.240 189 HB2 HIS 24 HB2 HIS 24 -36.558 -29.388 -8.981 190 HB3 HIS 24 HB3 HIS 24 -35.819 -29.977 -10.468 191 HD1 HIS 24 HD1 HIS 24 -35.409 -30.724 -6.749 192 HD2 HIS 24 HD2 HIS 24 -35.576 -32.658 -10.422 193 HE1 HIS 24 HE1 HIS 24 -35.207 -33.174 -6.228 194 H SER 25 H SER 25 -32.926 -26.942 -9.246 195 HA SER 25 HA SER 25 -34.262 -25.746 -11.573 196 HB2 SER 25 HB2 SER 25 -32.323 -24.443 -9.649 197 HB3 SER 25 HB3 SER 25 -33.281 -23.636 -10.889 198 HG SER 25 HG SER 25 -34.119 -23.590 -8.661 199 H LYS 26 H LYS 26 -33.119 -27.373 -12.904 200 HA LYS 26 HA LYS 26 -30.302 -27.368 -13.164 201 HB2 LYS 26 HB2 LYS 26 -30.726 -28.536 -15.313 202 HB3 LYS 26 HB3 LYS 26 -31.591 -29.248 -13.957 203 HG2 LYS 26 HG2 LYS 26 -33.325 -29.211 -15.378 204 HG3 LYS 26 HG3 LYS 26 -33.455 -27.526 -14.866 205 HD2 LYS 26 HD2 LYS 26 -33.448 -27.231 -17.130 206 HD3 LYS 26 HD3 LYS 26 -31.709 -27.180 -16.829 207 HE2 LYS 26 HE2 LYS 26 -31.372 -29.308 -17.674 208 HE3 LYS 26 HE3 LYS 26 -33.047 -29.789 -17.408 209 HZ1 LYS 26 HZ1 LYS 26 -33.730 -28.389 -19.226 210 HZ2 LYS 26 HZ2 LYS 26 -32.526 -29.450 -19.763 211 HZ3 LYS 26 HZ3 LYS 26 -32.148 -27.831 -19.452 212 H LEU 27 H LEU 27 -32.708 -25.185 -14.207 213 HA LEU 27 HA LEU 27 -31.725 -24.160 -16.574 214 HB2 LEU 27 HB2 LEU 27 -33.170 -22.919 -14.266 215 HB3 LEU 27 HB3 LEU 27 -32.642 -21.925 -15.623 216 HG LEU 27 HG LEU 27 -33.954 -23.673 -17.050 217 HD11 LEU 27 HD11 LEU 27 -35.946 -24.511 -15.824 218 HD12 LEU 27 HD12 LEU 27 -35.169 -24.028 -14.317 219 HD13 LEU 27 HD13 LEU 27 -34.432 -25.269 -15.330 220 HD21 LEU 27 HD21 LEU 27 -34.766 -21.537 -17.195 221 HD22 LEU 27 HD22 LEU 27 -34.961 -21.373 -15.449 222 HD23 LEU 27 HD23 LEU 27 -36.114 -22.332 -16.380 223 H LYS 28 H LYS 28 -30.678 -23.498 -13.272 224 HA LYS 28 HA LYS 28 -28.406 -21.973 -14.370 225 HB2 LYS 28 HB2 LYS 28 -28.300 -20.940 -12.051 226 HB3 LYS 28 HB3 LYS 28 -29.664 -20.462 -13.054 227 HG2 LYS 28 HG2 LYS 28 -31.082 -22.078 -11.863 228 HG3 LYS 28 HG3 LYS 28 -29.712 -22.493 -10.830 229 HD2 LYS 28 HD2 LYS 28 -29.797 -20.513 -9.687 230 HD3 LYS 28 HD3 LYS 28 -30.473 -19.627 -11.057 231 HE2 LYS 28 HE2 LYS 28 -32.637 -20.427 -10.649 232 HE3 LYS 28 HE3 LYS 28 -32.055 -21.733 -9.618 233 HZ1 LYS 28 HZ1 LYS 28 -32.084 -18.836 -8.977 234 HZ2 LYS 28 HZ2 LYS 28 -31.338 -20.008 -8.014 235 HZ3 LYS 28 HZ3 LYS 28 -33.013 -20.048 -8.250 236 H ALA 29 H ALA 29 -26.498 -22.926 -14.180 237 HA ALA 29 HA ALA 29 -26.132 -24.929 -12.046 238 HB1 ALA 29 HB1 ALA 29 -24.271 -25.241 -14.225 239 HB2 ALA 29 HB2 ALA 29 -25.407 -26.405 -13.541 240 HB3 ALA 29 HB3 ALA 29 -25.936 -25.293 -14.804 241 H TRP 30 H TRP 30 -24.798 -22.188 -13.741 242 HA TRP 30 HA TRP 30 -22.483 -22.207 -11.920 243 HB2 TRP 30 HB2 TRP 30 -22.841 -21.117 -14.702 244 HB3 TRP 30 HB3 TRP 30 -21.555 -20.528 -13.652 245 HD1 TRP 30 HD1 TRP 30 -22.744 -23.820 -15.293 246 HE1 TRP 30 HE1 TRP 30 -20.692 -25.342 -15.606 247 HE3 TRP 30 HE3 TRP 30 -19.234 -20.945 -12.937 248 HZ2 TRP 30 HZ2 TRP 30 -17.948 -25.326 -14.943 249 HZ3 TRP 30 HZ3 TRP 30 -16.919 -21.771 -12.820 250 HH2 TRP 30 HH2 TRP 30 -16.291 -23.916 -13.802 251 H LYS 31 H LYS 31 -21.847 -20.247 -10.927 252 HA LYS 31 HA LYS 31 -24.051 -18.318 -10.649 253 HB2 LYS 31 HB2 LYS 31 -22.918 -19.742 -8.676 254 HB3 LYS 31 HB3 LYS 31 -21.829 -18.360 -8.680 255 HG2 LYS 31 HG2 LYS 31 -23.458 -16.897 -7.992 256 HG3 LYS 31 HG3 LYS 31 -24.770 -17.886 -8.638 257 HD2 LYS 31 HD2 LYS 31 -23.096 -18.945 -6.402 258 HD3 LYS 31 HD3 LYS 31 -24.353 -17.755 -6.056 259 HE2 LYS 31 HE2 LYS 31 -26.007 -19.209 -7.141 260 HE3 LYS 31 HE3 LYS 31 -24.745 -20.400 -7.455 261 HZ1 LYS 31 HZ1 LYS 31 -25.479 -21.243 -5.521 262 HZ2 LYS 31 HZ2 LYS 31 -26.131 -19.779 -4.981 263 HZ3 LYS 31 HZ3 LYS 31 -24.471 -20.071 -4.831 264 H LEU 32 H LEU 32 -23.659 -16.118 -10.763 265 HA LEU 32 HA LEU 32 -20.946 -15.244 -11.436 266 HB2 LEU 32 HB2 LEU 32 -22.358 -15.734 -13.504 267 HB3 LEU 32 HB3 LEU 32 -23.322 -14.334 -13.034 268 HG LEU 32 HG LEU 32 -21.612 -13.897 -14.805 269 HD11 LEU 32 HD11 LEU 32 -22.429 -12.331 -12.700 270 HD12 LEU 32 HD12 LEU 32 -21.569 -11.771 -14.134 271 HD13 LEU 32 HD13 LEU 32 -20.673 -12.162 -12.667 272 HD21 LEU 32 HD21 LEU 32 -19.405 -14.219 -14.506 273 HD22 LEU 32 HD22 LEU 32 -19.939 -15.386 -13.296 274 HD23 LEU 32 HD23 LEU 32 -19.459 -13.761 -12.804 275 H GLU 33 H GLU 33 -20.399 -13.449 -10.383 276 HA GLU 33 HA GLU 33 -22.530 -11.639 -9.470 277 HB2 GLU 33 HB2 GLU 33 -21.820 -13.063 -7.589 278 HB3 GLU 33 HB3 GLU 33 -20.158 -12.541 -7.826 279 HG2 GLU 33 HG2 GLU 33 -21.396 -11.414 -5.964 280 HG3 GLU 33 HG3 GLU 33 -20.649 -10.337 -7.142 281 H PHE 34 H PHE 34 -22.193 -9.861 -10.645 282 HA PHE 34 HA PHE 34 -19.472 -8.986 -11.227 283 HB2 PHE 34 HB2 PHE 34 -20.567 -7.328 -12.704 284 HB3 PHE 34 HB3 PHE 34 -21.049 -8.979 -13.080 285 HD1 PHE 34 HD2 PHE 34 -22.128 -5.798 -11.595 286 HD2 PHE 34 HD1 PHE 34 -23.303 -9.706 -12.804 287 HE1 PHE 34 HE2 PHE 34 -24.491 -5.151 -11.373 288 HE2 PHE 34 HE1 PHE 34 -25.669 -9.066 -12.586 289 HZ PHE 34 HZ PHE 34 -26.265 -6.786 -11.869 290 H GLU 35 H GLU 35 -18.534 -7.182 -10.411 291 HA GLU 35 HA GLU 35 -19.358 -6.169 -7.946 292 HB2 GLU 35 HB2 GLU 35 -17.039 -6.061 -8.732 293 HB3 GLU 35 HB3 GLU 35 -17.505 -4.910 -9.977 294 HG2 GLU 35 HG2 GLU 35 -16.702 -3.472 -8.419 295 HG3 GLU 35 HG3 GLU 35 -18.385 -3.546 -7.901 296 HA PRO 36 HA PRO 36 -22.517 -3.289 -9.045 297 HB2 PRO 36 HB2 PRO 36 -22.556 -1.877 -6.727 298 HB3 PRO 36 HB3 PRO 36 -23.239 -3.501 -6.874 299 HG2 PRO 36 HG2 PRO 36 -20.589 -2.652 -5.772 300 HG3 PRO 36 HG3 PRO 36 -21.732 -3.850 -5.138 301 HD2 PRO 36 HD2 PRO 36 -19.524 -4.545 -6.543 302 HD3 PRO 36 HD3 PRO 36 -21.031 -5.483 -6.605 303 H SER 37 H SER 37 -22.552 -1.375 -10.070 304 HA SER 37 HA SER 37 -21.010 0.879 -9.331 305 HB2 SER 37 HB2 SER 37 -19.890 -0.949 -11.400 306 HB3 SER 37 HB3 SER 37 -19.772 0.785 -11.698 307 HG SER 37 HG SER 37 -19.051 -0.134 -9.169 308 H CYS 38 H CYS 38 -20.982 2.499 -11.321 309 HA CYS 38 HA CYS 38 -23.684 2.988 -11.963 310 HB2 CYS 38 HB2 CYS 38 -22.886 4.883 -13.209 311 HB3 CYS 38 HB3 CYS 38 -21.899 4.733 -11.760 312 HG CYS 38 HG CYS 38 -19.701 4.909 -13.056 313 H THR 39 H THR 39 -24.396 3.424 -14.281 314 HA THR 39 HA THR 39 -23.255 1.956 -16.417 315 HB THR 39 HB THR 39 -24.054 0.010 -15.171 316 HG1 THR 39 HG1 THR 39 -25.609 -0.709 -16.889 317 HG21 THR 39 HG21 THR 39 -26.109 1.589 -14.340 318 HG22 THR 39 HG22 THR 39 -26.087 -0.169 -14.213 319 HG23 THR 39 HG23 THR 39 -26.905 0.606 -15.569 320 H GLN 40 H GLN 40 -24.715 1.895 -18.336 321 HA GLN 40 HA GLN 40 -26.090 4.407 -18.560 322 HB2 GLN 40 HB2 GLN 40 -25.797 2.155 -20.555 323 HB3 GLN 40 HB3 GLN 40 -26.421 3.759 -20.914 324 HG2 GLN 40 HG2 GLN 40 -24.216 4.684 -20.183 325 HG3 GLN 40 HG3 GLN 40 -23.626 3.025 -20.085 326 HE21 GLN 40 HE21 GLN 40 -22.840 5.301 -21.803 327 HE22 GLN 40 HE22 GLN 40 -22.964 4.714 -23.423 328 H TYR 41 H TYR 41 -28.225 4.209 -20.025 329 HA TYR 41 HA TYR 41 -30.151 2.931 -18.290 330 HB2 TYR 41 HB2 TYR 41 -31.824 4.115 -19.578 331 HB3 TYR 41 HB3 TYR 41 -30.509 5.219 -19.191 332 HD1 TYR 41 HD1 TYR 41 -32.118 3.285 -21.878 333 HD2 TYR 41 HD2 TYR 41 -29.134 6.163 -20.919 334 HE1 TYR 41 HE1 TYR 41 -31.887 3.833 -24.264 335 HE2 TYR 41 HE2 TYR 41 -28.895 6.719 -23.302 336 HH TYR 41 HH TYR 41 -30.842 5.071 -25.778 337 H THR 42 H THR 42 -31.544 1.285 -18.820 338 HA THR 42 HA THR 42 -30.853 -0.226 -21.253 339 HB THR 42 HB THR 42 -31.580 -2.238 -20.129 340 HG1 THR 42 HG1 THR 42 -33.214 -1.606 -18.799 341 HG21 THR 42 HG21 THR 42 -29.279 -1.606 -19.726 342 HG22 THR 42 HG22 THR 42 -29.953 -2.313 -18.257 343 HG23 THR 42 HG23 THR 42 -29.765 -0.565 -18.390 344 H GLU 43 H GLU 43 -32.608 -1.455 -22.263 345 HA GLU 43 HA GLU 43 -35.206 -0.092 -21.976 346 HB2 GLU 43 HB2 GLU 43 -33.631 -0.847 -24.391 347 HB3 GLU 43 HB3 GLU 43 -35.384 -0.941 -24.488 348 HG2 GLU 43 HG2 GLU 43 -35.628 1.367 -24.055 349 HG3 GLU 43 HG3 GLU 43 -33.942 1.527 -23.569 350 HA PRO 44 HA PRO 44 -37.188 -3.956 -21.368 351 HB2 PRO 44 HB2 PRO 44 -39.494 -3.661 -22.771 352 HB3 PRO 44 HB3 PRO 44 -39.177 -2.812 -21.253 353 HG2 PRO 44 HG2 PRO 44 -38.920 -1.822 -24.067 354 HG3 PRO 44 HG3 PRO 44 -39.602 -1.002 -22.651 355 HD2 PRO 44 HD2 PRO 44 -37.103 -0.498 -23.566 356 HD3 PRO 44 HD3 PRO 44 -37.527 -0.403 -21.844 357 H LEU 45 H LEU 45 -37.712 -5.964 -22.316 358 HA LEU 45 HA LEU 45 -36.227 -6.691 -24.567 359 HB2 LEU 45 HB2 LEU 45 -37.091 -8.831 -24.303 360 HB3 LEU 45 HB3 LEU 45 -37.149 -8.149 -22.679 361 HG LEU 45 HG LEU 45 -39.515 -8.329 -24.543 362 HD11 LEU 45 HD11 LEU 45 -39.081 -10.016 -22.106 363 HD12 LEU 45 HD12 LEU 45 -38.481 -10.521 -23.686 364 HD13 LEU 45 HD13 LEU 45 -40.207 -10.257 -23.442 365 HD21 LEU 45 HD21 LEU 45 -39.086 -7.301 -21.778 366 HD22 LEU 45 HD22 LEU 45 -40.628 -8.057 -22.184 367 HD23 LEU 45 HD23 LEU 45 -40.072 -6.647 -23.086 368 H MET 46 H MET 46 -36.929 -7.451 -26.645 369 HA MET 46 HA MET 46 -39.448 -6.231 -27.560 370 HB2 MET 46 HB2 MET 46 -37.202 -5.117 -28.259 371 HB3 MET 46 HB3 MET 46 -37.055 -6.485 -29.353 372 HG2 MET 46 HG2 MET 46 -39.580 -4.915 -29.355 373 HG3 MET 46 HG3 MET 46 -38.148 -4.236 -30.125 374 HE1 MET 46 HE1 MET 46 -36.996 -4.907 -31.831 375 HE2 MET 46 HE2 MET 46 -36.966 -6.520 -32.544 376 HE3 MET 46 HE3 MET 46 -37.965 -5.256 -33.265 377 H ASN 47 H ASN 47 -40.770 -7.922 -27.853 378 HA ASN 47 HA ASN 47 -41.608 -9.905 -28.594 379 HB2 ASN 47 HB2 ASN 47 -40.753 -8.657 -30.758 380 HB3 ASN 47 HB3 ASN 47 -39.584 -9.974 -30.795 381 HD21 ASN 47 HD21 ASN 47 -40.201 -11.424 -32.217 382 HD22 ASN 47 HD22 ASN 47 -41.808 -12.019 -32.436 383 H TRP 48 H TRP 48 -39.547 -10.056 -26.632 384 HA TRP 48 HA TRP 48 -38.220 -11.577 -25.586 385 HB2 TRP 48 HB2 TRP 48 -40.264 -13.002 -26.296 386 HB3 TRP 48 HB3 TRP 48 -39.185 -13.669 -27.518 387 HD1 TRP 48 HD1 TRP 48 -37.982 -12.855 -23.964 388 HE1 TRP 48 HE1 TRP 48 -37.304 -15.053 -22.811 389 HE3 TRP 48 HE3 TRP 48 -39.563 -16.162 -27.528 390 HZ2 TRP 48 HZ2 TRP 48 -37.421 -17.824 -23.342 391 HZ3 TRP 48 HZ3 TRP 48 -39.241 -18.569 -27.129 392 HH2 TRP 48 HH2 TRP 48 -38.193 -19.380 -25.078 393 H THR 49 H THR 49 -36.977 -10.069 -27.557 394 HA THR 49 HA THR 49 -34.843 -11.905 -28.351 395 HB THR 49 HB THR 49 -35.641 -9.823 -30.339 396 HG1 THR 49 HG1 THR 49 -37.450 -10.822 -30.758 397 HG21 THR 49 HG21 THR 49 -34.153 -12.417 -30.320 398 HG22 THR 49 HG22 THR 49 -33.673 -10.853 -30.980 399 HG23 THR 49 HG23 THR 49 -34.872 -11.835 -31.822 400 H GLY 50 H GLY 50 -32.824 -11.052 -28.192 401 HA2 GLY 50 HA2 GLY 50 -31.317 -9.159 -28.317 402 HA3 GLY 50 HA3 GLY 50 -32.613 -8.153 -27.687 403 H SER 51 H SER 51 -33.342 -8.659 -25.447 404 HA SER 51 HA SER 51 -31.109 -9.657 -23.804 405 HB2 SER 51 HB2 SER 51 -31.865 -7.910 -22.101 406 HB3 SER 51 HB3 SER 51 -31.038 -7.300 -23.534 407 HG SER 51 HG SER 51 -32.777 -6.045 -23.482 408 H HIS 52 H HIS 52 -32.032 -9.811 -21.387 409 HA HIS 52 HA HIS 52 -34.096 -11.820 -21.537 410 HB2 HIS 52 HB2 HIS 52 -32.417 -10.743 -19.275 411 HB3 HIS 52 HB3 HIS 52 -33.692 -11.931 -19.022 412 HD1 HIS 52 HD1 HIS 52 -30.255 -11.923 -19.171 413 HD2 HIS 52 HD2 HIS 52 -33.119 -14.132 -21.216 414 HE1 HIS 52 HE1 HIS 52 -29.064 -13.985 -19.979 415 H ASP 53 H ASP 53 -35.644 -11.705 -19.445 416 HA ASP 53 HA ASP 53 -37.538 -9.714 -20.028 417 HB2 ASP 53 HB2 ASP 53 -37.222 -11.670 -17.766 418 HB3 ASP 53 HB3 ASP 53 -38.524 -10.484 -17.758 419 H THR 54 H THR 54 -38.469 -8.246 -18.278 420 HA THR 54 HA THR 54 -36.385 -6.444 -17.456 421 HB THR 54 HB THR 54 -38.455 -5.239 -16.389 422 HG1 THR 54 HG1 THR 54 -40.033 -6.753 -16.547 423 HG21 THR 54 HG21 THR 54 -37.952 -3.961 -18.147 424 HG22 THR 54 HG22 THR 54 -39.079 -4.931 -19.096 425 HG23 THR 54 HG23 THR 54 -37.367 -5.352 -19.059 426 H LYS 55 H LYS 55 -35.210 -7.537 -15.871 427 HA LYS 55 HA LYS 55 -36.418 -7.458 -13.230 428 HB2 LYS 55 HB2 LYS 55 -35.478 -9.969 -14.565 429 HB3 LYS 55 HB3 LYS 55 -35.290 -9.793 -12.825 430 HG2 LYS 55 HG2 LYS 55 -37.730 -9.348 -12.666 431 HG3 LYS 55 HG3 LYS 55 -37.860 -9.711 -14.389 432 HD2 LYS 55 HD2 LYS 55 -36.550 -11.676 -12.558 433 HD3 LYS 55 HD3 LYS 55 -38.311 -11.574 -12.611 434 HE2 LYS 55 HE2 LYS 55 -36.654 -11.860 -15.100 435 HE3 LYS 55 HE3 LYS 55 -37.175 -13.259 -14.163 436 HZ1 LYS 55 HZ1 LYS 55 -39.483 -12.000 -14.418 437 HZ2 LYS 55 HZ2 LYS 55 -38.925 -13.119 -15.558 438 HZ3 LYS 55 HZ3 LYS 55 -38.736 -11.462 -15.838 439 H GLN 56 H GLN 56 -34.752 -7.850 -11.508 440 HA GLN 56 HA GLN 56 -31.985 -7.585 -12.250 441 HB2 GLN 56 HB2 GLN 56 -31.689 -5.417 -11.031 442 HB3 GLN 56 HB3 GLN 56 -32.582 -5.286 -12.541 443 HG2 GLN 56 HG2 GLN 56 -34.671 -5.164 -11.340 444 HG3 GLN 56 HG3 GLN 56 -33.835 -5.416 -9.808 445 HE21 GLN 56 HE21 GLN 56 -35.284 -3.151 -11.577 446 HE22 GLN 56 HE22 GLN 56 -34.406 -1.747 -11.086 447 H GLN 57 H GLN 57 -30.778 -8.559 -10.757 448 HA GLN 57 HA GLN 57 -31.723 -8.633 -7.981 449 HB2 GLN 57 HB2 GLN 57 -31.062 -10.966 -9.742 450 HB3 GLN 57 HB3 GLN 57 -30.794 -11.073 -8.007 451 HG2 GLN 57 HG2 GLN 57 -33.066 -10.864 -7.522 452 HG3 GLN 57 HG3 GLN 57 -33.442 -10.237 -9.127 453 HE21 GLN 57 HE21 GLN 57 -33.176 -11.736 -10.935 454 HE22 GLN 57 HE22 GLN 57 -33.515 -13.410 -10.681 455 H VAL 58 H VAL 58 -30.019 -9.284 -6.445 456 HA VAL 58 HA VAL 58 -27.662 -7.803 -6.837 457 HB VAL 58 HB VAL 58 -28.065 -10.008 -4.815 458 HG11 VAL 58 HG11 VAL 58 -26.542 -8.431 -3.482 459 HG12 VAL 58 HG12 VAL 58 -25.809 -9.398 -4.763 460 HG13 VAL 58 HG13 VAL 58 -26.169 -7.693 -5.039 461 HG21 VAL 58 HG21 VAL 58 -29.847 -8.723 -4.245 462 HG22 VAL 58 HG22 VAL 58 -28.597 -7.797 -3.415 463 HG23 VAL 58 HG23 VAL 58 -29.182 -7.271 -4.995 464 H CYS 59 H CYS 59 -28.332 -11.265 -7.086 465 HA CYS 59 HA CYS 59 -25.628 -11.640 -8.194 466 HB2 CYS 59 HB2 CYS 59 -26.299 -12.878 -6.040 467 HB3 CYS 59 HB3 CYS 59 -27.337 -13.853 -7.074 468 HG CYS 59 HG CYS 59 -25.259 -15.503 -6.859 469 H LEU 60 H LEU 60 -25.378 -12.880 -10.064 470 HA LEU 60 HA LEU 60 -27.863 -13.344 -11.580 471 HB2 LEU 60 HB2 LEU 60 -26.806 -11.582 -12.676 472 HB3 LEU 60 HB3 LEU 60 -25.201 -12.263 -12.419 473 HG LEU 60 HG LEU 60 -25.661 -13.984 -14.096 474 HD11 LEU 60 HD11 LEU 60 -27.916 -14.415 -14.117 475 HD12 LEU 60 HD12 LEU 60 -27.746 -13.425 -15.566 476 HD13 LEU 60 HD13 LEU 60 -28.355 -12.707 -14.075 477 HD21 LEU 60 HD21 LEU 60 -26.045 -12.277 -16.053 478 HD22 LEU 60 HD22 LEU 60 -24.563 -12.238 -15.097 479 HD23 LEU 60 HD23 LEU 60 -25.859 -11.088 -14.764 480 H SER 61 H SER 61 -28.238 -15.369 -12.184 481 HA SER 61 HA SER 61 -26.083 -17.333 -11.910 482 HB2 SER 61 HB2 SER 61 -28.111 -18.947 -12.206 483 HB3 SER 61 HB3 SER 61 -27.913 -18.092 -10.677 484 HG SER 61 HG SER 61 -29.560 -16.778 -11.174 485 H PHE 62 H PHE 62 -25.985 -19.100 -13.511 486 HA PHE 62 HA PHE 62 -26.984 -18.432 -16.168 487 HB2 PHE 62 HB2 PHE 62 -24.086 -18.541 -15.394 488 HB3 PHE 62 HB3 PHE 62 -24.583 -18.988 -17.023 489 HD1 PHE 62 HD1 PHE 62 -26.234 -17.230 -18.150 490 HD2 PHE 62 HD2 PHE 62 -23.467 -16.367 -15.032 491 HE1 PHE 62 HE1 PHE 62 -26.245 -14.857 -18.800 492 HE2 PHE 62 HE2 PHE 62 -23.475 -13.993 -15.677 493 HZ PHE 62 HZ PHE 62 -24.866 -13.235 -17.563 494 H THR 63 H THR 63 -26.634 -20.208 -17.728 495 HA THR 63 HA THR 63 -27.207 -22.736 -16.476 496 HB THR 63 HB THR 63 -26.734 -22.621 -19.404 497 HG1 THR 63 HG1 THR 63 -27.975 -20.924 -19.623 498 HG21 THR 63 HG21 THR 63 -28.497 -24.003 -17.470 499 HG22 THR 63 HG22 THR 63 -27.697 -24.618 -18.915 500 HG23 THR 63 HG23 THR 63 -29.179 -23.673 -19.062 501 H THR 64 H THR 64 -24.641 -21.466 -18.582 502 HA THR 64 HA THR 64 -22.880 -23.595 -17.583 503 HB THR 64 HB THR 64 -21.832 -23.475 -19.979 504 HG1 THR 64 HG1 THR 64 -24.534 -22.956 -20.664 505 HG21 THR 64 HG21 THR 64 -23.777 -25.160 -20.688 506 HG22 THR 64 HG22 THR 64 -24.153 -25.023 -18.971 507 HG23 THR 64 HG23 THR 64 -22.560 -25.576 -19.482 508 H ARG 65 H ARG 65 -20.570 -23.107 -17.874 509 HA ARG 65 HA ARG 65 -19.903 -20.571 -16.903 510 HB2 ARG 65 HB2 ARG 65 -17.536 -21.246 -17.526 511 HB3 ARG 65 HB3 ARG 65 -18.398 -22.341 -16.454 512 HG2 ARG 65 HG2 ARG 65 -18.807 -23.877 -18.232 513 HG3 ARG 65 HG3 ARG 65 -18.187 -22.737 -19.427 514 HD2 ARG 65 HD2 ARG 65 -16.353 -24.077 -19.160 515 HD3 ARG 65 HD3 ARG 65 -16.026 -22.857 -17.931 516 HE ARG 65 HE ARG 65 -17.509 -25.036 -16.865 517 HH11 ARG 65 HH11 ARG 65 -14.314 -24.059 -17.840 518 HH12 ARG 65 HH12 ARG 65 -13.509 -25.155 -16.767 519 HH21 ARG 65 HH21 ARG 65 -16.461 -26.483 -15.447 520 HH22 ARG 65 HH22 ARG 65 -14.732 -26.534 -15.406 521 H GLU 66 H GLU 66 -19.856 -21.881 -20.180 522 HA GLU 66 HA GLU 66 -18.478 -19.900 -21.515 523 HB2 GLU 66 HB2 GLU 66 -19.624 -22.112 -22.355 524 HB3 GLU 66 HB3 GLU 66 -20.960 -21.037 -22.743 525 HG2 GLU 66 HG2 GLU 66 -18.196 -20.399 -23.676 526 HG3 GLU 66 HG3 GLU 66 -19.185 -21.574 -24.542 527 H LEU 67 H LEU 67 -21.734 -19.847 -20.249 528 HA LEU 67 HA LEU 67 -22.540 -17.473 -21.628 529 HB2 LEU 67 HB2 LEU 67 -23.664 -19.273 -19.590 530 HB3 LEU 67 HB3 LEU 67 -24.205 -17.598 -19.494 531 HG LEU 67 HG LEU 67 -24.393 -19.227 -22.019 532 HD11 LEU 67 HD11 LEU 67 -26.795 -18.747 -20.360 533 HD12 LEU 67 HD12 LEU 67 -25.681 -20.001 -19.816 534 HD13 LEU 67 HD13 LEU 67 -26.398 -20.097 -21.424 535 HD21 LEU 67 HD21 LEU 67 -26.237 -17.515 -22.414 536 HD22 LEU 67 HD22 LEU 67 -24.572 -16.939 -22.509 537 HD23 LEU 67 HD23 LEU 67 -25.537 -16.617 -21.067 538 H ALA 68 H ALA 68 -21.179 -18.200 -18.460 539 HA ALA 68 HA ALA 68 -21.474 -15.608 -17.362 540 HB1 ALA 68 HB1 ALA 68 -20.651 -18.058 -16.419 541 HB2 ALA 68 HB2 ALA 68 -19.178 -17.089 -16.363 542 HB3 ALA 68 HB3 ALA 68 -20.626 -16.540 -15.520 543 H ILE 69 H ILE 69 -18.480 -17.221 -18.453 544 HA ILE 69 HA ILE 69 -16.825 -15.012 -18.420 545 HB ILE 69 HB ILE 69 -16.739 -17.339 -20.342 546 HG12 ILE 69 HG12 ILE 69 -14.717 -17.618 -18.470 547 HG13 ILE 69 HG13 ILE 69 -16.066 -17.007 -17.519 548 HG21 ILE 69 HG21 ILE 69 -14.193 -16.623 -20.173 549 HG22 ILE 69 HG22 ILE 69 -15.282 -15.923 -21.369 550 HG23 ILE 69 HG23 ILE 69 -14.919 -15.042 -19.887 551 HD11 ILE 69 HD11 ILE 69 -17.024 -18.998 -17.521 552 HD12 ILE 69 HD12 ILE 69 -16.964 -19.079 -19.282 553 HD13 ILE 69 HD13 ILE 69 -15.591 -19.638 -18.327 554 H ALA 70 H ALA 70 -19.119 -16.020 -20.879 555 HA ALA 70 HA ALA 70 -18.285 -14.325 -22.957 556 HB1 ALA 70 HB1 ALA 70 -20.770 -14.539 -23.647 557 HB2 ALA 70 HB2 ALA 70 -19.759 -15.984 -23.621 558 HB3 ALA 70 HB3 ALA 70 -20.876 -15.666 -22.294 559 H TYR 71 H TYR 71 -20.435 -13.797 -20.215 560 HA TYR 71 HA TYR 71 -21.417 -11.275 -21.051 561 HB2 TYR 71 HB2 TYR 71 -22.333 -12.859 -19.227 562 HB3 TYR 71 HB3 TYR 71 -21.152 -12.097 -18.169 563 HD1 TYR 71 HD1 TYR 71 -23.373 -10.683 -20.820 564 HD2 TYR 71 HD2 TYR 71 -22.298 -10.720 -16.703 565 HE1 TYR 71 HE1 TYR 71 -24.948 -8.842 -20.399 566 HE2 TYR 71 HE2 TYR 71 -23.872 -8.880 -16.270 567 HH TYR 71 HH TYR 71 -26.183 -7.855 -18.586 568 H ALA 72 H ALA 72 -18.850 -12.185 -18.761 569 HA ALA 72 HA ALA 72 -18.047 -9.573 -18.113 570 HB1 ALA 72 HB1 ALA 72 -15.780 -11.238 -17.958 571 HB2 ALA 72 HB2 ALA 72 -16.859 -10.745 -16.653 572 HB3 ALA 72 HB3 ALA 72 -17.177 -12.233 -17.544 573 H VAL 73 H VAL 73 -16.506 -11.890 -20.351 574 HA VAL 73 HA VAL 73 -14.546 -10.243 -21.376 575 HB VAL 73 HB VAL 73 -16.105 -12.354 -22.872 576 HG11 VAL 73 HG11 VAL 73 -14.888 -10.890 -24.392 577 HG12 VAL 73 HG12 VAL 73 -13.407 -11.140 -23.465 578 HG13 VAL 73 HG13 VAL 73 -14.144 -12.488 -24.332 579 HG21 VAL 73 HG21 VAL 73 -14.579 -13.934 -22.104 580 HG22 VAL 73 HG22 VAL 73 -13.403 -12.710 -21.624 581 HG23 VAL 73 HG23 VAL 73 -14.875 -12.937 -20.680 582 H ALA 74 H ALA 74 -17.960 -10.294 -22.084 583 HA ALA 74 HA ALA 74 -18.088 -8.984 -24.507 584 HB1 ALA 74 HB1 ALA 74 -20.063 -8.049 -22.550 585 HB2 ALA 74 HB2 ALA 74 -20.292 -8.846 -24.107 586 HB3 ALA 74 HB3 ALA 74 -19.919 -9.804 -22.674 587 H HIS 75 H HIS 75 -17.292 -7.706 -21.360 588 HA HIS 75 HA HIS 75 -16.896 -5.058 -22.590 589 HB2 HIS 75 HB2 HIS 75 -18.818 -5.227 -20.919 590 HB3 HIS 75 HB3 HIS 75 -17.588 -5.475 -19.684 591 HD1 HIS 75 HD1 HIS 75 -18.211 -2.910 -22.437 592 HD2 HIS 75 HD2 HIS 75 -16.923 -3.152 -18.494 593 HE1 HIS 75 HE1 HIS 75 -17.779 -0.537 -21.724 594 H LYS 76 H LYS 76 -15.073 -7.372 -22.197 595 HA LYS 76 HA LYS 76 -12.954 -7.828 -21.493 596 HB2 LYS 76 HB2 LYS 76 -12.932 -4.824 -21.697 597 HB3 LYS 76 HB3 LYS 76 -11.488 -5.728 -21.261 598 HG2 LYS 76 HG2 LYS 76 -11.276 -5.419 -23.549 599 HG3 LYS 76 HG3 LYS 76 -11.914 -7.060 -23.413 600 HD2 LYS 76 HD2 LYS 76 -14.112 -6.332 -23.984 601 HD3 LYS 76 HD3 LYS 76 -13.646 -4.634 -23.861 602 HE2 LYS 76 HE2 LYS 76 -13.715 -5.127 -26.169 603 HE3 LYS 76 HE3 LYS 76 -12.008 -5.081 -25.732 604 HZ1 LYS 76 HZ1 LYS 76 -13.280 -7.108 -27.039 605 HZ2 LYS 76 HZ2 LYS 76 -13.132 -7.696 -25.460 606 HZ3 LYS 76 HZ3 LYS 76 -11.756 -7.199 -26.311 607 H ILE 77 H ILE 77 -14.747 -8.029 -19.440 608 HA ILE 77 HA ILE 77 -13.593 -6.629 -17.149 609 HB ILE 77 HB ILE 77 -15.989 -8.463 -17.288 610 HG12 ILE 77 HG12 ILE 77 -15.983 -5.479 -16.859 611 HG13 ILE 77 HG13 ILE 77 -16.095 -6.190 -18.465 612 HG21 ILE 77 HG21 ILE 77 -16.235 -6.958 -15.015 613 HG22 ILE 77 HG22 ILE 77 -15.668 -8.625 -15.082 614 HG23 ILE 77 HG23 ILE 77 -14.505 -7.299 -15.061 615 HD11 ILE 77 HD11 ILE 77 -18.283 -5.586 -17.570 616 HD12 ILE 77 HD12 ILE 77 -18.144 -7.323 -17.837 617 HD13 ILE 77 HD13 ILE 77 -18.021 -6.671 -16.204 618 H ASP 78 H ASP 78 -12.530 -7.631 -15.493 619 HA ASP 78 HA ASP 78 -11.231 -10.100 -16.071 620 HB2 ASP 78 HB2 ASP 78 -11.251 -8.247 -13.703 621 HB3 ASP 78 HB3 ASP 78 -10.431 -9.805 -13.626 622 H TYR 79 H TYR 79 -12.417 -11.913 -16.076 623 HA TYR 79 HA TYR 79 -14.352 -12.356 -13.919 624 HB2 TYR 79 HB2 TYR 79 -15.180 -14.213 -15.321 625 HB3 TYR 79 HB3 TYR 79 -15.205 -12.677 -16.179 626 HD1 TYR 79 HD1 TYR 79 -13.523 -15.938 -15.904 627 HD2 TYR 79 HD2 TYR 79 -13.819 -12.309 -18.106 628 HE1 TYR 79 HE1 TYR 79 -12.216 -16.945 -17.729 629 HE2 TYR 79 HE2 TYR 79 -12.514 -13.306 -19.937 630 HH TYR 79 HH TYR 79 -11.755 -15.294 -20.787 631 H THR 80 H THR 80 -14.127 -13.935 -12.429 632 HA THR 80 HA THR 80 -11.687 -15.584 -12.585 633 HB THR 80 HB THR 80 -11.521 -14.007 -10.754 634 HG1 THR 80 HG1 THR 80 -12.207 -16.475 -9.542 635 HG21 THR 80 HG21 THR 80 -13.114 -13.850 -8.983 636 HG22 THR 80 HG22 THR 80 -14.033 -15.219 -9.609 637 HG23 THR 80 HG23 THR 80 -14.003 -13.696 -10.497 638 H VAL 81 H VAL 81 -11.987 -17.702 -12.741 639 HA VAL 81 HA VAL 81 -14.646 -18.802 -12.206 640 HB VAL 81 HB VAL 81 -13.758 -20.844 -13.358 641 HG11 VAL 81 HG11 VAL 81 -13.578 -19.648 -15.639 642 HG12 VAL 81 HG12 VAL 81 -15.074 -19.490 -14.715 643 HG13 VAL 81 HG13 VAL 81 -13.895 -18.179 -14.718 644 HG21 VAL 81 HG21 VAL 81 -11.587 -21.072 -13.759 645 HG22 VAL 81 HG22 VAL 81 -11.588 -19.601 -14.732 646 HG23 VAL 81 HG23 VAL 81 -11.293 -19.511 -12.995 647 H LEU 82 H LEU 82 -15.032 -19.774 -10.339 648 HA LEU 82 HA LEU 82 -12.768 -20.908 -8.839 649 HB2 LEU 82 HB2 LEU 82 -13.875 -19.132 -7.650 650 HB3 LEU 82 HB3 LEU 82 -15.445 -19.893 -7.900 651 HG LEU 82 HG LEU 82 -14.767 -21.743 -6.432 652 HD11 LEU 82 HD11 LEU 82 -12.493 -20.440 -5.223 653 HD12 LEU 82 HD12 LEU 82 -12.191 -20.814 -6.919 654 HD13 LEU 82 HD13 LEU 82 -12.667 -22.096 -5.806 655 HD21 LEU 82 HD21 LEU 82 -14.807 -18.918 -5.497 656 HD22 LEU 82 HD22 LEU 82 -14.423 -20.185 -4.332 657 HD23 LEU 82 HD23 LEU 82 -15.957 -20.224 -5.205 658 H GLN 83 H GLN 83 -12.619 -23.041 -8.966 659 HA GLN 83 HA GLN 83 -15.098 -24.626 -8.936 660 HB2 GLN 83 HB2 GLN 83 -13.895 -26.285 -10.400 661 HB3 GLN 83 HB3 GLN 83 -14.318 -24.767 -11.181 662 HG2 GLN 83 HG2 GLN 83 -12.126 -24.043 -11.263 663 HG3 GLN 83 HG3 GLN 83 -11.615 -25.122 -9.965 664 HE21 GLN 83 HE21 GLN 83 -12.986 -25.246 -13.235 665 HE22 GLN 83 HE22 GLN 83 -12.052 -26.601 -13.761 666 H ASP 84 H ASP 84 -15.106 -26.421 -7.656 667 HA ASP 84 HA ASP 84 -12.827 -26.710 -5.847 668 HB2 ASP 84 HB2 ASP 84 -15.210 -26.404 -5.004 669 HB3 ASP 84 HB3 ASP 84 -15.524 -28.037 -5.587 670 H ASN 85 H ASN 85 -11.910 -28.745 -5.365 671 HA ASN 85 HA ASN 85 -10.953 -30.727 -5.945 672 HB2 ASN 85 HB2 ASN 85 -13.826 -31.161 -6.736 673 HB3 ASN 85 HB3 ASN 85 -12.619 -32.428 -6.944 674 HD21 ASN 85 HD21 ASN 85 -14.724 -32.928 -5.360 675 HD22 ASN 85 HD22 ASN 85 -14.249 -32.954 -3.699 676 HA PRO 86 HA PRO 86 -10.415 -29.285 -10.345 677 HB2 PRO 86 HB2 PRO 86 -7.750 -28.813 -10.124 678 HB3 PRO 86 HB3 PRO 86 -8.977 -27.604 -9.726 679 HG2 PRO 86 HG2 PRO 86 -7.438 -29.412 -7.903 680 HG3 PRO 86 HG3 PRO 86 -7.825 -27.693 -7.709 681 HD2 PRO 86 HD2 PRO 86 -9.208 -29.650 -6.446 682 HD3 PRO 86 HD3 PRO 86 -9.963 -28.129 -6.965 683 H ARG 87 H ARG 87 -10.712 -31.310 -11.231 684 HA ARG 87 HA ARG 87 -8.428 -33.165 -11.061 685 HB2 ARG 87 HB2 ARG 87 -9.930 -34.989 -11.425 686 HB3 ARG 87 HB3 ARG 87 -10.611 -33.995 -10.143 687 HG2 ARG 87 HG2 ARG 87 -12.490 -34.286 -11.357 688 HG3 ARG 87 HG3 ARG 87 -11.853 -32.886 -12.224 689 HD2 ARG 87 HD2 ARG 87 -10.611 -35.024 -13.449 690 HD3 ARG 87 HD3 ARG 87 -12.237 -35.626 -13.124 691 HE ARG 87 HE ARG 87 -11.485 -33.606 -15.020 692 HH11 ARG 87 HH11 ARG 87 -14.060 -34.830 -13.022 693 HH12 ARG 87 HH12 ARG 87 -15.318 -34.163 -14.010 694 HH21 ARG 87 HH21 ARG 87 -13.132 -32.723 -16.327 695 HH22 ARG 87 HH22 ARG 87 -14.790 -32.966 -15.890 696 H THR 88 H THR 88 -7.818 -34.293 -12.976 697 HA THR 88 HA THR 88 -8.595 -32.891 -15.452 698 HB THR 88 HB THR 88 -6.379 -33.331 -16.342 699 HG1 THR 88 HG1 THR 88 -4.832 -34.137 -14.577 700 HG21 THR 88 HG21 THR 88 -6.359 -32.073 -13.598 701 HG22 THR 88 HG22 THR 88 -6.586 -31.261 -15.148 702 HG23 THR 88 HG23 THR 88 -5.021 -31.966 -14.743 703 H ILE 89 H ILE 89 -8.259 -34.222 -17.453 704 HA ILE 89 HA ILE 89 -9.150 -36.983 -16.948 705 HB ILE 89 HB ILE 89 -9.557 -35.375 -19.470 706 HG12 ILE 89 HG12 ILE 89 -11.503 -35.915 -17.215 707 HG13 ILE 89 HG13 ILE 89 -10.753 -34.362 -17.564 708 HG21 ILE 89 HG21 ILE 89 -10.187 -37.310 -20.353 709 HG22 ILE 89 HG22 ILE 89 -9.886 -38.134 -18.824 710 HG23 ILE 89 HG23 ILE 89 -11.469 -37.425 -19.147 711 HD11 ILE 89 HD11 ILE 89 -11.856 -34.803 -19.935 712 HD12 ILE 89 HD12 ILE 89 -12.959 -35.759 -18.946 713 HD13 ILE 89 HD13 ILE 89 -12.732 -34.044 -18.606 714 H VAL 90 H VAL 90 -8.132 -38.683 -17.906 715 HA VAL 90 HA VAL 90 -5.734 -38.056 -19.503 716 HB VAL 90 HB VAL 90 -4.846 -40.266 -18.624 717 HG11 VAL 90 HG11 VAL 90 -3.808 -39.238 -16.822 718 HG12 VAL 90 HG12 VAL 90 -4.313 -37.867 -17.812 719 HG13 VAL 90 HG13 VAL 90 -5.249 -38.319 -16.386 720 HG21 VAL 90 HG21 VAL 90 -6.623 -39.978 -16.271 721 HG22 VAL 90 HG22 VAL 90 -7.312 -40.720 -17.714 722 HG23 VAL 90 HG23 VAL 90 -5.880 -41.420 -16.962 723 HA PRO 91 HA PRO 91 -8.618 -40.613 -22.103 724 HB2 PRO 91 HB2 PRO 91 -8.312 -39.107 -24.341 725 HB3 PRO 91 HB3 PRO 91 -9.510 -38.741 -23.094 726 HG2 PRO 91 HG2 PRO 91 -6.810 -37.530 -23.539 727 HG3 PRO 91 HG3 PRO 91 -8.341 -36.732 -23.134 728 HD2 PRO 91 HD2 PRO 91 -6.431 -37.245 -21.284 729 HD3 PRO 91 HD3 PRO 91 -8.163 -37.250 -20.895 730 H LYS 92 H LYS 92 -7.913 -42.291 -23.289 731 HA LYS 92 HA LYS 92 -5.082 -42.480 -23.880 732 HB2 LYS 92 HB2 LYS 92 -7.312 -44.487 -24.266 733 HB3 LYS 92 HB3 LYS 92 -5.597 -44.817 -24.474 734 HG2 LYS 92 HG2 LYS 92 -6.526 -43.733 -21.867 735 HG3 LYS 92 HG3 LYS 92 -6.850 -45.425 -22.249 736 HD2 LYS 92 HD2 LYS 92 -4.804 -45.714 -21.322 737 HD3 LYS 92 HD3 LYS 92 -4.264 -45.300 -22.951 738 HE2 LYS 92 HE2 LYS 92 -2.981 -43.867 -21.705 739 HE3 LYS 92 HE3 LYS 92 -4.383 -42.848 -22.026 740 HZ1 LYS 92 HZ1 LYS 92 -5.257 -43.721 -19.826 741 HZ2 LYS 92 HZ2 LYS 92 -3.978 -42.617 -19.756 742 HZ3 LYS 92 HZ3 LYS 92 -3.683 -44.268 -19.530 743 H SER 93 H SER 93 -4.708 -41.115 -25.604 744 HA SER 93 HA SER 93 -6.312 -41.288 -28.000 745 HB2 SER 93 HB2 SER 93 -5.260 -39.152 -27.170 746 HB3 SER 93 HB3 SER 93 -3.693 -39.822 -27.625 747 HG SER 93 HG SER 93 -5.753 -39.794 -29.523 748 H TYR 94 H TYR 94 -6.091 -43.035 -29.240 749 HA TYR 94 HA TYR 94 -3.488 -43.674 -30.326 750 HB2 TYR 94 HB2 TYR 94 -3.992 -45.039 -28.120 751 HB3 TYR 94 HB3 TYR 94 -4.979 -46.011 -29.207 752 HD1 TYR 94 HD2 TYR 94 -1.612 -44.402 -29.491 753 HD2 TYR 94 HD1 TYR 94 -3.913 -47.968 -29.779 754 HE1 TYR 94 HE2 TYR 94 0.395 -45.631 -30.204 755 HE2 TYR 94 HE1 TYR 94 -1.912 -49.209 -30.492 756 HH TYR 94 HH TYR 94 1.194 -47.564 -30.973 757 H ALA 95 H ALA 95 -3.847 -43.744 -32.433 758 HA ALA 95 HA ALA 95 -6.471 -44.454 -33.463 759 HB1 ALA 95 HB1 ALA 95 -4.052 -43.649 -35.062 760 HB2 ALA 95 HB2 ALA 95 -5.749 -43.575 -35.541 761 HB3 ALA 95 HB3 ALA 95 -5.136 -42.486 -34.297 762 H ASP 96 H ASP 96 -5.902 -46.708 -32.499 763 HA ASP 96 HA ASP 96 -4.159 -48.344 -34.100 764 HB2 ASP 96 HB2 ASP 96 -4.818 -48.608 -31.583 765 HB3 ASP 96 HB3 ASP 96 -6.217 -49.463 -32.229 766 H ASN 97 H ASN 97 -5.104 -47.972 -36.188 767 HA ASN 97 HA ASN 97 -7.373 -49.758 -36.691 768 HB2 ASN 97 HB2 ASN 97 -7.937 -47.190 -36.601 769 HB3 ASN 97 HB3 ASN 97 -7.213 -47.180 -38.207 770 HD21 ASN 97 HD21 ASN 97 -8.381 -47.854 -39.892 771 HD22 ASN 97 HD22 ASN 97 -9.965 -48.539 -39.786 772 H PHE 98 H PHE 98 -7.250 -50.909 -38.568 773 HA PHE 98 HA PHE 98 -5.154 -50.246 -40.495 774 HB2 PHE 98 HB2 PHE 98 -4.456 -52.673 -40.525 775 HB3 PHE 98 HB3 PHE 98 -4.003 -51.784 -39.074 776 HD1 PHE 98 HD2 PHE 98 -6.468 -54.179 -40.446 777 HD2 PHE 98 HD1 PHE 98 -4.714 -52.486 -36.957 778 HE1 PHE 98 HE2 PHE 98 -7.589 -55.877 -39.062 779 HE2 PHE 98 HE1 PHE 98 -5.831 -54.182 -35.567 780 HZ PHE 98 HZ PHE 98 -7.272 -55.879 -36.620 781 H THR 99 H THR 99 -5.408 -51.297 -42.552 782 HA THR 99 HA THR 99 -8.098 -52.407 -43.003 783 HB THR 99 HB THR 99 -8.210 -51.229 -45.154 784 HG1 THR 99 HG1 THR 99 -6.118 -50.845 -45.713 785 HG21 THR 99 HG21 THR 99 -8.145 -49.890 -42.552 786 HG22 THR 99 HG22 THR 99 -9.365 -49.835 -43.824 787 HG23 THR 99 HG23 THR 99 -7.944 -48.795 -43.919 788 H LYS 100 H LYS 100 -8.177 -53.353 -45.348 789 HA LYS 100 HA LYS 100 -5.657 -54.661 -46.054 790 HB2 LYS 100 HB2 LYS 100 -6.850 -56.854 -46.239 791 HB3 LYS 100 HB3 LYS 100 -6.666 -56.270 -44.591 792 HG2 LYS 100 HG2 LYS 100 -8.837 -56.653 -44.346 793 HG3 LYS 100 HG3 LYS 100 -9.108 -55.245 -45.375 794 HD2 LYS 100 HD2 LYS 100 -10.318 -56.810 -46.523 795 HD3 LYS 100 HD3 LYS 100 -8.747 -57.020 -47.298 796 HE2 LYS 100 HE2 LYS 100 -8.340 -59.017 -46.235 797 HE3 LYS 100 HE3 LYS 100 -9.388 -58.628 -44.872 798 HZ1 LYS 100 HZ1 LYS 100 -10.037 -60.269 -46.915 799 HZ2 LYS 100 HZ2 LYS 100 -10.779 -58.823 -47.383 800 HZ3 LYS 100 HZ3 LYS 100 -11.148 -59.518 -45.885 801 HA PRO 101 HA PRO 101 -6.951 -53.999 -50.197 802 HB2 PRO 101 HB2 PRO 101 -5.808 -56.114 -51.457 803 HB3 PRO 101 HB3 PRO 101 -4.876 -54.744 -50.841 804 HG2 PRO 101 HG2 PRO 101 -5.319 -57.439 -49.615 805 HG3 PRO 101 HG3 PRO 101 -3.826 -56.488 -49.718 806 HD2 PRO 101 HD2 PRO 101 -5.333 -56.597 -47.471 807 HD3 PRO 101 HD3 PRO 101 -4.404 -55.155 -47.928 808 H ARG 102 H ARG 102 -8.614 -54.485 -51.550 809 HA ARG 102 HA ARG 102 -10.370 -56.658 -50.754 810 HB2 ARG 102 HB2 ARG 102 -12.047 -55.602 -52.059 811 HB3 ARG 102 HB3 ARG 102 -11.176 -54.310 -51.244 812 HG2 ARG 102 HG2 ARG 102 -9.800 -54.141 -53.400 813 HG3 ARG 102 HG3 ARG 102 -11.086 -55.104 -54.129 814 HD2 ARG 102 HD2 ARG 102 -11.828 -52.700 -52.537 815 HD3 ARG 102 HD3 ARG 102 -11.157 -52.468 -54.150 816 HE ARG 102 HE ARG 102 -13.175 -54.371 -54.353 817 HH11 ARG 102 HH11 ARG 102 -12.834 -51.004 -53.535 818 HH12 ARG 102 HH12 ARG 102 -14.419 -50.575 -54.088 819 HH21 ARG 102 HH21 ARG 102 -15.265 -53.818 -55.082 820 HH22 ARG 102 HH22 ARG 102 -15.801 -52.176 -54.967 821 H ASP 103 H ASP 103 -11.613 -57.584 -52.841 822 HA ASP 103 HA ASP 103 -9.536 -58.562 -54.689 823 HB2 ASP 103 HB2 ASP 103 -11.891 -60.180 -53.702 824 HB3 ASP 103 HB3 ASP 103 -10.530 -60.749 -54.665 825 H MET 104 H MET 104 -10.483 -59.486 -56.732 826 HA MET 104 HA MET 104 -12.034 -57.536 -58.031 827 HB2 MET 104 HB2 MET 104 -10.387 -59.318 -58.988 828 HB3 MET 104 HB3 MET 104 -11.813 -60.342 -59.065 829 HG2 MET 104 HG2 MET 104 -12.922 -58.572 -60.422 830 HG3 MET 104 HG3 MET 104 -11.385 -57.712 -60.456 831 HE1 MET 104 HE1 MET 104 -9.144 -58.806 -61.443 832 HE2 MET 104 HE2 MET 104 -9.367 -59.336 -63.110 833 HE3 MET 104 HE3 MET 104 -10.062 -57.807 -62.571 Start of MODEL 15 1 H1 MET 1 H MET 1 -3.319 -3.916 3.279 2 HA MET 1 HA MET 1 -1.211 -3.383 1.289 3 HB2 MET 1 HB2 MET 1 -3.390 -5.461 1.327 4 HB3 MET 1 HB3 MET 1 -2.577 -4.997 -0.161 5 HG2 MET 1 HG2 MET 1 -1.307 -6.782 0.426 6 HG3 MET 1 HG3 MET 1 -0.419 -5.504 1.255 7 HE1 MET 1 HE1 MET 1 0.123 -8.451 3.377 8 HE2 MET 1 HE2 MET 1 0.727 -7.185 2.310 9 HE3 MET 1 HE3 MET 1 0.449 -6.840 4.017 10 H GLN 2 H GLN 2 -1.991 -1.148 1.369 11 HA GLN 2 HA GLN 2 -4.608 -0.405 0.665 12 HB2 GLN 2 HB2 GLN 2 -2.042 1.126 0.210 13 HB3 GLN 2 HB3 GLN 2 -3.664 1.806 0.199 14 HG2 GLN 2 HG2 GLN 2 -3.930 1.231 2.551 15 HG3 GLN 2 HG3 GLN 2 -2.313 0.529 2.567 16 HE21 GLN 2 HE21 GLN 2 -0.722 1.795 3.201 17 HE22 GLN 2 HE22 GLN 2 -0.755 3.521 3.251 18 H GLU 3 H GLU 3 -5.562 -1.096 -1.144 19 HA GLU 3 HA GLU 3 -4.077 -0.814 -3.674 20 HB2 GLU 3 HB2 GLU 3 -4.383 -3.161 -3.236 21 HB3 GLU 3 HB3 GLU 3 -6.086 -2.922 -2.875 22 HG2 GLU 3 HG2 GLU 3 -6.587 -2.442 -5.146 23 HG3 GLU 3 HG3 GLU 3 -4.877 -2.367 -5.568 24 H GLN 4 H GLN 4 -4.881 1.266 -4.050 25 HA GLN 4 HA GLN 4 -7.659 1.883 -3.962 26 HB2 GLN 4 HB2 GLN 4 -5.453 3.338 -5.429 27 HB3 GLN 4 HB3 GLN 4 -7.033 3.987 -5.012 28 HG2 GLN 4 HG2 GLN 4 -4.963 3.102 -3.016 29 HG3 GLN 4 HG3 GLN 4 -5.223 4.768 -3.531 30 HE21 GLN 4 HE21 GLN 4 -5.490 3.416 -0.898 31 HE22 GLN 4 HE22 GLN 4 -7.089 3.792 -0.361 32 H VAL 5 H VAL 5 -9.196 1.618 -5.453 33 HA VAL 5 HA VAL 5 -8.636 1.491 -8.261 34 HB VAL 5 HB VAL 5 -8.002 -0.797 -7.631 35 HG11 VAL 5 HG11 VAL 5 -9.812 -0.710 -5.705 36 HG12 VAL 5 HG12 VAL 5 -10.809 -1.481 -6.939 37 HG13 VAL 5 HG13 VAL 5 -9.300 -2.236 -6.426 38 HG21 VAL 5 HG21 VAL 5 -9.390 -0.094 -9.759 39 HG22 VAL 5 HG22 VAL 5 -9.020 -1.787 -9.428 40 HG23 VAL 5 HG23 VAL 5 -10.609 -1.137 -9.025 41 H SER 6 H SER 6 -10.463 1.765 -9.512 42 HA SER 6 HA SER 6 -13.036 1.887 -8.090 43 HB2 SER 6 HB2 SER 6 -12.103 3.930 -10.118 44 HB3 SER 6 HB3 SER 6 -13.600 3.968 -9.184 45 HG SER 6 HG SER 6 -12.148 5.290 -8.156 46 H ASN 7 H ASN 7 -12.638 -0.341 -9.358 47 HA ASN 7 HA ASN 7 -14.260 -0.095 -11.783 48 HB2 ASN 7 HB2 ASN 7 -11.583 -1.443 -11.560 49 HB3 ASN 7 HB3 ASN 7 -12.772 -2.005 -12.732 50 HD21 ASN 7 HD21 ASN 7 -10.194 -0.030 -12.302 51 HD22 ASN 7 HD22 ASN 7 -10.456 1.080 -13.600 52 H VAL 8 H VAL 8 -15.159 -2.237 -12.464 53 HA VAL 8 HA VAL 8 -15.866 -3.792 -10.072 54 HB VAL 8 HB VAL 8 -17.851 -4.512 -11.259 55 HG11 VAL 8 HG11 VAL 8 -17.566 -2.142 -10.161 56 HG12 VAL 8 HG12 VAL 8 -17.807 -1.587 -11.820 57 HG13 VAL 8 HG13 VAL 8 -19.043 -2.566 -11.028 58 HG21 VAL 8 HG21 VAL 8 -17.857 -2.831 -13.539 59 HG22 VAL 8 HG22 VAL 8 -16.356 -3.757 -13.558 60 HG23 VAL 8 HG23 VAL 8 -17.907 -4.593 -13.477 61 H ARG 9 H ARG 9 -16.284 -6.132 -10.425 62 HA ARG 9 HA ARG 9 -14.704 -7.327 -12.576 63 HB2 ARG 9 HB2 ARG 9 -14.289 -7.874 -9.633 64 HB3 ARG 9 HB3 ARG 9 -13.641 -8.881 -10.921 65 HG2 ARG 9 HG2 ARG 9 -12.117 -7.283 -11.587 66 HG3 ARG 9 HG3 ARG 9 -13.039 -5.959 -10.873 67 HD2 ARG 9 HD2 ARG 9 -11.085 -6.329 -9.535 68 HD3 ARG 9 HD3 ARG 9 -12.495 -6.872 -8.627 69 HE ARG 9 HE ARG 9 -11.269 -8.988 -10.101 70 HH11 ARG 9 HH11 ARG 9 -11.071 -7.109 -7.177 71 HH12 ARG 9 HH12 ARG 9 -10.248 -8.344 -6.284 72 HH21 ARG 9 HH21 ARG 9 -10.185 -10.623 -8.936 73 HH22 ARG 9 HH22 ARG 9 -9.743 -10.342 -7.286 74 H ALA 10 H ALA 10 -15.119 -9.625 -12.860 75 HA ALA 10 HA ALA 10 -17.864 -10.302 -12.068 76 HB1 ALA 10 HB1 ALA 10 -18.026 -10.655 -14.269 77 HB2 ALA 10 HB2 ALA 10 -16.276 -10.712 -14.480 78 HB3 ALA 10 HB3 ALA 10 -17.148 -12.152 -13.957 79 H ARG 11 H ARG 11 -18.282 -11.959 -10.746 80 HA ARG 11 HA ARG 11 -16.043 -13.724 -10.010 81 HB2 ARG 11 HB2 ARG 11 -18.481 -13.053 -8.354 82 HB3 ARG 11 HB3 ARG 11 -17.081 -13.984 -7.837 83 HG2 ARG 11 HG2 ARG 11 -15.733 -11.860 -8.348 84 HG3 ARG 11 HG3 ARG 11 -17.298 -11.043 -8.345 85 HD2 ARG 11 HD2 ARG 11 -16.552 -12.828 -6.070 86 HD3 ARG 11 HD3 ARG 11 -15.886 -11.198 -6.153 87 HE ARG 11 HE ARG 11 -18.566 -11.930 -5.476 88 HH11 ARG 11 HH11 ARG 11 -16.595 -9.435 -6.894 89 HH12 ARG 11 HH12 ARG 11 -17.708 -8.162 -6.520 90 HH21 ARG 11 HH21 ARG 11 -20.040 -10.262 -4.979 91 HH22 ARG 11 HH22 ARG 11 -19.667 -8.633 -5.430 92 H ILE 12 H ILE 12 -16.264 -15.531 -11.193 93 HA ILE 12 HA ILE 12 -18.931 -16.714 -11.496 94 HB ILE 12 HB ILE 12 -16.350 -17.404 -12.906 95 HG12 ILE 12 HG12 ILE 12 -18.792 -16.130 -14.124 96 HG13 ILE 12 HG13 ILE 12 -17.517 -15.158 -13.395 97 HG21 ILE 12 HG21 ILE 12 -19.152 -18.454 -13.226 98 HG22 ILE 12 HG22 ILE 12 -17.877 -18.693 -14.419 99 HG23 ILE 12 HG23 ILE 12 -17.702 -19.360 -12.795 100 HD11 ILE 12 HD11 ILE 12 -15.903 -16.189 -14.954 101 HD12 ILE 12 HD12 ILE 12 -17.242 -17.041 -15.724 102 HD13 ILE 12 HD13 ILE 12 -17.178 -15.279 -15.764 103 H TYR 13 H TYR 13 -19.480 -18.616 -10.592 104 HA TYR 13 HA TYR 13 -17.390 -20.240 -9.331 105 HB2 TYR 13 HB2 TYR 13 -18.214 -18.926 -7.508 106 HB3 TYR 13 HB3 TYR 13 -19.886 -19.196 -7.988 107 HD1 TYR 13 HD2 TYR 13 -16.962 -21.453 -7.383 108 HD2 TYR 13 HD1 TYR 13 -20.997 -20.488 -6.441 109 HE1 TYR 13 HE2 TYR 13 -17.072 -23.401 -5.886 110 HE2 TYR 13 HE1 TYR 13 -21.118 -22.432 -4.939 111 HH TYR 13 HH TYR 13 -19.657 -23.889 -3.692 112 H LYS 14 H LYS 14 -17.651 -22.375 -9.599 113 HA LYS 14 HA LYS 14 -19.889 -23.290 -11.191 114 HB2 LYS 14 HB2 LYS 14 -18.661 -25.291 -11.514 115 HB3 LYS 14 HB3 LYS 14 -17.481 -23.988 -11.562 116 HG2 LYS 14 HG2 LYS 14 -16.890 -24.468 -9.221 117 HG3 LYS 14 HG3 LYS 14 -18.028 -25.819 -9.234 118 HD2 LYS 14 HD2 LYS 14 -15.725 -25.562 -11.162 119 HD3 LYS 14 HD3 LYS 14 -15.620 -26.433 -9.631 120 HE2 LYS 14 HE2 LYS 14 -16.181 -28.163 -11.008 121 HE3 LYS 14 HE3 LYS 14 -17.796 -27.609 -10.570 122 HZ1 LYS 14 HZ1 LYS 14 -17.106 -26.097 -12.745 123 HZ2 LYS 14 HZ2 LYS 14 -18.161 -27.418 -12.738 124 HZ3 LYS 14 HZ3 LYS 14 -16.529 -27.641 -13.124 125 HA PRO 15 HA PRO 15 -22.318 -25.016 -7.966 126 HB2 PRO 15 HB2 PRO 15 -23.400 -27.162 -9.228 127 HB3 PRO 15 HB3 PRO 15 -23.888 -25.498 -9.573 128 HG2 PRO 15 HG2 PRO 15 -21.997 -27.268 -11.074 129 HG3 PRO 15 HG3 PRO 15 -23.252 -26.184 -11.703 130 HD2 PRO 15 HD2 PRO 15 -20.629 -25.511 -11.667 131 HD3 PRO 15 HD3 PRO 15 -21.926 -24.312 -11.476 132 H ALA 16 H ALA 16 -22.910 -27.412 -7.146 133 HA ALA 16 HA ALA 16 -20.659 -28.395 -5.847 134 HB1 ALA 16 HB1 ALA 16 -23.102 -30.047 -6.431 135 HB2 ALA 16 HB2 ALA 16 -22.023 -30.147 -5.040 136 HB3 ALA 16 HB3 ALA 16 -23.085 -28.753 -5.234 137 H LYS 17 H LYS 17 -19.103 -29.818 -6.342 138 HA LYS 17 HA LYS 17 -18.896 -30.774 -9.045 139 HB2 LYS 17 HB2 LYS 17 -16.936 -29.958 -7.767 140 HB3 LYS 17 HB3 LYS 17 -17.109 -31.319 -6.666 141 HG2 LYS 17 HG2 LYS 17 -15.435 -32.003 -8.111 142 HG3 LYS 17 HG3 LYS 17 -16.876 -32.780 -8.768 143 HD2 LYS 17 HD2 LYS 17 -15.922 -31.900 -10.673 144 HD3 LYS 17 HD3 LYS 17 -17.036 -30.611 -10.214 145 HE2 LYS 17 HE2 LYS 17 -15.331 -29.247 -9.429 146 HE3 LYS 17 HE3 LYS 17 -14.216 -30.595 -9.216 147 HZ1 LYS 17 HZ1 LYS 17 -15.149 -29.860 -11.912 148 HZ2 LYS 17 HZ2 LYS 17 -13.729 -30.659 -11.456 149 HZ3 LYS 17 HZ3 LYS 17 -13.887 -28.995 -11.188 150 H SER 18 H SER 18 -20.955 -32.054 -8.773 151 HA SER 18 HA SER 18 -20.273 -34.819 -8.445 152 HB2 SER 18 HB2 SER 18 -20.849 -33.897 -6.088 153 HB3 SER 18 HB3 SER 18 -22.514 -33.879 -6.671 154 HG SER 18 HG SER 18 -22.148 -35.850 -5.703 155 H THR 19 H THR 19 -22.029 -36.253 -9.092 156 HA THR 19 HA THR 19 -23.903 -34.889 -10.910 157 HB THR 19 HB THR 19 -22.962 -37.754 -11.097 158 HG1 THR 19 HG1 THR 19 -22.066 -35.453 -12.528 159 HG21 THR 19 HG21 THR 19 -23.743 -36.838 -13.594 160 HG22 THR 19 HG22 THR 19 -24.945 -36.158 -12.497 161 HG23 THR 19 HG23 THR 19 -24.669 -37.899 -12.535 162 H MET 20 H MET 20 -26.057 -35.334 -10.837 163 HA MET 20 HA MET 20 -26.963 -37.335 -8.879 164 HB2 MET 20 HB2 MET 20 -27.776 -34.464 -9.156 165 HB3 MET 20 HB3 MET 20 -28.920 -35.644 -8.529 166 HG2 MET 20 HG2 MET 20 -26.197 -35.498 -7.338 167 HG3 MET 20 HG3 MET 20 -27.387 -34.265 -6.924 168 HE1 MET 20 HE1 MET 20 -28.373 -35.820 -3.788 169 HE2 MET 20 HE2 MET 20 -27.563 -34.523 -4.667 170 HE3 MET 20 HE3 MET 20 -29.293 -34.792 -4.888 171 H GLN 21 H GLN 21 -28.184 -35.170 -11.442 172 HA GLN 21 HA GLN 21 -29.330 -37.433 -12.837 173 HB2 GLN 21 HB2 GLN 21 -30.980 -35.386 -11.415 174 HB3 GLN 21 HB3 GLN 21 -31.564 -36.043 -12.937 175 HG2 GLN 21 HG2 GLN 21 -31.090 -38.341 -11.822 176 HG3 GLN 21 HG3 GLN 21 -31.142 -37.414 -10.323 177 HE21 GLN 21 HE21 GLN 21 -33.073 -36.569 -9.619 178 HE22 GLN 21 HE22 GLN 21 -34.595 -36.999 -10.312 179 H SER 22 H SER 22 -29.521 -37.088 -15.000 180 HA SER 22 HA SER 22 -28.409 -34.598 -16.008 181 HB2 SER 22 HB2 SER 22 -27.451 -36.523 -17.011 182 HB3 SER 22 HB3 SER 22 -29.030 -37.261 -17.284 183 HG SER 22 HG SER 22 -28.451 -34.790 -18.474 184 H GLY 23 H GLY 23 -31.049 -36.638 -17.262 185 HA2 GLY 23 HA2 GLY 23 -33.057 -36.073 -18.221 186 HA3 GLY 23 HA3 GLY 23 -33.149 -34.856 -16.957 187 H HIS 24 H HIS 24 -33.033 -32.764 -17.511 188 HA HIS 24 HA HIS 24 -32.319 -32.148 -20.302 189 HB2 HIS 24 HB2 HIS 24 -34.224 -30.633 -18.506 190 HB3 HIS 24 HB3 HIS 24 -33.883 -30.282 -20.198 191 HD1 HIS 24 HD1 HIS 24 -34.839 -31.975 -21.966 192 HD2 HIS 24 HD2 HIS 24 -36.096 -32.618 -18.059 193 HE1 HIS 24 HE1 HIS 24 -36.806 -33.532 -22.139 194 H SER 25 H SER 25 -31.587 -29.837 -20.609 195 HA SER 25 HA SER 25 -29.769 -29.104 -18.409 196 HB2 SER 25 HB2 SER 25 -28.841 -29.893 -20.704 197 HB3 SER 25 HB3 SER 25 -29.332 -28.298 -21.273 198 HG SER 25 HG SER 25 -27.533 -27.620 -20.448 199 H LYS 26 H LYS 26 -32.354 -28.175 -18.295 200 HA LYS 26 HA LYS 26 -32.101 -25.353 -19.106 201 HB2 LYS 26 HB2 LYS 26 -34.025 -26.726 -20.056 202 HB3 LYS 26 HB3 LYS 26 -34.677 -26.765 -18.422 203 HG2 LYS 26 HG2 LYS 26 -35.794 -25.005 -19.474 204 HG3 LYS 26 HG3 LYS 26 -34.555 -24.223 -18.487 205 HD2 LYS 26 HD2 LYS 26 -33.140 -24.430 -20.698 206 HD3 LYS 26 HD3 LYS 26 -34.735 -24.506 -21.449 207 HE2 LYS 26 HE2 LYS 26 -33.799 -22.328 -19.583 208 HE3 LYS 26 HE3 LYS 26 -33.820 -22.211 -21.342 209 HZ1 LYS 26 HZ1 LYS 26 -36.349 -23.000 -20.688 210 HZ2 LYS 26 HZ2 LYS 26 -35.872 -21.432 -21.106 211 HZ3 LYS 26 HZ3 LYS 26 -35.960 -21.883 -19.478 212 H LEU 27 H LEU 27 -30.734 -25.908 -16.897 213 HA LEU 27 HA LEU 27 -32.294 -24.576 -14.826 214 HB2 LEU 27 HB2 LEU 27 -31.996 -26.144 -13.173 215 HB3 LEU 27 HB3 LEU 27 -32.294 -27.156 -14.584 216 HG LEU 27 HG LEU 27 -29.634 -27.117 -14.685 217 HD11 LEU 27 HD11 LEU 27 -29.851 -27.296 -11.755 218 HD12 LEU 27 HD12 LEU 27 -29.941 -25.671 -12.434 219 HD13 LEU 27 HD13 LEU 27 -28.540 -26.689 -12.765 220 HD21 LEU 27 HD21 LEU 27 -29.922 -29.291 -14.311 221 HD22 LEU 27 HD22 LEU 27 -31.611 -28.928 -13.955 222 HD23 LEU 27 HD23 LEU 27 -30.430 -29.007 -12.647 223 H LYS 28 H LYS 28 -31.100 -23.246 -13.521 224 HA LYS 28 HA LYS 28 -28.578 -22.387 -14.461 225 HB2 LYS 28 HB2 LYS 28 -30.335 -21.724 -12.153 226 HB3 LYS 28 HB3 LYS 28 -28.647 -21.240 -12.051 227 HG2 LYS 28 HG2 LYS 28 -29.600 -19.375 -12.978 228 HG3 LYS 28 HG3 LYS 28 -29.081 -20.247 -14.422 229 HD2 LYS 28 HD2 LYS 28 -31.236 -19.710 -15.004 230 HD3 LYS 28 HD3 LYS 28 -31.487 -21.293 -14.263 231 HE2 LYS 28 HE2 LYS 28 -33.134 -20.012 -13.264 232 HE3 LYS 28 HE3 LYS 28 -31.829 -19.932 -12.081 233 HZ1 LYS 28 HZ1 LYS 28 -33.051 -17.829 -13.555 234 HZ2 LYS 28 HZ2 LYS 28 -31.376 -17.836 -13.792 235 HZ3 LYS 28 HZ3 LYS 28 -32.009 -17.739 -12.226 236 H ALA 29 H ALA 29 -26.630 -23.209 -14.108 237 HA ALA 29 HA ALA 29 -26.241 -24.936 -11.750 238 HB1 ALA 29 HB1 ALA 29 -24.321 -25.214 -13.949 239 HB2 ALA 29 HB2 ALA 29 -25.147 -26.448 -12.998 240 HB3 ALA 29 HB3 ALA 29 -25.975 -25.676 -14.350 241 H TRP 30 H TRP 30 -24.701 -22.537 -13.854 242 HA TRP 30 HA TRP 30 -22.497 -22.209 -11.986 243 HB2 TRP 30 HB2 TRP 30 -23.132 -21.096 -14.705 244 HB3 TRP 30 HB3 TRP 30 -21.864 -20.380 -13.715 245 HD1 TRP 30 HD1 TRP 30 -22.730 -23.649 -15.546 246 HE1 TRP 30 HE1 TRP 30 -20.551 -24.960 -15.939 247 HE3 TRP 30 HE3 TRP 30 -19.513 -20.692 -12.891 248 HZ2 TRP 30 HZ2 TRP 30 -17.829 -24.767 -15.220 249 HZ3 TRP 30 HZ3 TRP 30 -17.138 -21.326 -12.793 250 HH2 TRP 30 HH2 TRP 30 -16.315 -23.321 -13.934 251 H LYS 31 H LYS 31 -21.920 -20.105 -11.130 252 HA LYS 31 HA LYS 31 -24.238 -18.326 -10.755 253 HB2 LYS 31 HB2 LYS 31 -22.182 -19.017 -8.650 254 HB3 LYS 31 HB3 LYS 31 -23.581 -17.972 -8.442 255 HG2 LYS 31 HG2 LYS 31 -24.916 -20.097 -9.153 256 HG3 LYS 31 HG3 LYS 31 -23.448 -20.941 -8.657 257 HD2 LYS 31 HD2 LYS 31 -23.643 -19.553 -6.493 258 HD3 LYS 31 HD3 LYS 31 -25.305 -19.256 -7.009 259 HE2 LYS 31 HE2 LYS 31 -24.103 -22.004 -6.733 260 HE3 LYS 31 HE3 LYS 31 -25.000 -21.198 -5.448 261 HZ1 LYS 31 HZ1 LYS 31 -25.990 -22.613 -7.690 262 HZ2 LYS 31 HZ2 LYS 31 -26.573 -21.026 -7.711 263 HZ3 LYS 31 HZ3 LYS 31 -26.835 -22.004 -6.357 264 H LEU 32 H LEU 32 -23.863 -16.320 -11.413 265 HA LEU 32 HA LEU 32 -21.075 -15.367 -11.489 266 HB2 LEU 32 HB2 LEU 32 -22.111 -15.704 -13.708 267 HB3 LEU 32 HB3 LEU 32 -23.363 -14.543 -13.272 268 HG LEU 32 HG LEU 32 -21.453 -13.746 -14.775 269 HD11 LEU 32 HD11 LEU 32 -23.115 -12.433 -13.149 270 HD12 LEU 32 HD12 LEU 32 -21.883 -11.624 -14.118 271 HD13 LEU 32 HD13 LEU 32 -21.579 -11.971 -12.415 272 HD21 LEU 32 HD21 LEU 32 -19.910 -13.194 -12.312 273 HD22 LEU 32 HD22 LEU 32 -19.356 -13.457 -13.966 274 HD23 LEU 32 HD23 LEU 32 -19.820 -14.832 -12.962 275 H GLU 33 H GLU 33 -20.592 -13.544 -10.425 276 HA GLU 33 HA GLU 33 -22.748 -11.726 -9.638 277 HB2 GLU 33 HB2 GLU 33 -22.252 -13.411 -7.797 278 HB3 GLU 33 HB3 GLU 33 -20.673 -12.650 -7.656 279 HG2 GLU 33 HG2 GLU 33 -21.704 -10.540 -7.082 280 HG3 GLU 33 HG3 GLU 33 -23.307 -11.237 -7.309 281 H PHE 34 H PHE 34 -22.183 -9.813 -10.419 282 HA PHE 34 HA PHE 34 -19.358 -9.135 -10.707 283 HB2 PHE 34 HB2 PHE 34 -20.171 -7.242 -12.063 284 HB3 PHE 34 HB3 PHE 34 -20.791 -8.781 -12.652 285 HD1 PHE 34 HD2 PHE 34 -21.638 -5.645 -10.960 286 HD2 PHE 34 HD1 PHE 34 -23.130 -9.308 -12.533 287 HE1 PHE 34 HE2 PHE 34 -23.933 -4.768 -10.819 288 HE2 PHE 34 HE1 PHE 34 -25.427 -8.437 -12.396 289 HZ PHE 34 HZ PHE 34 -25.831 -6.164 -11.537 290 H GLU 35 H GLU 35 -18.445 -7.242 -9.860 291 HA GLU 35 HA GLU 35 -19.166 -6.579 -7.247 292 HB2 GLU 35 HB2 GLU 35 -16.907 -6.249 -8.138 293 HB3 GLU 35 HB3 GLU 35 -17.502 -4.986 -9.205 294 HG2 GLU 35 HG2 GLU 35 -16.679 -3.701 -7.531 295 HG3 GLU 35 HG3 GLU 35 -18.320 -3.933 -6.931 296 HA PRO 36 HA PRO 36 -22.521 -3.769 -7.812 297 HB2 PRO 36 HB2 PRO 36 -22.489 -2.648 -5.339 298 HB3 PRO 36 HB3 PRO 36 -23.099 -4.279 -5.647 299 HG2 PRO 36 HG2 PRO 36 -20.431 -3.422 -4.595 300 HG3 PRO 36 HG3 PRO 36 -21.475 -4.749 -4.051 301 HD2 PRO 36 HD2 PRO 36 -19.326 -5.147 -5.648 302 HD3 PRO 36 HD3 PRO 36 -20.786 -6.153 -5.743 303 H SER 37 H SER 37 -22.895 -1.329 -6.911 304 HA SER 37 HA SER 37 -22.407 0.869 -7.243 305 HB2 SER 37 HB2 SER 37 -19.504 0.107 -6.893 306 HB3 SER 37 HB3 SER 37 -20.255 1.670 -6.572 307 HG SER 37 HG SER 37 -21.335 0.763 -4.835 308 H CYS 38 H CYS 38 -22.875 -0.417 -9.534 309 HA CYS 38 HA CYS 38 -20.805 -0.304 -11.459 310 HB2 CYS 38 HB2 CYS 38 -23.798 -0.485 -11.610 311 HB3 CYS 38 HB3 CYS 38 -22.849 -0.256 -13.073 312 HG CYS 38 HG CYS 38 -21.480 -2.625 -12.918 313 H THR 39 H THR 39 -19.765 1.629 -11.585 314 HA THR 39 HA THR 39 -21.312 4.084 -11.882 315 HB THR 39 HB THR 39 -19.325 4.057 -10.390 316 HG1 THR 39 HG1 THR 39 -19.355 6.102 -10.901 317 HG21 THR 39 HG21 THR 39 -17.691 3.904 -12.920 318 HG22 THR 39 HG22 THR 39 -17.988 2.516 -11.873 319 HG23 THR 39 HG23 THR 39 -17.110 3.915 -11.255 320 H GLN 40 H GLN 40 -19.462 1.845 -13.775 321 HA GLN 40 HA GLN 40 -19.115 3.621 -16.015 322 HB2 GLN 40 HB2 GLN 40 -17.586 1.681 -15.396 323 HB3 GLN 40 HB3 GLN 40 -18.833 0.620 -16.039 324 HG2 GLN 40 HG2 GLN 40 -17.534 0.822 -17.883 325 HG3 GLN 40 HG3 GLN 40 -18.602 2.201 -18.137 326 HE21 GLN 40 HE21 GLN 40 -16.486 2.502 -19.503 327 HE22 GLN 40 HE22 GLN 40 -15.309 3.532 -18.768 328 H TYR 41 H TYR 41 -21.016 0.655 -15.463 329 HA TYR 41 HA TYR 41 -22.770 1.463 -17.681 330 HB2 TYR 41 HB2 TYR 41 -21.789 -0.715 -18.032 331 HB3 TYR 41 HB3 TYR 41 -22.289 -1.246 -16.429 332 HD1 TYR 41 HD1 TYR 41 -23.472 -0.406 -19.818 333 HD2 TYR 41 HD2 TYR 41 -24.517 -2.018 -16.022 334 HE1 TYR 41 HE1 TYR 41 -25.575 -1.260 -20.766 335 HE2 TYR 41 HE2 TYR 41 -26.621 -2.877 -16.960 336 HH TYR 41 HH TYR 41 -27.990 -2.859 -18.733 337 H THR 42 H THR 42 -24.263 2.767 -16.739 338 HA THR 42 HA THR 42 -25.871 1.578 -14.573 339 HB THR 42 HB THR 42 -25.534 4.550 -14.933 340 HG1 THR 42 HG1 THR 42 -24.045 2.828 -13.214 341 HG21 THR 42 HG21 THR 42 -26.964 4.695 -13.229 342 HG22 THR 42 HG22 THR 42 -25.976 3.607 -12.253 343 HG23 THR 42 HG23 THR 42 -27.204 2.952 -13.337 344 H GLU 43 H GLU 43 -26.540 1.039 -17.156 345 HA GLU 43 HA GLU 43 -28.920 2.727 -17.566 346 HB2 GLU 43 HB2 GLU 43 -26.883 1.772 -19.508 347 HB3 GLU 43 HB3 GLU 43 -28.558 1.783 -20.043 348 HG2 GLU 43 HG2 GLU 43 -28.743 4.099 -19.799 349 HG3 GLU 43 HG3 GLU 43 -27.293 4.198 -18.802 350 HA PRO 44 HA PRO 44 -31.402 -0.887 -17.436 351 HB2 PRO 44 HB2 PRO 44 -33.255 -0.396 -19.358 352 HB3 PRO 44 HB3 PRO 44 -33.222 0.463 -17.814 353 HG2 PRO 44 HG2 PRO 44 -32.189 1.330 -20.487 354 HG3 PRO 44 HG3 PRO 44 -33.096 2.262 -19.282 355 HD2 PRO 44 HD2 PRO 44 -30.412 2.471 -19.566 356 HD3 PRO 44 HD3 PRO 44 -31.225 2.666 -18.000 357 H LEU 45 H LEU 45 -32.005 -2.827 -18.539 358 HA LEU 45 HA LEU 45 -30.361 -3.344 -20.921 359 HB2 LEU 45 HB2 LEU 45 -29.793 -4.689 -18.974 360 HB3 LEU 45 HB3 LEU 45 -31.459 -5.252 -18.861 361 HG LEU 45 HG LEU 45 -31.170 -6.367 -21.067 362 HD11 LEU 45 HD11 LEU 45 -28.755 -6.747 -21.740 363 HD12 LEU 45 HD12 LEU 45 -28.357 -5.372 -20.710 364 HD13 LEU 45 HD13 LEU 45 -29.432 -5.156 -22.092 365 HD21 LEU 45 HD21 LEU 45 -30.551 -7.269 -18.615 366 HD22 LEU 45 HD22 LEU 45 -28.992 -7.478 -19.413 367 HD23 LEU 45 HD23 LEU 45 -30.432 -8.256 -20.072 368 H MET 46 H MET 46 -33.583 -3.613 -19.568 369 HA MET 46 HA MET 46 -34.662 -3.930 -22.248 370 HB2 MET 46 HB2 MET 46 -36.075 -5.834 -21.637 371 HB3 MET 46 HB3 MET 46 -34.370 -6.241 -21.498 372 HG2 MET 46 HG2 MET 46 -34.446 -6.097 -19.127 373 HG3 MET 46 HG3 MET 46 -36.065 -5.403 -19.164 374 HE1 MET 46 HE1 MET 46 -33.798 -8.207 -19.158 375 HE2 MET 46 HE2 MET 46 -34.785 -9.662 -19.007 376 HE3 MET 46 HE3 MET 46 -34.395 -9.021 -20.604 377 H ASN 47 H ASN 47 -36.750 -3.153 -22.474 378 HA ASN 47 HA ASN 47 -38.028 -2.073 -20.056 379 HB2 ASN 47 HB2 ASN 47 -38.723 -0.125 -21.660 380 HB3 ASN 47 HB3 ASN 47 -37.135 -0.103 -20.898 381 HD21 ASN 47 HD21 ASN 47 -35.310 -0.713 -22.148 382 HD22 ASN 47 HD22 ASN 47 -35.337 -0.574 -23.870 383 H TRP 48 H TRP 48 -39.931 -3.037 -19.860 384 HA TRP 48 HA TRP 48 -41.452 -3.662 -22.303 385 HB2 TRP 48 HB2 TRP 48 -40.647 -5.511 -20.607 386 HB3 TRP 48 HB3 TRP 48 -42.046 -4.975 -19.681 387 HD1 TRP 48 HD1 TRP 48 -44.349 -5.921 -20.381 388 HE1 TRP 48 HE1 TRP 48 -45.185 -7.425 -22.296 389 HE3 TRP 48 HE3 TRP 48 -40.110 -6.033 -23.238 390 HZ2 TRP 48 HZ2 TRP 48 -44.181 -8.515 -24.698 391 HZ3 TRP 48 HZ3 TRP 48 -40.131 -7.330 -25.328 392 HH2 TRP 48 HH2 TRP 48 -42.125 -8.545 -26.041 393 H THR 49 H THR 49 -42.904 -2.098 -22.623 394 HA THR 49 HA THR 49 -44.485 -0.492 -22.226 395 HB THR 49 HB THR 49 -46.268 -1.320 -20.502 396 HG1 THR 49 HG1 THR 49 -46.116 -3.622 -20.231 397 HG21 THR 49 HG21 THR 49 -47.254 -2.760 -22.191 398 HG22 THR 49 HG22 THR 49 -45.693 -2.922 -22.998 399 HG23 THR 49 HG23 THR 49 -46.509 -1.358 -22.960 400 H GLY 50 H GLY 50 -42.413 0.518 -21.089 401 HA2 GLY 50 HA2 GLY 50 -43.302 2.142 -19.028 402 HA3 GLY 50 HA3 GLY 50 -42.482 0.790 -18.260 403 H SER 51 H SER 51 -41.854 3.728 -18.513 404 HA SER 51 HA SER 51 -39.396 3.738 -20.056 405 HB2 SER 51 HB2 SER 51 -39.240 6.104 -19.361 406 HB3 SER 51 HB3 SER 51 -40.807 5.737 -20.083 407 HG SER 51 HG SER 51 -41.712 5.697 -18.043 408 H HIS 52 H HIS 52 -37.405 3.448 -19.269 409 HA HIS 52 HA HIS 52 -35.743 2.868 -17.822 410 HB2 HIS 52 HB2 HIS 52 -36.430 5.353 -17.199 411 HB3 HIS 52 HB3 HIS 52 -36.931 4.590 -15.693 412 HD1 HIS 52 HD1 HIS 52 -33.827 4.847 -17.870 413 HD2 HIS 52 HD2 HIS 52 -34.917 4.268 -13.903 414 HE1 HIS 52 HE1 HIS 52 -31.671 4.840 -16.575 415 H ASP 53 H ASP 53 -37.936 1.118 -17.834 416 HA ASP 53 HA ASP 53 -38.076 0.282 -15.010 417 HB2 ASP 53 HB2 ASP 53 -40.041 0.121 -17.256 418 HB3 ASP 53 HB3 ASP 53 -40.068 -1.136 -16.022 419 H THR 54 H THR 54 -36.431 -1.115 -14.753 420 HA THR 54 HA THR 54 -36.446 -3.520 -16.430 421 HB THR 54 HB THR 54 -34.656 -2.010 -17.277 422 HG1 THR 54 HG1 THR 54 -34.320 -4.206 -17.544 423 HG21 THR 54 HG21 THR 54 -34.057 -0.904 -15.192 424 HG22 THR 54 HG22 THR 54 -32.643 -1.691 -15.893 425 HG23 THR 54 HG23 THR 54 -33.478 -2.432 -14.528 426 H LYS 55 H LYS 55 -34.915 -5.216 -15.429 427 HA LYS 55 HA LYS 55 -35.111 -5.092 -12.492 428 HB2 LYS 55 HB2 LYS 55 -35.896 -7.271 -14.390 429 HB3 LYS 55 HB3 LYS 55 -35.344 -7.691 -12.774 430 HG2 LYS 55 HG2 LYS 55 -37.127 -5.891 -12.061 431 HG3 LYS 55 HG3 LYS 55 -37.822 -6.298 -13.632 432 HD2 LYS 55 HD2 LYS 55 -37.106 -8.342 -11.535 433 HD3 LYS 55 HD3 LYS 55 -38.714 -7.633 -11.706 434 HE2 LYS 55 HE2 LYS 55 -38.957 -9.541 -12.955 435 HE3 LYS 55 HE3 LYS 55 -38.442 -8.404 -14.200 436 HZ1 LYS 55 HZ1 LYS 55 -37.229 -10.798 -13.471 437 HZ2 LYS 55 HZ2 LYS 55 -36.174 -9.562 -13.001 438 HZ3 LYS 55 HZ3 LYS 55 -36.690 -9.669 -14.609 439 H GLN 56 H GLN 56 -33.163 -5.117 -11.602 440 HA GLN 56 HA GLN 56 -31.059 -6.743 -12.866 441 HB2 GLN 56 HB2 GLN 56 -30.910 -4.121 -12.966 442 HB3 GLN 56 HB3 GLN 56 -30.374 -4.288 -11.299 443 HG2 GLN 56 HG2 GLN 56 -28.451 -5.445 -11.902 444 HG3 GLN 56 HG3 GLN 56 -29.086 -5.864 -13.492 445 HE21 GLN 56 HE21 GLN 56 -27.340 -3.593 -11.641 446 HE22 GLN 56 HE22 GLN 56 -27.024 -2.458 -12.905 447 H GLN 57 H GLN 57 -29.445 -7.594 -11.421 448 HA GLN 57 HA GLN 57 -30.128 -7.575 -8.579 449 HB2 GLN 57 HB2 GLN 57 -30.009 -10.016 -10.335 450 HB3 GLN 57 HB3 GLN 57 -29.732 -10.117 -8.601 451 HG2 GLN 57 HG2 GLN 57 -31.984 -8.946 -8.351 452 HG3 GLN 57 HG3 GLN 57 -32.232 -9.335 -10.053 453 HE21 GLN 57 HE21 GLN 57 -32.753 -11.378 -10.631 454 HE22 GLN 57 HE22 GLN 57 -33.010 -12.667 -9.510 455 H VAL 58 H VAL 58 -28.392 -7.654 -7.254 456 HA VAL 58 HA VAL 58 -25.848 -7.058 -8.179 457 HB VAL 58 HB VAL 58 -25.041 -7.706 -5.905 458 HG11 VAL 58 HG11 VAL 58 -26.336 -5.522 -6.622 459 HG12 VAL 58 HG12 VAL 58 -27.533 -6.138 -5.481 460 HG13 VAL 58 HG13 VAL 58 -25.884 -5.813 -4.943 461 HG21 VAL 58 HG21 VAL 58 -26.811 -8.306 -4.237 462 HG22 VAL 58 HG22 VAL 58 -27.902 -8.599 -5.591 463 HG23 VAL 58 HG23 VAL 58 -26.444 -9.574 -5.408 464 H CYS 59 H CYS 59 -27.333 -10.173 -7.556 465 HA CYS 59 HA CYS 59 -24.964 -11.463 -8.726 466 HB2 CYS 59 HB2 CYS 59 -25.107 -13.293 -7.166 467 HB3 CYS 59 HB3 CYS 59 -25.026 -11.793 -6.250 468 HG CYS 59 HG CYS 59 -28.051 -13.204 -6.911 469 H LEU 60 H LEU 60 -25.356 -13.148 -10.118 470 HA LEU 60 HA LEU 60 -28.138 -13.976 -10.524 471 HB2 LEU 60 HB2 LEU 60 -28.109 -13.577 -12.834 472 HB3 LEU 60 HB3 LEU 60 -27.469 -12.111 -12.095 473 HG LEU 60 HG LEU 60 -25.166 -13.393 -12.610 474 HD11 LEU 60 HD11 LEU 60 -25.355 -15.079 -14.034 475 HD12 LEU 60 HD12 LEU 60 -26.154 -14.021 -15.198 476 HD13 LEU 60 HD13 LEU 60 -27.111 -14.906 -14.009 477 HD21 LEU 60 HD21 LEU 60 -25.847 -11.100 -13.268 478 HD22 LEU 60 HD22 LEU 60 -26.684 -11.786 -14.660 479 HD23 LEU 60 HD23 LEU 60 -24.933 -11.947 -14.516 480 H SER 61 H SER 61 -28.189 -15.823 -12.211 481 HA SER 61 HA SER 61 -25.851 -17.570 -11.821 482 HB2 SER 61 HB2 SER 61 -28.774 -18.229 -11.476 483 HB3 SER 61 HB3 SER 61 -27.561 -19.479 -11.751 484 HG SER 61 HG SER 61 -27.406 -17.564 -9.665 485 H PHE 62 H PHE 62 -25.372 -19.009 -13.492 486 HA PHE 62 HA PHE 62 -26.841 -18.552 -16.003 487 HB2 PHE 62 HB2 PHE 62 -23.902 -18.558 -15.449 488 HB3 PHE 62 HB3 PHE 62 -24.475 -19.108 -17.020 489 HD1 PHE 62 HD2 PHE 62 -26.400 -17.439 -17.992 490 HD2 PHE 62 HD1 PHE 62 -23.220 -16.382 -15.368 491 HE1 PHE 62 HE2 PHE 62 -26.552 -15.106 -18.755 492 HE2 PHE 62 HE1 PHE 62 -23.367 -14.045 -16.127 493 HZ PHE 62 HZ PHE 62 -25.033 -13.405 -17.823 494 H THR 63 H THR 63 -26.472 -20.317 -17.629 495 HA THR 63 HA THR 63 -26.948 -22.862 -16.346 496 HB THR 63 HB THR 63 -26.718 -22.547 -19.317 497 HG1 THR 63 HG1 THR 63 -28.852 -21.632 -17.667 498 HG21 THR 63 HG21 THR 63 -28.484 -24.213 -19.326 499 HG22 THR 63 HG22 THR 63 -28.613 -24.122 -17.570 500 HG23 THR 63 HG23 THR 63 -27.150 -24.764 -18.314 501 H THR 64 H THR 64 -24.564 -21.522 -18.614 502 HA THR 64 HA THR 64 -22.702 -23.636 -17.776 503 HB THR 64 HB THR 64 -21.867 -23.902 -20.040 504 HG1 THR 64 HG1 THR 64 -22.312 -21.844 -20.879 505 HG21 THR 64 HG21 THR 64 -23.704 -25.359 -19.366 506 HG22 THR 64 HG22 THR 64 -23.825 -24.970 -21.082 507 HG23 THR 64 HG23 THR 64 -24.875 -24.161 -19.919 508 H ARG 65 H ARG 65 -20.435 -23.100 -18.132 509 HA ARG 65 HA ARG 65 -19.754 -20.564 -17.188 510 HB2 ARG 65 HB2 ARG 65 -17.425 -21.174 -17.811 511 HB3 ARG 65 HB3 ARG 65 -18.254 -22.428 -16.897 512 HG2 ARG 65 HG2 ARG 65 -17.462 -23.792 -18.479 513 HG3 ARG 65 HG3 ARG 65 -18.809 -23.182 -19.442 514 HD2 ARG 65 HD2 ARG 65 -17.464 -21.972 -20.792 515 HD3 ARG 65 HD3 ARG 65 -16.372 -21.532 -19.480 516 HE ARG 65 HE ARG 65 -15.044 -23.304 -20.048 517 HH11 ARG 65 HH11 ARG 65 -18.186 -23.740 -21.483 518 HH12 ARG 65 HH12 ARG 65 -17.714 -25.125 -22.411 519 HH21 ARG 65 HH21 ARG 65 -14.411 -25.128 -21.263 520 HH22 ARG 65 HH22 ARG 65 -15.567 -25.914 -22.283 521 H GLU 66 H GLU 66 -19.805 -21.849 -20.482 522 HA GLU 66 HA GLU 66 -18.558 -19.803 -21.848 523 HB2 GLU 66 HB2 GLU 66 -20.673 -21.778 -22.540 524 HB3 GLU 66 HB3 GLU 66 -20.424 -20.439 -23.650 525 HG2 GLU 66 HG2 GLU 66 -18.384 -21.175 -24.308 526 HG3 GLU 66 HG3 GLU 66 -18.022 -21.911 -22.748 527 H LEU 67 H LEU 67 -21.743 -19.877 -20.431 528 HA LEU 67 HA LEU 67 -22.665 -17.500 -21.760 529 HB2 LEU 67 HB2 LEU 67 -23.711 -19.386 -19.743 530 HB3 LEU 67 HB3 LEU 67 -24.342 -17.741 -19.672 531 HG LEU 67 HG LEU 67 -24.427 -19.467 -22.143 532 HD11 LEU 67 HD11 LEU 67 -27.005 -19.171 -21.224 533 HD12 LEU 67 HD12 LEU 67 -26.083 -19.493 -19.755 534 HD13 LEU 67 HD13 LEU 67 -26.018 -20.627 -21.104 535 HD21 LEU 67 HD21 LEU 67 -26.031 -17.829 -22.929 536 HD22 LEU 67 HD22 LEU 67 -24.512 -17.037 -22.513 537 HD23 LEU 67 HD23 LEU 67 -25.889 -16.931 -21.417 538 H ALA 68 H ALA 68 -21.312 -18.303 -18.601 539 HA ALA 68 HA ALA 68 -21.679 -15.768 -17.411 540 HB1 ALA 68 HB1 ALA 68 -20.755 -18.225 -16.572 541 HB2 ALA 68 HB2 ALA 68 -19.328 -17.194 -16.468 542 HB3 ALA 68 HB3 ALA 68 -20.802 -16.748 -15.609 543 H ILE 69 H ILE 69 -18.606 -17.217 -18.506 544 HA ILE 69 HA ILE 69 -17.059 -14.935 -18.412 545 HB ILE 69 HB ILE 69 -16.840 -17.208 -20.391 546 HG12 ILE 69 HG12 ILE 69 -14.841 -17.447 -18.483 547 HG13 ILE 69 HG13 ILE 69 -16.240 -16.933 -17.547 548 HG21 ILE 69 HG21 ILE 69 -14.336 -16.402 -20.179 549 HG22 ILE 69 HG22 ILE 69 -15.442 -15.673 -21.342 550 HG23 ILE 69 HG23 ILE 69 -15.110 -14.860 -19.813 551 HD11 ILE 69 HD11 ILE 69 -15.654 -19.498 -18.203 552 HD12 ILE 69 HD12 ILE 69 -17.260 -18.906 -17.777 553 HD13 ILE 69 HD13 ILE 69 -16.798 -19.061 -19.471 554 H ALA 70 H ALA 70 -19.275 -15.996 -20.921 555 HA ALA 70 HA ALA 70 -18.540 -14.357 -23.024 556 HB1 ALA 70 HB1 ALA 70 -21.150 -14.362 -23.426 557 HB2 ALA 70 HB2 ALA 70 -20.181 -15.821 -23.636 558 HB3 ALA 70 HB3 ALA 70 -21.104 -15.581 -22.153 559 H TYR 71 H TYR 71 -20.562 -13.600 -20.221 560 HA TYR 71 HA TYR 71 -21.334 -11.018 -21.064 561 HB2 TYR 71 HB2 TYR 71 -22.532 -12.203 -19.298 562 HB3 TYR 71 HB3 TYR 71 -21.102 -12.161 -18.272 563 HD1 TYR 71 HD1 TYR 71 -22.602 -9.462 -20.359 564 HD2 TYR 71 HD2 TYR 71 -21.708 -10.858 -16.440 565 HE1 TYR 71 HE1 TYR 71 -23.340 -7.307 -19.429 566 HE2 TYR 71 HE2 TYR 71 -22.444 -8.708 -15.499 567 HH TYR 71 HH TYR 71 -23.761 -6.820 -16.031 568 H ALA 72 H ALA 72 -18.818 -12.053 -18.760 569 HA ALA 72 HA ALA 72 -17.759 -9.544 -18.196 570 HB1 ALA 72 HB1 ALA 72 -16.915 -11.105 -16.774 571 HB2 ALA 72 HB2 ALA 72 -16.748 -12.328 -18.035 572 HB3 ALA 72 HB3 ALA 72 -15.570 -11.021 -17.913 573 H VAL 73 H VAL 73 -16.568 -11.919 -20.581 574 HA VAL 73 HA VAL 73 -14.532 -10.418 -21.688 575 HB VAL 73 HB VAL 73 -16.360 -12.341 -23.135 576 HG11 VAL 73 HG11 VAL 73 -15.224 -11.200 -24.824 577 HG12 VAL 73 HG12 VAL 73 -13.741 -11.081 -23.875 578 HG13 VAL 73 HG13 VAL 73 -14.235 -12.634 -24.549 579 HG21 VAL 73 HG21 VAL 73 -15.111 -13.130 -21.048 580 HG22 VAL 73 HG22 VAL 73 -14.900 -14.070 -22.525 581 HG23 VAL 73 HG23 VAL 73 -13.643 -12.945 -22.008 582 H ALA 74 H ALA 74 -17.983 -10.208 -22.233 583 HA ALA 74 HA ALA 74 -18.110 -8.786 -24.595 584 HB1 ALA 74 HB1 ALA 74 -19.987 -9.653 -23.019 585 HB2 ALA 74 HB2 ALA 74 -19.898 -8.036 -22.320 586 HB3 ALA 74 HB3 ALA 74 -20.281 -8.238 -24.029 587 H HIS 75 H HIS 75 -17.241 -7.666 -21.388 588 HA HIS 75 HA HIS 75 -16.647 -5.019 -22.540 589 HB2 HIS 75 HB2 HIS 75 -17.836 -5.739 -19.874 590 HB3 HIS 75 HB3 HIS 75 -16.980 -4.217 -20.101 591 HD1 HIS 75 HD1 HIS 75 -19.676 -6.037 -22.093 592 HD2 HIS 75 HD2 HIS 75 -18.775 -2.272 -20.586 593 HE1 HIS 75 HE1 HIS 75 -21.584 -4.557 -22.796 594 H LYS 76 H LYS 76 -15.001 -7.487 -22.181 595 HA LYS 76 HA LYS 76 -12.921 -8.106 -21.485 596 HB2 LYS 76 HB2 LYS 76 -12.589 -5.102 -21.513 597 HB3 LYS 76 HB3 LYS 76 -11.256 -6.237 -21.350 598 HG2 LYS 76 HG2 LYS 76 -11.383 -6.919 -23.530 599 HG3 LYS 76 HG3 LYS 76 -13.098 -6.523 -23.669 600 HD2 LYS 76 HD2 LYS 76 -11.082 -4.350 -23.262 601 HD3 LYS 76 HD3 LYS 76 -11.328 -5.038 -24.869 602 HE2 LYS 76 HE2 LYS 76 -13.705 -4.488 -24.743 603 HE3 LYS 76 HE3 LYS 76 -13.473 -3.824 -23.126 604 HZ1 LYS 76 HZ1 LYS 76 -11.631 -2.581 -24.794 605 HZ2 LYS 76 HZ2 LYS 76 -12.993 -1.894 -24.063 606 HZ3 LYS 76 HZ3 LYS 76 -13.111 -2.557 -25.614 607 H ILE 77 H ILE 77 -14.910 -7.854 -19.428 608 HA ILE 77 HA ILE 77 -13.672 -6.631 -17.134 609 HB ILE 77 HB ILE 77 -16.033 -8.511 -17.256 610 HG12 ILE 77 HG12 ILE 77 -15.987 -5.491 -17.088 611 HG13 ILE 77 HG13 ILE 77 -16.325 -6.404 -18.554 612 HG21 ILE 77 HG21 ILE 77 -15.785 -8.562 -15.039 613 HG22 ILE 77 HG22 ILE 77 -14.589 -7.266 -15.064 614 HG23 ILE 77 HG23 ILE 77 -16.309 -6.877 -15.051 615 HD11 ILE 77 HD11 ILE 77 -18.227 -7.473 -17.241 616 HD12 ILE 77 HD12 ILE 77 -17.977 -6.179 -16.068 617 HD13 ILE 77 HD13 ILE 77 -18.415 -5.790 -17.731 618 H ASP 78 H ASP 78 -12.591 -7.604 -15.481 619 HA ASP 78 HA ASP 78 -11.291 -10.082 -16.029 620 HB2 ASP 78 HB2 ASP 78 -11.326 -8.345 -13.554 621 HB3 ASP 78 HB3 ASP 78 -10.300 -9.764 -13.751 622 H TYR 79 H TYR 79 -12.488 -11.890 -15.988 623 HA TYR 79 HA TYR 79 -14.389 -12.290 -13.794 624 HB2 TYR 79 HB2 TYR 79 -15.224 -14.188 -15.157 625 HB3 TYR 79 HB3 TYR 79 -15.303 -12.650 -16.011 626 HD1 TYR 79 HD2 TYR 79 -13.650 -15.916 -15.841 627 HD2 TYR 79 HD1 TYR 79 -13.888 -12.218 -17.931 628 HE1 TYR 79 HE2 TYR 79 -12.379 -16.895 -17.705 629 HE2 TYR 79 HE1 TYR 79 -12.618 -13.186 -19.802 630 HH TYR 79 HH TYR 79 -11.427 -16.532 -19.676 631 H THR 80 H THR 80 -14.082 -13.766 -12.235 632 HA THR 80 HA THR 80 -11.639 -15.401 -12.386 633 HB THR 80 HB THR 80 -11.601 -13.831 -10.530 634 HG1 THR 80 HG1 THR 80 -10.624 -15.749 -10.010 635 HG21 THR 80 HG21 THR 80 -14.040 -13.566 -10.269 636 HG22 THR 80 HG22 THR 80 -13.242 -13.917 -8.735 637 HG23 THR 80 HG23 THR 80 -14.128 -15.186 -9.580 638 H VAL 81 H VAL 81 -11.771 -17.561 -12.320 639 HA VAL 81 HA VAL 81 -14.428 -18.764 -12.135 640 HB VAL 81 HB VAL 81 -13.282 -20.829 -12.960 641 HG11 VAL 81 HG11 VAL 81 -12.939 -19.985 -15.255 642 HG12 VAL 81 HG12 VAL 81 -14.417 -19.366 -14.515 643 HG13 VAL 81 HG13 VAL 81 -12.990 -18.336 -14.633 644 HG21 VAL 81 HG21 VAL 81 -10.940 -19.619 -14.025 645 HG22 VAL 81 HG22 VAL 81 -10.962 -19.342 -12.284 646 HG23 VAL 81 HG23 VAL 81 -11.066 -20.985 -12.916 647 H LEU 82 H LEU 82 -15.097 -19.693 -10.323 648 HA LEU 82 HA LEU 82 -13.089 -20.523 -8.339 649 HB2 LEU 82 HB2 LEU 82 -15.973 -19.714 -8.021 650 HB3 LEU 82 HB3 LEU 82 -14.992 -20.383 -6.718 651 HG LEU 82 HG LEU 82 -14.295 -17.838 -8.172 652 HD11 LEU 82 HD11 LEU 82 -15.506 -17.895 -5.445 653 HD12 LEU 82 HD12 LEU 82 -16.546 -17.925 -6.869 654 HD13 LEU 82 HD13 LEU 82 -15.434 -16.578 -6.617 655 HD21 LEU 82 HD21 LEU 82 -13.242 -19.303 -5.792 656 HD22 LEU 82 HD22 LEU 82 -13.101 -17.547 -5.877 657 HD23 LEU 82 HD23 LEU 82 -12.368 -18.552 -7.127 658 H GLN 83 H GLN 83 -12.797 -22.625 -8.062 659 HA GLN 83 HA GLN 83 -14.912 -24.469 -8.943 660 HB2 GLN 83 HB2 GLN 83 -11.964 -25.002 -8.537 661 HB3 GLN 83 HB3 GLN 83 -13.145 -26.157 -9.140 662 HG2 GLN 83 HG2 GLN 83 -13.567 -24.457 -11.008 663 HG3 GLN 83 HG3 GLN 83 -12.056 -23.715 -10.484 664 HE21 GLN 83 HE21 GLN 83 -12.489 -24.813 -13.029 665 HE22 GLN 83 HE22 GLN 83 -11.439 -26.172 -13.218 666 H ASP 84 H ASP 84 -15.149 -26.484 -7.699 667 HA ASP 84 HA ASP 84 -15.606 -25.961 -4.971 668 HB2 ASP 84 HB2 ASP 84 -15.626 -28.456 -6.644 669 HB3 ASP 84 HB3 ASP 84 -15.838 -28.552 -4.898 670 H ASN 85 H ASN 85 -14.239 -25.916 -3.325 671 HA ASN 85 HA ASN 85 -11.769 -27.513 -3.499 672 HB2 ASN 85 HB2 ASN 85 -11.481 -24.991 -3.744 673 HB3 ASN 85 HB3 ASN 85 -11.979 -24.870 -2.060 674 HD21 ASN 85 HD21 ASN 85 -9.427 -25.443 -4.197 675 HD22 ASN 85 HD22 ASN 85 -8.224 -25.872 -3.032 676 HA PRO 86 HA PRO 86 -14.198 -28.749 0.264 677 HB2 PRO 86 HB2 PRO 86 -13.873 -31.417 -0.116 678 HB3 PRO 86 HB3 PRO 86 -15.186 -30.494 -0.856 679 HG2 PRO 86 HG2 PRO 86 -12.586 -31.375 -2.049 680 HG3 PRO 86 HG3 PRO 86 -14.211 -31.406 -2.759 681 HD2 PRO 86 HD2 PRO 86 -12.400 -29.481 -3.346 682 HD3 PRO 86 HD3 PRO 86 -14.148 -29.169 -3.313 683 H ARG 87 H ARG 87 -13.426 -30.437 1.961 684 HA ARG 87 HA ARG 87 -10.680 -29.778 2.584 685 HB2 ARG 87 HB2 ARG 87 -12.691 -31.415 4.142 686 HB3 ARG 87 HB3 ARG 87 -11.139 -30.847 4.743 687 HG2 ARG 87 HG2 ARG 87 -13.421 -29.085 3.873 688 HG3 ARG 87 HG3 ARG 87 -13.002 -29.479 5.542 689 HD2 ARG 87 HD2 ARG 87 -10.741 -28.491 5.110 690 HD3 ARG 87 HD3 ARG 87 -11.349 -27.939 3.549 691 HE ARG 87 HE ARG 87 -12.391 -26.226 4.630 692 HH11 ARG 87 HH11 ARG 87 -11.743 -28.755 6.932 693 HH12 ARG 87 HH12 ARG 87 -12.299 -27.838 8.293 694 HH21 ARG 87 HH21 ARG 87 -13.126 -25.008 6.413 695 HH22 ARG 87 HH22 ARG 87 -13.087 -25.707 7.996 696 H THR 88 H THR 88 -8.996 -31.011 2.101 697 HA THR 88 HA THR 88 -9.433 -33.898 1.687 698 HB THR 88 HB THR 88 -7.275 -32.373 0.253 699 HG1 THR 88 HG1 THR 88 -9.248 -31.400 -0.342 700 HG21 THR 88 HG21 THR 88 -8.643 -34.653 -0.997 701 HG22 THR 88 HG22 THR 88 -7.765 -35.041 0.483 702 HG23 THR 88 HG23 THR 88 -6.921 -34.294 -0.873 703 H ILE 89 H ILE 89 -8.441 -35.050 3.196 704 HA ILE 89 HA ILE 89 -6.653 -34.105 5.085 705 HB ILE 89 HB ILE 89 -6.120 -36.436 5.595 706 HG12 ILE 89 HG12 ILE 89 -7.676 -37.090 3.082 707 HG13 ILE 89 HG13 ILE 89 -5.932 -37.237 3.263 708 HG21 ILE 89 HG21 ILE 89 -9.034 -36.384 4.906 709 HG22 ILE 89 HG22 ILE 89 -8.237 -37.051 6.330 710 HG23 ILE 89 HG23 ILE 89 -8.372 -35.304 6.133 711 HD11 ILE 89 HD11 ILE 89 -8.072 -38.837 4.627 712 HD12 ILE 89 HD12 ILE 89 -6.824 -39.401 3.515 713 HD13 ILE 89 HD13 ILE 89 -6.383 -38.857 5.134 714 H VAL 90 H VAL 90 -4.454 -34.033 5.288 715 HA VAL 90 HA VAL 90 -2.853 -34.845 2.955 716 HB VAL 90 HB VAL 90 -3.077 -32.463 2.766 717 HG11 VAL 90 HG11 VAL 90 -3.581 -31.328 4.618 718 HG12 VAL 90 HG12 VAL 90 -2.879 -32.565 5.663 719 HG13 VAL 90 HG13 VAL 90 -1.850 -31.319 4.957 720 HG21 VAL 90 HG21 VAL 90 -0.642 -33.787 3.022 721 HG22 VAL 90 HG22 VAL 90 -0.929 -32.241 2.222 722 HG23 VAL 90 HG23 VAL 90 -0.434 -32.280 3.913 723 HA PRO 91 HA PRO 91 -1.107 -36.657 6.839 724 HB2 PRO 91 HB2 PRO 91 -0.578 -39.080 5.733 725 HB3 PRO 91 HB3 PRO 91 -2.150 -38.662 6.426 726 HG2 PRO 91 HG2 PRO 91 -1.285 -38.671 3.560 727 HG3 PRO 91 HG3 PRO 91 -2.800 -39.255 4.273 728 HD2 PRO 91 HD2 PRO 91 -2.604 -36.858 3.029 729 HD3 PRO 91 HD3 PRO 91 -3.705 -37.139 4.392 730 H LYS 92 H LYS 92 1.045 -36.974 7.339 731 HA LYS 92 HA LYS 92 2.948 -36.010 5.398 732 HB2 LYS 92 HB2 LYS 92 4.559 -36.117 7.232 733 HB3 LYS 92 HB3 LYS 92 3.088 -35.300 7.741 734 HG2 LYS 92 HG2 LYS 92 2.441 -37.730 8.550 735 HG3 LYS 92 HG3 LYS 92 4.196 -37.923 8.580 736 HD2 LYS 92 HD2 LYS 92 2.953 -35.518 9.844 737 HD3 LYS 92 HD3 LYS 92 2.928 -37.061 10.699 738 HE2 LYS 92 HE2 LYS 92 5.339 -37.204 10.584 739 HE3 LYS 92 HE3 LYS 92 5.410 -35.734 9.613 740 HZ1 LYS 92 HZ1 LYS 92 4.016 -35.004 11.843 741 HZ2 LYS 92 HZ2 LYS 92 5.644 -34.665 11.530 742 HZ3 LYS 92 HZ3 LYS 92 5.224 -36.023 12.448 743 H SER 93 H SER 93 4.263 -37.188 4.163 744 HA SER 93 HA SER 93 5.309 -39.718 4.896 745 HB2 SER 93 HB2 SER 93 4.111 -40.842 2.817 746 HB3 SER 93 HB3 SER 93 3.348 -40.832 4.407 747 HG SER 93 HG SER 93 2.628 -39.525 2.093 748 H TYR 94 H TYR 94 7.018 -40.281 3.618 749 HA TYR 94 HA TYR 94 7.389 -39.455 0.946 750 HB2 TYR 94 HB2 TYR 94 9.290 -37.856 1.379 751 HB3 TYR 94 HB3 TYR 94 7.693 -37.235 1.774 752 HD1 TYR 94 HD1 TYR 94 7.013 -36.962 4.123 753 HD2 TYR 94 HD2 TYR 94 10.942 -38.222 3.085 754 HE1 TYR 94 HE1 TYR 94 7.779 -36.427 6.398 755 HE2 TYR 94 HE2 TYR 94 11.719 -37.692 5.358 756 HH TYR 94 HH TYR 94 11.108 -36.349 7.245 757 H ALA 95 H ALA 95 8.870 -40.743 0.038 758 HA ALA 95 HA ALA 95 10.227 -42.688 1.627 759 HB1 ALA 95 HB1 ALA 95 9.291 -43.032 -0.698 760 HB2 ALA 95 HB2 ALA 95 10.704 -42.160 -1.294 761 HB3 ALA 95 HB3 ALA 95 10.910 -43.671 -0.407 762 H ASP 96 H ASP 96 11.841 -41.941 2.889 763 HA ASP 96 HA ASP 96 13.636 -39.875 2.123 764 HB2 ASP 96 HB2 ASP 96 13.054 -40.496 4.489 765 HB3 ASP 96 HB3 ASP 96 14.046 -41.939 4.292 766 H ASN 97 H ASN 97 14.918 -40.180 0.404 767 HA ASN 97 HA ASN 97 16.612 -42.589 0.385 768 HB2 ASN 97 HB2 ASN 97 15.255 -41.214 -1.934 769 HB3 ASN 97 HB3 ASN 97 16.606 -42.322 -2.152 770 HD21 ASN 97 HD21 ASN 97 13.291 -42.040 -1.911 771 HD22 ASN 97 HD22 ASN 97 12.899 -43.709 -1.696 772 H PHE 98 H PHE 98 18.455 -41.732 1.208 773 HA PHE 98 HA PHE 98 19.574 -39.378 -0.165 774 HB2 PHE 98 HB2 PHE 98 20.934 -39.043 1.898 775 HB3 PHE 98 HB3 PHE 98 19.200 -38.904 2.175 776 HD1 PHE 98 HD2 PHE 98 22.190 -40.923 2.770 777 HD2 PHE 98 HD1 PHE 98 18.014 -40.533 3.492 778 HE1 PHE 98 HE2 PHE 98 22.344 -42.611 4.554 779 HE2 PHE 98 HE1 PHE 98 18.161 -42.220 5.277 780 HZ PHE 98 HZ PHE 98 20.328 -43.263 5.809 781 H THR 99 H THR 99 21.676 -39.431 -0.897 782 HA THR 99 HA THR 99 23.197 -41.910 -0.548 783 HB THR 99 HB THR 99 22.601 -40.672 -3.242 784 HG1 THR 99 HG1 THR 99 21.071 -42.123 -3.309 785 HG21 THR 99 HG21 THR 99 23.821 -42.946 -3.873 786 HG22 THR 99 HG22 THR 99 24.614 -42.658 -2.324 787 HG23 THR 99 HG23 THR 99 24.718 -41.452 -3.607 788 H LYS 100 H LYS 100 25.327 -41.584 -0.287 789 HA LYS 100 HA LYS 100 26.669 -39.282 -1.377 790 HB2 LYS 100 HB2 LYS 100 27.515 -38.642 0.977 791 HB3 LYS 100 HB3 LYS 100 25.916 -38.096 0.488 792 HG2 LYS 100 HG2 LYS 100 24.838 -39.505 1.934 793 HG3 LYS 100 HG3 LYS 100 26.163 -40.672 1.958 794 HD2 LYS 100 HD2 LYS 100 27.445 -39.344 3.419 795 HD3 LYS 100 HD3 LYS 100 26.441 -37.919 3.134 796 HE2 LYS 100 HE2 LYS 100 24.536 -39.269 4.164 797 HE3 LYS 100 HE3 LYS 100 25.781 -40.391 4.712 798 HZ1 LYS 100 HZ1 LYS 100 25.188 -38.712 6.387 799 HZ2 LYS 100 HZ2 LYS 100 25.729 -37.491 5.349 800 HZ3 LYS 100 HZ3 LYS 100 26.821 -38.635 5.951 801 HA PRO 101 HA PRO 101 30.140 -41.963 -1.237 802 HB2 PRO 101 HB2 PRO 101 32.188 -40.208 -0.918 803 HB3 PRO 101 HB3 PRO 101 31.287 -40.368 -2.431 804 HG2 PRO 101 HG2 PRO 101 30.988 -38.336 -0.252 805 HG3 PRO 101 HG3 PRO 101 30.976 -38.102 -2.010 806 HD2 PRO 101 HD2 PRO 101 28.707 -38.188 -0.536 807 HD3 PRO 101 HD3 PRO 101 28.780 -38.773 -2.210 808 H ARG 102 H ARG 102 32.255 -42.336 0.068 809 HA ARG 102 HA ARG 102 32.014 -41.613 2.878 810 HB2 ARG 102 HB2 ARG 102 30.694 -43.762 2.401 811 HB3 ARG 102 HB3 ARG 102 32.259 -44.520 2.136 812 HG2 ARG 102 HG2 ARG 102 32.900 -44.250 4.363 813 HG3 ARG 102 HG3 ARG 102 31.654 -43.037 4.668 814 HD2 ARG 102 HD2 ARG 102 30.972 -45.077 5.711 815 HD3 ARG 102 HD3 ARG 102 29.942 -44.812 4.307 816 HE ARG 102 HE ARG 102 31.938 -46.390 3.357 817 HH11 ARG 102 HH11 ARG 102 29.718 -46.627 6.028 818 HH12 ARG 102 HH12 ARG 102 29.665 -48.359 5.999 819 HH21 ARG 102 HH21 ARG 102 31.877 -48.670 3.309 820 HH22 ARG 102 HH22 ARG 102 30.894 -49.520 4.452 821 H ASP 103 H ASP 103 33.934 -41.912 4.072 822 HA ASP 103 HA ASP 103 36.322 -41.977 2.404 823 HB2 ASP 103 HB2 ASP 103 35.955 -41.277 5.326 824 HB3 ASP 103 HB3 ASP 103 37.477 -41.168 4.445 825 H MET 104 H MET 104 38.249 -43.153 3.176 826 HA MET 104 HA MET 104 37.476 -45.822 4.092 827 HB2 MET 104 HB2 MET 104 38.856 -45.335 1.956 828 HB3 MET 104 HB3 MET 104 40.197 -45.071 3.062 829 HG2 MET 104 HG2 MET 104 38.627 -47.577 3.324 830 HG3 MET 104 HG3 MET 104 39.743 -47.418 1.970 831 HE1 MET 104 HE1 MET 104 42.092 -49.569 4.043 832 HE2 MET 104 HE2 MET 104 40.432 -49.778 3.483 833 HE3 MET 104 HE3 MET 104 41.641 -49.068 2.413 Start of MODEL 16 1 H1 MET 1 H MET 1 -0.027 -5.164 -2.992 2 HA MET 1 HA MET 1 -2.610 -6.437 -2.732 3 HB2 MET 1 HB2 MET 1 -0.793 -4.936 -0.876 4 HB3 MET 1 HB3 MET 1 -2.464 -5.240 -0.420 5 HG2 MET 1 HG2 MET 1 -2.155 -7.561 -0.405 6 HG3 MET 1 HG3 MET 1 -0.638 -7.448 -1.292 7 HE1 MET 1 HE1 MET 1 1.973 -6.439 1.125 8 HE2 MET 1 HE2 MET 1 1.680 -7.989 0.337 9 HE3 MET 1 HE3 MET 1 1.390 -6.486 -0.539 10 H GLN 2 H GLN 2 -1.519 -3.111 -2.027 11 HA GLN 2 HA GLN 2 -4.210 -2.128 -2.486 12 HB2 GLN 2 HB2 GLN 2 -1.697 -1.007 -1.338 13 HB3 GLN 2 HB3 GLN 2 -2.887 0.117 -1.981 14 HG2 GLN 2 HG2 GLN 2 -3.589 -1.998 0.030 15 HG3 GLN 2 HG3 GLN 2 -3.011 -0.397 0.491 16 HE21 GLN 2 HE21 GLN 2 -4.226 1.380 -0.868 17 HE22 GLN 2 HE22 GLN 2 -5.948 1.243 -0.822 18 H GLU 3 H GLU 3 -4.640 -2.190 -4.647 19 HA GLU 3 HA GLU 3 -3.022 -0.403 -6.326 20 HB2 GLU 3 HB2 GLU 3 -4.069 -3.122 -7.130 21 HB3 GLU 3 HB3 GLU 3 -3.342 -1.962 -8.233 22 HG2 GLU 3 HG2 GLU 3 -1.227 -2.248 -7.354 23 HG3 GLU 3 HG3 GLU 3 -1.836 -2.882 -5.826 24 H GLN 4 H GLN 4 -4.314 -0.162 -8.548 25 HA GLN 4 HA GLN 4 -7.102 0.446 -7.815 26 HB2 GLN 4 HB2 GLN 4 -5.126 1.971 -9.490 27 HB3 GLN 4 HB3 GLN 4 -6.857 2.224 -9.671 28 HG2 GLN 4 HG2 GLN 4 -7.038 2.896 -7.358 29 HG3 GLN 4 HG3 GLN 4 -5.329 2.549 -7.099 30 HE21 GLN 4 HE21 GLN 4 -7.081 5.034 -7.000 31 HE22 GLN 4 HE22 GLN 4 -6.192 6.201 -7.913 32 H VAL 5 H VAL 5 -8.647 -0.483 -8.988 33 HA VAL 5 HA VAL 5 -7.877 -1.762 -11.530 34 HB VAL 5 HB VAL 5 -10.164 -2.550 -9.722 35 HG11 VAL 5 HG11 VAL 5 -10.830 -3.894 -11.360 36 HG12 VAL 5 HG12 VAL 5 -9.637 -3.131 -12.414 37 HG13 VAL 5 HG13 VAL 5 -9.215 -4.586 -11.509 38 HG21 VAL 5 HG21 VAL 5 -8.407 -4.628 -9.655 39 HG22 VAL 5 HG22 VAL 5 -7.314 -3.244 -9.676 40 HG23 VAL 5 HG23 VAL 5 -8.538 -3.382 -8.414 41 H SER 6 H SER 6 -8.488 -0.455 -13.141 42 HA SER 6 HA SER 6 -10.638 1.371 -13.015 43 HB2 SER 6 HB2 SER 6 -8.818 1.764 -14.553 44 HB3 SER 6 HB3 SER 6 -9.132 0.242 -15.384 45 HG SER 6 HG SER 6 -10.654 1.178 -16.490 46 H ASN 7 H ASN 7 -10.389 -1.344 -15.304 47 HA ASN 7 HA ASN 7 -13.136 -1.465 -15.835 48 HB2 ASN 7 HB2 ASN 7 -11.090 -3.679 -16.099 49 HB3 ASN 7 HB3 ASN 7 -12.660 -3.624 -16.894 50 HD21 ASN 7 HD21 ASN 7 -12.805 -2.681 -18.816 51 HD22 ASN 7 HD22 ASN 7 -11.562 -1.744 -19.566 52 H VAL 8 H VAL 8 -14.801 -2.638 -14.998 53 HA VAL 8 HA VAL 8 -14.782 -3.337 -12.300 54 HB VAL 8 HB VAL 8 -16.924 -4.587 -12.841 55 HG11 VAL 8 HG11 VAL 8 -16.333 -1.738 -13.136 56 HG12 VAL 8 HG12 VAL 8 -17.849 -2.239 -13.889 57 HG13 VAL 8 HG13 VAL 8 -17.569 -2.547 -12.175 58 HG21 VAL 8 HG21 VAL 8 -15.878 -4.509 -15.429 59 HG22 VAL 8 HG22 VAL 8 -17.481 -5.059 -14.943 60 HG23 VAL 8 HG23 VAL 8 -17.238 -3.386 -15.441 61 H ARG 9 H ARG 9 -15.763 -5.691 -11.742 62 HA ARG 9 HA ARG 9 -14.185 -7.763 -13.064 63 HB2 ARG 9 HB2 ARG 9 -13.260 -8.591 -10.983 64 HB3 ARG 9 HB3 ARG 9 -12.795 -6.909 -11.204 65 HG2 ARG 9 HG2 ARG 9 -13.760 -6.305 -9.300 66 HG3 ARG 9 HG3 ARG 9 -15.260 -7.136 -9.716 67 HD2 ARG 9 HD2 ARG 9 -14.543 -8.225 -7.785 68 HD3 ARG 9 HD3 ARG 9 -14.008 -9.286 -9.086 69 HE ARG 9 HE ARG 9 -11.860 -8.913 -8.426 70 HH11 ARG 9 HH11 ARG 9 -13.856 -6.333 -7.211 71 HH12 ARG 9 HH12 ARG 9 -12.578 -5.597 -6.301 72 HH21 ARG 9 HH21 ARG 9 -10.169 -7.954 -7.232 73 HH22 ARG 9 HH22 ARG 9 -10.481 -6.519 -6.315 74 H ALA 10 H ALA 10 -14.997 -9.857 -12.816 75 HA ALA 10 HA ALA 10 -17.674 -10.002 -11.590 76 HB1 ALA 10 HB1 ALA 10 -18.487 -10.744 -13.515 77 HB2 ALA 10 HB2 ALA 10 -16.907 -10.484 -14.258 78 HB3 ALA 10 HB3 ALA 10 -17.302 -12.050 -13.548 79 H ARG 11 H ARG 11 -18.309 -12.073 -10.720 80 HA ARG 11 HA ARG 11 -16.013 -13.720 -9.883 81 HB2 ARG 11 HB2 ARG 11 -17.630 -12.186 -8.238 82 HB3 ARG 11 HB3 ARG 11 -18.305 -13.802 -8.082 83 HG2 ARG 11 HG2 ARG 11 -16.072 -14.653 -7.494 84 HG3 ARG 11 HG3 ARG 11 -15.445 -13.005 -7.585 85 HD2 ARG 11 HD2 ARG 11 -17.818 -13.411 -5.875 86 HD3 ARG 11 HD3 ARG 11 -16.319 -14.148 -5.311 87 HE ARG 11 HE ARG 11 -16.962 -11.367 -5.332 88 HH11 ARG 11 HH11 ARG 11 -14.343 -13.647 -5.581 89 HH12 ARG 11 HH12 ARG 11 -13.146 -12.535 -5.006 90 HH21 ARG 11 HH21 ARG 11 -15.394 -9.892 -4.574 91 HH22 ARG 11 HH22 ARG 11 -13.745 -10.399 -4.433 92 H ILE 12 H ILE 12 -16.180 -15.475 -11.158 93 HA ILE 12 HA ILE 12 -18.804 -16.705 -11.566 94 HB ILE 12 HB ILE 12 -16.143 -17.303 -12.863 95 HG12 ILE 12 HG12 ILE 12 -18.635 -16.015 -13.999 96 HG13 ILE 12 HG13 ILE 12 -17.193 -15.138 -13.496 97 HG21 ILE 12 HG21 ILE 12 -17.478 -19.315 -12.735 98 HG22 ILE 12 HG22 ILE 12 -18.875 -18.463 -13.392 99 HG23 ILE 12 HG23 ILE 12 -17.450 -18.725 -14.397 100 HD11 ILE 12 HD11 ILE 12 -16.067 -16.855 -15.194 101 HD12 ILE 12 HD12 ILE 12 -17.680 -16.771 -15.902 102 HD13 ILE 12 HD13 ILE 12 -16.731 -15.300 -15.695 103 H TYR 13 H TYR 13 -19.425 -18.436 -10.460 104 HA TYR 13 HA TYR 13 -17.363 -20.084 -9.150 105 HB2 TYR 13 HB2 TYR 13 -18.689 -18.584 -7.591 106 HB3 TYR 13 HB3 TYR 13 -20.102 -19.548 -8.002 107 HD1 TYR 13 HD2 TYR 13 -20.095 -22.009 -7.450 108 HD2 TYR 13 HD1 TYR 13 -17.133 -19.332 -5.981 109 HE1 TYR 13 HE2 TYR 13 -19.498 -23.636 -5.705 110 HE2 TYR 13 HE1 TYR 13 -16.527 -20.952 -4.232 111 HH TYR 13 HH TYR 13 -16.729 -23.578 -4.007 112 H LYS 14 H LYS 14 -17.687 -22.291 -9.109 113 HA LYS 14 HA LYS 14 -19.916 -23.276 -10.767 114 HB2 LYS 14 HB2 LYS 14 -17.841 -23.638 -11.919 115 HB3 LYS 14 HB3 LYS 14 -17.096 -24.315 -10.477 116 HG2 LYS 14 HG2 LYS 14 -17.686 -26.033 -12.118 117 HG3 LYS 14 HG3 LYS 14 -18.546 -26.246 -10.591 118 HD2 LYS 14 HD2 LYS 14 -20.570 -25.762 -11.508 119 HD3 LYS 14 HD3 LYS 14 -19.890 -24.626 -12.676 120 HE2 LYS 14 HE2 LYS 14 -20.767 -26.587 -13.808 121 HE3 LYS 14 HE3 LYS 14 -19.015 -26.507 -13.981 122 HZ1 LYS 14 HZ1 LYS 14 -20.179 -28.727 -13.329 123 HZ2 LYS 14 HZ2 LYS 14 -20.150 -28.069 -11.771 124 HZ3 LYS 14 HZ3 LYS 14 -18.704 -28.300 -12.619 125 HA PRO 15 HA PRO 15 -20.721 -25.047 -6.627 126 HB2 PRO 15 HB2 PRO 15 -23.409 -25.179 -6.984 127 HB3 PRO 15 HB3 PRO 15 -22.581 -23.710 -6.452 128 HG2 PRO 15 HG2 PRO 15 -23.540 -24.462 -9.188 129 HG3 PRO 15 HG3 PRO 15 -23.663 -22.905 -8.348 130 HD2 PRO 15 HD2 PRO 15 -21.779 -23.401 -10.228 131 HD3 PRO 15 HD3 PRO 15 -21.490 -22.320 -8.850 132 H ALA 16 H ALA 16 -20.741 -27.169 -6.189 133 HA ALA 16 HA ALA 16 -20.949 -29.073 -8.319 134 HB1 ALA 16 HB1 ALA 16 -19.373 -29.239 -6.367 135 HB2 ALA 16 HB2 ALA 16 -20.765 -29.678 -5.378 136 HB3 ALA 16 HB3 ALA 16 -20.285 -30.704 -6.729 137 H LYS 17 H LYS 17 -22.304 -31.067 -8.074 138 HA LYS 17 HA LYS 17 -24.990 -30.350 -7.093 139 HB2 LYS 17 HB2 LYS 17 -24.241 -32.128 -9.421 140 HB3 LYS 17 HB3 LYS 17 -25.881 -31.829 -8.860 141 HG2 LYS 17 HG2 LYS 17 -25.744 -30.355 -10.600 142 HG3 LYS 17 HG3 LYS 17 -25.238 -29.324 -9.260 143 HD2 LYS 17 HD2 LYS 17 -23.023 -29.340 -9.910 144 HD3 LYS 17 HD3 LYS 17 -23.183 -30.864 -10.785 145 HE2 LYS 17 HE2 LYS 17 -24.668 -28.442 -11.717 146 HE3 LYS 17 HE3 LYS 17 -22.954 -28.619 -12.094 147 HZ1 LYS 17 HZ1 LYS 17 -25.085 -29.736 -13.449 148 HZ2 LYS 17 HZ2 LYS 17 -24.342 -31.025 -12.646 149 HZ3 LYS 17 HZ3 LYS 17 -23.441 -30.050 -13.694 150 H SER 18 H SER 18 -23.119 -31.518 -5.385 151 HA SER 18 HA SER 18 -23.834 -34.351 -5.252 152 HB2 SER 18 HB2 SER 18 -21.435 -33.486 -4.964 153 HB3 SER 18 HB3 SER 18 -21.959 -32.909 -3.382 154 HG SER 18 HG SER 18 -21.031 -35.034 -3.344 155 H THR 19 H THR 19 -25.859 -32.408 -4.730 156 HA THR 19 HA THR 19 -26.212 -32.435 -1.834 157 HB THR 19 HB THR 19 -28.184 -31.308 -3.807 158 HG1 THR 19 HG1 THR 19 -26.617 -29.990 -4.370 159 HG21 THR 19 HG21 THR 19 -29.250 -30.792 -1.917 160 HG22 THR 19 HG22 THR 19 -27.917 -29.704 -1.526 161 HG23 THR 19 HG23 THR 19 -27.900 -31.367 -0.940 162 H MET 20 H MET 20 -27.829 -33.526 -0.772 163 HA MET 20 HA MET 20 -29.259 -35.546 -2.367 164 HB2 MET 20 HB2 MET 20 -27.980 -35.609 0.314 165 HB3 MET 20 HB3 MET 20 -29.452 -36.547 0.107 166 HG2 MET 20 HG2 MET 20 -27.068 -36.789 -1.705 167 HG3 MET 20 HG3 MET 20 -27.311 -37.787 -0.274 168 HE1 MET 20 HE1 MET 20 -27.958 -40.093 -0.648 169 HE2 MET 20 HE2 MET 20 -29.458 -39.439 0.011 170 HE3 MET 20 HE3 MET 20 -29.505 -40.543 -1.366 171 H GLN 21 H GLN 21 -29.595 -33.550 0.565 172 HA GLN 21 HA GLN 21 -32.413 -33.941 0.743 173 HB2 GLN 21 HB2 GLN 21 -31.135 -33.414 2.731 174 HB3 GLN 21 HB3 GLN 21 -30.597 -31.896 2.026 175 HG2 GLN 21 HG2 GLN 21 -32.642 -30.878 2.317 176 HG3 GLN 21 HG3 GLN 21 -33.513 -32.410 2.374 177 HE21 GLN 21 HE21 GLN 21 -34.559 -31.880 4.280 178 HE22 GLN 21 HE22 GLN 21 -33.745 -31.839 5.803 179 H SER 22 H SER 22 -34.052 -32.808 -0.116 180 HA SER 22 HA SER 22 -35.180 -31.352 -1.450 181 HB2 SER 22 HB2 SER 22 -32.965 -29.463 -0.616 182 HB3 SER 22 HB3 SER 22 -34.470 -28.980 -1.399 183 HG SER 22 HG SER 22 -34.231 -28.976 1.061 184 H GLY 23 H GLY 23 -33.148 -33.072 -2.613 185 HA2 GLY 23 HA2 GLY 23 -31.507 -31.870 -4.492 186 HA3 GLY 23 HA3 GLY 23 -32.252 -33.449 -4.694 187 H HIS 24 H HIS 24 -31.746 -30.971 -6.460 188 HA HIS 24 HA HIS 24 -34.380 -31.062 -7.742 189 HB2 HIS 24 HB2 HIS 24 -34.096 -28.591 -8.273 190 HB3 HIS 24 HB3 HIS 24 -34.500 -28.983 -6.605 191 HD1 HIS 24 HD1 HIS 24 -33.416 -27.040 -5.441 192 HD2 HIS 24 HD2 HIS 24 -30.827 -29.000 -8.032 193 HE1 HIS 24 HE1 HIS 24 -31.149 -26.041 -5.008 194 H SER 25 H SER 25 -34.227 -30.009 -9.995 195 HA SER 25 HA SER 25 -31.622 -30.172 -11.245 196 HB2 SER 25 HB2 SER 25 -33.759 -32.239 -11.687 197 HB3 SER 25 HB3 SER 25 -32.633 -31.830 -12.981 198 HG SER 25 HG SER 25 -31.294 -33.120 -12.022 199 H LYS 26 H LYS 26 -32.013 -29.996 -13.773 200 HA LYS 26 HA LYS 26 -32.639 -28.608 -15.463 201 HB2 LYS 26 HB2 LYS 26 -35.264 -29.102 -14.079 202 HB3 LYS 26 HB3 LYS 26 -35.164 -28.074 -15.502 203 HG2 LYS 26 HG2 LYS 26 -35.670 -30.067 -16.480 204 HG3 LYS 26 HG3 LYS 26 -33.907 -30.154 -16.510 205 HD2 LYS 26 HD2 LYS 26 -34.262 -31.270 -14.148 206 HD3 LYS 26 HD3 LYS 26 -35.859 -31.628 -14.808 207 HE2 LYS 26 HE2 LYS 26 -33.348 -32.260 -16.327 208 HE3 LYS 26 HE3 LYS 26 -34.005 -33.371 -15.126 209 HZ1 LYS 26 HZ1 LYS 26 -35.813 -32.347 -17.187 210 HZ2 LYS 26 HZ2 LYS 26 -35.799 -33.851 -16.415 211 HZ3 LYS 26 HZ3 LYS 26 -34.682 -33.521 -17.641 212 H LEU 27 H LEU 27 -31.246 -27.057 -14.160 213 HA LEU 27 HA LEU 27 -32.519 -24.516 -14.129 214 HB2 LEU 27 HB2 LEU 27 -31.774 -24.140 -11.653 215 HB3 LEU 27 HB3 LEU 27 -33.348 -24.839 -12.025 216 HG LEU 27 HG LEU 27 -32.552 -27.046 -11.474 217 HD11 LEU 27 HD11 LEU 27 -30.306 -27.479 -10.714 218 HD12 LEU 27 HD12 LEU 27 -29.880 -25.778 -10.898 219 HD13 LEU 27 HD13 LEU 27 -30.251 -26.751 -12.321 220 HD21 LEU 27 HD21 LEU 27 -32.943 -26.672 -9.320 221 HD22 LEU 27 HD22 LEU 27 -32.841 -24.945 -9.665 222 HD23 LEU 27 HD23 LEU 27 -31.409 -25.824 -9.126 223 H LYS 28 H LYS 28 -30.888 -22.868 -12.992 224 HA LYS 28 HA LYS 28 -28.595 -22.783 -14.525 225 HB2 LYS 28 HB2 LYS 28 -27.781 -21.069 -12.963 226 HB3 LYS 28 HB3 LYS 28 -29.477 -20.830 -13.360 227 HG2 LYS 28 HG2 LYS 28 -28.922 -22.436 -10.950 228 HG3 LYS 28 HG3 LYS 28 -28.507 -20.722 -10.867 229 HD2 LYS 28 HD2 LYS 28 -30.929 -20.489 -11.944 230 HD3 LYS 28 HD3 LYS 28 -31.160 -22.032 -11.118 231 HE2 LYS 28 HE2 LYS 28 -30.048 -20.727 -9.112 232 HE3 LYS 28 HE3 LYS 28 -30.648 -19.321 -9.992 233 HZ1 LYS 28 HZ1 LYS 28 -32.341 -21.628 -9.203 234 HZ2 LYS 28 HZ2 LYS 28 -32.862 -20.161 -9.865 235 HZ3 LYS 28 HZ3 LYS 28 -32.210 -20.200 -8.304 236 H ALA 29 H ALA 29 -26.410 -23.222 -14.149 237 HA ALA 29 HA ALA 29 -25.883 -25.117 -11.951 238 HB1 ALA 29 HB1 ALA 29 -24.978 -26.605 -13.353 239 HB2 ALA 29 HB2 ALA 29 -25.818 -25.712 -14.622 240 HB3 ALA 29 HB3 ALA 29 -24.126 -25.361 -14.269 241 H TRP 30 H TRP 30 -24.688 -22.457 -13.895 242 HA TRP 30 HA TRP 30 -22.299 -22.269 -12.200 243 HB2 TRP 30 HB2 TRP 30 -22.986 -21.226 -14.928 244 HB3 TRP 30 HB3 TRP 30 -21.717 -20.450 -13.983 245 HD1 TRP 30 HD1 TRP 30 -22.558 -23.848 -15.597 246 HE1 TRP 30 HE1 TRP 30 -20.353 -25.109 -16.013 247 HE3 TRP 30 HE3 TRP 30 -19.331 -20.614 -13.306 248 HZ2 TRP 30 HZ2 TRP 30 -17.608 -24.775 -15.445 249 HZ3 TRP 30 HZ3 TRP 30 -16.930 -21.159 -13.286 250 HH2 TRP 30 HH2 TRP 30 -16.090 -23.197 -14.333 251 H LYS 31 H LYS 31 -21.659 -20.162 -11.392 252 HA LYS 31 HA LYS 31 -23.965 -18.394 -10.897 253 HB2 LYS 31 HB2 LYS 31 -22.125 -19.697 -9.049 254 HB3 LYS 31 HB3 LYS 31 -22.192 -17.956 -8.807 255 HG2 LYS 31 HG2 LYS 31 -23.885 -18.571 -7.435 256 HG3 LYS 31 HG3 LYS 31 -24.799 -18.414 -8.937 257 HD2 LYS 31 HD2 LYS 31 -24.546 -20.830 -9.324 258 HD3 LYS 31 HD3 LYS 31 -23.670 -20.972 -7.798 259 HE2 LYS 31 HE2 LYS 31 -26.465 -19.872 -7.995 260 HE3 LYS 31 HE3 LYS 31 -26.123 -21.582 -7.737 261 HZ1 LYS 31 HZ1 LYS 31 -26.130 -21.045 -5.588 262 HZ2 LYS 31 HZ2 LYS 31 -25.979 -19.388 -5.887 263 HZ3 LYS 31 HZ3 LYS 31 -24.602 -20.370 -5.860 264 H LEU 32 H LEU 32 -23.617 -16.181 -10.911 265 HA LEU 32 HA LEU 32 -20.928 -15.238 -11.604 266 HB2 LEU 32 HB2 LEU 32 -22.026 -15.497 -13.719 267 HB3 LEU 32 HB3 LEU 32 -23.459 -14.656 -13.131 268 HG LEU 32 HG LEU 32 -21.866 -13.410 -14.714 269 HD11 LEU 32 HD11 LEU 32 -23.506 -12.583 -12.571 270 HD12 LEU 32 HD12 LEU 32 -23.067 -11.683 -14.022 271 HD13 LEU 32 HD13 LEU 32 -22.079 -11.546 -12.568 272 HD21 LEU 32 HD21 LEU 32 -19.954 -14.149 -12.949 273 HD22 LEU 32 HD22 LEU 32 -20.338 -12.533 -12.358 274 HD23 LEU 32 HD23 LEU 32 -19.823 -12.762 -14.030 275 H GLU 33 H GLU 33 -20.357 -13.506 -10.465 276 HA GLU 33 HA GLU 33 -22.469 -11.779 -9.365 277 HB2 GLU 33 HB2 GLU 33 -19.980 -12.549 -7.844 278 HB3 GLU 33 HB3 GLU 33 -21.371 -11.658 -7.243 279 HG2 GLU 33 HG2 GLU 33 -21.367 -14.545 -8.091 280 HG3 GLU 33 HG3 GLU 33 -21.348 -13.954 -6.432 281 H PHE 34 H PHE 34 -22.186 -10.013 -10.611 282 HA PHE 34 HA PHE 34 -19.536 -9.049 -11.261 283 HB2 PHE 34 HB2 PHE 34 -22.307 -8.431 -12.105 284 HB3 PHE 34 HB3 PHE 34 -21.166 -7.091 -12.157 285 HD1 PHE 34 HD1 PHE 34 -18.850 -7.691 -13.291 286 HD2 PHE 34 HD2 PHE 34 -22.512 -9.751 -13.967 287 HE1 PHE 34 HE1 PHE 34 -17.989 -8.507 -15.447 288 HE2 PHE 34 HE2 PHE 34 -21.658 -10.570 -16.124 289 HZ PHE 34 HZ PHE 34 -19.393 -9.950 -16.866 290 H GLU 35 H GLU 35 -18.607 -7.141 -10.557 291 HA GLU 35 HA GLU 35 -19.149 -6.364 -7.904 292 HB2 GLU 35 HB2 GLU 35 -17.322 -4.938 -8.086 293 HB3 GLU 35 HB3 GLU 35 -16.960 -6.178 -9.279 294 HG2 GLU 35 HG2 GLU 35 -17.780 -4.727 -11.054 295 HG3 GLU 35 HG3 GLU 35 -18.171 -3.485 -9.866 296 HA PRO 36 HA PRO 36 -22.223 -3.253 -8.258 297 HB2 PRO 36 HB2 PRO 36 -21.474 -1.540 -6.290 298 HB3 PRO 36 HB3 PRO 36 -22.188 -3.123 -5.965 299 HG2 PRO 36 HG2 PRO 36 -19.311 -2.299 -5.924 300 HG3 PRO 36 HG3 PRO 36 -20.196 -3.327 -4.782 301 HD2 PRO 36 HD2 PRO 36 -18.588 -4.341 -6.710 302 HD3 PRO 36 HD3 PRO 36 -20.043 -5.184 -6.140 303 H SER 37 H SER 37 -22.100 -2.113 -10.125 304 HA SER 37 HA SER 37 -19.954 -0.175 -10.506 305 HB2 SER 37 HB2 SER 37 -20.299 -1.378 -12.481 306 HB3 SER 37 HB3 SER 37 -22.053 -1.366 -12.298 307 HG SER 37 HG SER 37 -21.636 0.132 -13.833 308 H CYS 38 H CYS 38 -23.478 -0.296 -10.238 309 HA CYS 38 HA CYS 38 -23.453 2.560 -9.568 310 HB2 CYS 38 HB2 CYS 38 -25.210 1.201 -11.605 311 HB3 CYS 38 HB3 CYS 38 -25.679 2.712 -10.837 312 HG CYS 38 HG CYS 38 -23.742 2.242 -13.426 313 H THR 39 H THR 39 -25.850 3.136 -8.823 314 HA THR 39 HA THR 39 -26.616 1.053 -6.882 315 HB THR 39 HB THR 39 -27.189 3.982 -6.503 316 HG1 THR 39 HG1 THR 39 -24.962 2.754 -5.293 317 HG21 THR 39 HG21 THR 39 -27.301 3.366 -4.157 318 HG22 THR 39 HG22 THR 39 -26.814 1.716 -4.543 319 HG23 THR 39 HG23 THR 39 -28.371 2.329 -5.097 320 H GLN 40 H GLN 40 -27.937 3.810 -8.715 321 HA GLN 40 HA GLN 40 -30.646 3.108 -8.324 322 HB2 GLN 40 HB2 GLN 40 -29.263 4.853 -10.356 323 HB3 GLN 40 HB3 GLN 40 -31.008 4.633 -10.338 324 HG2 GLN 40 HG2 GLN 40 -29.420 5.656 -7.998 325 HG3 GLN 40 HG3 GLN 40 -30.201 6.690 -9.194 326 HE21 GLN 40 HE21 GLN 40 -30.598 6.167 -6.239 327 HE22 GLN 40 HE22 GLN 40 -32.295 5.885 -6.087 328 H TYR 41 H TYR 41 -32.159 2.305 -9.891 329 HA TYR 41 HA TYR 41 -30.946 0.578 -11.944 330 HB2 TYR 41 HB2 TYR 41 -32.564 -1.164 -11.433 331 HB3 TYR 41 HB3 TYR 41 -31.654 -0.756 -9.983 332 HD1 TYR 41 HD1 TYR 41 -32.749 0.841 -8.308 333 HD2 TYR 41 HD2 TYR 41 -34.903 -1.095 -11.424 334 HE1 TYR 41 HE1 TYR 41 -34.850 1.239 -7.093 335 HE2 TYR 41 HE2 TYR 41 -37.011 -0.702 -10.219 336 HH TYR 41 HH TYR 41 -37.893 0.858 -8.514 337 H THR 42 H THR 42 -31.804 0.736 -13.919 338 HA THR 42 HA THR 42 -33.768 2.719 -14.474 339 HB THR 42 HB THR 42 -33.581 2.015 -16.808 340 HG1 THR 42 HG1 THR 42 -32.847 0.088 -17.324 341 HG21 THR 42 HG21 THR 42 -31.266 2.533 -17.150 342 HG22 THR 42 HG22 THR 42 -30.851 1.992 -15.524 343 HG23 THR 42 HG23 THR 42 -31.820 3.447 -15.748 344 H GLU 43 H GLU 43 -35.618 2.107 -16.063 345 HA GLU 43 HA GLU 43 -37.579 0.741 -14.688 346 HB2 GLU 43 HB2 GLU 43 -38.714 0.561 -16.980 347 HB3 GLU 43 HB3 GLU 43 -38.314 2.170 -16.396 348 HG2 GLU 43 HG2 GLU 43 -36.546 2.410 -17.889 349 HG3 GLU 43 HG3 GLU 43 -36.449 0.678 -18.196 350 HA PRO 44 HA PRO 44 -36.948 -3.561 -15.270 351 HB2 PRO 44 HB2 PRO 44 -39.497 -4.466 -15.497 352 HB3 PRO 44 HB3 PRO 44 -38.811 -3.898 -13.970 353 HG2 PRO 44 HG2 PRO 44 -40.584 -2.455 -15.903 354 HG3 PRO 44 HG3 PRO 44 -40.658 -2.495 -14.132 355 HD2 PRO 44 HD2 PRO 44 -39.574 -0.423 -15.500 356 HD3 PRO 44 HD3 PRO 44 -38.986 -0.925 -13.902 357 H LEU 45 H LEU 45 -35.925 -3.864 -17.220 358 HA LEU 45 HA LEU 45 -37.628 -4.696 -19.431 359 HB2 LEU 45 HB2 LEU 45 -36.838 -2.203 -19.579 360 HB3 LEU 45 HB3 LEU 45 -35.311 -2.931 -20.077 361 HG LEU 45 HG LEU 45 -36.695 -4.138 -21.870 362 HD11 LEU 45 HD11 LEU 45 -38.798 -2.959 -20.527 363 HD12 LEU 45 HD12 LEU 45 -38.859 -3.685 -22.133 364 HD13 LEU 45 HD13 LEU 45 -38.598 -1.950 -21.959 365 HD21 LEU 45 HD21 LEU 45 -36.773 -1.926 -23.232 366 HD22 LEU 45 HD22 LEU 45 -35.220 -2.551 -22.674 367 HD23 LEU 45 HD23 LEU 45 -36.005 -1.230 -21.806 368 H MET 46 H MET 46 -36.943 -6.602 -20.133 369 HA MET 46 HA MET 46 -34.100 -7.150 -20.366 370 HB2 MET 46 HB2 MET 46 -35.912 -8.524 -18.428 371 HB3 MET 46 HB3 MET 46 -34.662 -9.467 -19.228 372 HG2 MET 46 HG2 MET 46 -33.118 -7.504 -18.431 373 HG3 MET 46 HG3 MET 46 -34.406 -7.259 -17.254 374 HE1 MET 46 HE1 MET 46 -31.516 -10.784 -17.579 375 HE2 MET 46 HE2 MET 46 -32.871 -10.797 -18.708 376 HE3 MET 46 HE3 MET 46 -31.731 -9.451 -18.713 377 H ASN 47 H ASN 47 -33.651 -9.088 -21.617 378 HA ASN 47 HA ASN 47 -35.488 -9.383 -23.787 379 HB2 ASN 47 HB2 ASN 47 -33.017 -11.031 -23.226 380 HB3 ASN 47 HB3 ASN 47 -33.820 -10.813 -24.778 381 HD21 ASN 47 HD21 ASN 47 -31.788 -9.353 -22.369 382 HD22 ASN 47 HD22 ASN 47 -31.236 -8.036 -23.343 383 H TRP 48 H TRP 48 -34.178 -11.691 -21.405 384 HA TRP 48 HA TRP 48 -36.635 -13.280 -21.751 385 HB2 TRP 48 HB2 TRP 48 -34.831 -14.511 -22.764 386 HB3 TRP 48 HB3 TRP 48 -33.801 -14.254 -21.358 387 HD1 TRP 48 HD1 TRP 48 -33.722 -16.209 -19.713 388 HE1 TRP 48 HE1 TRP 48 -35.194 -18.260 -19.212 389 HE3 TRP 48 HE3 TRP 48 -37.595 -15.225 -22.901 390 HZ2 TRP 48 HZ2 TRP 48 -37.669 -19.321 -20.058 391 HZ3 TRP 48 HZ3 TRP 48 -39.477 -16.809 -22.995 392 HH2 TRP 48 HH2 TRP 48 -39.511 -18.814 -21.603 393 H THR 49 H THR 49 -37.818 -12.999 -19.978 394 HA THR 49 HA THR 49 -36.496 -12.675 -17.388 395 HB THR 49 HB THR 49 -38.932 -12.233 -16.634 396 HG1 THR 49 HG1 THR 49 -39.327 -11.568 -19.350 397 HG21 THR 49 HG21 THR 49 -38.815 -9.883 -17.593 398 HG22 THR 49 HG22 THR 49 -37.364 -10.408 -18.445 399 HG23 THR 49 HG23 THR 49 -37.406 -10.424 -16.683 400 H GLY 50 H GLY 50 -39.426 -14.374 -18.528 401 HA2 GLY 50 HA2 GLY 50 -40.150 -16.527 -18.122 402 HA3 GLY 50 HA3 GLY 50 -38.558 -16.886 -17.469 403 H SER 51 H SER 51 -39.695 -18.140 -15.857 404 HA SER 51 HA SER 51 -41.331 -16.707 -13.942 405 HB2 SER 51 HB2 SER 51 -41.851 -19.053 -14.599 406 HB3 SER 51 HB3 SER 51 -40.341 -19.567 -13.847 407 HG SER 51 HG SER 51 -42.143 -19.797 -12.444 408 H HIS 52 H HIS 52 -39.997 -15.235 -12.936 409 HA HIS 52 HA HIS 52 -37.477 -16.052 -11.791 410 HB2 HIS 52 HB2 HIS 52 -37.277 -13.752 -11.049 411 HB3 HIS 52 HB3 HIS 52 -37.816 -13.778 -12.726 412 HD1 HIS 52 HD1 HIS 52 -40.116 -12.807 -13.242 413 HD2 HIS 52 HD2 HIS 52 -39.222 -12.872 -9.185 414 HE1 HIS 52 HE1 HIS 52 -41.895 -11.413 -12.139 415 H ASP 53 H ASP 53 -36.980 -16.187 -9.598 416 HA ASP 53 HA ASP 53 -39.308 -16.634 -7.855 417 HB2 ASP 53 HB2 ASP 53 -37.594 -17.921 -6.452 418 HB3 ASP 53 HB3 ASP 53 -38.079 -18.641 -7.983 419 H THR 54 H THR 54 -35.989 -15.351 -7.792 420 HA THR 54 HA THR 54 -36.845 -13.511 -5.656 421 HB THR 54 HB THR 54 -34.638 -13.612 -4.662 422 HG1 THR 54 HG1 THR 54 -33.868 -15.736 -6.334 423 HG21 THR 54 HG21 THR 54 -35.302 -16.498 -5.072 424 HG22 THR 54 HG22 THR 54 -36.470 -15.444 -4.274 425 HG23 THR 54 HG23 THR 54 -34.857 -15.647 -3.592 426 H LYS 55 H LYS 55 -35.778 -11.454 -5.606 427 HA LYS 55 HA LYS 55 -35.452 -10.297 -8.167 428 HB2 LYS 55 HB2 LYS 55 -36.289 -9.011 -6.266 429 HB3 LYS 55 HB3 LYS 55 -34.753 -9.210 -5.434 430 HG2 LYS 55 HG2 LYS 55 -33.637 -7.774 -6.903 431 HG3 LYS 55 HG3 LYS 55 -34.925 -7.867 -8.108 432 HD2 LYS 55 HD2 LYS 55 -35.576 -6.790 -5.409 433 HD3 LYS 55 HD3 LYS 55 -34.669 -5.768 -6.527 434 HE2 LYS 55 HE2 LYS 55 -37.098 -7.152 -7.541 435 HE3 LYS 55 HE3 LYS 55 -37.318 -5.773 -6.464 436 HZ1 LYS 55 HZ1 LYS 55 -35.544 -5.587 -8.814 437 HZ2 LYS 55 HZ2 LYS 55 -36.306 -4.342 -7.960 438 HZ3 LYS 55 HZ3 LYS 55 -37.211 -5.352 -8.970 439 H GLN 56 H GLN 56 -33.738 -10.347 -9.450 440 HA GLN 56 HA GLN 56 -31.096 -10.840 -8.250 441 HB2 GLN 56 HB2 GLN 56 -30.496 -11.552 -10.631 442 HB3 GLN 56 HB3 GLN 56 -31.555 -12.618 -9.718 443 HG2 GLN 56 HG2 GLN 56 -32.803 -10.557 -11.449 444 HG3 GLN 56 HG3 GLN 56 -32.057 -11.956 -12.218 445 HE21 GLN 56 HE21 GLN 56 -32.626 -14.017 -10.675 446 HE22 GLN 56 HE22 GLN 56 -34.330 -14.238 -10.498 447 H GLN 57 H GLN 57 -30.185 -8.892 -7.925 448 HA GLN 57 HA GLN 57 -30.052 -7.065 -10.232 449 HB2 GLN 57 HB2 GLN 57 -29.978 -5.185 -8.649 450 HB3 GLN 57 HB3 GLN 57 -31.472 -6.102 -8.505 451 HG2 GLN 57 HG2 GLN 57 -30.451 -7.300 -6.565 452 HG3 GLN 57 HG3 GLN 57 -29.102 -6.169 -6.659 453 HE21 GLN 57 HE21 GLN 57 -32.652 -6.084 -6.636 454 HE22 GLN 57 HE22 GLN 57 -32.782 -4.762 -5.530 455 H VAL 58 H VAL 58 -28.417 -8.410 -7.426 456 HA VAL 58 HA VAL 58 -25.867 -7.343 -8.442 457 HB VAL 58 HB VAL 58 -25.000 -7.921 -6.129 458 HG11 VAL 58 HG11 VAL 58 -27.155 -5.822 -6.352 459 HG12 VAL 58 HG12 VAL 58 -25.887 -5.871 -5.126 460 HG13 VAL 58 HG13 VAL 58 -25.467 -5.631 -6.822 461 HG21 VAL 58 HG21 VAL 58 -26.331 -8.741 -4.522 462 HG22 VAL 58 HG22 VAL 58 -27.680 -7.699 -4.974 463 HG23 VAL 58 HG23 VAL 58 -27.398 -9.204 -5.848 464 H CYS 59 H CYS 59 -27.638 -10.215 -7.616 465 HA CYS 59 HA CYS 59 -25.286 -11.854 -8.292 466 HB2 CYS 59 HB2 CYS 59 -26.488 -13.701 -7.095 467 HB3 CYS 59 HB3 CYS 59 -26.023 -12.354 -6.062 468 HG CYS 59 HG CYS 59 -28.415 -12.859 -5.024 469 H LEU 60 H LEU 60 -25.334 -12.891 -10.168 470 HA LEU 60 HA LEU 60 -27.950 -13.505 -11.376 471 HB2 LEU 60 HB2 LEU 60 -27.192 -11.737 -12.684 472 HB3 LEU 60 HB3 LEU 60 -25.513 -12.269 -12.597 473 HG LEU 60 HG LEU 60 -26.046 -14.135 -14.111 474 HD11 LEU 60 HD11 LEU 60 -28.142 -14.421 -15.115 475 HD12 LEU 60 HD12 LEU 60 -28.723 -12.852 -14.558 476 HD13 LEU 60 HD13 LEU 60 -28.496 -14.167 -13.405 477 HD21 LEU 60 HD21 LEU 60 -26.707 -11.349 -15.037 478 HD22 LEU 60 HD22 LEU 60 -26.513 -12.713 -16.137 479 HD23 LEU 60 HD23 LEU 60 -25.160 -12.189 -15.134 480 H SER 61 H SER 61 -28.226 -15.546 -12.036 481 HA SER 61 HA SER 61 -25.937 -17.365 -11.821 482 HB2 SER 61 HB2 SER 61 -27.407 -19.045 -11.241 483 HB3 SER 61 HB3 SER 61 -28.294 -17.644 -10.639 484 HG SER 61 HG SER 61 -29.377 -17.652 -12.732 485 H PHE 62 H PHE 62 -25.714 -19.094 -13.400 486 HA PHE 62 HA PHE 62 -26.880 -18.517 -16.026 487 HB2 PHE 62 HB2 PHE 62 -23.956 -18.646 -15.346 488 HB3 PHE 62 HB3 PHE 62 -24.519 -19.066 -16.960 489 HD1 PHE 62 HD1 PHE 62 -25.673 -17.361 -18.343 490 HD2 PHE 62 HD2 PHE 62 -23.815 -16.397 -14.637 491 HE1 PHE 62 HE1 PHE 62 -25.681 -14.979 -18.962 492 HE2 PHE 62 HE2 PHE 62 -23.820 -14.015 -15.250 493 HZ PHE 62 HZ PHE 62 -24.755 -13.302 -17.414 494 H THR 63 H THR 63 -26.491 -20.316 -17.590 495 HA THR 63 HA THR 63 -26.990 -22.841 -16.253 496 HB THR 63 HB THR 63 -26.813 -22.707 -19.219 497 HG1 THR 63 HG1 THR 63 -28.028 -20.947 -19.154 498 HG21 THR 63 HG21 THR 63 -28.667 -24.209 -19.116 499 HG22 THR 63 HG22 THR 63 -28.943 -23.844 -17.412 500 HG23 THR 63 HG23 THR 63 -27.502 -24.735 -17.901 501 H THR 64 H THR 64 -24.712 -21.603 -18.694 502 HA THR 64 HA THR 64 -22.815 -23.690 -17.847 503 HB THR 64 HB THR 64 -22.014 -23.496 -20.350 504 HG1 THR 64 HG1 THR 64 -23.818 -23.183 -21.742 505 HG21 THR 64 HG21 THR 64 -24.357 -25.101 -19.347 506 HG22 THR 64 HG22 THR 64 -22.669 -25.596 -19.468 507 HG23 THR 64 HG23 THR 64 -23.628 -25.364 -20.930 508 H ARG 65 H ARG 65 -20.555 -23.171 -18.303 509 HA ARG 65 HA ARG 65 -19.826 -20.635 -17.393 510 HB2 ARG 65 HB2 ARG 65 -17.538 -21.255 -17.977 511 HB3 ARG 65 HB3 ARG 65 -18.371 -22.604 -17.216 512 HG2 ARG 65 HG2 ARG 65 -18.868 -23.334 -19.658 513 HG3 ARG 65 HG3 ARG 65 -17.523 -22.264 -20.055 514 HD2 ARG 65 HD2 ARG 65 -17.401 -24.519 -18.057 515 HD3 ARG 65 HD3 ARG 65 -16.844 -24.625 -19.727 516 HE ARG 65 HE ARG 65 -15.515 -22.475 -18.690 517 HH11 ARG 65 HH11 ARG 65 -15.832 -25.833 -17.827 518 HH12 ARG 65 HH12 ARG 65 -14.257 -25.933 -17.113 519 HH21 ARG 65 HH21 ARG 65 -13.438 -22.595 -17.753 520 HH22 ARG 65 HH22 ARG 65 -12.896 -24.091 -17.071 521 H GLU 66 H GLU 66 -20.071 -21.918 -20.672 522 HA GLU 66 HA GLU 66 -18.844 -19.902 -22.106 523 HB2 GLU 66 HB2 GLU 66 -21.342 -21.418 -22.883 524 HB3 GLU 66 HB3 GLU 66 -20.282 -20.551 -23.986 525 HG2 GLU 66 HG2 GLU 66 -18.560 -22.100 -23.744 526 HG3 GLU 66 HG3 GLU 66 -19.247 -22.770 -22.264 527 H LEU 67 H LEU 67 -21.949 -19.907 -20.521 528 HA LEU 67 HA LEU 67 -22.842 -17.475 -21.798 529 HB2 LEU 67 HB2 LEU 67 -24.118 -19.552 -20.565 530 HB3 LEU 67 HB3 LEU 67 -24.182 -18.301 -19.326 531 HG LEU 67 HG LEU 67 -25.320 -16.805 -20.889 532 HD11 LEU 67 HD11 LEU 67 -24.974 -19.110 -22.783 533 HD12 LEU 67 HD12 LEU 67 -24.500 -17.425 -23.002 534 HD13 LEU 67 HD13 LEU 67 -26.206 -17.870 -23.016 535 HD21 LEU 67 HD21 LEU 67 -26.383 -19.405 -20.037 536 HD22 LEU 67 HD22 LEU 67 -27.308 -18.606 -21.309 537 HD23 LEU 67 HD23 LEU 67 -27.013 -17.777 -19.779 538 H ALA 68 H ALA 68 -21.429 -18.433 -18.720 539 HA ALA 68 HA ALA 68 -21.756 -15.954 -17.398 540 HB1 ALA 68 HB1 ALA 68 -19.404 -17.497 -16.607 541 HB2 ALA 68 HB2 ALA 68 -20.804 -16.992 -15.660 542 HB3 ALA 68 HB3 ALA 68 -20.894 -18.441 -16.661 543 H ILE 69 H ILE 69 -18.723 -17.385 -18.623 544 HA ILE 69 HA ILE 69 -17.156 -15.116 -18.460 545 HB ILE 69 HB ILE 69 -16.992 -17.366 -20.467 546 HG12 ILE 69 HG12 ILE 69 -14.916 -17.708 -18.767 547 HG13 ILE 69 HG13 ILE 69 -16.077 -16.955 -17.680 548 HG21 ILE 69 HG21 ILE 69 -15.196 -15.034 -19.949 549 HG22 ILE 69 HG22 ILE 69 -14.522 -16.568 -20.497 550 HG23 ILE 69 HG23 ILE 69 -15.717 -15.728 -21.485 551 HD11 ILE 69 HD11 ILE 69 -17.019 -19.205 -19.360 552 HD12 ILE 69 HD12 ILE 69 -15.948 -19.567 -18.006 553 HD13 ILE 69 HD13 ILE 69 -17.479 -18.739 -17.723 554 H ALA 70 H ALA 70 -19.424 -16.068 -20.960 555 HA ALA 70 HA ALA 70 -18.686 -14.330 -23.002 556 HB1 ALA 70 HB1 ALA 70 -20.281 -15.785 -23.722 557 HB2 ALA 70 HB2 ALA 70 -21.205 -15.691 -22.222 558 HB3 ALA 70 HB3 ALA 70 -21.309 -14.387 -23.404 559 H TYR 71 H TYR 71 -20.442 -13.722 -20.040 560 HA TYR 71 HA TYR 71 -21.416 -11.144 -20.791 561 HB2 TYR 71 HB2 TYR 71 -21.534 -12.878 -18.459 562 HB3 TYR 71 HB3 TYR 71 -21.301 -11.192 -18.010 563 HD1 TYR 71 HD2 TYR 71 -23.205 -12.554 -20.900 564 HD2 TYR 71 HD1 TYR 71 -23.384 -10.588 -17.130 565 HE1 TYR 71 HE2 TYR 71 -25.605 -12.137 -21.238 566 HE2 TYR 71 HE1 TYR 71 -25.786 -10.167 -17.458 567 HH TYR 71 HH TYR 71 -27.617 -10.821 -18.701 568 H ALA 72 H ALA 72 -18.790 -12.210 -18.630 569 HA ALA 72 HA ALA 72 -17.787 -9.665 -18.037 570 HB1 ALA 72 HB1 ALA 72 -17.199 -11.674 -16.770 571 HB2 ALA 72 HB2 ALA 72 -16.278 -12.274 -18.150 572 HB3 ALA 72 HB3 ALA 72 -15.763 -10.808 -17.315 573 H VAL 73 H VAL 73 -16.588 -12.033 -20.422 574 HA VAL 73 HA VAL 73 -14.581 -10.486 -21.544 575 HB VAL 73 HB VAL 73 -16.338 -12.516 -22.930 576 HG11 VAL 73 HG11 VAL 73 -14.485 -12.728 -24.529 577 HG12 VAL 73 HG12 VAL 73 -15.195 -11.112 -24.549 578 HG13 VAL 73 HG13 VAL 73 -13.657 -11.391 -23.732 579 HG21 VAL 73 HG21 VAL 73 -14.735 -14.145 -22.347 580 HG22 VAL 73 HG22 VAL 73 -13.578 -12.928 -21.809 581 HG23 VAL 73 HG23 VAL 73 -15.039 -13.230 -20.869 582 H ALA 74 H ALA 74 -18.026 -10.312 -21.982 583 HA ALA 74 HA ALA 74 -18.280 -9.019 -24.401 584 HB1 ALA 74 HB1 ALA 74 -20.398 -8.334 -23.711 585 HB2 ALA 74 HB2 ALA 74 -20.090 -9.778 -22.746 586 HB3 ALA 74 HB3 ALA 74 -19.903 -8.179 -22.026 587 H HIS 75 H HIS 75 -17.238 -7.718 -21.311 588 HA HIS 75 HA HIS 75 -16.603 -5.183 -22.668 589 HB2 HIS 75 HB2 HIS 75 -17.906 -5.648 -20.010 590 HB3 HIS 75 HB3 HIS 75 -16.914 -4.214 -20.252 591 HD1 HIS 75 HD1 HIS 75 -17.806 -2.420 -21.903 592 HD2 HIS 75 HD2 HIS 75 -20.372 -5.633 -21.313 593 HE1 HIS 75 HE1 HIS 75 -20.015 -1.700 -22.863 594 H LYS 76 H LYS 76 -14.998 -7.609 -22.153 595 HA LYS 76 HA LYS 76 -12.938 -8.221 -21.395 596 HB2 LYS 76 HB2 LYS 76 -12.371 -5.259 -21.310 597 HB3 LYS 76 HB3 LYS 76 -11.220 -6.563 -21.562 598 HG2 LYS 76 HG2 LYS 76 -12.788 -7.038 -23.646 599 HG3 LYS 76 HG3 LYS 76 -13.126 -5.317 -23.456 600 HD2 LYS 76 HD2 LYS 76 -11.316 -5.257 -24.875 601 HD3 LYS 76 HD3 LYS 76 -10.516 -5.133 -23.307 602 HE2 LYS 76 HE2 LYS 76 -9.699 -7.277 -23.403 603 HE3 LYS 76 HE3 LYS 76 -10.991 -7.836 -24.463 604 HZ1 LYS 76 HZ1 LYS 76 -8.420 -6.832 -25.141 605 HZ2 LYS 76 HZ2 LYS 76 -9.632 -5.942 -25.914 606 HZ3 LYS 76 HZ3 LYS 76 -9.554 -7.619 -26.119 607 H ILE 77 H ILE 77 -14.862 -8.046 -19.375 608 HA ILE 77 HA ILE 77 -13.705 -6.659 -17.117 609 HB ILE 77 HB ILE 77 -16.016 -8.603 -17.178 610 HG12 ILE 77 HG12 ILE 77 -16.136 -5.587 -17.081 611 HG13 ILE 77 HG13 ILE 77 -16.258 -6.502 -18.580 612 HG21 ILE 77 HG21 ILE 77 -16.272 -6.768 -15.074 613 HG22 ILE 77 HG22 ILE 77 -15.924 -8.492 -14.962 614 HG23 ILE 77 HG23 ILE 77 -14.600 -7.330 -15.032 615 HD11 ILE 77 HD11 ILE 77 -18.221 -7.687 -17.595 616 HD12 ILE 77 HD12 ILE 77 -18.143 -6.558 -16.242 617 HD13 ILE 77 HD13 ILE 77 -18.456 -5.962 -17.871 618 H ASP 78 H ASP 78 -12.549 -7.526 -15.476 619 HA ASP 78 HA ASP 78 -11.280 -10.055 -15.907 620 HB2 ASP 78 HB2 ASP 78 -11.129 -8.506 -13.333 621 HB3 ASP 78 HB3 ASP 78 -9.897 -9.513 -14.091 622 H TYR 79 H TYR 79 -12.669 -11.751 -15.744 623 HA TYR 79 HA TYR 79 -14.318 -11.983 -13.332 624 HB2 TYR 79 HB2 TYR 79 -15.489 -13.772 -14.514 625 HB3 TYR 79 HB3 TYR 79 -15.442 -12.313 -15.496 626 HD1 TYR 79 HD1 TYR 79 -14.018 -12.205 -17.493 627 HD2 TYR 79 HD2 TYR 79 -14.335 -15.772 -15.195 628 HE1 TYR 79 HE1 TYR 79 -13.036 -13.482 -19.352 629 HE2 TYR 79 HE2 TYR 79 -13.354 -17.059 -17.046 630 HH TYR 79 HH TYR 79 -11.631 -16.009 -19.307 631 H THR 80 H THR 80 -14.057 -13.586 -11.852 632 HA THR 80 HA THR 80 -11.623 -15.210 -12.115 633 HB THR 80 HB THR 80 -11.601 -13.806 -10.150 634 HG1 THR 80 HG1 THR 80 -10.658 -15.583 -9.444 635 HG21 THR 80 HG21 THR 80 -14.199 -15.148 -9.388 636 HG22 THR 80 HG22 THR 80 -14.017 -13.474 -9.910 637 HG23 THR 80 HG23 THR 80 -13.294 -14.008 -8.394 638 H VAL 81 H VAL 81 -11.721 -17.368 -12.231 639 HA VAL 81 HA VAL 81 -14.361 -18.626 -12.112 640 HB VAL 81 HB VAL 81 -11.760 -19.769 -13.140 641 HG11 VAL 81 HG11 VAL 81 -14.598 -20.758 -13.176 642 HG12 VAL 81 HG12 VAL 81 -13.371 -21.362 -14.291 643 HG13 VAL 81 HG13 VAL 81 -13.162 -21.568 -12.551 644 HG21 VAL 81 HG21 VAL 81 -12.565 -17.808 -14.426 645 HG22 VAL 81 HG22 VAL 81 -12.574 -19.304 -15.359 646 HG23 VAL 81 HG23 VAL 81 -14.082 -18.659 -14.712 647 H LEU 82 H LEU 82 -14.940 -19.579 -10.283 648 HA LEU 82 HA LEU 82 -12.848 -20.703 -8.546 649 HB2 LEU 82 HB2 LEU 82 -14.771 -18.882 -7.922 650 HB3 LEU 82 HB3 LEU 82 -15.552 -20.389 -7.450 651 HG LEU 82 HG LEU 82 -12.812 -19.636 -6.470 652 HD11 LEU 82 HD11 LEU 82 -15.112 -18.184 -5.930 653 HD12 LEU 82 HD12 LEU 82 -13.617 -18.183 -4.995 654 HD13 LEU 82 HD13 LEU 82 -14.936 -19.263 -4.546 655 HD21 LEU 82 HD21 LEU 82 -14.827 -21.735 -5.886 656 HD22 LEU 82 HD22 LEU 82 -13.883 -21.106 -4.536 657 HD23 LEU 82 HD23 LEU 82 -13.066 -21.831 -5.922 658 H GLN 83 H GLN 83 -12.641 -22.824 -8.801 659 HA GLN 83 HA GLN 83 -15.086 -24.452 -8.959 660 HB2 GLN 83 HB2 GLN 83 -13.741 -26.039 -10.411 661 HB3 GLN 83 HB3 GLN 83 -14.229 -24.526 -11.164 662 HG2 GLN 83 HG2 GLN 83 -11.986 -23.612 -10.713 663 HG3 GLN 83 HG3 GLN 83 -11.509 -25.177 -10.055 664 HE21 GLN 83 HE21 GLN 83 -10.720 -23.507 -12.471 665 HE22 GLN 83 HE22 GLN 83 -10.763 -24.633 -13.781 666 H ASP 84 H ASP 84 -14.692 -26.757 -8.341 667 HA ASP 84 HA ASP 84 -12.877 -26.831 -6.035 668 HB2 ASP 84 HB2 ASP 84 -15.434 -27.308 -5.894 669 HB3 ASP 84 HB3 ASP 84 -15.009 -28.877 -6.574 670 H ASN 85 H ASN 85 -11.223 -28.237 -5.912 671 HA ASN 85 HA ASN 85 -9.679 -29.788 -6.527 672 HB2 ASN 85 HB2 ASN 85 -11.719 -31.279 -6.308 673 HB3 ASN 85 HB3 ASN 85 -11.895 -31.155 -8.057 674 HD21 ASN 85 HD21 ASN 85 -11.416 -33.510 -6.472 675 HD22 ASN 85 HD22 ASN 85 -9.923 -34.184 -7.022 676 HA PRO 86 HA PRO 86 -9.342 -27.695 -10.674 677 HB2 PRO 86 HB2 PRO 86 -6.989 -26.456 -10.128 678 HB3 PRO 86 HB3 PRO 86 -8.560 -25.749 -9.735 679 HG2 PRO 86 HG2 PRO 86 -6.647 -27.218 -7.962 680 HG3 PRO 86 HG3 PRO 86 -7.575 -25.744 -7.629 681 HD2 PRO 86 HD2 PRO 86 -8.339 -28.182 -6.730 682 HD3 PRO 86 HD3 PRO 86 -9.505 -26.915 -7.162 683 H ARG 87 H ARG 87 -8.667 -29.111 -12.152 684 HA ARG 87 HA ARG 87 -5.961 -29.908 -12.365 685 HB2 ARG 87 HB2 ARG 87 -6.696 -31.433 -10.532 686 HB3 ARG 87 HB3 ARG 87 -7.885 -32.120 -11.632 687 HG2 ARG 87 HG2 ARG 87 -6.076 -33.607 -11.655 688 HG3 ARG 87 HG3 ARG 87 -5.941 -32.686 -13.154 689 HD2 ARG 87 HD2 ARG 87 -4.272 -31.233 -12.107 690 HD3 ARG 87 HD3 ARG 87 -4.409 -32.156 -10.611 691 HE ARG 87 HE ARG 87 -3.751 -33.846 -12.792 692 HH11 ARG 87 HH11 ARG 87 -2.399 -31.486 -10.619 693 HH12 ARG 87 HH12 ARG 87 -0.789 -32.119 -10.724 694 HH21 ARG 87 HH21 ARG 87 -1.637 -34.690 -12.939 695 HH22 ARG 87 HH22 ARG 87 -0.357 -33.942 -12.044 696 H THR 88 H THR 88 -5.729 -29.748 -14.488 697 HA THR 88 HA THR 88 -7.721 -31.045 -16.224 698 HB THR 88 HB THR 88 -8.122 -28.643 -16.337 699 HG1 THR 88 HG1 THR 88 -8.496 -29.146 -18.355 700 HG21 THR 88 HG21 THR 88 -5.862 -27.903 -15.669 701 HG22 THR 88 HG22 THR 88 -6.426 -27.096 -17.134 702 HG23 THR 88 HG23 THR 88 -5.251 -28.407 -17.244 703 H ILE 89 H ILE 89 -6.908 -32.291 -17.813 704 HA ILE 89 HA ILE 89 -4.003 -32.548 -17.963 705 HB ILE 89 HB ILE 89 -6.138 -34.307 -19.178 706 HG12 ILE 89 HG12 ILE 89 -5.103 -35.846 -17.272 707 HG13 ILE 89 HG13 ILE 89 -4.772 -34.287 -16.525 708 HG21 ILE 89 HG21 ILE 89 -4.421 -35.070 -20.388 709 HG22 ILE 89 HG22 ILE 89 -3.234 -34.228 -19.394 710 HG23 ILE 89 HG23 ILE 89 -3.852 -35.800 -18.888 711 HD11 ILE 89 HD11 ILE 89 -7.476 -34.410 -17.507 712 HD12 ILE 89 HD12 ILE 89 -7.129 -35.739 -16.399 713 HD13 ILE 89 HD13 ILE 89 -6.876 -34.072 -15.882 714 H VAL 90 H VAL 90 -2.820 -32.266 -19.812 715 HA VAL 90 HA VAL 90 -2.243 -31.322 -21.804 716 HB VAL 90 HB VAL 90 -4.931 -32.306 -22.760 717 HG11 VAL 90 HG11 VAL 90 -3.785 -32.494 -24.926 718 HG12 VAL 90 HG12 VAL 90 -3.801 -30.834 -24.325 719 HG13 VAL 90 HG13 VAL 90 -2.332 -31.802 -24.205 720 HG21 VAL 90 HG21 VAL 90 -2.673 -33.785 -21.767 721 HG22 VAL 90 HG22 VAL 90 -4.246 -34.373 -22.307 722 HG23 VAL 90 HG23 VAL 90 -2.943 -34.141 -23.473 723 HA PRO 91 HA PRO 91 -4.902 -27.597 -20.940 724 HB2 PRO 91 HB2 PRO 91 -2.826 -25.946 -20.359 725 HB3 PRO 91 HB3 PRO 91 -3.608 -26.969 -19.148 726 HG2 PRO 91 HG2 PRO 91 -1.063 -27.429 -20.658 727 HG3 PRO 91 HG3 PRO 91 -1.411 -27.702 -18.940 728 HD2 PRO 91 HD2 PRO 91 -1.393 -29.707 -20.760 729 HD3 PRO 91 HD3 PRO 91 -2.463 -29.712 -19.343 730 H LYS 92 H LYS 92 -5.166 -25.786 -22.259 731 HA LYS 92 HA LYS 92 -3.331 -25.551 -24.547 732 HB2 LYS 92 HB2 LYS 92 -5.648 -26.759 -24.910 733 HB3 LYS 92 HB3 LYS 92 -6.262 -25.111 -24.941 734 HG2 LYS 92 HG2 LYS 92 -3.923 -25.770 -26.649 735 HG3 LYS 92 HG3 LYS 92 -5.518 -26.349 -27.138 736 HD2 LYS 92 HD2 LYS 92 -6.357 -24.013 -26.932 737 HD3 LYS 92 HD3 LYS 92 -4.700 -23.492 -26.619 738 HE2 LYS 92 HE2 LYS 92 -5.294 -23.159 -28.959 739 HE3 LYS 92 HE3 LYS 92 -4.013 -24.358 -28.798 740 HZ1 LYS 92 HZ1 LYS 92 -6.359 -24.667 -30.165 741 HZ2 LYS 92 HZ2 LYS 92 -6.605 -25.551 -28.745 742 HZ3 LYS 92 HZ3 LYS 92 -5.281 -25.900 -29.739 743 H SER 93 H SER 93 -2.370 -23.653 -24.092 744 HA SER 93 HA SER 93 -4.047 -21.382 -23.285 745 HB2 SER 93 HB2 SER 93 -2.304 -21.458 -21.761 746 HB3 SER 93 HB3 SER 93 -1.146 -22.044 -22.957 747 HG SER 93 HG SER 93 -0.925 -19.783 -22.275 748 H TYR 94 H TYR 94 -4.052 -19.455 -24.416 749 HA TYR 94 HA TYR 94 -2.384 -18.853 -26.604 750 HB2 TYR 94 HB2 TYR 94 -3.622 -20.723 -27.653 751 HB3 TYR 94 HB3 TYR 94 -5.132 -19.866 -27.368 752 HD1 TYR 94 HD2 TYR 94 -1.815 -18.754 -28.689 753 HD2 TYR 94 HD1 TYR 94 -5.992 -19.160 -29.391 754 HE1 TYR 94 HE2 TYR 94 -1.559 -17.598 -30.845 755 HE2 TYR 94 HE1 TYR 94 -5.748 -18.006 -31.549 756 HH TYR 94 HH TYR 94 -2.660 -16.619 -32.551 757 H ALA 95 H ALA 95 -2.342 -16.721 -26.445 758 HA ALA 95 HA ALA 95 -4.510 -15.228 -25.306 759 HB1 ALA 95 HB1 ALA 95 -2.767 -13.963 -24.757 760 HB2 ALA 95 HB2 ALA 95 -1.730 -14.772 -25.931 761 HB3 ALA 95 HB3 ALA 95 -2.730 -13.409 -26.431 762 H ASP 96 H ASP 96 -5.349 -13.237 -26.402 763 HA ASP 96 HA ASP 96 -6.152 -13.931 -29.130 764 HB2 ASP 96 HB2 ASP 96 -7.291 -11.856 -27.244 765 HB3 ASP 96 HB3 ASP 96 -7.957 -12.301 -28.812 766 H ASN 97 H ASN 97 -6.483 -12.037 -30.638 767 HA ASN 97 HA ASN 97 -4.083 -10.351 -30.539 768 HB2 ASN 97 HB2 ASN 97 -4.580 -9.997 -32.993 769 HB3 ASN 97 HB3 ASN 97 -4.168 -11.649 -32.541 770 HD21 ASN 97 HD21 ASN 97 -6.380 -9.672 -34.097 771 HD22 ASN 97 HD22 ASN 97 -7.645 -10.827 -34.322 772 H PHE 98 H PHE 98 -4.177 -8.154 -30.622 773 HA PHE 98 HA PHE 98 -6.693 -6.934 -29.925 774 HB2 PHE 98 HB2 PHE 98 -5.386 -4.884 -29.644 775 HB3 PHE 98 HB3 PHE 98 -4.601 -6.235 -28.832 776 HD1 PHE 98 HD1 PHE 98 -4.460 -3.980 -31.728 777 HD2 PHE 98 HD2 PHE 98 -2.463 -7.024 -29.526 778 HE1 PHE 98 HE1 PHE 98 -2.384 -3.506 -32.963 779 HE2 PHE 98 HE2 PHE 98 -0.384 -6.556 -30.756 780 HZ PHE 98 HZ PHE 98 -0.342 -4.794 -32.476 781 H THR 99 H THR 99 -7.930 -5.582 -31.138 782 HA THR 99 HA THR 99 -7.115 -4.373 -33.560 783 HB THR 99 HB THR 99 -7.191 -6.672 -34.422 784 HG1 THR 99 HG1 THR 99 -7.759 -5.230 -35.970 785 HG21 THR 99 HG21 THR 99 -10.146 -6.791 -34.116 786 HG22 THR 99 HG22 THR 99 -9.158 -7.185 -32.710 787 HG23 THR 99 HG23 THR 99 -8.965 -8.097 -34.207 788 H LYS 100 H LYS 100 -8.464 -2.738 -34.023 789 HA LYS 100 HA LYS 100 -10.191 -1.271 -33.813 790 HB2 LYS 100 HB2 LYS 100 -11.503 -3.932 -34.051 791 HB3 LYS 100 HB3 LYS 100 -12.510 -2.569 -33.583 792 HG2 LYS 100 HG2 LYS 100 -12.725 -2.618 -35.884 793 HG3 LYS 100 HG3 LYS 100 -11.486 -1.388 -35.629 794 HD2 LYS 100 HD2 LYS 100 -10.535 -2.644 -37.310 795 HD3 LYS 100 HD3 LYS 100 -9.845 -3.410 -35.877 796 HE2 LYS 100 HE2 LYS 100 -11.344 -5.229 -36.010 797 HE3 LYS 100 HE3 LYS 100 -12.375 -4.393 -37.170 798 HZ1 LYS 100 HZ1 LYS 100 -9.630 -5.412 -37.664 799 HZ2 LYS 100 HZ2 LYS 100 -10.532 -4.509 -38.773 800 HZ3 LYS 100 HZ3 LYS 100 -11.069 -6.041 -38.296 801 HA PRO 101 HA PRO 101 -10.215 -1.833 -29.190 802 HB2 PRO 101 HB2 PRO 101 -9.035 0.552 -28.651 803 HB3 PRO 101 HB3 PRO 101 -8.117 -0.923 -28.974 804 HG2 PRO 101 HG2 PRO 101 -8.766 1.345 -30.817 805 HG3 PRO 101 HG3 PRO 101 -7.237 0.470 -30.616 806 HD2 PRO 101 HD2 PRO 101 -8.950 -0.037 -32.651 807 HD3 PRO 101 HD3 PRO 101 -7.932 -1.297 -31.924 808 H ARG 102 H ARG 102 -12.102 -1.364 -28.271 809 HA ARG 102 HA ARG 102 -14.015 0.370 -29.280 810 HB2 ARG 102 HB2 ARG 102 -14.160 -1.517 -27.465 811 HB3 ARG 102 HB3 ARG 102 -13.894 -0.191 -26.341 812 HG2 ARG 102 HG2 ARG 102 -16.027 0.091 -28.395 813 HG3 ARG 102 HG3 ARG 102 -16.314 -0.953 -27.001 814 HD2 ARG 102 HD2 ARG 102 -15.296 1.852 -26.679 815 HD3 ARG 102 HD3 ARG 102 -17.019 1.513 -26.843 816 HE ARG 102 HE ARG 102 -15.391 1.069 -24.536 817 HH11 ARG 102 HH11 ARG 102 -18.194 -0.054 -26.268 818 HH12 ARG 102 HH12 ARG 102 -18.951 -0.732 -24.865 819 HH21 ARG 102 HH21 ARG 102 -16.377 0.180 -22.681 820 HH22 ARG 102 HH22 ARG 102 -17.918 -0.596 -22.824 821 H ASP 103 H ASP 103 -13.619 2.471 -29.626 822 HA ASP 103 HA ASP 103 -13.079 4.157 -27.315 823 HB2 ASP 103 HB2 ASP 103 -10.911 3.492 -28.679 824 HB3 ASP 103 HB3 ASP 103 -11.483 4.753 -29.769 825 H MET 104 H MET 104 -14.028 6.145 -27.438 826 HA MET 104 HA MET 104 -16.005 6.516 -29.483 827 HB2 MET 104 HB2 MET 104 -15.170 8.202 -27.122 828 HB3 MET 104 HB3 MET 104 -16.469 8.653 -28.219 829 HG2 MET 104 HG2 MET 104 -17.526 6.422 -27.651 830 HG3 MET 104 HG3 MET 104 -16.345 6.313 -26.348 831 HE1 MET 104 HE1 MET 104 -16.569 9.788 -25.221 832 HE2 MET 104 HE2 MET 104 -17.135 8.825 -23.857 833 HE3 MET 104 HE3 MET 104 -15.841 8.217 -24.889 Start of MODEL 17 1 H1 MET 1 H MET 1 -4.523 -7.233 -1.170 2 HA MET 1 HA MET 1 -5.867 -6.602 1.332 3 HB2 MET 1 HB2 MET 1 -3.183 -5.838 0.186 4 HB3 MET 1 HB3 MET 1 -3.799 -5.170 1.693 5 HG2 MET 1 HG2 MET 1 -3.582 -7.150 2.822 6 HG3 MET 1 HG3 MET 1 -3.717 -8.124 1.360 7 HE1 MET 1 HE1 MET 1 -0.400 -7.691 3.793 8 HE2 MET 1 HE2 MET 1 -0.531 -5.978 3.396 9 HE3 MET 1 HE3 MET 1 -1.941 -6.856 3.989 10 H GLN 2 H GLN 2 -4.332 -4.608 -1.202 11 HA GLN 2 HA GLN 2 -6.676 -2.903 -1.318 12 HB2 GLN 2 HB2 GLN 2 -4.083 -2.072 -0.097 13 HB3 GLN 2 HB3 GLN 2 -4.968 -0.895 -1.059 14 HG2 GLN 2 HG2 GLN 2 -6.961 -1.345 0.386 15 HG3 GLN 2 HG3 GLN 2 -5.909 -2.313 1.417 16 HE21 GLN 2 HE21 GLN 2 -3.802 -1.089 1.987 17 HE22 GLN 2 HE22 GLN 2 -4.024 0.533 2.539 18 H GLU 3 H GLU 3 -6.877 -1.820 -3.239 19 HA GLU 3 HA GLU 3 -4.731 -1.362 -5.036 20 HB2 GLU 3 HB2 GLU 3 -5.497 -2.935 -6.823 21 HB3 GLU 3 HB3 GLU 3 -4.774 -3.725 -5.429 22 HG2 GLU 3 HG2 GLU 3 -7.109 -4.099 -4.571 23 HG3 GLU 3 HG3 GLU 3 -7.686 -3.554 -6.145 24 H GLN 4 H GLN 4 -5.362 0.514 -5.856 25 HA GLN 4 HA GLN 4 -7.953 1.513 -5.884 26 HB2 GLN 4 HB2 GLN 4 -5.692 2.269 -7.743 27 HB3 GLN 4 HB3 GLN 4 -7.112 3.244 -7.392 28 HG2 GLN 4 HG2 GLN 4 -6.358 3.863 -5.336 29 HG3 GLN 4 HG3 GLN 4 -5.419 2.388 -5.113 30 HE21 GLN 4 HE21 GLN 4 -3.400 3.013 -4.795 31 HE22 GLN 4 HE22 GLN 4 -2.514 4.110 -5.792 32 H VAL 5 H VAL 5 -9.658 0.771 -6.945 33 HA VAL 5 HA VAL 5 -9.325 -0.042 -9.753 34 HB VAL 5 HB VAL 5 -9.533 -2.080 -8.422 35 HG11 VAL 5 HG11 VAL 5 -11.054 -2.429 -6.790 36 HG12 VAL 5 HG12 VAL 5 -11.073 -0.666 -6.728 37 HG13 VAL 5 HG13 VAL 5 -12.320 -1.531 -7.628 38 HG21 VAL 5 HG21 VAL 5 -12.219 -2.005 -9.608 39 HG22 VAL 5 HG22 VAL 5 -10.920 -1.470 -10.672 40 HG23 VAL 5 HG23 VAL 5 -10.859 -3.075 -9.944 41 H SER 6 H SER 6 -10.702 0.912 -11.109 42 HA SER 6 HA SER 6 -12.932 2.440 -9.959 43 HB2 SER 6 HB2 SER 6 -12.872 3.707 -12.112 44 HB3 SER 6 HB3 SER 6 -11.369 3.814 -11.197 45 HG SER 6 HG SER 6 -10.518 3.188 -13.018 46 H ASN 7 H ASN 7 -12.121 -0.064 -12.242 47 HA ASN 7 HA ASN 7 -14.802 -0.167 -13.343 48 HB2 ASN 7 HB2 ASN 7 -12.381 -1.926 -13.798 49 HB3 ASN 7 HB3 ASN 7 -13.912 -2.090 -14.654 50 HD21 ASN 7 HD21 ASN 7 -11.647 -1.719 -16.071 51 HD22 ASN 7 HD22 ASN 7 -11.620 -0.137 -16.763 52 H VAL 8 H VAL 8 -15.467 -2.713 -13.607 53 HA VAL 8 HA VAL 8 -15.702 -3.686 -10.836 54 HB VAL 8 HB VAL 8 -17.786 -4.795 -11.547 55 HG11 VAL 8 HG11 VAL 8 -17.757 -2.494 -10.578 56 HG12 VAL 8 HG12 VAL 8 -17.836 -1.859 -12.223 57 HG13 VAL 8 HG13 VAL 8 -19.159 -2.838 -11.589 58 HG21 VAL 8 HG21 VAL 8 -17.244 -3.401 -14.164 59 HG22 VAL 8 HG22 VAL 8 -17.354 -5.138 -13.884 60 HG23 VAL 8 HG23 VAL 8 -18.790 -4.128 -13.726 61 H ARG 9 H ARG 9 -16.419 -6.165 -10.958 62 HA ARG 9 HA ARG 9 -14.758 -7.599 -12.892 63 HB2 ARG 9 HB2 ARG 9 -13.839 -9.014 -11.033 64 HB3 ARG 9 HB3 ARG 9 -13.251 -7.357 -11.053 65 HG2 ARG 9 HG2 ARG 9 -14.904 -6.793 -9.300 66 HG3 ARG 9 HG3 ARG 9 -15.361 -8.497 -9.236 67 HD2 ARG 9 HD2 ARG 9 -13.733 -7.803 -7.479 68 HD3 ARG 9 HD3 ARG 9 -13.176 -9.126 -8.503 69 HE ARG 9 HE ARG 9 -12.305 -6.612 -9.501 70 HH11 ARG 9 HH11 ARG 9 -11.671 -8.992 -7.040 71 HH12 ARG 9 HH12 ARG 9 -9.995 -8.579 -6.888 72 HH21 ARG 9 HH21 ARG 9 -10.101 -6.060 -9.311 73 HH22 ARG 9 HH22 ARG 9 -9.103 -6.910 -8.180 74 H ALA 10 H ALA 10 -15.268 -9.857 -13.071 75 HA ALA 10 HA ALA 10 -18.040 -10.422 -12.275 76 HB1 ALA 10 HB1 ALA 10 -17.000 -10.500 -14.743 77 HB2 ALA 10 HB2 ALA 10 -16.694 -12.165 -14.244 78 HB3 ALA 10 HB3 ALA 10 -18.338 -11.527 -14.225 79 H ARG 11 H ARG 11 -18.342 -11.766 -10.635 80 HA ARG 11 HA ARG 11 -16.188 -13.587 -9.855 81 HB2 ARG 11 HB2 ARG 11 -17.125 -12.100 -8.130 82 HB3 ARG 11 HB3 ARG 11 -18.714 -12.811 -8.385 83 HG2 ARG 11 HG2 ARG 11 -17.813 -14.995 -7.667 84 HG3 ARG 11 HG3 ARG 11 -16.269 -14.211 -7.326 85 HD2 ARG 11 HD2 ARG 11 -18.794 -13.171 -6.105 86 HD3 ARG 11 HD3 ARG 11 -17.985 -14.573 -5.407 87 HE ARG 11 HE ARG 11 -17.174 -11.856 -5.189 88 HH11 ARG 11 HH11 ARG 11 -15.962 -15.112 -5.413 89 HH12 ARG 11 HH12 ARG 11 -14.485 -14.758 -4.579 90 HH21 ARG 11 HH21 ARG 11 -15.234 -11.378 -4.089 91 HH22 ARG 11 HH22 ARG 11 -14.072 -12.634 -3.826 92 H ILE 12 H ILE 12 -16.311 -15.430 -11.004 93 HA ILE 12 HA ILE 12 -18.932 -16.730 -11.289 94 HB ILE 12 HB ILE 12 -16.366 -17.339 -12.762 95 HG12 ILE 12 HG12 ILE 12 -18.839 -15.966 -13.825 96 HG13 ILE 12 HG13 ILE 12 -17.427 -15.090 -13.242 97 HG21 ILE 12 HG21 ILE 12 -17.454 -19.293 -13.053 98 HG22 ILE 12 HG22 ILE 12 -19.028 -18.598 -12.668 99 HG23 ILE 12 HG23 ILE 12 -18.336 -18.377 -14.275 100 HD11 ILE 12 HD11 ILE 12 -17.517 -15.359 -15.702 101 HD12 ILE 12 HD12 ILE 12 -16.062 -16.030 -14.964 102 HD13 ILE 12 HD13 ILE 12 -17.366 -17.101 -15.477 103 H TYR 13 H TYR 13 -19.335 -18.695 -10.421 104 HA TYR 13 HA TYR 13 -17.282 -20.474 -9.541 105 HB2 TYR 13 HB2 TYR 13 -17.663 -20.365 -7.161 106 HB3 TYR 13 HB3 TYR 13 -17.237 -18.757 -7.732 107 HD1 TYR 13 HD1 TYR 13 -19.246 -17.179 -8.283 108 HD2 TYR 13 HD2 TYR 13 -19.536 -20.636 -5.819 109 HE1 TYR 13 HE1 TYR 13 -21.287 -16.269 -7.257 110 HE2 TYR 13 HE2 TYR 13 -21.579 -19.736 -4.787 111 HH TYR 13 HH TYR 13 -22.955 -17.995 -4.642 112 H LYS 14 H LYS 14 -18.087 -22.501 -8.909 113 HA LYS 14 HA LYS 14 -20.939 -22.890 -9.517 114 HB2 LYS 14 HB2 LYS 14 -19.388 -24.035 -11.041 115 HB3 LYS 14 HB3 LYS 14 -18.653 -24.864 -9.675 116 HG2 LYS 14 HG2 LYS 14 -21.184 -25.611 -9.296 117 HG3 LYS 14 HG3 LYS 14 -21.224 -25.365 -11.044 118 HD2 LYS 14 HD2 LYS 14 -19.175 -27.057 -9.617 119 HD3 LYS 14 HD3 LYS 14 -20.652 -27.694 -10.344 120 HE2 LYS 14 HE2 LYS 14 -18.579 -26.116 -11.858 121 HE3 LYS 14 HE3 LYS 14 -18.600 -27.877 -11.774 122 HZ1 LYS 14 HZ1 LYS 14 -20.805 -27.855 -12.775 123 HZ2 LYS 14 HZ2 LYS 14 -19.676 -27.094 -13.780 124 HZ3 LYS 14 HZ3 LYS 14 -20.764 -26.166 -12.876 125 HA PRO 15 HA PRO 15 -20.787 -23.715 -5.022 126 HB2 PRO 15 HB2 PRO 15 -23.374 -23.007 -4.599 127 HB3 PRO 15 HB3 PRO 15 -22.055 -21.832 -4.668 128 HG2 PRO 15 HG2 PRO 15 -24.022 -22.598 -6.791 129 HG3 PRO 15 HG3 PRO 15 -23.440 -20.986 -6.335 130 HD2 PRO 15 HD2 PRO 15 -22.484 -22.327 -8.485 131 HD3 PRO 15 HD3 PRO 15 -21.480 -21.221 -7.526 132 H ALA 16 H ALA 16 -22.542 -24.949 -3.678 133 HA ALA 16 HA ALA 16 -22.830 -27.517 -4.851 134 HB1 ALA 16 HB1 ALA 16 -24.400 -26.828 -2.432 135 HB2 ALA 16 HB2 ALA 16 -23.398 -28.241 -2.773 136 HB3 ALA 16 HB3 ALA 16 -22.643 -26.711 -2.327 137 H LYS 17 H LYS 17 -24.934 -28.711 -4.876 138 HA LYS 17 HA LYS 17 -26.789 -27.335 -6.546 139 HB2 LYS 17 HB2 LYS 17 -27.085 -30.037 -5.220 140 HB3 LYS 17 HB3 LYS 17 -28.021 -29.436 -6.583 141 HG2 LYS 17 HG2 LYS 17 -25.039 -29.741 -6.713 142 HG3 LYS 17 HG3 LYS 17 -26.142 -31.067 -7.087 143 HD2 LYS 17 HD2 LYS 17 -27.236 -29.586 -8.771 144 HD3 LYS 17 HD3 LYS 17 -25.977 -28.388 -8.464 145 HE2 LYS 17 HE2 LYS 17 -24.276 -29.886 -9.242 146 HE3 LYS 17 HE3 LYS 17 -25.428 -31.216 -9.352 147 HZ1 LYS 17 HZ1 LYS 17 -26.589 -29.420 -10.934 148 HZ2 LYS 17 HZ2 LYS 17 -25.500 -30.586 -11.494 149 HZ3 LYS 17 HZ3 LYS 17 -24.966 -29.012 -11.182 150 H SER 18 H SER 18 -29.259 -27.822 -5.990 151 HA SER 18 HA SER 18 -29.842 -27.243 -3.192 152 HB2 SER 18 HB2 SER 18 -31.007 -25.465 -5.329 153 HB3 SER 18 HB3 SER 18 -30.999 -25.220 -3.582 154 HG SER 18 HG SER 18 -29.207 -24.408 -5.384 155 H THR 19 H THR 19 -32.344 -27.005 -2.960 156 HA THR 19 HA THR 19 -33.481 -29.379 -4.175 157 HB THR 19 HB THR 19 -35.378 -29.012 -2.642 158 HG1 THR 19 HG1 THR 19 -33.890 -26.758 -1.729 159 HG21 THR 19 HG21 THR 19 -32.604 -29.375 -1.826 160 HG22 THR 19 HG22 THR 19 -34.046 -30.273 -1.354 161 HG23 THR 19 HG23 THR 19 -33.627 -28.776 -0.521 162 H MET 20 H MET 20 -35.774 -29.309 -4.946 163 HA MET 20 HA MET 20 -37.299 -28.620 -6.484 164 HB2 MET 20 HB2 MET 20 -36.639 -25.828 -5.544 165 HB3 MET 20 HB3 MET 20 -38.127 -26.367 -6.309 166 HG2 MET 20 HG2 MET 20 -38.526 -27.834 -4.337 167 HG3 MET 20 HG3 MET 20 -37.125 -27.092 -3.569 168 HE1 MET 20 HE1 MET 20 -39.971 -25.444 -1.525 169 HE2 MET 20 HE2 MET 20 -39.611 -27.114 -1.967 170 HE3 MET 20 HE3 MET 20 -38.314 -26.043 -1.437 171 H GLN 21 H GLN 21 -34.783 -29.102 -7.508 172 HA GLN 21 HA GLN 21 -34.352 -26.938 -9.448 173 HB2 GLN 21 HB2 GLN 21 -32.589 -29.056 -8.297 174 HB3 GLN 21 HB3 GLN 21 -32.239 -28.456 -9.913 175 HG2 GLN 21 HG2 GLN 21 -32.266 -26.135 -8.916 176 HG3 GLN 21 HG3 GLN 21 -32.283 -26.918 -7.337 177 HE21 GLN 21 HE21 GLN 21 -30.286 -25.237 -8.877 178 HE22 GLN 21 HE22 GLN 21 -28.811 -26.128 -8.759 179 H SER 22 H SER 22 -34.110 -27.438 -11.675 180 HA SER 22 HA SER 22 -34.723 -28.421 -13.633 181 HB2 SER 22 HB2 SER 22 -34.750 -31.134 -12.379 182 HB3 SER 22 HB3 SER 22 -34.112 -30.627 -13.944 183 HG SER 22 HG SER 22 -32.374 -31.013 -12.630 184 H GLY 23 H GLY 23 -36.797 -27.417 -12.136 185 HA2 GLY 23 HA2 GLY 23 -38.924 -29.440 -12.447 186 HA3 GLY 23 HA3 GLY 23 -38.999 -28.087 -11.329 187 H HIS 24 H HIS 24 -39.650 -26.087 -12.048 188 HA HIS 24 HA HIS 24 -40.435 -25.907 -14.880 189 HB2 HIS 24 HB2 HIS 24 -42.431 -24.580 -14.091 190 HB3 HIS 24 HB3 HIS 24 -42.469 -26.294 -13.688 191 HD1 HIS 24 HD1 HIS 24 -42.210 -26.928 -11.185 192 HD2 HIS 24 HD2 HIS 24 -42.286 -22.839 -11.918 193 HE1 HIS 24 HE1 HIS 24 -42.553 -25.848 -8.940 194 H SER 25 H SER 25 -38.039 -24.923 -13.652 195 HA SER 25 HA SER 25 -38.439 -22.044 -14.101 196 HB2 SER 25 HB2 SER 25 -38.048 -22.841 -11.627 197 HB3 SER 25 HB3 SER 25 -36.368 -22.976 -12.145 198 HG SER 25 HG SER 25 -36.254 -20.908 -11.874 199 H LYS 26 H LYS 26 -36.267 -20.935 -14.501 200 HA LYS 26 HA LYS 26 -35.083 -22.022 -16.784 201 HB2 LYS 26 HB2 LYS 26 -34.442 -19.760 -14.951 202 HB3 LYS 26 HB3 LYS 26 -33.200 -20.278 -16.083 203 HG2 LYS 26 HG2 LYS 26 -34.577 -19.798 -17.952 204 HG3 LYS 26 HG3 LYS 26 -35.996 -19.569 -16.927 205 HD2 LYS 26 HD2 LYS 26 -35.102 -17.423 -17.654 206 HD3 LYS 26 HD3 LYS 26 -34.934 -17.608 -15.907 207 HE2 LYS 26 HE2 LYS 26 -32.914 -16.657 -16.880 208 HE3 LYS 26 HE3 LYS 26 -32.594 -18.252 -16.201 209 HZ1 LYS 26 HZ1 LYS 26 -32.684 -19.196 -18.402 210 HZ2 LYS 26 HZ2 LYS 26 -31.554 -17.937 -18.377 211 HZ3 LYS 26 HZ3 LYS 26 -33.075 -17.695 -19.078 212 H LEU 27 H LEU 27 -32.891 -22.732 -17.135 213 HA LEU 27 HA LEU 27 -31.996 -24.515 -15.021 214 HB2 LEU 27 HB2 LEU 27 -31.490 -24.248 -17.941 215 HB3 LEU 27 HB3 LEU 27 -30.281 -25.063 -16.952 216 HG LEU 27 HG LEU 27 -32.306 -26.496 -16.148 217 HD11 LEU 27 HD11 LEU 27 -34.190 -25.583 -17.060 218 HD12 LEU 27 HD12 LEU 27 -33.791 -26.768 -18.303 219 HD13 LEU 27 HD13 LEU 27 -33.366 -25.072 -18.534 220 HD21 LEU 27 HD21 LEU 27 -30.369 -27.307 -17.430 221 HD22 LEU 27 HD22 LEU 27 -31.170 -26.818 -18.923 222 HD23 LEU 27 HD23 LEU 27 -31.872 -28.089 -17.921 223 H LYS 28 H LYS 28 -30.209 -24.251 -13.822 224 HA LYS 28 HA LYS 28 -28.204 -22.283 -14.633 225 HB2 LYS 28 HB2 LYS 28 -29.678 -22.262 -11.997 226 HB3 LYS 28 HB3 LYS 28 -28.174 -21.391 -12.274 227 HG2 LYS 28 HG2 LYS 28 -29.650 -19.721 -12.694 228 HG3 LYS 28 HG3 LYS 28 -29.539 -20.411 -14.316 229 HD2 LYS 28 HD2 LYS 28 -31.812 -20.317 -14.093 230 HD3 LYS 28 HD3 LYS 28 -31.517 -21.922 -13.419 231 HE2 LYS 28 HE2 LYS 28 -31.340 -20.729 -11.159 232 HE3 LYS 28 HE3 LYS 28 -32.075 -19.349 -11.974 233 HZ1 LYS 28 HZ1 LYS 28 -34.025 -20.286 -11.561 234 HZ2 LYS 28 HZ2 LYS 28 -33.307 -21.706 -10.990 235 HZ3 LYS 28 HZ3 LYS 28 -33.627 -21.525 -12.642 236 H ALA 29 H ALA 29 -26.243 -23.129 -14.447 237 HA ALA 29 HA ALA 29 -25.833 -25.307 -12.502 238 HB1 ALA 29 HB1 ALA 29 -25.595 -25.485 -15.223 239 HB2 ALA 29 HB2 ALA 29 -23.931 -25.198 -14.714 240 HB3 ALA 29 HB3 ALA 29 -24.831 -26.564 -14.056 241 H TRP 30 H TRP 30 -24.567 -22.362 -13.898 242 HA TRP 30 HA TRP 30 -22.432 -22.373 -11.866 243 HB2 TRP 30 HB2 TRP 30 -22.452 -21.259 -14.667 244 HB3 TRP 30 HB3 TRP 30 -21.272 -20.746 -13.465 245 HD1 TRP 30 HD1 TRP 30 -22.360 -23.911 -15.385 246 HE1 TRP 30 HE1 TRP 30 -20.353 -25.519 -15.486 247 HE3 TRP 30 HE3 TRP 30 -19.099 -21.324 -12.418 248 HZ2 TRP 30 HZ2 TRP 30 -17.733 -25.669 -14.445 249 HZ3 TRP 30 HZ3 TRP 30 -16.863 -22.268 -12.020 250 HH2 TRP 30 HH2 TRP 30 -16.195 -24.396 -13.013 251 H LYS 31 H LYS 31 -21.891 -20.337 -10.907 252 HA LYS 31 HA LYS 31 -24.142 -18.434 -10.931 253 HB2 LYS 31 HB2 LYS 31 -23.548 -19.783 -8.797 254 HB3 LYS 31 HB3 LYS 31 -22.177 -18.687 -8.671 255 HG2 LYS 31 HG2 LYS 31 -23.534 -17.346 -7.534 256 HG3 LYS 31 HG3 LYS 31 -24.308 -16.989 -9.079 257 HD2 LYS 31 HD2 LYS 31 -25.738 -19.071 -8.614 258 HD3 LYS 31 HD3 LYS 31 -25.155 -18.934 -6.954 259 HE2 LYS 31 HE2 LYS 31 -26.051 -16.676 -6.811 260 HE3 LYS 31 HE3 LYS 31 -26.585 -16.765 -8.488 261 HZ1 LYS 31 HZ1 LYS 31 -28.206 -18.339 -7.960 262 HZ2 LYS 31 HZ2 LYS 31 -28.304 -17.213 -6.702 263 HZ3 LYS 31 HZ3 LYS 31 -27.524 -18.693 -6.453 264 H LEU 32 H LEU 32 -23.749 -16.277 -11.170 265 HA LEU 32 HA LEU 32 -20.956 -15.399 -11.381 266 HB2 LEU 32 HB2 LEU 32 -21.721 -15.855 -13.639 267 HB3 LEU 32 HB3 LEU 32 -23.142 -14.843 -13.382 268 HG LEU 32 HG LEU 32 -21.150 -13.918 -14.751 269 HD11 LEU 32 HD11 LEU 32 -23.199 -12.721 -13.724 270 HD12 LEU 32 HD12 LEU 32 -21.818 -11.759 -14.251 271 HD13 LEU 32 HD13 LEU 32 -22.043 -12.114 -12.538 272 HD21 LEU 32 HD21 LEU 32 -20.090 -12.941 -12.164 273 HD22 LEU 32 HD22 LEU 32 -19.264 -13.227 -13.696 274 HD23 LEU 32 HD23 LEU 32 -19.662 -14.584 -12.642 275 H GLU 33 H GLU 33 -20.587 -13.635 -10.217 276 HA GLU 33 HA GLU 33 -22.822 -11.788 -9.704 277 HB2 GLU 33 HB2 GLU 33 -20.708 -12.492 -7.668 278 HB3 GLU 33 HB3 GLU 33 -22.153 -11.522 -7.418 279 HG2 GLU 33 HG2 GLU 33 -23.478 -13.601 -7.990 280 HG3 GLU 33 HG3 GLU 33 -21.960 -14.485 -7.854 281 H PHE 34 H PHE 34 -22.282 -10.065 -10.898 282 HA PHE 34 HA PHE 34 -19.512 -9.197 -11.072 283 HB2 PHE 34 HB2 PHE 34 -20.301 -7.620 -12.746 284 HB3 PHE 34 HB3 PHE 34 -20.939 -9.222 -13.097 285 HD1 PHE 34 HD1 PHE 34 -23.300 -9.709 -12.828 286 HD2 PHE 34 HD2 PHE 34 -21.745 -5.823 -12.052 287 HE1 PHE 34 HE1 PHE 34 -25.582 -8.791 -12.874 288 HE2 PHE 34 HE2 PHE 34 -24.025 -4.899 -12.097 289 HZ PHE 34 HZ PHE 34 -25.947 -6.383 -12.507 290 H GLU 35 H GLU 35 -18.676 -7.380 -10.168 291 HA GLU 35 HA GLU 35 -19.959 -6.298 -7.885 292 HB2 GLU 35 HB2 GLU 35 -17.390 -5.921 -9.287 293 HB3 GLU 35 HB3 GLU 35 -17.954 -4.531 -8.370 294 HG2 GLU 35 HG2 GLU 35 -16.731 -5.600 -6.776 295 HG3 GLU 35 HG3 GLU 35 -18.315 -6.318 -6.486 296 HA PRO 36 HA PRO 36 -22.197 -2.852 -9.421 297 HB2 PRO 36 HB2 PRO 36 -21.705 -0.952 -7.546 298 HB3 PRO 36 HB3 PRO 36 -22.738 -2.354 -7.245 299 HG2 PRO 36 HG2 PRO 36 -19.874 -1.916 -6.495 300 HG3 PRO 36 HG3 PRO 36 -21.187 -2.619 -5.532 301 HD2 PRO 36 HD2 PRO 36 -19.330 -4.137 -6.789 302 HD3 PRO 36 HD3 PRO 36 -21.005 -4.677 -6.554 303 H SER 37 H SER 37 -21.839 -1.434 -11.007 304 HA SER 37 HA SER 37 -19.191 -0.156 -11.164 305 HB2 SER 37 HB2 SER 37 -19.237 -0.354 -13.462 306 HB3 SER 37 HB3 SER 37 -20.178 -1.777 -13.016 307 HG SER 37 HG SER 37 -21.075 0.704 -14.010 308 H CYS 38 H CYS 38 -19.266 1.957 -12.468 309 HA CYS 38 HA CYS 38 -21.238 3.671 -11.186 310 HB2 CYS 38 HB2 CYS 38 -18.607 4.099 -12.533 311 HB3 CYS 38 HB3 CYS 38 -19.736 5.446 -12.450 312 HG CYS 38 HG CYS 38 -19.824 4.477 -9.469 313 H THR 39 H THR 39 -22.880 2.571 -12.654 314 HA THR 39 HA THR 39 -22.911 3.290 -15.422 315 HB THR 39 HB THR 39 -25.130 2.333 -15.496 316 HG1 THR 39 HG1 THR 39 -25.066 1.946 -12.692 317 HG21 THR 39 HG21 THR 39 -23.180 0.798 -15.353 318 HG22 THR 39 HG22 THR 39 -24.667 0.097 -14.714 319 HG23 THR 39 HG23 THR 39 -23.430 0.699 -13.611 320 H GLN 40 H GLN 40 -24.945 4.416 -16.310 321 HA GLN 40 HA GLN 40 -25.550 6.784 -14.667 322 HB2 GLN 40 HB2 GLN 40 -23.938 6.992 -16.744 323 HB3 GLN 40 HB3 GLN 40 -25.446 6.982 -17.648 324 HG2 GLN 40 HG2 GLN 40 -24.696 9.248 -17.202 325 HG3 GLN 40 HG3 GLN 40 -26.230 8.912 -16.399 326 HE21 GLN 40 HE21 GLN 40 -26.288 9.952 -14.546 327 HE22 GLN 40 HE22 GLN 40 -25.004 10.056 -13.395 328 H TYR 41 H TYR 41 -27.112 4.403 -14.850 329 HA TYR 41 HA TYR 41 -29.282 3.763 -15.084 330 HB2 TYR 41 HB2 TYR 41 -29.478 6.294 -14.324 331 HB3 TYR 41 HB3 TYR 41 -30.116 6.496 -15.953 332 HD1 TYR 41 HD1 TYR 41 -30.533 3.884 -13.304 333 HD2 TYR 41 HD2 TYR 41 -32.413 6.646 -15.938 334 HE1 TYR 41 HE1 TYR 41 -32.736 3.114 -12.528 335 HE2 TYR 41 HE2 TYR 41 -34.621 5.885 -15.169 336 HH TYR 41 HH TYR 41 -35.240 3.168 -13.758 337 H THR 42 H THR 42 -27.528 3.529 -17.312 338 HA THR 42 HA THR 42 -29.462 3.750 -19.526 339 HB THR 42 HB THR 42 -26.494 3.757 -19.996 340 HG1 THR 42 HG1 THR 42 -26.664 6.071 -20.044 341 HG21 THR 42 HG21 THR 42 -27.328 5.110 -22.005 342 HG22 THR 42 HG22 THR 42 -28.940 4.556 -21.551 343 HG23 THR 42 HG23 THR 42 -27.695 3.385 -21.980 344 H GLU 43 H GLU 43 -30.023 1.564 -18.592 345 HA GLU 43 HA GLU 43 -28.317 -0.483 -19.846 346 HB2 GLU 43 HB2 GLU 43 -28.394 -0.339 -17.232 347 HB3 GLU 43 HB3 GLU 43 -29.962 -1.110 -17.423 348 HG2 GLU 43 HG2 GLU 43 -28.798 -2.897 -18.755 349 HG3 GLU 43 HG3 GLU 43 -27.276 -2.175 -18.237 350 HA PRO 44 HA PRO 44 -32.635 -0.628 -21.568 351 HB2 PRO 44 HB2 PRO 44 -31.849 -0.792 -24.161 352 HB3 PRO 44 HB3 PRO 44 -32.070 0.747 -23.320 353 HG2 PRO 44 HG2 PRO 44 -29.547 -0.767 -23.867 354 HG3 PRO 44 HG3 PRO 44 -29.859 0.973 -24.005 355 HD2 PRO 44 HD2 PRO 44 -28.580 -0.114 -21.880 356 HD3 PRO 44 HD3 PRO 44 -29.612 1.325 -21.740 357 H LEU 45 H LEU 45 -33.708 -2.455 -22.227 358 HA LEU 45 HA LEU 45 -32.064 -4.867 -22.628 359 HB2 LEU 45 HB2 LEU 45 -33.857 -6.146 -21.578 360 HB3 LEU 45 HB3 LEU 45 -33.203 -4.923 -20.491 361 HG LEU 45 HG LEU 45 -35.664 -4.290 -22.052 362 HD11 LEU 45 HD11 LEU 45 -35.652 -6.630 -20.738 363 HD12 LEU 45 HD12 LEU 45 -37.071 -5.589 -20.859 364 HD13 LEU 45 HD13 LEU 45 -36.064 -5.542 -19.411 365 HD21 LEU 45 HD21 LEU 45 -34.150 -2.978 -20.158 366 HD22 LEU 45 HD22 LEU 45 -35.515 -3.604 -19.232 367 HD23 LEU 45 HD23 LEU 45 -35.799 -2.574 -20.636 368 H MET 46 H MET 46 -33.805 -6.676 -23.479 369 HA MET 46 HA MET 46 -35.125 -5.477 -25.824 370 HB2 MET 46 HB2 MET 46 -32.871 -6.773 -26.158 371 HB3 MET 46 HB3 MET 46 -33.882 -8.199 -25.967 372 HG2 MET 46 HG2 MET 46 -35.008 -7.837 -27.928 373 HG3 MET 46 HG3 MET 46 -34.709 -6.100 -27.904 374 HE1 MET 46 HE1 MET 46 -33.195 -9.094 -30.368 375 HE2 MET 46 HE2 MET 46 -32.219 -9.581 -28.982 376 HE3 MET 46 HE3 MET 46 -33.967 -9.414 -28.815 377 H ASN 47 H ASN 47 -34.865 -8.632 -24.168 378 HA ASN 47 HA ASN 47 -37.440 -9.506 -24.878 379 HB2 ASN 47 HB2 ASN 47 -37.121 -11.152 -22.990 380 HB3 ASN 47 HB3 ASN 47 -35.830 -11.133 -24.188 381 HD21 ASN 47 HD21 ASN 47 -34.112 -11.736 -23.035 382 HD22 ASN 47 HD22 ASN 47 -33.530 -10.924 -21.625 383 H TRP 48 H TRP 48 -39.037 -10.177 -23.030 384 HA TRP 48 HA TRP 48 -39.698 -7.702 -21.600 385 HB2 TRP 48 HB2 TRP 48 -41.298 -9.971 -22.696 386 HB3 TRP 48 HB3 TRP 48 -41.933 -9.102 -21.302 387 HD1 TRP 48 HD1 TRP 48 -40.065 -7.453 -24.249 388 HE1 TRP 48 HE1 TRP 48 -41.664 -5.781 -25.378 389 HE3 TRP 48 HE3 TRP 48 -44.314 -8.477 -21.597 390 HZ2 TRP 48 HZ2 TRP 48 -44.369 -5.000 -25.171 391 HZ3 TRP 48 HZ3 TRP 48 -46.364 -7.223 -22.123 392 HH2 TRP 48 HH2 TRP 48 -46.389 -5.520 -23.874 393 H THR 49 H THR 49 -40.500 -7.810 -19.421 394 HA THR 49 HA THR 49 -38.995 -9.681 -17.814 395 HB THR 49 HB THR 49 -39.921 -8.404 -15.883 396 HG1 THR 49 HG1 THR 49 -41.852 -7.630 -16.619 397 HG21 THR 49 HG21 THR 49 -38.878 -6.148 -16.651 398 HG22 THR 49 HG22 THR 49 -38.474 -7.038 -18.121 399 HG23 THR 49 HG23 THR 49 -37.859 -7.584 -16.561 400 H GLY 50 H GLY 50 -39.963 -10.913 -16.057 401 HA2 GLY 50 HA2 GLY 50 -42.518 -12.081 -16.906 402 HA3 GLY 50 HA3 GLY 50 -41.343 -12.839 -15.841 403 H SER 51 H SER 51 -42.693 -13.287 -14.152 404 HA SER 51 HA SER 51 -43.831 -10.949 -12.765 405 HB2 SER 51 HB2 SER 51 -44.991 -13.745 -12.792 406 HB3 SER 51 HB3 SER 51 -45.684 -12.328 -12.005 407 HG SER 51 HG SER 51 -46.704 -12.576 -13.962 408 H HIS 52 H HIS 52 -42.312 -10.611 -11.230 409 HA HIS 52 HA HIS 52 -42.002 -12.688 -9.207 410 HB2 HIS 52 HB2 HIS 52 -39.616 -12.581 -9.147 411 HB3 HIS 52 HB3 HIS 52 -40.075 -12.871 -10.822 412 HD1 HIS 52 HD1 HIS 52 -38.289 -10.497 -8.649 413 HD2 HIS 52 HD2 HIS 52 -39.751 -10.590 -12.537 414 HE1 HIS 52 HE1 HIS 52 -37.181 -8.574 -9.829 415 H ASP 53 H ASP 53 -41.054 -11.843 -7.190 416 HA ASP 53 HA ASP 53 -42.182 -9.276 -6.567 417 HB2 ASP 53 HB2 ASP 53 -42.131 -11.325 -5.041 418 HB3 ASP 53 HB3 ASP 53 -40.438 -10.937 -4.752 419 H THR 54 H THR 54 -38.899 -10.578 -6.050 420 HA THR 54 HA THR 54 -37.693 -8.198 -7.140 421 HB THR 54 HB THR 54 -38.159 -7.346 -4.930 422 HG1 THR 54 HG1 THR 54 -35.438 -8.079 -4.767 423 HG21 THR 54 HG21 THR 54 -37.450 -10.047 -4.130 424 HG22 THR 54 HG22 THR 54 -38.374 -8.821 -3.262 425 HG23 THR 54 HG23 THR 54 -36.613 -8.830 -3.168 426 H LYS 55 H LYS 55 -35.473 -8.424 -7.539 427 HA LYS 55 HA LYS 55 -34.101 -10.827 -6.682 428 HB2 LYS 55 HB2 LYS 55 -35.320 -11.638 -8.634 429 HB3 LYS 55 HB3 LYS 55 -34.691 -10.313 -9.603 430 HG2 LYS 55 HG2 LYS 55 -32.388 -11.219 -9.148 431 HG3 LYS 55 HG3 LYS 55 -33.175 -12.640 -8.456 432 HD2 LYS 55 HD2 LYS 55 -33.939 -11.705 -11.190 433 HD3 LYS 55 HD3 LYS 55 -32.454 -12.631 -10.967 434 HE2 LYS 55 HE2 LYS 55 -34.057 -14.217 -9.600 435 HE3 LYS 55 HE3 LYS 55 -35.291 -13.461 -10.606 436 HZ1 LYS 55 HZ1 LYS 55 -33.583 -15.542 -11.290 437 HZ2 LYS 55 HZ2 LYS 55 -33.100 -14.207 -12.210 438 HZ3 LYS 55 HZ3 LYS 55 -34.699 -14.752 -12.286 439 H GLN 56 H GLN 56 -32.066 -10.302 -6.253 440 HA GLN 56 HA GLN 56 -31.003 -7.751 -6.785 441 HB2 GLN 56 HB2 GLN 56 -29.588 -10.295 -5.970 442 HB3 GLN 56 HB3 GLN 56 -28.876 -8.688 -5.927 443 HG2 GLN 56 HG2 GLN 56 -31.405 -9.239 -4.444 444 HG3 GLN 56 HG3 GLN 56 -29.854 -9.730 -3.767 445 HE21 GLN 56 HE21 GLN 56 -31.474 -7.911 -2.492 446 HE22 GLN 56 HE22 GLN 56 -30.724 -6.354 -2.521 447 H GLN 57 H GLN 57 -29.792 -6.959 -8.403 448 HA GLN 57 HA GLN 57 -29.458 -8.588 -10.772 449 HB2 GLN 57 HB2 GLN 57 -28.737 -6.503 -11.843 450 HB3 GLN 57 HB3 GLN 57 -30.267 -6.295 -11.001 451 HG2 GLN 57 HG2 GLN 57 -28.643 -5.519 -9.051 452 HG3 GLN 57 HG3 GLN 57 -27.606 -5.137 -10.424 453 HE21 GLN 57 HE21 GLN 57 -28.349 -3.631 -11.976 454 HE22 GLN 57 HE22 GLN 57 -29.552 -2.459 -11.571 455 H VAL 58 H VAL 58 -27.427 -7.013 -8.361 456 HA VAL 58 HA VAL 58 -24.933 -7.271 -9.517 457 HB VAL 58 HB VAL 58 -25.536 -7.722 -6.593 458 HG11 VAL 58 HG11 VAL 58 -23.232 -8.270 -7.448 459 HG12 VAL 58 HG12 VAL 58 -23.060 -6.560 -7.850 460 HG13 VAL 58 HG13 VAL 58 -23.299 -7.053 -6.174 461 HG21 VAL 58 HG21 VAL 58 -26.402 -5.657 -6.669 462 HG22 VAL 58 HG22 VAL 58 -24.731 -5.118 -6.838 463 HG23 VAL 58 HG23 VAL 58 -25.736 -5.335 -8.271 464 H CYS 59 H CYS 59 -26.947 -9.717 -8.045 465 HA CYS 59 HA CYS 59 -24.866 -11.722 -8.626 466 HB2 CYS 59 HB2 CYS 59 -25.254 -11.642 -6.249 467 HB3 CYS 59 HB3 CYS 59 -26.996 -11.724 -6.482 468 HG CYS 59 HG CYS 59 -26.164 -14.170 -5.458 469 H LEU 60 H LEU 60 -25.364 -13.364 -9.959 470 HA LEU 60 HA LEU 60 -28.133 -14.030 -10.524 471 HB2 LEU 60 HB2 LEU 60 -27.913 -13.747 -12.923 472 HB3 LEU 60 HB3 LEU 60 -27.678 -12.215 -12.084 473 HG LEU 60 HG LEU 60 -25.245 -13.765 -12.771 474 HD11 LEU 60 HD11 LEU 60 -27.059 -12.491 -14.793 475 HD12 LEU 60 HD12 LEU 60 -26.290 -14.078 -14.838 476 HD13 LEU 60 HD13 LEU 60 -25.319 -12.622 -15.055 477 HD21 LEU 60 HD21 LEU 60 -24.615 -11.340 -13.426 478 HD22 LEU 60 HD22 LEU 60 -24.779 -11.755 -11.719 479 HD23 LEU 60 HD23 LEU 60 -26.081 -10.900 -12.548 480 H SER 61 H SER 61 -28.199 -15.865 -12.203 481 HA SER 61 HA SER 61 -25.861 -17.621 -11.850 482 HB2 SER 61 HB2 SER 61 -27.809 -19.455 -11.934 483 HB3 SER 61 HB3 SER 61 -27.270 -18.726 -10.421 484 HG SER 61 HG SER 61 -29.598 -18.732 -10.795 485 H PHE 62 H PHE 62 -25.134 -18.591 -13.644 486 HA PHE 62 HA PHE 62 -26.698 -18.230 -16.106 487 HB2 PHE 62 HB2 PHE 62 -23.766 -18.349 -15.525 488 HB3 PHE 62 HB3 PHE 62 -24.339 -18.841 -17.115 489 HD1 PHE 62 HD2 PHE 62 -25.964 -17.145 -18.283 490 HD2 PHE 62 HD1 PHE 62 -23.249 -16.141 -15.162 491 HE1 PHE 62 HE2 PHE 62 -26.031 -14.789 -18.987 492 HE2 PHE 62 HE1 PHE 62 -23.313 -13.782 -15.860 493 HZ PHE 62 HZ PHE 62 -24.704 -13.104 -17.776 494 H THR 63 H THR 63 -26.960 -19.930 -17.568 495 HA THR 63 HA THR 63 -27.413 -22.464 -16.462 496 HB THR 63 HB THR 63 -26.946 -22.090 -19.405 497 HG1 THR 63 HG1 THR 63 -28.971 -20.973 -17.797 498 HG21 THR 63 HG21 THR 63 -28.436 -23.840 -19.675 499 HG22 THR 63 HG22 THR 63 -29.222 -23.548 -18.123 500 HG23 THR 63 HG23 THR 63 -27.624 -24.293 -18.177 501 H THR 64 H THR 64 -24.840 -21.394 -18.686 502 HA THR 64 HA THR 64 -23.255 -23.724 -17.817 503 HB THR 64 HB THR 64 -22.043 -23.081 -20.129 504 HG1 THR 64 HG1 THR 64 -23.363 -22.136 -21.521 505 HG21 THR 64 HG21 THR 64 -23.126 -24.966 -21.108 506 HG22 THR 64 HG22 THR 64 -24.544 -24.765 -20.079 507 HG23 THR 64 HG23 THR 64 -23.011 -25.283 -19.376 508 H ARG 65 H ARG 65 -20.822 -23.313 -18.268 509 HA ARG 65 HA ARG 65 -20.038 -21.102 -16.657 510 HB2 ARG 65 HB2 ARG 65 -18.734 -23.096 -16.523 511 HB3 ARG 65 HB3 ARG 65 -18.474 -23.121 -18.262 512 HG2 ARG 65 HG2 ARG 65 -17.509 -20.658 -17.131 513 HG3 ARG 65 HG3 ARG 65 -16.799 -22.050 -16.310 514 HD2 ARG 65 HD2 ARG 65 -16.823 -21.572 -19.288 515 HD3 ARG 65 HD3 ARG 65 -15.441 -21.346 -18.218 516 HE ARG 65 HE ARG 65 -16.271 -23.955 -17.867 517 HH11 ARG 65 HH11 ARG 65 -15.089 -21.982 -20.481 518 HH12 ARG 65 HH12 ARG 65 -14.348 -23.307 -21.318 519 HH21 ARG 65 HH21 ARG 65 -15.300 -25.706 -18.960 520 HH22 ARG 65 HH22 ARG 65 -14.470 -25.424 -20.453 521 H GLU 66 H GLU 66 -19.543 -21.880 -20.096 522 HA GLU 66 HA GLU 66 -18.117 -19.645 -20.861 523 HB2 GLU 66 HB2 GLU 66 -18.595 -21.597 -22.315 524 HB3 GLU 66 HB3 GLU 66 -20.254 -21.040 -22.482 525 HG2 GLU 66 HG2 GLU 66 -19.628 -19.178 -23.742 526 HG3 GLU 66 HG3 GLU 66 -17.940 -19.302 -23.251 527 H LEU 67 H LEU 67 -21.546 -19.972 -20.241 528 HA LEU 67 HA LEU 67 -22.513 -17.664 -21.445 529 HB2 LEU 67 HB2 LEU 67 -23.490 -19.630 -19.713 530 HB3 LEU 67 HB3 LEU 67 -23.764 -18.099 -18.884 531 HG LEU 67 HG LEU 67 -25.739 -18.681 -20.108 532 HD11 LEU 67 HD11 LEU 67 -24.277 -16.302 -20.517 533 HD12 LEU 67 HD12 LEU 67 -26.023 -16.540 -20.596 534 HD13 LEU 67 HD13 LEU 67 -25.043 -16.716 -22.051 535 HD21 LEU 67 HD21 LEU 67 -23.923 -18.908 -22.504 536 HD22 LEU 67 HD22 LEU 67 -25.686 -18.925 -22.573 537 HD23 LEU 67 HD23 LEU 67 -24.823 -20.210 -21.725 538 H ALA 68 H ALA 68 -21.142 -18.095 -18.200 539 HA ALA 68 HA ALA 68 -21.515 -15.449 -17.320 540 HB1 ALA 68 HB1 ALA 68 -20.834 -17.606 -16.021 541 HB2 ALA 68 HB2 ALA 68 -19.192 -17.072 -16.384 542 HB3 ALA 68 HB3 ALA 68 -20.276 -16.027 -15.467 543 H ILE 69 H ILE 69 -18.518 -17.010 -18.477 544 HA ILE 69 HA ILE 69 -16.909 -14.764 -18.554 545 HB ILE 69 HB ILE 69 -16.850 -17.106 -20.461 546 HG12 ILE 69 HG12 ILE 69 -14.801 -17.460 -18.693 547 HG13 ILE 69 HG13 ILE 69 -16.023 -16.728 -17.658 548 HG21 ILE 69 HG21 ILE 69 -14.317 -16.378 -20.373 549 HG22 ILE 69 HG22 ILE 69 -15.447 -15.638 -21.508 550 HG23 ILE 69 HG23 ILE 69 -15.025 -14.803 -20.013 551 HD11 ILE 69 HD11 ILE 69 -17.268 -18.577 -17.636 552 HD12 ILE 69 HD12 ILE 69 -17.043 -18.866 -19.362 553 HD13 ILE 69 HD13 ILE 69 -15.808 -19.382 -18.214 554 H ALA 70 H ALA 70 -19.165 -15.964 -20.994 555 HA ALA 70 HA ALA 70 -18.505 -14.268 -23.100 556 HB1 ALA 70 HB1 ALA 70 -19.971 -15.887 -23.761 557 HB2 ALA 70 HB2 ALA 70 -20.956 -15.750 -22.304 558 HB3 ALA 70 HB3 ALA 70 -21.088 -14.535 -23.577 559 H TYR 71 H TYR 71 -20.170 -13.609 -20.137 560 HA TYR 71 HA TYR 71 -21.357 -11.145 -21.044 561 HB2 TYR 71 HB2 TYR 71 -22.441 -12.460 -19.285 562 HB3 TYR 71 HB3 TYR 71 -21.028 -12.265 -18.252 563 HD1 TYR 71 HD2 TYR 71 -22.741 -9.722 -20.364 564 HD2 TYR 71 HD1 TYR 71 -21.823 -11.047 -16.427 565 HE1 TYR 71 HE2 TYR 71 -23.700 -7.651 -19.451 566 HE2 TYR 71 HE1 TYR 71 -22.780 -8.979 -15.501 567 HH TYR 71 HH TYR 71 -24.781 -7.142 -16.789 568 H ALA 72 H ALA 72 -18.765 -11.985 -18.747 569 HA ALA 72 HA ALA 72 -17.925 -9.361 -18.229 570 HB1 ALA 72 HB1 ALA 72 -17.135 -10.911 -16.708 571 HB2 ALA 72 HB2 ALA 72 -16.630 -12.042 -17.964 572 HB3 ALA 72 HB3 ALA 72 -15.697 -10.574 -17.673 573 H VAL 73 H VAL 73 -16.501 -11.773 -20.441 574 HA VAL 73 HA VAL 73 -14.504 -10.222 -21.543 575 HB VAL 73 HB VAL 73 -16.183 -12.293 -22.966 576 HG11 VAL 73 HG11 VAL 73 -15.047 -11.155 -24.661 577 HG12 VAL 73 HG12 VAL 73 -13.600 -10.941 -23.675 578 HG13 VAL 73 HG13 VAL 73 -14.011 -12.537 -24.306 579 HG21 VAL 73 HG21 VAL 73 -14.997 -12.960 -20.821 580 HG22 VAL 73 HG22 VAL 73 -14.619 -13.910 -22.259 581 HG23 VAL 73 HG23 VAL 73 -13.487 -12.683 -21.690 582 H ALA 74 H ALA 74 -17.936 -10.179 -22.196 583 HA ALA 74 HA ALA 74 -18.054 -8.882 -24.627 584 HB1 ALA 74 HB1 ALA 74 -20.256 -8.302 -24.109 585 HB2 ALA 74 HB2 ALA 74 -19.958 -9.753 -23.150 586 HB3 ALA 74 HB3 ALA 74 -19.911 -8.164 -22.385 587 H HIS 75 H HIS 75 -17.223 -7.599 -21.488 588 HA HIS 75 HA HIS 75 -16.715 -4.988 -22.749 589 HB2 HIS 75 HB2 HIS 75 -18.076 -5.625 -20.165 590 HB3 HIS 75 HB3 HIS 75 -17.122 -4.149 -20.279 591 HD1 HIS 75 HD1 HIS 75 -20.444 -4.962 -20.368 592 HD2 HIS 75 HD2 HIS 75 -18.033 -2.921 -23.067 593 HE1 HIS 75 HE1 HIS 75 -22.015 -3.574 -21.758 594 H LYS 76 H LYS 76 -15.003 -7.369 -22.214 595 HA LYS 76 HA LYS 76 -12.931 -7.884 -21.416 596 HB2 LYS 76 HB2 LYS 76 -12.785 -4.896 -21.745 597 HB3 LYS 76 HB3 LYS 76 -11.396 -5.824 -21.195 598 HG2 LYS 76 HG2 LYS 76 -11.010 -5.712 -23.452 599 HG3 LYS 76 HG3 LYS 76 -11.856 -7.255 -23.321 600 HD2 LYS 76 HD2 LYS 76 -13.951 -6.168 -23.950 601 HD3 LYS 76 HD3 LYS 76 -13.121 -4.613 -24.052 602 HE2 LYS 76 HE2 LYS 76 -11.873 -5.285 -25.929 603 HE3 LYS 76 HE3 LYS 76 -12.260 -6.987 -25.679 604 HZ1 LYS 76 HZ1 LYS 76 -13.572 -5.220 -27.328 605 HZ2 LYS 76 HZ2 LYS 76 -14.620 -5.444 -26.019 606 HZ3 LYS 76 HZ3 LYS 76 -14.078 -6.779 -26.906 607 H ILE 77 H ILE 77 -14.496 -8.272 -19.413 608 HA ILE 77 HA ILE 77 -13.488 -6.713 -17.131 609 HB ILE 77 HB ILE 77 -15.907 -8.516 -17.285 610 HG12 ILE 77 HG12 ILE 77 -15.839 -5.519 -16.937 611 HG13 ILE 77 HG13 ILE 77 -15.984 -6.286 -18.514 612 HG21 ILE 77 HG21 ILE 77 -16.211 -7.002 -15.047 613 HG22 ILE 77 HG22 ILE 77 -15.586 -8.650 -15.069 614 HG23 ILE 77 HG23 ILE 77 -14.470 -7.285 -15.048 615 HD11 ILE 77 HD11 ILE 77 -17.917 -6.423 -16.219 616 HD12 ILE 77 HD12 ILE 77 -18.162 -5.695 -17.808 617 HD13 ILE 77 HD13 ILE 77 -18.028 -7.446 -17.651 618 H ASP 78 H ASP 78 -12.542 -7.711 -15.384 619 HA ASP 78 HA ASP 78 -11.208 -10.177 -15.888 620 HB2 ASP 78 HB2 ASP 78 -11.380 -8.368 -13.485 621 HB3 ASP 78 HB3 ASP 78 -10.496 -9.891 -13.440 622 H TYR 79 H TYR 79 -12.499 -11.936 -16.027 623 HA TYR 79 HA TYR 79 -14.466 -12.413 -13.908 624 HB2 TYR 79 HB2 TYR 79 -15.341 -14.175 -15.389 625 HB3 TYR 79 HB3 TYR 79 -15.294 -12.612 -16.197 626 HD1 TYR 79 HD2 TYR 79 -13.718 -12.194 -18.008 627 HD2 TYR 79 HD1 TYR 79 -13.889 -15.986 -16.087 628 HE1 TYR 79 HE2 TYR 79 -12.422 -13.180 -19.852 629 HE2 TYR 79 HE1 TYR 79 -12.592 -16.982 -17.925 630 HH TYR 79 HH TYR 79 -10.766 -15.575 -19.860 631 H THR 80 H THR 80 -14.190 -13.929 -12.395 632 HA THR 80 HA THR 80 -11.858 -15.713 -12.651 633 HB THR 80 HB THR 80 -11.552 -14.186 -10.808 634 HG1 THR 80 HG1 THR 80 -11.149 -16.576 -10.572 635 HG21 THR 80 HG21 THR 80 -14.361 -14.479 -10.496 636 HG22 THR 80 HG22 THR 80 -13.272 -13.383 -9.644 637 HG23 THR 80 HG23 THR 80 -13.591 -14.992 -8.995 638 H VAL 81 H VAL 81 -12.303 -17.793 -12.908 639 HA VAL 81 HA VAL 81 -14.981 -18.780 -12.283 640 HB VAL 81 HB VAL 81 -14.232 -20.838 -13.496 641 HG11 VAL 81 HG11 VAL 81 -13.902 -19.450 -15.747 642 HG12 VAL 81 HG12 VAL 81 -15.457 -19.559 -14.919 643 HG13 VAL 81 HG13 VAL 81 -14.436 -18.138 -14.697 644 HG21 VAL 81 HG21 VAL 81 -11.690 -19.631 -13.180 645 HG22 VAL 81 HG22 VAL 81 -12.081 -21.177 -13.933 646 HG23 VAL 81 HG23 VAL 81 -12.034 -19.708 -14.908 647 H LEU 82 H LEU 82 -15.368 -19.783 -10.433 648 HA LEU 82 HA LEU 82 -13.120 -21.042 -9.010 649 HB2 LEU 82 HB2 LEU 82 -15.403 -19.425 -8.160 650 HB3 LEU 82 HB3 LEU 82 -15.167 -20.880 -7.194 651 HG LEU 82 HG LEU 82 -12.940 -18.923 -7.690 652 HD11 LEU 82 HD11 LEU 82 -13.808 -17.442 -6.290 653 HD12 LEU 82 HD12 LEU 82 -14.071 -18.690 -5.071 654 HD13 LEU 82 HD13 LEU 82 -15.309 -18.370 -6.285 655 HD21 LEU 82 HD21 LEU 82 -11.884 -19.971 -5.871 656 HD22 LEU 82 HD22 LEU 82 -12.544 -21.289 -6.841 657 HD23 LEU 82 HD23 LEU 82 -13.368 -20.780 -5.366 658 H GLN 83 H GLN 83 -13.076 -23.158 -9.415 659 HA GLN 83 HA GLN 83 -15.625 -24.633 -9.368 660 HB2 GLN 83 HB2 GLN 83 -14.682 -26.237 -10.892 661 HB3 GLN 83 HB3 GLN 83 -14.461 -24.630 -11.571 662 HG2 GLN 83 HG2 GLN 83 -12.150 -24.615 -10.936 663 HG3 GLN 83 HG3 GLN 83 -12.337 -26.137 -10.066 664 HE21 GLN 83 HE21 GLN 83 -13.014 -24.832 -13.300 665 HE22 GLN 83 HE22 GLN 83 -12.397 -26.193 -14.164 666 H ASP 84 H ASP 84 -15.544 -26.810 -8.504 667 HA ASP 84 HA ASP 84 -13.658 -26.984 -6.266 668 HB2 ASP 84 HB2 ASP 84 -16.298 -27.180 -6.141 669 HB3 ASP 84 HB3 ASP 84 -15.965 -28.858 -6.560 670 H ASN 85 H ASN 85 -12.413 -28.804 -5.874 671 HA ASN 85 HA ASN 85 -11.068 -30.553 -6.426 672 HB2 ASN 85 HB2 ASN 85 -13.437 -31.606 -6.375 673 HB3 ASN 85 HB3 ASN 85 -13.294 -31.638 -8.130 674 HD21 ASN 85 HD21 ASN 85 -13.202 -33.816 -8.369 675 HD22 ASN 85 HD22 ASN 85 -11.900 -34.792 -7.788 676 HA PRO 86 HA PRO 86 -10.210 -28.631 -10.590 677 HB2 PRO 86 HB2 PRO 86 -7.746 -27.702 -9.933 678 HB3 PRO 86 HB3 PRO 86 -9.226 -26.777 -9.655 679 HG2 PRO 86 HG2 PRO 86 -7.636 -28.431 -7.731 680 HG3 PRO 86 HG3 PRO 86 -8.372 -26.834 -7.493 681 HD2 PRO 86 HD2 PRO 86 -9.511 -29.115 -6.581 682 HD3 PRO 86 HD3 PRO 86 -10.467 -27.719 -7.116 683 H ARG 87 H ARG 87 -8.790 -29.408 -12.171 684 HA ARG 87 HA ARG 87 -7.778 -32.051 -11.690 685 HB2 ARG 87 HB2 ARG 87 -7.540 -30.315 -14.155 686 HB3 ARG 87 HB3 ARG 87 -7.208 -32.040 -14.070 687 HG2 ARG 87 HG2 ARG 87 -9.636 -32.290 -13.320 688 HG3 ARG 87 HG3 ARG 87 -9.845 -30.632 -13.885 689 HD2 ARG 87 HD2 ARG 87 -9.512 -31.197 -16.088 690 HD3 ARG 87 HD3 ARG 87 -8.547 -32.617 -15.687 691 HE ARG 87 HE ARG 87 -11.249 -32.908 -14.841 692 HH11 ARG 87 HH11 ARG 87 -9.164 -33.065 -17.625 693 HH12 ARG 87 HH12 ARG 87 -10.175 -34.180 -18.482 694 HH21 ARG 87 HH21 ARG 87 -12.589 -34.377 -15.960 695 HH22 ARG 87 HH22 ARG 87 -12.124 -34.926 -17.535 696 H THR 88 H THR 88 -5.612 -32.751 -12.015 697 HA THR 88 HA THR 88 -3.542 -30.683 -11.959 698 HB THR 88 HB THR 88 -3.705 -32.906 -9.914 699 HG1 THR 88 HG1 THR 88 -4.000 -31.167 -8.453 700 HG21 THR 88 HG21 THR 88 -1.646 -30.751 -10.390 701 HG22 THR 88 HG22 THR 88 -1.408 -32.497 -10.474 702 HG23 THR 88 HG23 THR 88 -1.733 -31.724 -8.923 703 H ILE 89 H ILE 89 -1.896 -31.180 -13.255 704 HA ILE 89 HA ILE 89 -1.690 -33.942 -14.236 705 HB ILE 89 HB ILE 89 -0.410 -33.000 -16.121 706 HG12 ILE 89 HG12 ILE 89 -1.148 -30.306 -14.959 707 HG13 ILE 89 HG13 ILE 89 0.460 -31.019 -14.872 708 HG21 ILE 89 HG21 ILE 89 -3.110 -32.960 -15.730 709 HG22 ILE 89 HG22 ILE 89 -2.786 -31.300 -16.228 710 HG23 ILE 89 HG23 ILE 89 -2.302 -32.641 -17.266 711 HD11 ILE 89 HD11 ILE 89 0.515 -29.497 -16.657 712 HD12 ILE 89 HD12 ILE 89 0.409 -31.095 -17.397 713 HD13 ILE 89 HD13 ILE 89 -1.024 -30.072 -17.299 714 H VAL 90 H VAL 90 0.367 -34.930 -14.467 715 HA VAL 90 HA VAL 90 2.109 -34.523 -12.278 716 HB VAL 90 HB VAL 90 1.860 -36.723 -13.283 717 HG11 VAL 90 HG11 VAL 90 3.526 -36.472 -15.585 718 HG12 VAL 90 HG12 VAL 90 1.853 -37.029 -15.481 719 HG13 VAL 90 HG13 VAL 90 2.201 -35.314 -15.707 720 HG21 VAL 90 HG21 VAL 90 3.906 -36.342 -12.090 721 HG22 VAL 90 HG22 VAL 90 4.273 -37.306 -13.521 722 HG23 VAL 90 HG23 VAL 90 4.644 -35.582 -13.500 723 HA PRO 91 HA PRO 91 4.670 -31.299 -13.897 724 HB2 PRO 91 HB2 PRO 91 6.678 -31.507 -12.081 725 HB3 PRO 91 HB3 PRO 91 5.115 -30.775 -11.704 726 HG2 PRO 91 HG2 PRO 91 6.108 -33.535 -11.108 727 HG3 PRO 91 HG3 PRO 91 5.195 -32.426 -10.069 728 HD2 PRO 91 HD2 PRO 91 4.024 -34.478 -11.392 729 HD3 PRO 91 HD3 PRO 91 3.183 -32.951 -11.063 730 H LYS 92 H LYS 92 6.478 -31.077 -15.176 731 HA LYS 92 HA LYS 92 7.625 -33.524 -16.195 732 HB2 LYS 92 HB2 LYS 92 6.984 -31.731 -17.735 733 HB3 LYS 92 HB3 LYS 92 8.121 -30.639 -16.955 734 HG2 LYS 92 HG2 LYS 92 9.956 -32.184 -17.632 735 HG3 LYS 92 HG3 LYS 92 8.766 -33.104 -18.555 736 HD2 LYS 92 HD2 LYS 92 8.528 -31.470 -20.138 737 HD3 LYS 92 HD3 LYS 92 8.920 -30.170 -19.010 738 HE2 LYS 92 HE2 LYS 92 10.716 -30.359 -20.575 739 HE3 LYS 92 HE3 LYS 92 11.282 -30.971 -19.023 740 HZ1 LYS 92 HZ1 LYS 92 11.482 -32.267 -21.393 741 HZ2 LYS 92 HZ2 LYS 92 10.128 -33.002 -20.695 742 HZ3 LYS 92 HZ3 LYS 92 11.605 -32.992 -19.870 743 H SER 93 H SER 93 9.645 -34.284 -15.874 744 HA SER 93 HA SER 93 11.508 -32.635 -14.304 745 HB2 SER 93 HB2 SER 93 11.915 -34.296 -12.753 746 HB3 SER 93 HB3 SER 93 10.208 -34.594 -13.085 747 HG SER 93 HG SER 93 12.165 -36.296 -13.332 748 H TYR 94 H TYR 94 13.541 -32.582 -15.048 749 HA TYR 94 HA TYR 94 14.740 -34.711 -16.519 750 HB2 TYR 94 HB2 TYR 94 13.374 -33.884 -18.332 751 HB3 TYR 94 HB3 TYR 94 13.901 -32.231 -18.032 752 HD1 TYR 94 HD2 TYR 94 15.217 -35.585 -18.987 753 HD2 TYR 94 HD1 TYR 94 15.712 -31.365 -19.208 754 HE1 TYR 94 HE2 TYR 94 17.065 -35.891 -20.580 755 HE2 TYR 94 HE1 TYR 94 17.561 -31.659 -20.803 756 HH TYR 94 HH TYR 94 18.374 -34.816 -22.111 757 H ALA 95 H ALA 95 16.732 -34.651 -15.738 758 HA ALA 95 HA ALA 95 17.917 -32.110 -14.937 759 HB1 ALA 95 HB1 ALA 95 18.820 -33.310 -13.307 760 HB2 ALA 95 HB2 ALA 95 18.056 -34.760 -13.961 761 HB3 ALA 95 HB3 ALA 95 19.676 -34.303 -14.487 762 H ASP 96 H ASP 96 20.136 -31.597 -15.521 763 HA ASP 96 HA ASP 96 20.793 -32.538 -18.235 764 HB2 ASP 96 HB2 ASP 96 21.975 -30.330 -18.477 765 HB3 ASP 96 HB3 ASP 96 20.226 -30.212 -18.312 766 H ASN 97 H ASN 97 23.280 -31.854 -18.642 767 HA ASN 97 HA ASN 97 24.775 -33.274 -16.548 768 HB2 ASN 97 HB2 ASN 97 26.391 -33.845 -18.262 769 HB3 ASN 97 HB3 ASN 97 24.778 -34.271 -18.827 770 HD21 ASN 97 HD21 ASN 97 27.317 -33.608 -20.238 771 HD22 ASN 97 HD22 ASN 97 26.891 -32.357 -21.351 772 H PHE 98 H PHE 98 27.242 -32.612 -16.690 773 HA PHE 98 HA PHE 98 27.623 -29.759 -17.050 774 HB2 PHE 98 HB2 PHE 98 27.750 -31.094 -14.348 775 HB3 PHE 98 HB3 PHE 98 28.560 -29.569 -14.688 776 HD1 PHE 98 HD2 PHE 98 27.169 -27.601 -15.420 777 HD2 PHE 98 HD1 PHE 98 25.471 -31.164 -13.829 778 HE1 PHE 98 HE2 PHE 98 25.089 -26.384 -14.925 779 HE2 PHE 98 HE1 PHE 98 23.387 -29.953 -13.333 780 HZ PHE 98 HZ PHE 98 23.194 -27.560 -13.880 781 H THR 99 H THR 99 29.970 -29.209 -16.221 782 HA THR 99 HA THR 99 31.918 -31.261 -16.224 783 HB THR 99 HB THR 99 31.283 -31.429 -18.605 784 HG1 THR 99 HG1 THR 99 33.379 -31.956 -18.322 785 HG21 THR 99 HG21 THR 99 32.348 -28.619 -18.872 786 HG22 THR 99 HG22 THR 99 30.632 -29.023 -18.852 787 HG23 THR 99 HG23 THR 99 31.667 -29.631 -20.145 788 H LYS 100 H LYS 100 33.863 -30.495 -15.549 789 HA LYS 100 HA LYS 100 33.987 -27.718 -14.781 790 HB2 LYS 100 HB2 LYS 100 35.558 -30.176 -14.221 791 HB3 LYS 100 HB3 LYS 100 36.405 -28.641 -14.077 792 HG2 LYS 100 HG2 LYS 100 35.544 -28.362 -12.062 793 HG3 LYS 100 HG3 LYS 100 33.921 -28.364 -12.754 794 HD2 LYS 100 HD2 LYS 100 33.819 -30.097 -11.216 795 HD3 LYS 100 HD3 LYS 100 34.179 -30.944 -12.723 796 HE2 LYS 100 HE2 LYS 100 36.293 -31.482 -12.072 797 HE3 LYS 100 HE3 LYS 100 36.481 -30.023 -11.100 798 HZ1 LYS 100 HZ1 LYS 100 35.572 -31.000 -9.288 799 HZ2 LYS 100 HZ2 LYS 100 36.175 -32.398 -10.022 800 HZ3 LYS 100 HZ3 LYS 100 34.540 -31.999 -10.181 801 HA PRO 101 HA PRO 101 36.461 -26.102 -18.025 802 HB2 PRO 101 HB2 PRO 101 38.171 -24.466 -16.695 803 HB3 PRO 101 HB3 PRO 101 36.455 -24.097 -16.903 804 HG2 PRO 101 HG2 PRO 101 37.867 -25.266 -14.537 805 HG3 PRO 101 HG3 PRO 101 36.608 -24.019 -14.584 806 HD2 PRO 101 HD2 PRO 101 36.077 -26.604 -13.976 807 HD3 PRO 101 HD3 PRO 101 34.912 -25.563 -14.819 808 H ARG 102 H ARG 102 38.197 -26.705 -19.192 809 HA ARG 102 HA ARG 102 40.209 -28.373 -17.868 810 HB2 ARG 102 HB2 ARG 102 38.837 -29.078 -19.962 811 HB3 ARG 102 HB3 ARG 102 39.957 -28.045 -20.841 812 HG2 ARG 102 HG2 ARG 102 41.139 -30.031 -18.998 813 HG3 ARG 102 HG3 ARG 102 40.373 -30.647 -20.463 814 HD2 ARG 102 HD2 ARG 102 42.374 -30.252 -21.403 815 HD3 ARG 102 HD3 ARG 102 41.817 -28.580 -21.460 816 HE ARG 102 HE ARG 102 43.009 -28.940 -18.987 817 HH11 ARG 102 HH11 ARG 102 43.939 -29.073 -22.340 818 HH12 ARG 102 HH12 ARG 102 45.577 -28.596 -22.040 819 HH21 ARG 102 HH21 ARG 102 45.164 -28.311 -18.579 820 HH22 ARG 102 HH22 ARG 102 46.273 -28.164 -19.900 821 H ASP 103 H ASP 103 41.116 -26.308 -16.988 822 HA ASP 103 HA ASP 103 43.467 -25.613 -18.371 823 HB2 ASP 103 HB2 ASP 103 41.606 -24.306 -19.623 824 HB3 ASP 103 HB3 ASP 103 41.593 -23.270 -18.199 825 H MET 104 H MET 104 44.937 -24.775 -16.983 826 HA MET 104 HA MET 104 43.942 -23.961 -14.331 827 HB2 MET 104 HB2 MET 104 45.187 -26.071 -14.276 828 HB3 MET 104 HB3 MET 104 46.561 -25.293 -15.048 829 HG2 MET 104 HG2 MET 104 46.900 -23.882 -13.129 830 HG3 MET 104 HG3 MET 104 45.445 -24.518 -12.365 831 HE1 MET 104 HE1 MET 104 49.317 -24.897 -12.361 832 HE2 MET 104 HE2 MET 104 49.498 -26.586 -12.834 833 HE3 MET 104 HE3 MET 104 48.785 -25.427 -13.957 Start of MODEL 18 1 H1 MET 1 H MET 1 -14.754 7.032 1.128 2 HA MET 1 HA MET 1 -13.718 4.353 0.474 3 HB2 MET 1 HB2 MET 1 -14.769 6.453 -1.428 4 HB3 MET 1 HB3 MET 1 -13.899 5.011 -1.935 5 HG2 MET 1 HG2 MET 1 -16.035 4.293 -2.206 6 HG3 MET 1 HG3 MET 1 -15.763 3.798 -0.537 7 HE1 MET 1 HE1 MET 1 -18.276 3.665 -1.550 8 HE2 MET 1 HE2 MET 1 -18.908 4.071 0.045 9 HE3 MET 1 HE3 MET 1 -19.445 4.975 -1.372 10 H GLN 2 H GLN 2 -11.697 4.315 -0.674 11 HA GLN 2 HA GLN 2 -10.144 6.803 -0.496 12 HB2 GLN 2 HB2 GLN 2 -9.760 5.113 1.419 13 HB3 GLN 2 HB3 GLN 2 -8.941 4.140 0.205 14 HG2 GLN 2 HG2 GLN 2 -7.254 5.728 -0.100 15 HG3 GLN 2 HG3 GLN 2 -8.184 6.995 0.700 16 HE21 GLN 2 HE21 GLN 2 -5.695 4.865 1.051 17 HE22 GLN 2 HE22 GLN 2 -5.606 4.811 2.774 18 H GLU 3 H GLU 3 -10.127 3.465 -1.734 19 HA GLU 3 HA GLU 3 -8.473 4.326 -3.986 20 HB2 GLU 3 HB2 GLU 3 -9.165 1.680 -2.779 21 HB3 GLU 3 HB3 GLU 3 -8.665 1.744 -4.463 22 HG2 GLU 3 HG2 GLU 3 -6.538 2.545 -3.924 23 HG3 GLU 3 HG3 GLU 3 -7.029 3.008 -2.295 24 H GLN 4 H GLN 4 -9.847 5.407 -5.344 25 HA GLN 4 HA GLN 4 -12.309 4.071 -6.189 26 HB2 GLN 4 HB2 GLN 4 -12.450 6.440 -5.527 27 HB3 GLN 4 HB3 GLN 4 -11.305 6.857 -6.794 28 HG2 GLN 4 HG2 GLN 4 -13.502 7.381 -7.555 29 HG3 GLN 4 HG3 GLN 4 -12.916 5.989 -8.465 30 HE21 GLN 4 HE21 GLN 4 -15.342 7.216 -6.430 31 HE22 GLN 4 HE22 GLN 4 -16.270 5.769 -6.265 32 H VAL 5 H VAL 5 -12.604 3.248 -8.185 33 HA VAL 5 HA VAL 5 -10.536 3.733 -10.218 34 HB VAL 5 HB VAL 5 -10.630 1.347 -10.872 35 HG11 VAL 5 HG11 VAL 5 -9.276 0.492 -8.996 36 HG12 VAL 5 HG12 VAL 5 -8.804 2.120 -9.486 37 HG13 VAL 5 HG13 VAL 5 -9.772 1.882 -8.031 38 HG21 VAL 5 HG21 VAL 5 -11.598 0.264 -8.406 39 HG22 VAL 5 HG22 VAL 5 -12.834 1.299 -9.120 40 HG23 VAL 5 HG23 VAL 5 -12.161 -0.038 -10.049 41 H SER 6 H SER 6 -11.368 2.458 -12.331 42 HA SER 6 HA SER 6 -14.224 3.070 -12.681 43 HB2 SER 6 HB2 SER 6 -12.973 4.946 -13.609 44 HB3 SER 6 HB3 SER 6 -11.984 3.844 -14.567 45 HG SER 6 HG SER 6 -13.667 4.731 -15.813 46 H ASN 7 H ASN 7 -13.486 0.546 -12.178 47 HA ASN 7 HA ASN 7 -14.183 -0.800 -14.628 48 HB2 ASN 7 HB2 ASN 7 -12.245 -2.417 -14.429 49 HB3 ASN 7 HB3 ASN 7 -11.826 -0.802 -14.994 50 HD21 ASN 7 HD21 ASN 7 -11.277 -3.199 -12.671 51 HD22 ASN 7 HD22 ASN 7 -10.198 -2.310 -11.655 52 H VAL 8 H VAL 8 -14.864 -2.979 -14.296 53 HA VAL 8 HA VAL 8 -15.339 -3.652 -11.465 54 HB VAL 8 HB VAL 8 -17.431 -4.786 -12.235 55 HG11 VAL 8 HG11 VAL 8 -18.048 -2.853 -11.242 56 HG12 VAL 8 HG12 VAL 8 -16.957 -1.873 -12.225 57 HG13 VAL 8 HG13 VAL 8 -18.502 -2.411 -12.887 58 HG21 VAL 8 HG21 VAL 8 -17.337 -3.159 -14.729 59 HG22 VAL 8 HG22 VAL 8 -16.505 -4.714 -14.695 60 HG23 VAL 8 HG23 VAL 8 -18.238 -4.635 -14.378 61 H ARG 9 H ARG 9 -16.074 -6.084 -11.345 62 HA ARG 9 HA ARG 9 -14.460 -7.736 -13.148 63 HB2 ARG 9 HB2 ARG 9 -14.201 -7.584 -10.155 64 HB3 ARG 9 HB3 ARG 9 -13.755 -9.040 -11.034 65 HG2 ARG 9 HG2 ARG 9 -11.736 -7.994 -10.949 66 HG3 ARG 9 HG3 ARG 9 -12.350 -7.341 -12.469 67 HD2 ARG 9 HD2 ARG 9 -12.702 -5.262 -11.593 68 HD3 ARG 9 HD3 ARG 9 -13.002 -5.879 -9.969 69 HE ARG 9 HE ARG 9 -10.284 -6.213 -10.822 70 HH11 ARG 9 HH11 ARG 9 -12.571 -4.007 -9.399 71 HH12 ARG 9 HH12 ARG 9 -11.361 -3.074 -8.583 72 HH21 ARG 9 HH21 ARG 9 -8.681 -4.991 -9.752 73 HH22 ARG 9 HH22 ARG 9 -9.149 -3.634 -8.785 74 H ALA 10 H ALA 10 -15.104 -9.928 -13.260 75 HA ALA 10 HA ALA 10 -17.872 -10.358 -12.380 76 HB1 ALA 10 HB1 ALA 10 -18.255 -11.498 -14.286 77 HB2 ALA 10 HB2 ALA 10 -16.848 -10.601 -14.860 78 HB3 ALA 10 HB3 ALA 10 -16.663 -12.257 -14.280 79 H ARG 11 H ARG 11 -18.425 -11.990 -11.042 80 HA ARG 11 HA ARG 11 -16.241 -13.694 -10.046 81 HB2 ARG 11 HB2 ARG 11 -18.827 -12.984 -8.653 82 HB3 ARG 11 HB3 ARG 11 -17.475 -13.870 -7.965 83 HG2 ARG 11 HG2 ARG 11 -16.071 -11.896 -8.120 84 HG3 ARG 11 HG3 ARG 11 -17.393 -11.000 -8.872 85 HD2 ARG 11 HD2 ARG 11 -18.637 -10.945 -6.907 86 HD3 ARG 11 HD3 ARG 11 -17.756 -12.298 -6.199 87 HE ARG 11 HE ARG 11 -15.864 -10.375 -6.456 88 HH11 ARG 11 HH11 ARG 11 -19.024 -10.468 -5.000 89 HH12 ARG 11 HH12 ARG 11 -18.641 -9.296 -3.783 90 HH21 ARG 11 HH21 ARG 11 -15.348 -8.831 -4.859 91 HH22 ARG 11 HH22 ARG 11 -16.550 -8.364 -3.705 92 H ILE 12 H ILE 12 -16.330 -15.549 -11.177 93 HA ILE 12 HA ILE 12 -18.941 -16.816 -11.612 94 HB ILE 12 HB ILE 12 -16.260 -17.485 -12.834 95 HG12 ILE 12 HG12 ILE 12 -18.657 -16.277 -14.209 96 HG13 ILE 12 HG13 ILE 12 -17.396 -15.286 -13.486 97 HG21 ILE 12 HG21 ILE 12 -19.012 -18.563 -13.431 98 HG22 ILE 12 HG22 ILE 12 -17.548 -18.929 -14.341 99 HG23 ILE 12 HG23 ILE 12 -17.691 -19.442 -12.660 100 HD11 ILE 12 HD11 ILE 12 -15.748 -16.269 -14.964 101 HD12 ILE 12 HD12 ILE 12 -16.979 -17.324 -15.660 102 HD13 ILE 12 HD13 ILE 12 -17.081 -15.579 -15.888 103 H TYR 13 H TYR 13 -19.445 -18.798 -10.797 104 HA TYR 13 HA TYR 13 -17.404 -20.265 -9.296 105 HB2 TYR 13 HB2 TYR 13 -18.418 -18.953 -7.575 106 HB3 TYR 13 HB3 TYR 13 -20.036 -19.295 -8.179 107 HD1 TYR 13 HD1 TYR 13 -17.225 -21.665 -7.600 108 HD2 TYR 13 HD2 TYR 13 -21.088 -20.361 -6.387 109 HE1 TYR 13 HE1 TYR 13 -17.383 -23.583 -6.069 110 HE2 TYR 13 HE2 TYR 13 -21.257 -22.274 -4.852 111 HH TYR 13 HH TYR 13 -20.330 -24.432 -4.490 112 H LYS 14 H LYS 14 -17.511 -22.394 -9.623 113 HA LYS 14 HA LYS 14 -19.527 -23.462 -11.367 114 HB2 LYS 14 HB2 LYS 14 -18.230 -25.442 -11.413 115 HB3 LYS 14 HB3 LYS 14 -17.075 -24.116 -11.347 116 HG2 LYS 14 HG2 LYS 14 -16.755 -24.487 -8.967 117 HG3 LYS 14 HG3 LYS 14 -17.953 -25.784 -8.996 118 HD2 LYS 14 HD2 LYS 14 -16.428 -26.814 -10.822 119 HD3 LYS 14 HD3 LYS 14 -15.202 -25.718 -10.181 120 HE2 LYS 14 HE2 LYS 14 -15.083 -26.809 -8.167 121 HE3 LYS 14 HE3 LYS 14 -16.738 -27.408 -8.272 122 HZ1 LYS 14 HZ1 LYS 14 -14.875 -29.083 -8.563 123 HZ2 LYS 14 HZ2 LYS 14 -14.617 -28.388 -10.083 124 HZ3 LYS 14 HZ3 LYS 14 -16.107 -29.105 -9.724 125 HA PRO 15 HA PRO 15 -22.363 -25.083 -8.432 126 HB2 PRO 15 HB2 PRO 15 -23.217 -27.315 -9.720 127 HB3 PRO 15 HB3 PRO 15 -23.677 -25.683 -10.218 128 HG2 PRO 15 HG2 PRO 15 -21.562 -27.480 -11.340 129 HG3 PRO 15 HG3 PRO 15 -22.733 -26.459 -12.196 130 HD2 PRO 15 HD2 PRO 15 -20.154 -25.721 -11.824 131 HD3 PRO 15 HD3 PRO 15 -21.483 -24.547 -11.883 132 H ALA 16 H ALA 16 -22.745 -26.814 -6.949 133 HA ALA 16 HA ALA 16 -20.331 -28.360 -6.388 134 HB1 ALA 16 HB1 ALA 16 -21.914 -26.910 -4.743 135 HB2 ALA 16 HB2 ALA 16 -22.583 -28.525 -4.506 136 HB3 ALA 16 HB3 ALA 16 -20.870 -28.228 -4.209 137 H LYS 17 H LYS 17 -20.252 -30.563 -6.316 138 HA LYS 17 HA LYS 17 -22.261 -31.989 -7.790 139 HB2 LYS 17 HB2 LYS 17 -19.913 -32.551 -8.082 140 HB3 LYS 17 HB3 LYS 17 -19.766 -32.945 -6.375 141 HG2 LYS 17 HG2 LYS 17 -21.075 -34.883 -6.599 142 HG3 LYS 17 HG3 LYS 17 -21.664 -34.397 -8.191 143 HD2 LYS 17 HD2 LYS 17 -20.069 -35.977 -8.737 144 HD3 LYS 17 HD3 LYS 17 -19.144 -34.477 -8.847 145 HE2 LYS 17 HE2 LYS 17 -17.747 -35.881 -7.628 146 HE3 LYS 17 HE3 LYS 17 -18.544 -34.921 -6.383 147 HZ1 LYS 17 HZ1 LYS 17 -18.392 -37.576 -6.327 148 HZ2 LYS 17 HZ2 LYS 17 -19.879 -37.391 -7.114 149 HZ3 LYS 17 HZ3 LYS 17 -19.637 -36.700 -5.589 150 H SER 18 H SER 18 -24.019 -32.902 -6.975 151 HA SER 18 HA SER 18 -24.125 -33.424 -4.085 152 HB2 SER 18 HB2 SER 18 -26.450 -33.093 -4.166 153 HB3 SER 18 HB3 SER 18 -25.824 -31.882 -5.284 154 HG SER 18 HG SER 18 -26.951 -32.806 -6.781 155 H THR 19 H THR 19 -25.321 -35.336 -3.371 156 HA THR 19 HA THR 19 -24.472 -37.664 -4.830 157 HB THR 19 HB THR 19 -26.224 -37.642 -2.373 158 HG1 THR 19 HG1 THR 19 -23.458 -37.176 -2.669 159 HG21 THR 19 HG21 THR 19 -24.901 -39.677 -3.956 160 HG22 THR 19 HG22 THR 19 -26.094 -39.853 -2.670 161 HG23 THR 19 HG23 THR 19 -24.382 -39.724 -2.272 162 H MET 20 H MET 20 -25.759 -37.332 -6.760 163 HA MET 20 HA MET 20 -27.557 -37.671 -8.116 164 HB2 MET 20 HB2 MET 20 -28.350 -39.642 -5.965 165 HB3 MET 20 HB3 MET 20 -28.899 -39.646 -7.636 166 HG2 MET 20 HG2 MET 20 -26.446 -39.907 -8.265 167 HG3 MET 20 HG3 MET 20 -26.175 -40.283 -6.565 168 HE1 MET 20 HE1 MET 20 -26.049 -43.060 -9.331 169 HE2 MET 20 HE2 MET 20 -25.117 -41.910 -8.371 170 HE3 MET 20 HE3 MET 20 -25.527 -43.491 -7.703 171 H GLN 21 H GLN 21 -27.854 -35.458 -6.484 172 HA GLN 21 HA GLN 21 -30.723 -35.533 -5.818 173 HB2 GLN 21 HB2 GLN 21 -29.088 -35.113 -3.918 174 HB3 GLN 21 HB3 GLN 21 -28.719 -33.579 -4.696 175 HG2 GLN 21 HG2 GLN 21 -31.108 -32.964 -4.518 176 HG3 GLN 21 HG3 GLN 21 -31.391 -34.460 -3.628 177 HE21 GLN 21 HE21 GLN 21 -31.709 -33.960 -1.583 178 HE22 GLN 21 HE22 GLN 21 -30.752 -32.873 -0.640 179 H SER 22 H SER 22 -30.561 -35.177 -8.329 180 HA SER 22 HA SER 22 -30.276 -32.319 -8.928 181 HB2 SER 22 HB2 SER 22 -30.387 -34.770 -10.686 182 HB3 SER 22 HB3 SER 22 -30.509 -33.135 -11.335 183 HG SER 22 HG SER 22 -28.441 -32.874 -11.038 184 H GLY 23 H GLY 23 -31.906 -31.479 -10.581 185 HA2 GLY 23 HA2 GLY 23 -34.595 -32.324 -9.706 186 HA3 GLY 23 HA3 GLY 23 -34.171 -30.688 -10.187 187 H HIS 24 H HIS 24 -36.147 -31.052 -11.537 188 HA HIS 24 HA HIS 24 -35.646 -32.660 -13.930 189 HB2 HIS 24 HB2 HIS 24 -37.881 -32.549 -12.525 190 HB3 HIS 24 HB3 HIS 24 -38.176 -31.124 -13.516 191 HD1 HIS 24 HD1 HIS 24 -38.655 -31.498 -16.017 192 HD2 HIS 24 HD2 HIS 24 -37.971 -35.001 -13.890 193 HE1 HIS 24 HE1 HIS 24 -39.372 -33.362 -17.545 194 H SER 25 H SER 25 -36.450 -29.336 -12.984 195 HA SER 25 HA SER 25 -35.566 -28.453 -15.653 196 HB2 SER 25 HB2 SER 25 -37.518 -27.086 -13.783 197 HB3 SER 25 HB3 SER 25 -37.018 -26.489 -15.365 198 HG SER 25 HG SER 25 -39.025 -27.635 -15.407 199 H LYS 26 H LYS 26 -33.381 -28.415 -14.881 200 HA LYS 26 HA LYS 26 -32.808 -26.217 -13.007 201 HB2 LYS 26 HB2 LYS 26 -32.024 -28.622 -12.507 202 HB3 LYS 26 HB3 LYS 26 -30.849 -28.363 -13.790 203 HG2 LYS 26 HG2 LYS 26 -29.725 -26.711 -12.594 204 HG3 LYS 26 HG3 LYS 26 -31.085 -26.448 -11.500 205 HD2 LYS 26 HD2 LYS 26 -30.724 -28.677 -10.536 206 HD3 LYS 26 HD3 LYS 26 -29.352 -28.918 -11.619 207 HE2 LYS 26 HE2 LYS 26 -29.399 -26.506 -9.870 208 HE3 LYS 26 HE3 LYS 26 -29.012 -28.068 -9.149 209 HZ1 LYS 26 HZ1 LYS 26 -27.068 -28.217 -10.285 210 HZ2 LYS 26 HZ2 LYS 26 -27.164 -26.532 -10.176 211 HZ3 LYS 26 HZ3 LYS 26 -27.616 -27.315 -11.607 212 H LEU 27 H LEU 27 -33.119 -24.739 -14.828 213 HA LEU 27 HA LEU 27 -31.562 -24.782 -17.157 214 HB2 LEU 27 HB2 LEU 27 -33.064 -22.691 -15.662 215 HB3 LEU 27 HB3 LEU 27 -31.964 -22.184 -16.942 216 HG LEU 27 HG LEU 27 -34.258 -22.337 -17.749 217 HD11 LEU 27 HD11 LEU 27 -32.807 -24.650 -18.972 218 HD12 LEU 27 HD12 LEU 27 -32.178 -23.009 -19.125 219 HD13 LEU 27 HD13 LEU 27 -33.781 -23.402 -19.750 220 HD21 LEU 27 HD21 LEU 27 -34.721 -24.292 -16.074 221 HD22 LEU 27 HD22 LEU 27 -34.218 -25.303 -17.429 222 HD23 LEU 27 HD23 LEU 27 -35.589 -24.207 -17.607 223 H LYS 28 H LYS 28 -31.135 -22.400 -14.546 224 HA LYS 28 HA LYS 28 -28.456 -21.839 -15.253 225 HB2 LYS 28 HB2 LYS 28 -29.722 -21.325 -12.563 226 HB3 LYS 28 HB3 LYS 28 -28.392 -20.448 -13.308 227 HG2 LYS 28 HG2 LYS 28 -31.251 -20.474 -14.253 228 HG3 LYS 28 HG3 LYS 28 -30.440 -19.157 -13.403 229 HD2 LYS 28 HD2 LYS 28 -28.733 -19.467 -15.439 230 HD3 LYS 28 HD3 LYS 28 -30.208 -20.036 -16.223 231 HE2 LYS 28 HE2 LYS 28 -30.417 -17.533 -14.664 232 HE3 LYS 28 HE3 LYS 28 -29.471 -17.456 -16.150 233 HZ1 LYS 28 HZ1 LYS 28 -31.423 -17.161 -17.150 234 HZ2 LYS 28 HZ2 LYS 28 -32.311 -17.668 -15.802 235 HZ3 LYS 28 HZ3 LYS 28 -31.701 -18.810 -16.891 236 H ALA 29 H ALA 29 -26.602 -22.799 -14.711 237 HA ALA 29 HA ALA 29 -26.664 -24.827 -12.571 238 HB1 ALA 29 HB1 ALA 29 -25.276 -26.246 -13.801 239 HB2 ALA 29 HB2 ALA 29 -26.429 -25.636 -14.990 240 HB3 ALA 29 HB3 ALA 29 -24.799 -24.966 -14.916 241 H TRP 30 H TRP 30 -24.763 -22.353 -14.215 242 HA TRP 30 HA TRP 30 -22.741 -22.482 -12.098 243 HB2 TRP 30 HB2 TRP 30 -22.790 -21.281 -14.852 244 HB3 TRP 30 HB3 TRP 30 -21.601 -20.748 -13.665 245 HD1 TRP 30 HD1 TRP 30 -22.764 -24.102 -15.248 246 HE1 TRP 30 HE1 TRP 30 -20.694 -25.611 -15.499 247 HE3 TRP 30 HE3 TRP 30 -19.269 -21.055 -13.094 248 HZ2 TRP 30 HZ2 TRP 30 -17.944 -25.522 -14.870 249 HZ3 TRP 30 HZ3 TRP 30 -16.942 -21.841 -12.958 250 HH2 TRP 30 HH2 TRP 30 -16.295 -24.028 -13.827 251 H LYS 31 H LYS 31 -21.955 -20.444 -11.176 252 HA LYS 31 HA LYS 31 -24.161 -18.524 -10.833 253 HB2 LYS 31 HB2 LYS 31 -21.868 -19.012 -8.929 254 HB3 LYS 31 HB3 LYS 31 -23.317 -18.062 -8.630 255 HG2 LYS 31 HG2 LYS 31 -24.506 -20.363 -9.137 256 HG3 LYS 31 HG3 LYS 31 -22.941 -21.006 -8.633 257 HD2 LYS 31 HD2 LYS 31 -24.067 -20.922 -6.624 258 HD3 LYS 31 HD3 LYS 31 -23.244 -19.361 -6.623 259 HE2 LYS 31 HE2 LYS 31 -25.957 -19.523 -7.828 260 HE3 LYS 31 HE3 LYS 31 -25.823 -19.583 -6.072 261 HZ1 LYS 31 HZ1 LYS 31 -25.116 -17.397 -7.910 262 HZ2 LYS 31 HZ2 LYS 31 -24.334 -17.517 -6.416 263 HZ3 LYS 31 HZ3 LYS 31 -26.015 -17.341 -6.477 264 H LEU 32 H LEU 32 -23.792 -16.353 -11.048 265 HA LEU 32 HA LEU 32 -21.065 -15.450 -11.614 266 HB2 LEU 32 HB2 LEU 32 -22.190 -15.990 -13.760 267 HB3 LEU 32 HB3 LEU 32 -23.428 -14.799 -13.370 268 HG LEU 32 HG LEU 32 -21.596 -14.112 -15.006 269 HD11 LEU 32 HD11 LEU 32 -21.468 -12.091 -12.917 270 HD12 LEU 32 HD12 LEU 32 -23.101 -12.695 -13.193 271 HD13 LEU 32 HD13 LEU 32 -22.177 -12.013 -14.531 272 HD21 LEU 32 HD21 LEU 32 -19.919 -13.383 -12.685 273 HD22 LEU 32 HD22 LEU 32 -19.458 -13.804 -14.335 274 HD23 LEU 32 HD23 LEU 32 -19.880 -15.074 -13.185 275 H GLU 33 H GLU 33 -20.602 -13.599 -10.613 276 HA GLU 33 HA GLU 33 -22.772 -11.748 -9.939 277 HB2 GLU 33 HB2 GLU 33 -20.654 -12.486 -7.925 278 HB3 GLU 33 HB3 GLU 33 -22.119 -11.550 -7.663 279 HG2 GLU 33 HG2 GLU 33 -23.416 -13.631 -8.220 280 HG3 GLU 33 HG3 GLU 33 -21.885 -14.502 -8.160 281 H PHE 34 H PHE 34 -22.206 -9.989 -11.048 282 HA PHE 34 HA PHE 34 -19.396 -9.242 -11.273 283 HB2 PHE 34 HB2 PHE 34 -20.081 -7.714 -12.983 284 HB3 PHE 34 HB3 PHE 34 -20.939 -9.226 -13.263 285 HD1 PHE 34 HD2 PHE 34 -23.339 -9.407 -12.631 286 HD2 PHE 34 HD1 PHE 34 -21.237 -5.707 -12.549 287 HE1 PHE 34 HE2 PHE 34 -25.480 -8.195 -12.619 288 HE2 PHE 34 HE1 PHE 34 -23.375 -4.489 -12.537 289 HZ PHE 34 HZ PHE 34 -25.501 -5.733 -12.573 290 H GLU 35 H GLU 35 -18.498 -7.447 -10.376 291 HA GLU 35 HA GLU 35 -19.625 -6.374 -8.041 292 HB2 GLU 35 HB2 GLU 35 -17.253 -5.728 -9.730 293 HB3 GLU 35 HB3 GLU 35 -17.762 -4.551 -8.529 294 HG2 GLU 35 HG2 GLU 35 -17.546 -7.325 -7.579 295 HG3 GLU 35 HG3 GLU 35 -16.033 -6.551 -8.046 296 HA PRO 36 HA PRO 36 -22.138 -3.018 -9.329 297 HB2 PRO 36 HB2 PRO 36 -21.552 -1.109 -7.488 298 HB3 PRO 36 HB3 PRO 36 -22.494 -2.556 -7.106 299 HG2 PRO 36 HG2 PRO 36 -19.592 -2.002 -6.621 300 HG3 PRO 36 HG3 PRO 36 -20.780 -2.765 -5.548 301 HD2 PRO 36 HD2 PRO 36 -18.987 -4.195 -6.988 302 HD3 PRO 36 HD3 PRO 36 -20.609 -4.807 -6.603 303 H SER 37 H SER 37 -21.988 -1.578 -10.928 304 HA SER 37 HA SER 37 -19.388 -0.403 -11.533 305 HB2 SER 37 HB2 SER 37 -20.623 0.334 -13.656 306 HB3 SER 37 HB3 SER 37 -20.374 -1.398 -13.439 307 HG SER 37 HG SER 37 -22.629 -0.270 -13.913 308 H CYS 38 H CYS 38 -22.718 0.848 -11.762 309 HA CYS 38 HA CYS 38 -21.763 3.346 -10.525 310 HB2 CYS 38 HB2 CYS 38 -22.140 3.605 -12.964 311 HB3 CYS 38 HB3 CYS 38 -23.813 3.108 -12.738 312 HG CYS 38 HG CYS 38 -22.395 5.933 -11.423 313 H THR 39 H THR 39 -22.966 4.164 -8.905 314 HA THR 39 HA THR 39 -25.177 2.561 -7.932 315 HB THR 39 HB THR 39 -25.098 3.982 -5.940 316 HG1 THR 39 HG1 THR 39 -23.595 5.679 -5.833 317 HG21 THR 39 HG21 THR 39 -23.157 2.197 -6.761 318 HG22 THR 39 HG22 THR 39 -23.369 2.816 -5.124 319 HG23 THR 39 HG23 THR 39 -22.226 3.592 -6.219 320 H GLN 40 H GLN 40 -26.922 2.950 -9.252 321 HA GLN 40 HA GLN 40 -28.369 5.374 -8.765 322 HB2 GLN 40 HB2 GLN 40 -26.977 6.219 -10.542 323 HB3 GLN 40 HB3 GLN 40 -27.315 4.809 -11.539 324 HG2 GLN 40 HG2 GLN 40 -29.596 5.478 -11.821 325 HG3 GLN 40 HG3 GLN 40 -29.398 6.795 -10.666 326 HE21 GLN 40 HE21 GLN 40 -28.961 8.725 -11.457 327 HE22 GLN 40 HE22 GLN 40 -28.353 9.060 -13.040 328 H TYR 41 H TYR 41 -30.477 4.926 -8.731 329 HA TYR 41 HA TYR 41 -31.448 2.329 -9.146 330 HB2 TYR 41 HB2 TYR 41 -33.604 3.197 -8.633 331 HB3 TYR 41 HB3 TYR 41 -32.456 4.121 -7.670 332 HD1 TYR 41 HD1 TYR 41 -31.854 6.443 -8.378 333 HD2 TYR 41 HD2 TYR 41 -34.991 4.255 -10.240 334 HE1 TYR 41 HE1 TYR 41 -32.755 8.536 -9.304 335 HE2 TYR 41 HE2 TYR 41 -35.901 6.341 -11.172 336 HH TYR 41 HH TYR 41 -34.284 9.080 -11.474 337 H THR 42 H THR 42 -32.646 1.393 -10.771 338 HA THR 42 HA THR 42 -32.893 2.919 -13.278 339 HB THR 42 HB THR 42 -32.454 0.715 -14.470 340 HG1 THR 42 HG1 THR 42 -31.487 -0.902 -13.312 341 HG21 THR 42 HG21 THR 42 -30.071 1.676 -12.906 342 HG22 THR 42 HG22 THR 42 -30.823 2.660 -14.162 343 HG23 THR 42 HG23 THR 42 -30.132 1.088 -14.567 344 H GLU 43 H GLU 43 -34.595 2.264 -14.685 345 HA GLU 43 HA GLU 43 -36.921 1.327 -13.256 346 HB2 GLU 43 HB2 GLU 43 -36.399 2.566 -15.914 347 HB3 GLU 43 HB3 GLU 43 -37.875 1.634 -15.719 348 HG2 GLU 43 HG2 GLU 43 -38.200 3.093 -13.594 349 HG3 GLU 43 HG3 GLU 43 -37.050 4.170 -14.386 350 HA PRO 44 HA PRO 44 -37.035 -2.849 -14.590 351 HB2 PRO 44 HB2 PRO 44 -39.673 -3.229 -15.109 352 HB3 PRO 44 HB3 PRO 44 -39.032 -3.053 -13.471 353 HG2 PRO 44 HG2 PRO 44 -40.365 -1.015 -15.212 354 HG3 PRO 44 HG3 PRO 44 -40.594 -1.331 -13.481 355 HD2 PRO 44 HD2 PRO 44 -39.065 0.706 -14.399 356 HD3 PRO 44 HD3 PRO 44 -38.706 -0.151 -12.887 357 H LEU 45 H LEU 45 -37.261 -4.249 -16.390 358 HA LEU 45 HA LEU 45 -37.851 -2.910 -18.945 359 HB2 LEU 45 HB2 LEU 45 -35.443 -3.128 -18.672 360 HB3 LEU 45 HB3 LEU 45 -35.621 -4.853 -18.363 361 HG LEU 45 HG LEU 45 -36.595 -3.768 -20.961 362 HD11 LEU 45 HD11 LEU 45 -33.705 -4.167 -20.221 363 HD12 LEU 45 HD12 LEU 45 -34.468 -2.718 -20.875 364 HD13 LEU 45 HD13 LEU 45 -34.294 -4.154 -21.884 365 HD21 LEU 45 HD21 LEU 45 -35.550 -6.013 -21.648 366 HD22 LEU 45 HD22 LEU 45 -37.034 -6.041 -20.695 367 HD23 LEU 45 HD23 LEU 45 -35.481 -6.348 -19.917 368 H MET 46 H MET 46 -37.304 -6.128 -17.502 369 HA MET 46 HA MET 46 -38.769 -7.534 -19.464 370 HB2 MET 46 HB2 MET 46 -38.185 -8.339 -16.609 371 HB3 MET 46 HB3 MET 46 -38.688 -9.419 -17.902 372 HG2 MET 46 HG2 MET 46 -36.238 -7.788 -18.298 373 HG3 MET 46 HG3 MET 46 -36.165 -9.171 -17.207 374 HE1 MET 46 HE1 MET 46 -37.253 -11.769 -18.288 375 HE2 MET 46 HE2 MET 46 -35.883 -12.141 -19.335 376 HE3 MET 46 HE3 MET 46 -35.621 -11.305 -17.803 377 H ASN 47 H ASN 47 -40.817 -8.612 -19.231 378 HA ASN 47 HA ASN 47 -42.782 -6.913 -17.943 379 HB2 ASN 47 HB2 ASN 47 -42.928 -9.194 -19.897 380 HB3 ASN 47 HB3 ASN 47 -44.375 -8.620 -19.075 381 HD21 ASN 47 HD21 ASN 47 -44.806 -6.272 -19.253 382 HD22 ASN 47 HD22 ASN 47 -44.450 -5.501 -20.758 383 H TRP 48 H TRP 48 -42.793 -7.275 -15.777 384 HA TRP 48 HA TRP 48 -42.811 -9.990 -14.744 385 HB2 TRP 48 HB2 TRP 48 -43.004 -7.364 -13.255 386 HB3 TRP 48 HB3 TRP 48 -42.718 -8.948 -12.541 387 HD1 TRP 48 HD1 TRP 48 -40.907 -5.992 -13.791 388 HE1 TRP 48 HE1 TRP 48 -38.389 -6.488 -13.997 389 HE3 TRP 48 HE3 TRP 48 -41.041 -11.081 -13.319 390 HZ2 TRP 48 HZ2 TRP 48 -36.686 -8.739 -13.964 391 HZ3 TRP 48 HZ3 TRP 48 -38.924 -12.330 -13.418 392 HH2 TRP 48 HH2 TRP 48 -36.793 -11.182 -13.734 393 H THR 49 H THR 49 -44.461 -10.723 -13.245 394 HA THR 49 HA THR 49 -47.117 -9.913 -14.143 395 HB THR 49 HB THR 49 -47.915 -11.941 -12.988 396 HG1 THR 49 HG1 THR 49 -46.416 -12.143 -11.331 397 HG21 THR 49 HG21 THR 49 -46.634 -11.823 -15.353 398 HG22 THR 49 HG22 THR 49 -47.336 -13.305 -14.704 399 HG23 THR 49 HG23 THR 49 -45.612 -12.989 -14.514 400 H GLY 50 H GLY 50 -45.151 -10.034 -11.229 401 HA2 GLY 50 HA2 GLY 50 -47.292 -9.281 -9.468 402 HA3 GLY 50 HA3 GLY 50 -45.583 -9.334 -9.068 403 H SER 51 H SER 51 -45.279 -7.397 -8.115 404 HA SER 51 HA SER 51 -46.515 -4.991 -8.879 405 HB2 SER 51 HB2 SER 51 -43.842 -5.175 -7.489 406 HB3 SER 51 HB3 SER 51 -45.064 -3.914 -7.332 407 HG SER 51 HG SER 51 -44.891 -6.372 -6.100 408 H HIS 52 H HIS 52 -45.124 -3.005 -9.488 409 HA HIS 52 HA HIS 52 -43.491 -3.741 -11.825 410 HB2 HIS 52 HB2 HIS 52 -45.261 -1.344 -11.331 411 HB3 HIS 52 HB3 HIS 52 -44.123 -1.440 -12.673 412 HD1 HIS 52 HD1 HIS 52 -44.688 -4.427 -13.436 413 HD2 HIS 52 HD2 HIS 52 -47.585 -1.521 -12.780 414 HE1 HIS 52 HE1 HIS 52 -46.725 -5.214 -14.684 415 H ASP 53 H ASP 53 -42.446 -3.537 -9.162 416 HA ASP 53 HA ASP 53 -40.432 -1.482 -9.652 417 HB2 ASP 53 HB2 ASP 53 -42.272 -0.584 -8.113 418 HB3 ASP 53 HB3 ASP 53 -41.677 -1.735 -6.919 419 H THR 54 H THR 54 -38.427 -2.152 -9.169 420 HA THR 54 HA THR 54 -37.999 -4.275 -7.230 421 HB THR 54 HB THR 54 -36.510 -5.481 -8.958 422 HG1 THR 54 HG1 THR 54 -36.973 -3.667 -10.526 423 HG21 THR 54 HG21 THR 54 -39.021 -5.961 -8.054 424 HG22 THR 54 HG22 THR 54 -38.137 -7.040 -9.134 425 HG23 THR 54 HG23 THR 54 -39.305 -5.894 -9.792 426 H LYS 55 H LYS 55 -35.578 -4.765 -7.065 427 HA LYS 55 HA LYS 55 -34.082 -2.248 -7.395 428 HB2 LYS 55 HB2 LYS 55 -34.683 -3.183 -5.028 429 HB3 LYS 55 HB3 LYS 55 -33.367 -4.308 -5.337 430 HG2 LYS 55 HG2 LYS 55 -32.311 -2.609 -4.197 431 HG3 LYS 55 HG3 LYS 55 -31.998 -2.180 -5.880 432 HD2 LYS 55 HD2 LYS 55 -32.679 -0.160 -4.973 433 HD3 LYS 55 HD3 LYS 55 -34.179 -0.787 -5.661 434 HE2 LYS 55 HE2 LYS 55 -34.833 -0.083 -3.550 435 HE3 LYS 55 HE3 LYS 55 -34.553 -1.807 -3.317 436 HZ1 LYS 55 HZ1 LYS 55 -32.925 -1.398 -1.879 437 HZ2 LYS 55 HZ2 LYS 55 -33.457 0.207 -1.846 438 HZ3 LYS 55 HZ3 LYS 55 -32.196 -0.246 -2.879 439 H GLN 56 H GLN 56 -31.979 -2.325 -8.139 440 HA GLN 56 HA GLN 56 -31.310 -4.357 -9.944 441 HB2 GLN 56 HB2 GLN 56 -29.173 -3.246 -10.173 442 HB3 GLN 56 HB3 GLN 56 -30.448 -2.040 -10.058 443 HG2 GLN 56 HG2 GLN 56 -29.896 -1.695 -7.697 444 HG3 GLN 56 HG3 GLN 56 -28.603 -2.884 -7.835 445 HE21 GLN 56 HE21 GLN 56 -26.884 -1.596 -7.466 446 HE22 GLN 56 HE22 GLN 56 -26.429 -0.266 -8.472 447 H GLN 57 H GLN 57 -30.054 -6.152 -9.824 448 HA GLN 57 HA GLN 57 -29.082 -6.896 -7.147 449 HB2 GLN 57 HB2 GLN 57 -30.397 -8.443 -9.324 450 HB3 GLN 57 HB3 GLN 57 -29.193 -9.271 -8.344 451 HG2 GLN 57 HG2 GLN 57 -30.445 -8.729 -6.328 452 HG3 GLN 57 HG3 GLN 57 -31.643 -7.872 -7.296 453 HE21 GLN 57 HE21 GLN 57 -32.188 -9.443 -9.338 454 HE22 GLN 57 HE22 GLN 57 -32.781 -10.983 -8.827 455 H VAL 58 H VAL 58 -27.135 -8.182 -7.035 456 HA VAL 58 HA VAL 58 -25.290 -7.594 -9.256 457 HB VAL 58 HB VAL 58 -23.484 -7.850 -7.492 458 HG11 VAL 58 HG11 VAL 58 -24.514 -5.681 -8.427 459 HG12 VAL 58 HG12 VAL 58 -25.308 -5.558 -6.856 460 HG13 VAL 58 HG13 VAL 58 -23.547 -5.587 -6.957 461 HG21 VAL 58 HG21 VAL 58 -25.265 -7.081 -5.331 462 HG22 VAL 58 HG22 VAL 58 -25.593 -8.709 -5.924 463 HG23 VAL 58 HG23 VAL 58 -23.978 -8.286 -5.359 464 H CYS 59 H CYS 59 -26.521 -10.041 -7.104 465 HA CYS 59 HA CYS 59 -24.661 -12.032 -8.167 466 HB2 CYS 59 HB2 CYS 59 -26.784 -12.435 -6.055 467 HB3 CYS 59 HB3 CYS 59 -25.416 -13.482 -6.411 468 HG CYS 59 HG CYS 59 -25.165 -12.020 -3.933 469 H LEU 60 H LEU 60 -25.213 -13.173 -9.891 470 HA LEU 60 HA LEU 60 -28.033 -13.900 -10.272 471 HB2 LEU 60 HB2 LEU 60 -27.841 -13.483 -12.666 472 HB3 LEU 60 HB3 LEU 60 -27.586 -12.014 -11.727 473 HG LEU 60 HG LEU 60 -25.193 -13.556 -12.590 474 HD11 LEU 60 HD11 LEU 60 -26.406 -13.571 -14.634 475 HD12 LEU 60 HD12 LEU 60 -25.221 -12.270 -14.740 476 HD13 LEU 60 HD13 LEU 60 -26.914 -11.895 -14.417 477 HD21 LEU 60 HD21 LEU 60 -24.766 -11.661 -11.248 478 HD22 LEU 60 HD22 LEU 60 -25.898 -10.664 -12.162 479 HD23 LEU 60 HD23 LEU 60 -24.382 -11.181 -12.901 480 H SER 61 H SER 61 -28.121 -15.549 -12.217 481 HA SER 61 HA SER 61 -25.888 -17.445 -11.936 482 HB2 SER 61 HB2 SER 61 -28.790 -18.276 -12.081 483 HB3 SER 61 HB3 SER 61 -27.393 -19.294 -11.728 484 HG SER 61 HG SER 61 -28.067 -18.869 -9.748 485 H PHE 62 H PHE 62 -25.733 -19.016 -13.692 486 HA PHE 62 HA PHE 62 -27.071 -18.225 -16.174 487 HB2 PHE 62 HB2 PHE 62 -24.152 -18.097 -15.609 488 HB3 PHE 62 HB3 PHE 62 -24.643 -18.684 -17.195 489 HD1 PHE 62 HD1 PHE 62 -26.339 -17.202 -18.483 490 HD2 PHE 62 HD2 PHE 62 -23.941 -15.831 -15.245 491 HE1 PHE 62 HE1 PHE 62 -26.635 -14.883 -19.251 492 HE2 PHE 62 HE2 PHE 62 -24.234 -13.510 -16.008 493 HZ PHE 62 HZ PHE 62 -25.583 -13.033 -18.012 494 H THR 63 H THR 63 -26.989 -19.847 -17.844 495 HA THR 63 HA THR 63 -27.540 -22.421 -16.969 496 HB THR 63 HB THR 63 -26.429 -22.096 -19.716 497 HG1 THR 63 HG1 THR 63 -28.141 -20.868 -20.374 498 HG21 THR 63 HG21 THR 63 -28.475 -23.403 -20.265 499 HG22 THR 63 HG22 THR 63 -28.877 -23.421 -18.547 500 HG23 THR 63 HG23 THR 63 -27.410 -24.214 -19.118 501 H THR 64 H THR 64 -24.598 -21.329 -18.670 502 HA THR 64 HA THR 64 -23.091 -23.398 -17.226 503 HB THR 64 HB THR 64 -21.777 -23.865 -19.282 504 HG1 THR 64 HG1 THR 64 -22.766 -23.178 -21.288 505 HG21 THR 64 HG21 THR 64 -23.837 -25.189 -18.522 506 HG22 THR 64 HG22 THR 64 -23.294 -25.413 -20.186 507 HG23 THR 64 HG23 THR 64 -24.684 -24.384 -19.842 508 H ARG 65 H ARG 65 -20.628 -23.039 -17.733 509 HA ARG 65 HA ARG 65 -19.937 -20.522 -16.668 510 HB2 ARG 65 HB2 ARG 65 -17.593 -21.221 -17.137 511 HB3 ARG 65 HB3 ARG 65 -18.525 -22.428 -16.260 512 HG2 ARG 65 HG2 ARG 65 -17.734 -23.864 -17.768 513 HG3 ARG 65 HG3 ARG 65 -18.936 -23.166 -18.856 514 HD2 ARG 65 HD2 ARG 65 -17.377 -21.850 -19.946 515 HD3 ARG 65 HD3 ARG 65 -16.251 -21.886 -18.590 516 HE ARG 65 HE ARG 65 -15.319 -23.764 -19.487 517 HH11 ARG 65 HH11 ARG 65 -18.508 -23.356 -20.823 518 HH12 ARG 65 HH12 ARG 65 -18.348 -24.671 -21.941 519 HH21 ARG 65 HH21 ARG 65 -15.097 -25.496 -20.955 520 HH22 ARG 65 HH22 ARG 65 -16.409 -25.888 -22.015 521 H GLU 66 H GLU 66 -19.834 -21.827 -19.950 522 HA GLU 66 HA GLU 66 -18.416 -19.844 -21.244 523 HB2 GLU 66 HB2 GLU 66 -19.620 -22.065 -22.087 524 HB3 GLU 66 HB3 GLU 66 -20.844 -20.911 -22.599 525 HG2 GLU 66 HG2 GLU 66 -18.859 -19.659 -23.686 526 HG3 GLU 66 HG3 GLU 66 -18.020 -21.201 -23.521 527 H LEU 67 H LEU 67 -21.686 -19.781 -20.034 528 HA LEU 67 HA LEU 67 -22.521 -17.456 -21.454 529 HB2 LEU 67 HB2 LEU 67 -23.674 -19.337 -19.691 530 HB3 LEU 67 HB3 LEU 67 -23.915 -17.744 -18.977 531 HG LEU 67 HG LEU 67 -25.850 -18.263 -20.258 532 HD11 LEU 67 HD11 LEU 67 -24.522 -16.518 -22.237 533 HD12 LEU 67 HD12 LEU 67 -24.487 -15.981 -20.559 534 HD13 LEU 67 HD13 LEU 67 -26.031 -16.294 -21.352 535 HD21 LEU 67 HD21 LEU 67 -23.904 -18.973 -22.439 536 HD22 LEU 67 HD22 LEU 67 -25.616 -18.682 -22.743 537 HD23 LEU 67 HD23 LEU 67 -25.120 -20.000 -21.682 538 H ALA 68 H ALA 68 -21.038 -18.038 -18.315 539 HA ALA 68 HA ALA 68 -21.307 -15.384 -17.341 540 HB1 ALA 68 HB1 ALA 68 -19.052 -17.061 -16.400 541 HB2 ALA 68 HB2 ALA 68 -20.226 -16.116 -15.482 542 HB3 ALA 68 HB3 ALA 68 -20.685 -17.680 -16.152 543 H ILE 69 H ILE 69 -18.407 -17.118 -18.499 544 HA ILE 69 HA ILE 69 -16.688 -14.943 -18.572 545 HB ILE 69 HB ILE 69 -16.698 -17.330 -20.423 546 HG12 ILE 69 HG12 ILE 69 -14.672 -17.598 -18.530 547 HG13 ILE 69 HG13 ILE 69 -16.044 -16.989 -17.610 548 HG21 ILE 69 HG21 ILE 69 -15.193 -16.001 -21.487 549 HG22 ILE 69 HG22 ILE 69 -14.817 -15.075 -20.035 550 HG23 ILE 69 HG23 ILE 69 -14.125 -16.680 -20.260 551 HD11 ILE 69 HD11 ILE 69 -17.015 -18.974 -17.637 552 HD12 ILE 69 HD12 ILE 69 -16.872 -19.084 -19.392 553 HD13 ILE 69 HD13 ILE 69 -15.543 -19.618 -18.364 554 H ALA 70 H ALA 70 -19.074 -16.000 -20.921 555 HA ALA 70 HA ALA 70 -18.252 -14.376 -23.074 556 HB1 ALA 70 HB1 ALA 70 -20.712 -14.645 -23.770 557 HB2 ALA 70 HB2 ALA 70 -19.717 -16.096 -23.640 558 HB3 ALA 70 HB3 ALA 70 -20.851 -15.686 -22.353 559 H TYR 71 H TYR 71 -20.155 -13.732 -20.221 560 HA TYR 71 HA TYR 71 -21.230 -11.246 -21.160 561 HB2 TYR 71 HB2 TYR 71 -22.447 -12.463 -19.471 562 HB3 TYR 71 HB3 TYR 71 -21.053 -12.456 -18.396 563 HD1 TYR 71 HD1 TYR 71 -22.483 -9.656 -20.391 564 HD2 TYR 71 HD2 TYR 71 -21.778 -11.274 -16.520 565 HE1 TYR 71 HE1 TYR 71 -23.282 -7.563 -19.378 566 HE2 TYR 71 HE2 TYR 71 -22.577 -9.185 -15.495 567 HH TYR 71 HH TYR 71 -24.343 -7.179 -16.547 568 H ALA 72 H ALA 72 -18.744 -12.094 -18.751 569 HA ALA 72 HA ALA 72 -17.909 -9.502 -18.157 570 HB1 ALA 72 HB1 ALA 72 -16.386 -12.100 -18.096 571 HB2 ALA 72 HB2 ALA 72 -15.774 -10.583 -17.436 572 HB3 ALA 72 HB3 ALA 72 -17.229 -11.314 -16.761 573 H VAL 73 H VAL 73 -16.471 -11.808 -20.468 574 HA VAL 73 HA VAL 73 -14.492 -10.129 -21.480 575 HB VAL 73 HB VAL 73 -15.991 -12.307 -22.944 576 HG11 VAL 73 HG11 VAL 73 -13.315 -11.045 -23.534 577 HG12 VAL 73 HG12 VAL 73 -14.021 -12.418 -24.391 578 HG13 VAL 73 HG13 VAL 73 -14.793 -10.833 -24.473 579 HG21 VAL 73 HG21 VAL 73 -13.303 -12.549 -21.629 580 HG22 VAL 73 HG22 VAL 73 -14.798 -12.861 -20.747 581 HG23 VAL 73 HG23 VAL 73 -14.391 -13.830 -22.163 582 H ALA 74 H ALA 74 -17.905 -10.307 -22.199 583 HA ALA 74 HA ALA 74 -18.057 -9.030 -24.641 584 HB1 ALA 74 HB1 ALA 74 -20.110 -8.107 -22.801 585 HB2 ALA 74 HB2 ALA 74 -20.256 -9.078 -24.267 586 HB3 ALA 74 HB3 ALA 74 -19.864 -9.852 -22.731 587 H HIS 75 H HIS 75 -17.355 -7.690 -21.496 588 HA HIS 75 HA HIS 75 -17.027 -5.047 -22.754 589 HB2 HIS 75 HB2 HIS 75 -18.977 -5.383 -21.046 590 HB3 HIS 75 HB3 HIS 75 -17.693 -5.324 -19.841 591 HD1 HIS 75 HD1 HIS 75 -18.993 -3.192 -22.711 592 HD2 HIS 75 HD2 HIS 75 -17.066 -2.811 -19.050 593 HE1 HIS 75 HE1 HIS 75 -18.810 -0.717 -22.301 594 H LYS 76 H LYS 76 -15.134 -7.281 -22.278 595 HA LYS 76 HA LYS 76 -13.015 -7.643 -21.523 596 HB2 LYS 76 HB2 LYS 76 -13.148 -4.656 -21.785 597 HB3 LYS 76 HB3 LYS 76 -11.687 -5.429 -21.185 598 HG2 LYS 76 HG2 LYS 76 -11.178 -5.341 -23.394 599 HG3 LYS 76 HG3 LYS 76 -12.003 -6.900 -23.359 600 HD2 LYS 76 HD2 LYS 76 -13.044 -5.885 -25.143 601 HD3 LYS 76 HD3 LYS 76 -14.130 -5.446 -23.824 602 HE2 LYS 76 HE2 LYS 76 -13.832 -3.431 -24.926 603 HE3 LYS 76 HE3 LYS 76 -12.643 -3.337 -23.627 604 HZ1 LYS 76 HZ1 LYS 76 -11.229 -4.495 -25.589 605 HZ2 LYS 76 HZ2 LYS 76 -11.246 -2.832 -25.281 606 HZ3 LYS 76 HZ3 LYS 76 -12.244 -3.478 -26.484 607 H ILE 77 H ILE 77 -14.667 -8.130 -19.528 608 HA ILE 77 HA ILE 77 -13.681 -6.647 -17.191 609 HB ILE 77 HB ILE 77 -16.042 -8.519 -17.402 610 HG12 ILE 77 HG12 ILE 77 -16.095 -5.537 -16.954 611 HG13 ILE 77 HG13 ILE 77 -16.168 -6.242 -18.565 612 HG21 ILE 77 HG21 ILE 77 -14.653 -7.281 -15.132 613 HG22 ILE 77 HG22 ILE 77 -16.405 -7.089 -15.126 614 HG23 ILE 77 HG23 ILE 77 -15.696 -8.702 -15.190 615 HD11 ILE 77 HD11 ILE 77 -18.215 -7.387 -18.008 616 HD12 ILE 77 HD12 ILE 77 -18.122 -6.799 -16.347 617 HD13 ILE 77 HD13 ILE 77 -18.377 -5.663 -17.672 618 H ASP 78 H ASP 78 -12.686 -7.675 -15.494 619 HA ASP 78 HA ASP 78 -11.357 -10.141 -16.098 620 HB2 ASP 78 HB2 ASP 78 -11.357 -8.859 -13.382 621 HB3 ASP 78 HB3 ASP 78 -10.071 -9.758 -14.182 622 H TYR 79 H TYR 79 -12.484 -11.980 -16.028 623 HA TYR 79 HA TYR 79 -14.445 -12.376 -13.885 624 HB2 TYR 79 HB2 TYR 79 -15.242 -14.279 -15.240 625 HB3 TYR 79 HB3 TYR 79 -15.271 -12.769 -16.143 626 HD1 TYR 79 HD2 TYR 79 -13.682 -16.051 -15.817 627 HD2 TYR 79 HD1 TYR 79 -13.753 -12.403 -18.005 628 HE1 TYR 79 HE2 TYR 79 -12.347 -17.099 -17.596 629 HE2 TYR 79 HE1 TYR 79 -12.419 -13.442 -19.792 630 HH TYR 79 HH TYR 79 -10.679 -15.528 -19.813 631 H THR 80 H THR 80 -14.228 -13.920 -12.354 632 HA THR 80 HA THR 80 -11.799 -15.589 -12.464 633 HB THR 80 HB THR 80 -11.528 -13.927 -10.732 634 HG1 THR 80 HG1 THR 80 -11.182 -15.349 -9.010 635 HG21 THR 80 HG21 THR 80 -14.320 -14.276 -10.380 636 HG22 THR 80 HG22 THR 80 -13.258 -13.110 -9.593 637 HG23 THR 80 HG23 THR 80 -13.535 -14.688 -8.856 638 H VAL 81 H VAL 81 -12.167 -17.701 -12.526 639 HA VAL 81 HA VAL 81 -14.829 -18.716 -11.917 640 HB VAL 81 HB VAL 81 -12.436 -20.159 -13.068 641 HG11 VAL 81 HG11 VAL 81 -14.880 -21.384 -13.773 642 HG12 VAL 81 HG12 VAL 81 -13.591 -22.028 -12.754 643 HG13 VAL 81 HG13 VAL 81 -14.916 -21.115 -12.030 644 HG21 VAL 81 HG21 VAL 81 -13.233 -18.365 -14.528 645 HG22 VAL 81 HG22 VAL 81 -13.579 -19.951 -15.216 646 HG23 VAL 81 HG23 VAL 81 -14.867 -19.023 -14.449 647 H LEU 82 H LEU 82 -15.337 -19.813 -10.132 648 HA LEU 82 HA LEU 82 -13.165 -20.514 -8.280 649 HB2 LEU 82 HB2 LEU 82 -14.767 -18.955 -7.374 650 HB3 LEU 82 HB3 LEU 82 -16.100 -20.024 -7.803 651 HG LEU 82 HG LEU 82 -15.245 -21.673 -6.159 652 HD11 LEU 82 HD11 LEU 82 -13.593 -20.914 -4.504 653 HD12 LEU 82 HD12 LEU 82 -13.328 -19.455 -5.456 654 HD13 LEU 82 HD13 LEU 82 -12.912 -21.032 -6.126 655 HD21 LEU 82 HD21 LEU 82 -16.495 -20.742 -4.544 656 HD22 LEU 82 HD22 LEU 82 -16.787 -19.479 -5.738 657 HD23 LEU 82 HD23 LEU 82 -15.538 -19.262 -4.513 658 H GLN 83 H GLN 83 -12.772 -22.575 -7.767 659 HA GLN 83 HA GLN 83 -14.797 -24.600 -8.441 660 HB2 GLN 83 HB2 GLN 83 -12.815 -26.096 -9.049 661 HB3 GLN 83 HB3 GLN 83 -13.251 -24.837 -10.198 662 HG2 GLN 83 HG2 GLN 83 -11.187 -24.224 -8.152 663 HG3 GLN 83 HG3 GLN 83 -10.753 -25.274 -9.500 664 HE21 GLN 83 HE21 GLN 83 -10.715 -22.186 -8.475 665 HE22 GLN 83 HE22 GLN 83 -10.716 -21.361 -9.992 666 H ASP 84 H ASP 84 -15.440 -25.400 -6.552 667 HA ASP 84 HA ASP 84 -13.557 -25.638 -4.339 668 HB2 ASP 84 HB2 ASP 84 -15.505 -26.127 -2.968 669 HB3 ASP 84 HB3 ASP 84 -15.809 -24.689 -3.938 670 H ASN 85 H ASN 85 -12.944 -27.550 -3.394 671 HA ASN 85 HA ASN 85 -12.313 -29.738 -3.352 672 HB2 ASN 85 HB2 ASN 85 -15.234 -29.887 -4.039 673 HB3 ASN 85 HB3 ASN 85 -14.270 -31.356 -3.927 674 HD21 ASN 85 HD21 ASN 85 -16.387 -29.662 -2.276 675 HD22 ASN 85 HD22 ASN 85 -15.836 -29.910 -0.657 676 HA PRO 86 HA PRO 86 -11.608 -29.746 -7.961 677 HB2 PRO 86 HB2 PRO 86 -8.901 -29.636 -7.797 678 HB3 PRO 86 HB3 PRO 86 -9.920 -28.193 -7.813 679 HG2 PRO 86 HG2 PRO 86 -8.658 -29.596 -5.489 680 HG3 PRO 86 HG3 PRO 86 -8.772 -27.857 -5.819 681 HD2 PRO 86 HD2 PRO 86 -10.425 -29.124 -4.087 682 HD3 PRO 86 HD3 PRO 86 -10.943 -27.728 -5.053 683 H ARG 87 H ARG 87 -11.631 -31.686 -8.891 684 HA ARG 87 HA ARG 87 -10.590 -33.990 -7.453 685 HB2 ARG 87 HB2 ARG 87 -12.858 -33.956 -8.579 686 HB3 ARG 87 HB3 ARG 87 -12.006 -33.967 -10.117 687 HG2 ARG 87 HG2 ARG 87 -12.605 -36.198 -9.695 688 HG3 ARG 87 HG3 ARG 87 -10.881 -36.089 -9.330 689 HD2 ARG 87 HD2 ARG 87 -11.210 -36.291 -7.065 690 HD3 ARG 87 HD3 ARG 87 -12.849 -35.648 -7.139 691 HE ARG 87 HE ARG 87 -13.624 -37.775 -7.449 692 HH11 ARG 87 HH11 ARG 87 -10.211 -37.706 -8.131 693 HH12 ARG 87 HH12 ARG 87 -10.079 -39.425 -8.309 694 HH21 ARG 87 HH21 ARG 87 -13.464 -40.038 -7.680 695 HH22 ARG 87 HH22 ARG 87 -11.931 -40.750 -8.053 696 H THR 88 H THR 88 -8.847 -35.168 -8.030 697 HA THR 88 HA THR 88 -7.092 -34.043 -10.054 698 HB THR 88 HB THR 88 -6.477 -36.448 -8.349 699 HG1 THR 88 HG1 THR 88 -5.949 -35.125 -6.697 700 HG21 THR 88 HG21 THR 88 -4.490 -36.301 -9.342 701 HG22 THR 88 HG22 THR 88 -4.297 -34.666 -8.713 702 HG23 THR 88 HG23 THR 88 -5.054 -34.923 -10.285 703 H ILE 89 H ILE 89 -7.426 -34.668 -12.089 704 HA ILE 89 HA ILE 89 -8.699 -37.085 -12.835 705 HB ILE 89 HB ILE 89 -8.049 -36.524 -15.131 706 HG12 ILE 89 HG12 ILE 89 -6.491 -34.264 -13.859 707 HG13 ILE 89 HG13 ILE 89 -5.788 -35.673 -14.644 708 HG21 ILE 89 HG21 ILE 89 -9.454 -34.703 -15.345 709 HG22 ILE 89 HG22 ILE 89 -9.913 -35.337 -13.765 710 HG23 ILE 89 HG23 ILE 89 -8.851 -33.933 -13.876 711 HD11 ILE 89 HD11 ILE 89 -7.612 -34.433 -16.443 712 HD12 ILE 89 HD12 ILE 89 -6.514 -33.214 -15.796 713 HD13 ILE 89 HD13 ILE 89 -5.868 -34.646 -16.595 714 H VAL 90 H VAL 90 -7.870 -38.959 -13.757 715 HA VAL 90 HA VAL 90 -4.966 -39.361 -13.441 716 HB VAL 90 HB VAL 90 -6.127 -40.552 -11.667 717 HG11 VAL 90 HG11 VAL 90 -7.554 -42.174 -13.756 718 HG12 VAL 90 HG12 VAL 90 -7.831 -42.137 -12.014 719 HG13 VAL 90 HG13 VAL 90 -8.278 -40.751 -13.010 720 HG21 VAL 90 HG21 VAL 90 -5.344 -42.859 -12.185 721 HG22 VAL 90 HG22 VAL 90 -5.048 -42.339 -13.844 722 HG23 VAL 90 HG23 VAL 90 -4.147 -41.608 -12.516 723 HA PRO 91 HA PRO 91 -5.104 -40.476 -17.720 724 HB2 PRO 91 HB2 PRO 91 -2.621 -41.561 -17.877 725 HB3 PRO 91 HB3 PRO 91 -2.904 -39.818 -17.793 726 HG2 PRO 91 HG2 PRO 91 -2.127 -41.717 -15.613 727 HG3 PRO 91 HG3 PRO 91 -1.509 -40.090 -15.953 728 HD2 PRO 91 HD2 PRO 91 -3.342 -40.577 -14.021 729 HD3 PRO 91 HD3 PRO 91 -3.304 -39.060 -14.940 730 H LYS 92 H LYS 92 -6.121 -42.168 -18.570 731 HA LYS 92 HA LYS 92 -6.315 -44.673 -17.232 732 HB2 LYS 92 HB2 LYS 92 -7.608 -45.381 -19.204 733 HB3 LYS 92 HB3 LYS 92 -8.155 -43.829 -18.583 734 HG2 LYS 92 HG2 LYS 92 -8.122 -43.375 -20.812 735 HG3 LYS 92 HG3 LYS 92 -6.478 -42.894 -20.383 736 HD2 LYS 92 HD2 LYS 92 -5.537 -44.773 -21.350 737 HD3 LYS 92 HD3 LYS 92 -7.030 -45.708 -21.233 738 HE2 LYS 92 HE2 LYS 92 -6.558 -43.375 -23.087 739 HE3 LYS 92 HE3 LYS 92 -6.509 -45.074 -23.549 740 HZ1 LYS 92 HZ1 LYS 92 -8.737 -43.380 -23.381 741 HZ2 LYS 92 HZ2 LYS 92 -8.929 -44.613 -22.240 742 HZ3 LYS 92 HZ3 LYS 92 -8.683 -44.998 -23.869 743 H SER 93 H SER 93 -6.038 -46.728 -18.739 744 HA SER 93 HA SER 93 -3.489 -46.600 -20.174 745 HB2 SER 93 HB2 SER 93 -2.519 -48.417 -18.948 746 HB3 SER 93 HB3 SER 93 -3.077 -47.235 -17.762 747 HG SER 93 HG SER 93 -3.621 -49.540 -17.398 748 H TYR 94 H TYR 94 -3.027 -49.025 -20.963 749 HA TYR 94 HA TYR 94 -5.295 -50.615 -21.595 750 HB2 TYR 94 HB2 TYR 94 -5.140 -50.208 -24.105 751 HB3 TYR 94 HB3 TYR 94 -5.922 -48.948 -23.156 752 HD1 TYR 94 HD1 TYR 94 -2.906 -49.844 -25.058 753 HD2 TYR 94 HD2 TYR 94 -4.937 -46.763 -22.944 754 HE1 TYR 94 HE1 TYR 94 -1.353 -48.184 -25.999 755 HE2 TYR 94 HE2 TYR 94 -3.392 -45.094 -23.879 756 HH TYR 94 HH TYR 94 -1.899 -44.813 -25.754 757 H ALA 95 H ALA 95 -4.630 -52.624 -22.038 758 HA ALA 95 HA ALA 95 -1.769 -53.051 -22.478 759 HB1 ALA 95 HB1 ALA 95 -2.476 -55.489 -22.004 760 HB2 ALA 95 HB2 ALA 95 -2.454 -54.334 -20.670 761 HB3 ALA 95 HB3 ALA 95 -3.983 -54.772 -21.432 762 H ASP 96 H ASP 96 -4.897 -53.635 -23.948 763 HA ASP 96 HA ASP 96 -5.506 -54.644 -25.919 764 HB2 ASP 96 HB2 ASP 96 -4.465 -53.636 -27.857 765 HB3 ASP 96 HB3 ASP 96 -4.626 -52.415 -26.597 766 H ASN 97 H ASN 97 -3.978 -56.387 -24.340 767 HA ASN 97 HA ASN 97 -2.020 -57.644 -26.075 768 HB2 ASN 97 HB2 ASN 97 -1.409 -58.953 -24.240 769 HB3 ASN 97 HB3 ASN 97 -1.904 -57.439 -23.490 770 HD21 ASN 97 HD21 ASN 97 -4.067 -57.332 -22.607 771 HD22 ASN 97 HD22 ASN 97 -4.794 -58.766 -21.974 772 H PHE 98 H PHE 98 -2.149 -59.936 -26.610 773 HA PHE 98 HA PHE 98 -4.931 -60.779 -27.089 774 HB2 PHE 98 HB2 PHE 98 -2.439 -61.331 -28.713 775 HB3 PHE 98 HB3 PHE 98 -4.013 -62.050 -29.033 776 HD1 PHE 98 HD1 PHE 98 -5.898 -60.615 -29.757 777 HD2 PHE 98 HD2 PHE 98 -1.928 -59.124 -29.393 778 HE1 PHE 98 HE1 PHE 98 -6.503 -58.676 -31.146 779 HE2 PHE 98 HE2 PHE 98 -2.526 -57.182 -30.780 780 HZ PHE 98 HZ PHE 98 -4.817 -56.955 -31.658 781 H THR 99 H THR 99 -4.943 -63.283 -27.572 782 HA THR 99 HA THR 99 -3.584 -64.558 -25.292 783 HB THR 99 HB THR 99 -5.381 -66.293 -25.445 784 HG1 THR 99 HG1 THR 99 -6.141 -66.047 -27.517 785 HG21 THR 99 HG21 THR 99 -5.458 -63.784 -24.279 786 HG22 THR 99 HG22 THR 99 -6.536 -65.133 -23.920 787 HG23 THR 99 HG23 THR 99 -7.014 -63.912 -25.098 788 H LYS 100 H LYS 100 -2.138 -64.247 -27.640 789 HA LYS 100 HA LYS 100 -0.847 -65.396 -29.120 790 HB2 LYS 100 HB2 LYS 100 -0.513 -66.769 -27.009 791 HB3 LYS 100 HB3 LYS 100 -1.707 -67.888 -27.652 792 HG2 LYS 100 HG2 LYS 100 0.410 -68.779 -28.185 793 HG3 LYS 100 HG3 LYS 100 -0.245 -68.116 -29.684 794 HD2 LYS 100 HD2 LYS 100 1.072 -66.024 -29.207 795 HD3 LYS 100 HD3 LYS 100 1.856 -66.906 -27.895 796 HE2 LYS 100 HE2 LYS 100 2.868 -68.422 -29.377 797 HE3 LYS 100 HE3 LYS 100 1.807 -67.960 -30.707 798 HZ1 LYS 100 HZ1 LYS 100 3.318 -65.750 -29.704 799 HZ2 LYS 100 HZ2 LYS 100 3.172 -66.324 -31.289 800 HZ3 LYS 100 HZ3 LYS 100 4.318 -67.003 -30.247 801 HA PRO 101 HA PRO 101 -4.648 -66.599 -31.520 802 HB2 PRO 101 HB2 PRO 101 -4.223 -64.839 -33.542 803 HB3 PRO 101 HB3 PRO 101 -5.105 -64.416 -32.071 804 HG2 PRO 101 HG2 PRO 101 -2.253 -63.865 -32.794 805 HG3 PRO 101 HG3 PRO 101 -3.439 -62.795 -32.025 806 HD2 PRO 101 HD2 PRO 101 -1.528 -64.100 -30.619 807 HD3 PRO 101 HD3 PRO 101 -3.130 -63.739 -29.945 808 H ARG 102 H ARG 102 -4.464 -68.317 -32.806 809 HA ARG 102 HA ARG 102 -1.933 -68.793 -34.190 810 HB2 ARG 102 HB2 ARG 102 -4.266 -70.580 -33.512 811 HB3 ARG 102 HB3 ARG 102 -2.954 -71.092 -34.564 812 HG2 ARG 102 HG2 ARG 102 -1.362 -70.898 -32.801 813 HG3 ARG 102 HG3 ARG 102 -2.546 -70.119 -31.748 814 HD2 ARG 102 HD2 ARG 102 -3.867 -72.161 -31.695 815 HD3 ARG 102 HD3 ARG 102 -2.737 -72.940 -32.801 816 HE ARG 102 HE ARG 102 -1.328 -73.318 -31.038 817 HH11 ARG 102 HH11 ARG 102 -3.697 -70.941 -30.115 818 HH12 ARG 102 HH12 ARG 102 -3.224 -70.925 -28.448 819 HH21 ARG 102 HH21 ARG 102 -0.695 -73.307 -28.847 820 HH22 ARG 102 HH22 ARG 102 -1.515 -72.271 -27.728 821 H ASP 103 H ASP 103 -1.795 -69.204 -36.391 822 HA ASP 103 HA ASP 103 -4.218 -68.822 -37.996 823 HB2 ASP 103 HB2 ASP 103 -1.626 -67.340 -38.493 824 HB3 ASP 103 HB3 ASP 103 -3.085 -67.243 -39.475 825 H MET 104 H MET 104 -4.194 -69.823 -40.010 826 HA MET 104 HA MET 104 -2.629 -72.155 -40.225 827 HB2 MET 104 HB2 MET 104 -4.523 -70.726 -42.055 828 HB3 MET 104 HB3 MET 104 -3.575 -72.077 -42.662 829 HG2 MET 104 HG2 MET 104 -4.564 -73.578 -41.117 830 HG3 MET 104 HG3 MET 104 -5.317 -72.259 -40.223 831 HE1 MET 104 HE1 MET 104 -8.402 -71.329 -42.106 832 HE2 MET 104 HE2 MET 104 -7.960 -71.970 -40.523 833 HE3 MET 104 HE3 MET 104 -7.024 -70.655 -41.236 Start of MODEL 19 1 H1 MET 1 H MET 1 -2.620 -1.638 -0.895 2 HA MET 1 HA MET 1 -3.144 1.077 -1.862 3 HB2 MET 1 HB2 MET 1 -0.646 -0.457 -1.221 4 HB3 MET 1 HB3 MET 1 -0.573 0.962 -2.256 5 HG2 MET 1 HG2 MET 1 -1.959 1.168 0.366 6 HG3 MET 1 HG3 MET 1 -0.198 1.142 0.328 7 HE1 MET 1 HE1 MET 1 0.704 4.498 0.131 8 HE2 MET 1 HE2 MET 1 -0.505 4.210 1.384 9 HE3 MET 1 HE3 MET 1 0.654 2.947 0.970 10 H GLN 2 H GLN 2 -2.040 -2.094 -2.953 11 HA GLN 2 HA GLN 2 -1.914 -1.155 -5.713 12 HB2 GLN 2 HB2 GLN 2 -1.298 -3.892 -4.587 13 HB3 GLN 2 HB3 GLN 2 -0.956 -3.336 -6.221 14 HG2 GLN 2 HG2 GLN 2 0.551 -1.614 -5.251 15 HG3 GLN 2 HG3 GLN 2 0.291 -2.347 -3.669 16 HE21 GLN 2 HE21 GLN 2 2.741 -2.386 -4.039 17 HE22 GLN 2 HE22 GLN 2 3.374 -3.849 -4.702 18 H GLU 3 H GLU 3 -4.436 -0.913 -4.968 19 HA GLU 3 HA GLU 3 -5.778 -3.223 -6.208 20 HB2 GLU 3 HB2 GLU 3 -6.894 -1.501 -3.989 21 HB3 GLU 3 HB3 GLU 3 -7.701 -2.862 -4.753 22 HG2 GLU 3 HG2 GLU 3 -5.102 -3.116 -3.268 23 HG3 GLU 3 HG3 GLU 3 -6.679 -3.311 -2.506 24 H GLN 4 H GLN 4 -6.596 -2.662 -8.105 25 HA GLN 4 HA GLN 4 -7.211 0.130 -8.660 26 HB2 GLN 4 HB2 GLN 4 -6.876 -2.324 -10.352 27 HB3 GLN 4 HB3 GLN 4 -7.670 -0.898 -11.005 28 HG2 GLN 4 HG2 GLN 4 -5.721 0.422 -10.727 29 HG3 GLN 4 HG3 GLN 4 -4.930 -0.834 -9.776 30 HE21 GLN 4 HE21 GLN 4 -4.483 0.606 -12.473 31 HE22 GLN 4 HE22 GLN 4 -4.058 -0.687 -13.536 32 H VAL 5 H VAL 5 -9.186 0.887 -8.340 33 HA VAL 5 HA VAL 5 -11.463 -0.974 -8.545 34 HB VAL 5 HB VAL 5 -12.690 0.649 -7.100 35 HG11 VAL 5 HG11 VAL 5 -12.032 -0.432 -5.226 36 HG12 VAL 5 HG12 VAL 5 -11.097 -1.389 -6.378 37 HG13 VAL 5 HG13 VAL 5 -10.325 -0.076 -5.488 38 HG21 VAL 5 HG21 VAL 5 -10.134 1.855 -6.215 39 HG22 VAL 5 HG22 VAL 5 -10.822 2.444 -7.728 40 HG23 VAL 5 HG23 VAL 5 -11.761 2.535 -6.239 41 H SER 6 H SER 6 -10.503 0.092 -10.887 42 HA SER 6 HA SER 6 -12.134 2.419 -11.535 43 HB2 SER 6 HB2 SER 6 -9.705 2.037 -12.325 44 HB3 SER 6 HB3 SER 6 -10.404 0.905 -13.481 45 HG SER 6 HG SER 6 -10.769 3.691 -13.279 46 H ASN 7 H ASN 7 -11.665 -0.886 -12.785 47 HA ASN 7 HA ASN 7 -14.386 -0.752 -13.904 48 HB2 ASN 7 HB2 ASN 7 -12.329 -2.773 -14.751 49 HB3 ASN 7 HB3 ASN 7 -13.737 -2.193 -15.635 50 HD21 ASN 7 HD21 ASN 7 -10.483 -1.463 -14.627 51 HD22 ASN 7 HD22 ASN 7 -10.206 -0.191 -15.763 52 H VAL 8 H VAL 8 -15.876 -2.255 -13.340 53 HA VAL 8 HA VAL 8 -15.603 -3.673 -10.943 54 HB VAL 8 HB VAL 8 -17.715 -4.804 -11.559 55 HG11 VAL 8 HG11 VAL 8 -18.968 -2.963 -11.124 56 HG12 VAL 8 HG12 VAL 8 -17.378 -2.260 -10.825 57 HG13 VAL 8 HG13 VAL 8 -18.183 -1.996 -12.372 58 HG21 VAL 8 HG21 VAL 8 -17.695 -3.223 -14.110 59 HG22 VAL 8 HG22 VAL 8 -17.061 -4.867 -14.041 60 HG23 VAL 8 HG23 VAL 8 -18.751 -4.557 -13.642 61 H ARG 9 H ARG 9 -16.219 -6.130 -10.893 62 HA ARG 9 HA ARG 9 -14.665 -7.606 -12.898 63 HB2 ARG 9 HB2 ARG 9 -13.789 -9.021 -10.954 64 HB3 ARG 9 HB3 ARG 9 -13.075 -7.429 -11.176 65 HG2 ARG 9 HG2 ARG 9 -14.179 -6.544 -9.322 66 HG3 ARG 9 HG3 ARG 9 -15.348 -7.865 -9.275 67 HD2 ARG 9 HD2 ARG 9 -13.892 -9.301 -8.249 68 HD3 ARG 9 HD3 ARG 9 -12.470 -8.524 -8.943 69 HE ARG 9 HE ARG 9 -13.685 -6.738 -7.159 70 HH11 ARG 9 HH11 ARG 9 -11.956 -9.760 -7.143 71 HH12 ARG 9 HH12 ARG 9 -11.296 -9.524 -5.558 72 HH21 ARG 9 HH21 ARG 9 -12.822 -6.416 -5.072 73 HH22 ARG 9 HH22 ARG 9 -11.790 -7.622 -4.381 74 H ALA 10 H ALA 10 -15.223 -9.828 -13.099 75 HA ALA 10 HA ALA 10 -17.955 -10.395 -12.188 76 HB1 ALA 10 HB1 ALA 10 -17.254 -12.343 -14.036 77 HB2 ALA 10 HB2 ALA 10 -18.247 -10.915 -14.331 78 HB3 ALA 10 HB3 ALA 10 -16.512 -10.865 -14.650 79 H ARG 11 H ARG 11 -18.205 -11.737 -10.537 80 HA ARG 11 HA ARG 11 -16.031 -13.565 -9.833 81 HB2 ARG 11 HB2 ARG 11 -18.506 -12.851 -8.252 82 HB3 ARG 11 HB3 ARG 11 -17.119 -13.762 -7.670 83 HG2 ARG 11 HG2 ARG 11 -15.739 -11.690 -8.174 84 HG3 ARG 11 HG3 ARG 11 -17.278 -10.845 -8.352 85 HD2 ARG 11 HD2 ARG 11 -17.897 -11.459 -6.082 86 HD3 ARG 11 HD3 ARG 11 -16.397 -12.367 -5.902 87 HE ARG 11 HE ARG 11 -15.943 -9.631 -6.593 88 HH11 ARG 11 HH11 ARG 11 -16.645 -11.797 -3.958 89 HH12 ARG 11 HH12 ARG 11 -15.947 -10.765 -2.753 90 HH21 ARG 11 HH21 ARG 11 -15.021 -8.266 -5.017 91 HH22 ARG 11 HH22 ARG 11 -15.024 -8.757 -3.356 92 H ILE 12 H ILE 12 -16.204 -15.410 -10.972 93 HA ILE 12 HA ILE 12 -18.841 -16.694 -11.166 94 HB ILE 12 HB ILE 12 -16.324 -17.312 -12.716 95 HG12 ILE 12 HG12 ILE 12 -18.842 -15.987 -13.727 96 HG13 ILE 12 HG13 ILE 12 -17.442 -15.076 -13.169 97 HG21 ILE 12 HG21 ILE 12 -17.938 -18.587 -14.168 98 HG22 ILE 12 HG22 ILE 12 -17.639 -19.280 -12.574 99 HG23 ILE 12 HG23 ILE 12 -19.129 -18.388 -12.883 100 HD11 ILE 12 HD11 ILE 12 -16.088 -16.284 -14.888 101 HD12 ILE 12 HD12 ILE 12 -17.599 -16.945 -15.514 102 HD13 ILE 12 HD13 ILE 12 -17.325 -15.203 -15.530 103 H TYR 13 H TYR 13 -19.260 -18.546 -10.129 104 HA TYR 13 HA TYR 13 -17.100 -20.269 -9.235 105 HB2 TYR 13 HB2 TYR 13 -17.959 -20.297 -6.892 106 HB3 TYR 13 HB3 TYR 13 -17.248 -18.757 -7.362 107 HD1 TYR 13 HD2 TYR 13 -18.742 -16.825 -7.887 108 HD2 TYR 13 HD1 TYR 13 -20.238 -20.452 -6.239 109 HE1 TYR 13 HE2 TYR 13 -20.802 -15.662 -7.211 110 HE2 TYR 13 HE1 TYR 13 -22.302 -19.299 -5.560 111 HH TYR 13 HH TYR 13 -22.916 -15.948 -6.466 112 H LYS 14 H LYS 14 -17.765 -22.377 -8.734 113 HA LYS 14 HA LYS 14 -20.499 -23.011 -9.621 114 HB2 LYS 14 HB2 LYS 14 -18.252 -23.920 -10.735 115 HB3 LYS 14 HB3 LYS 14 -18.404 -25.119 -9.458 116 HG2 LYS 14 HG2 LYS 14 -20.851 -25.325 -10.341 117 HG3 LYS 14 HG3 LYS 14 -20.168 -24.613 -11.804 118 HD2 LYS 14 HD2 LYS 14 -20.005 -26.934 -12.128 119 HD3 LYS 14 HD3 LYS 14 -18.383 -26.429 -11.652 120 HE2 LYS 14 HE2 LYS 14 -18.643 -28.243 -10.288 121 HE3 LYS 14 HE3 LYS 14 -19.293 -26.984 -9.240 122 HZ1 LYS 14 HZ1 LYS 14 -21.260 -27.975 -9.237 123 HZ2 LYS 14 HZ2 LYS 14 -20.571 -29.281 -10.061 124 HZ3 LYS 14 HZ3 LYS 14 -21.317 -28.035 -10.927 125 HA PRO 15 HA PRO 15 -20.675 -23.965 -5.152 126 HB2 PRO 15 HB2 PRO 15 -23.346 -23.518 -4.955 127 HB3 PRO 15 HB3 PRO 15 -22.147 -22.222 -4.873 128 HG2 PRO 15 HG2 PRO 15 -23.829 -23.100 -7.187 129 HG3 PRO 15 HG3 PRO 15 -23.449 -21.457 -6.641 130 HD2 PRO 15 HD2 PRO 15 -22.179 -22.631 -8.724 131 HD3 PRO 15 HD3 PRO 15 -21.376 -21.467 -7.649 132 H ALA 16 H ALA 16 -21.694 -25.689 -4.019 133 HA ALA 16 HA ALA 16 -21.973 -28.070 -5.459 134 HB1 ALA 16 HB1 ALA 16 -22.315 -29.109 -3.436 135 HB2 ALA 16 HB2 ALA 16 -21.504 -27.627 -2.926 136 HB3 ALA 16 HB3 ALA 16 -23.257 -27.768 -2.783 137 H LYS 17 H LYS 17 -23.839 -29.442 -5.708 138 HA LYS 17 HA LYS 17 -26.160 -27.944 -6.569 139 HB2 LYS 17 HB2 LYS 17 -25.442 -30.873 -6.731 140 HB3 LYS 17 HB3 LYS 17 -26.957 -30.213 -7.332 141 HG2 LYS 17 HG2 LYS 17 -25.546 -28.667 -8.765 142 HG3 LYS 17 HG3 LYS 17 -24.176 -29.692 -8.329 143 HD2 LYS 17 HD2 LYS 17 -25.238 -31.616 -9.307 144 HD3 LYS 17 HD3 LYS 17 -26.720 -30.702 -9.599 145 HE2 LYS 17 HE2 LYS 17 -25.625 -30.772 -11.676 146 HE3 LYS 17 HE3 LYS 17 -25.294 -29.161 -11.038 147 HZ1 LYS 17 HZ1 LYS 17 -23.443 -30.969 -11.921 148 HZ2 LYS 17 HZ2 LYS 17 -23.313 -31.050 -10.237 149 HZ3 LYS 17 HZ3 LYS 17 -23.125 -29.566 -11.030 150 H SER 18 H SER 18 -25.331 -30.306 -4.087 151 HA SER 18 HA SER 18 -27.684 -29.520 -2.574 152 HB2 SER 18 HB2 SER 18 -27.211 -32.345 -3.532 153 HB3 SER 18 HB3 SER 18 -28.253 -31.966 -2.161 154 HG SER 18 HG SER 18 -29.553 -30.749 -3.538 155 H THR 19 H THR 19 -27.356 -29.584 -0.413 156 HA THR 19 HA THR 19 -24.973 -30.984 0.588 157 HB THR 19 HB THR 19 -24.700 -28.984 2.185 158 HG1 THR 19 HG1 THR 19 -25.502 -27.021 1.367 159 HG21 THR 19 HG21 THR 19 -23.456 -27.675 0.371 160 HG22 THR 19 HG22 THR 19 -24.019 -28.920 -0.742 161 HG23 THR 19 HG23 THR 19 -22.986 -29.356 0.619 162 H MET 20 H MET 20 -27.566 -28.923 1.919 163 HA MET 20 HA MET 20 -27.804 -30.392 4.312 164 HB2 MET 20 HB2 MET 20 -29.395 -28.278 2.945 165 HB3 MET 20 HB3 MET 20 -30.179 -29.185 4.232 166 HG2 MET 20 HG2 MET 20 -27.516 -27.857 4.602 167 HG3 MET 20 HG3 MET 20 -29.041 -27.013 4.869 168 HE1 MET 20 HE1 MET 20 -30.173 -26.981 7.227 169 HE2 MET 20 HE2 MET 20 -29.072 -27.437 8.528 170 HE3 MET 20 HE3 MET 20 -28.511 -26.391 7.222 171 H GLN 21 H GLN 21 -30.403 -30.060 1.906 172 HA GLN 21 HA GLN 21 -30.882 -32.951 2.106 173 HB2 GLN 21 HB2 GLN 21 -32.863 -30.727 2.521 174 HB3 GLN 21 HB3 GLN 21 -33.383 -32.326 2.005 175 HG2 GLN 21 HG2 GLN 21 -32.161 -33.220 4.036 176 HG3 GLN 21 HG3 GLN 21 -32.051 -31.545 4.576 177 HE21 GLN 21 HE21 GLN 21 -33.480 -31.225 6.118 178 HE22 GLN 21 HE22 GLN 21 -35.124 -31.757 6.110 179 H SER 22 H SER 22 -32.700 -33.530 0.413 180 HA SER 22 HA SER 22 -31.627 -33.215 -2.118 181 HB2 SER 22 HB2 SER 22 -34.364 -34.002 -1.154 182 HB3 SER 22 HB3 SER 22 -34.027 -33.868 -2.881 183 HG SER 22 HG SER 22 -32.653 -35.533 -2.762 184 H GLY 23 H GLY 23 -31.580 -31.597 -3.528 185 HA2 GLY 23 HA2 GLY 23 -33.356 -29.299 -3.062 186 HA3 GLY 23 HA3 GLY 23 -31.832 -29.249 -3.934 187 H HIS 24 H HIS 24 -34.286 -28.179 -4.872 188 HA HIS 24 HA HIS 24 -34.488 -29.662 -7.373 189 HB2 HIS 24 HB2 HIS 24 -36.992 -29.464 -7.328 190 HB3 HIS 24 HB3 HIS 24 -36.331 -30.603 -6.158 191 HD1 HIS 24 HD1 HIS 24 -37.443 -26.961 -6.206 192 HD2 HIS 24 HD2 HIS 24 -37.334 -30.253 -3.674 193 HE1 HIS 24 HE1 HIS 24 -38.611 -26.231 -4.102 194 H SER 25 H SER 25 -36.183 -28.333 -8.821 195 HA SER 25 HA SER 25 -36.434 -26.449 -10.075 196 HB2 SER 25 HB2 SER 25 -36.539 -25.400 -7.264 197 HB3 SER 25 HB3 SER 25 -36.613 -24.283 -8.626 198 HG SER 25 HG SER 25 -38.542 -25.023 -9.154 199 H LYS 26 H LYS 26 -33.769 -27.419 -9.729 200 HA LYS 26 HA LYS 26 -32.205 -24.926 -9.760 201 HB2 LYS 26 HB2 LYS 26 -31.657 -26.948 -8.194 202 HB3 LYS 26 HB3 LYS 26 -30.968 -27.655 -9.649 203 HG2 LYS 26 HG2 LYS 26 -29.498 -25.699 -9.882 204 HG3 LYS 26 HG3 LYS 26 -30.164 -25.041 -8.385 205 HD2 LYS 26 HD2 LYS 26 -29.080 -27.808 -8.325 206 HD3 LYS 26 HD3 LYS 26 -27.928 -26.473 -8.426 207 HE2 LYS 26 HE2 LYS 26 -28.158 -26.785 -6.138 208 HE3 LYS 26 HE3 LYS 26 -29.282 -25.468 -6.467 209 HZ1 LYS 26 HZ1 LYS 26 -30.578 -27.966 -6.768 210 HZ2 LYS 26 HZ2 LYS 26 -30.953 -26.692 -5.720 211 HZ3 LYS 26 HZ3 LYS 26 -29.845 -27.880 -5.246 212 H LEU 27 H LEU 27 -32.426 -24.250 -11.852 213 HA LEU 27 HA LEU 27 -31.921 -26.134 -14.020 214 HB2 LEU 27 HB2 LEU 27 -32.832 -23.266 -13.977 215 HB3 LEU 27 HB3 LEU 27 -32.482 -24.148 -15.461 216 HG LEU 27 HG LEU 27 -34.612 -24.901 -13.461 217 HD11 LEU 27 HD11 LEU 27 -35.033 -22.767 -14.678 218 HD12 LEU 27 HD12 LEU 27 -36.208 -24.037 -15.014 219 HD13 LEU 27 HD13 LEU 27 -34.947 -23.671 -16.190 220 HD21 LEU 27 HD21 LEU 27 -34.337 -26.890 -14.476 221 HD22 LEU 27 HD22 LEU 27 -33.487 -26.190 -15.854 222 HD23 LEU 27 HD23 LEU 27 -35.248 -26.131 -15.782 223 H LYS 28 H LYS 28 -30.527 -23.274 -12.521 224 HA LYS 28 HA LYS 28 -28.375 -23.114 -14.442 225 HB2 LYS 28 HB2 LYS 28 -27.527 -21.311 -12.947 226 HB3 LYS 28 HB3 LYS 28 -29.175 -21.048 -13.503 227 HG2 LYS 28 HG2 LYS 28 -28.965 -22.472 -10.950 228 HG3 LYS 28 HG3 LYS 28 -28.345 -20.819 -10.930 229 HD2 LYS 28 HD2 LYS 28 -30.655 -20.449 -12.273 230 HD3 LYS 28 HD3 LYS 28 -31.107 -21.812 -11.247 231 HE2 LYS 28 HE2 LYS 28 -30.478 -20.587 -9.269 232 HE3 LYS 28 HE3 LYS 28 -29.854 -19.259 -10.245 233 HZ1 LYS 28 HZ1 LYS 28 -32.566 -19.862 -9.482 234 HZ2 LYS 28 HZ2 LYS 28 -32.392 -19.488 -11.122 235 HZ3 LYS 28 HZ3 LYS 28 -31.874 -18.388 -9.945 236 H ALA 29 H ALA 29 -26.118 -23.282 -13.846 237 HA ALA 29 HA ALA 29 -25.647 -25.147 -11.612 238 HB1 ALA 29 HB1 ALA 29 -23.843 -25.291 -13.951 239 HB2 ALA 29 HB2 ALA 29 -24.442 -26.571 -12.895 240 HB3 ALA 29 HB3 ALA 29 -25.477 -25.919 -14.165 241 H TRP 30 H TRP 30 -24.359 -22.561 -13.630 242 HA TRP 30 HA TRP 30 -22.148 -22.185 -11.735 243 HB2 TRP 30 HB2 TRP 30 -22.604 -21.254 -14.563 244 HB3 TRP 30 HB3 TRP 30 -21.359 -20.537 -13.545 245 HD1 TRP 30 HD1 TRP 30 -22.241 -23.802 -15.343 246 HE1 TRP 30 HE1 TRP 30 -20.118 -25.248 -15.506 247 HE3 TRP 30 HE3 TRP 30 -19.117 -20.986 -12.436 248 HZ2 TRP 30 HZ2 TRP 30 -17.469 -25.201 -14.532 249 HZ3 TRP 30 HZ3 TRP 30 -16.804 -21.757 -12.102 250 HH2 TRP 30 HH2 TRP 30 -15.999 -23.821 -13.128 251 H LYS 31 H LYS 31 -21.770 -20.198 -10.741 252 HA LYS 31 HA LYS 31 -24.067 -18.352 -10.759 253 HB2 LYS 31 HB2 LYS 31 -22.231 -19.205 -8.529 254 HB3 LYS 31 HB3 LYS 31 -23.205 -17.744 -8.420 255 HG2 LYS 31 HG2 LYS 31 -24.337 -20.487 -8.923 256 HG3 LYS 31 HG3 LYS 31 -24.208 -19.741 -7.329 257 HD2 LYS 31 HD2 LYS 31 -25.528 -17.794 -8.322 258 HD3 LYS 31 HD3 LYS 31 -25.881 -18.875 -9.672 259 HE2 LYS 31 HE2 LYS 31 -26.479 -19.489 -6.781 260 HE3 LYS 31 HE3 LYS 31 -27.650 -18.840 -7.928 261 HZ1 LYS 31 HZ1 LYS 31 -26.719 -20.974 -9.251 262 HZ2 LYS 31 HZ2 LYS 31 -28.105 -20.989 -8.283 263 HZ3 LYS 31 HZ3 LYS 31 -26.630 -21.531 -7.656 264 H LEU 32 H LEU 32 -23.712 -16.222 -11.094 265 HA LEU 32 HA LEU 32 -20.915 -15.321 -11.291 266 HB2 LEU 32 HB2 LEU 32 -21.860 -15.641 -13.516 267 HB3 LEU 32 HB3 LEU 32 -23.213 -14.590 -13.102 268 HG LEU 32 HG LEU 32 -21.295 -13.658 -14.556 269 HD11 LEU 32 HD11 LEU 32 -22.206 -11.688 -14.077 270 HD12 LEU 32 HD12 LEU 32 -21.592 -11.723 -12.425 271 HD13 LEU 32 HD13 LEU 32 -23.120 -12.512 -12.814 272 HD21 LEU 32 HD21 LEU 32 -19.299 -13.118 -13.616 273 HD22 LEU 32 HD22 LEU 32 -19.673 -14.534 -12.634 274 HD23 LEU 32 HD23 LEU 32 -19.984 -12.916 -12.004 275 H GLU 33 H GLU 33 -20.437 -13.569 -10.133 276 HA GLU 33 HA GLU 33 -22.613 -11.760 -9.339 277 HB2 GLU 33 HB2 GLU 33 -22.243 -13.118 -7.408 278 HB3 GLU 33 HB3 GLU 33 -20.498 -12.967 -7.560 279 HG2 GLU 33 HG2 GLU 33 -21.331 -11.599 -5.744 280 HG3 GLU 33 HG3 GLU 33 -20.646 -10.596 -7.022 281 H PHE 34 H PHE 34 -22.118 -9.984 -10.479 282 HA PHE 34 HA PHE 34 -19.366 -9.150 -10.826 283 HB2 PHE 34 HB2 PHE 34 -20.347 -7.321 -12.183 284 HB3 PHE 34 HB3 PHE 34 -20.874 -8.914 -12.714 285 HD1 PHE 34 HD2 PHE 34 -21.890 -5.858 -10.932 286 HD2 PHE 34 HD1 PHE 34 -23.157 -9.550 -12.628 287 HE1 PHE 34 HE2 PHE 34 -24.236 -5.144 -10.727 288 HE2 PHE 34 HE1 PHE 34 -25.505 -8.842 -12.426 289 HZ PHE 34 HZ PHE 34 -26.047 -6.636 -11.473 290 H GLU 35 H GLU 35 -18.377 -7.435 -9.871 291 HA GLU 35 HA GLU 35 -19.365 -6.538 -7.371 292 HB2 GLU 35 HB2 GLU 35 -16.982 -5.932 -9.060 293 HB3 GLU 35 HB3 GLU 35 -17.382 -4.820 -7.758 294 HG2 GLU 35 HG2 GLU 35 -16.847 -7.768 -7.474 295 HG3 GLU 35 HG3 GLU 35 -15.753 -6.458 -7.031 296 HA PRO 36 HA PRO 36 -21.647 -2.920 -8.335 297 HB2 PRO 36 HB2 PRO 36 -20.894 -1.210 -6.366 298 HB3 PRO 36 HB3 PRO 36 -21.932 -2.612 -6.077 299 HG2 PRO 36 HG2 PRO 36 -18.989 -2.306 -5.616 300 HG3 PRO 36 HG3 PRO 36 -20.211 -3.065 -4.579 301 HD2 PRO 36 HD2 PRO 36 -18.552 -4.501 -6.165 302 HD3 PRO 36 HD3 PRO 36 -20.207 -5.024 -5.793 303 H SER 37 H SER 37 -21.537 -0.759 -9.128 304 HA SER 37 HA SER 37 -18.827 0.084 -9.925 305 HB2 SER 37 HB2 SER 37 -19.943 1.076 -11.960 306 HB3 SER 37 HB3 SER 37 -19.965 -0.686 -11.892 307 HG SER 37 HG SER 37 -22.008 0.591 -12.390 308 H CYS 38 H CYS 38 -18.604 2.416 -10.350 309 HA CYS 38 HA CYS 38 -20.332 3.987 -8.555 310 HB2 CYS 38 HB2 CYS 38 -17.461 4.606 -9.263 311 HB3 CYS 38 HB3 CYS 38 -18.445 5.374 -8.023 312 HG CYS 38 HG CYS 38 -18.652 2.790 -6.638 313 H THR 39 H THR 39 -20.982 6.043 -9.192 314 HA THR 39 HA THR 39 -21.825 7.539 -10.696 315 HB THR 39 HB THR 39 -20.248 8.721 -12.002 316 HG1 THR 39 HG1 THR 39 -18.195 7.749 -12.532 317 HG21 THR 39 HG21 THR 39 -18.630 7.510 -9.759 318 HG22 THR 39 HG22 THR 39 -19.855 8.759 -9.535 319 HG23 THR 39 HG23 THR 39 -18.415 9.097 -10.494 320 H GLN 40 H GLN 40 -22.402 4.811 -11.292 321 HA GLN 40 HA GLN 40 -22.900 5.079 -14.156 322 HB2 GLN 40 HB2 GLN 40 -20.836 3.699 -13.872 323 HB3 GLN 40 HB3 GLN 40 -21.787 2.540 -12.954 324 HG2 GLN 40 HG2 GLN 40 -22.940 1.811 -14.805 325 HG3 GLN 40 HG3 GLN 40 -22.657 3.304 -15.699 326 HE21 GLN 40 HE21 GLN 40 -22.228 0.573 -16.550 327 HE22 GLN 40 HE22 GLN 40 -20.554 0.439 -16.950 328 H TYR 41 H TYR 41 -24.761 4.047 -14.876 329 HA TYR 41 HA TYR 41 -26.765 3.616 -12.887 330 HB2 TYR 41 HB2 TYR 41 -26.948 4.520 -15.361 331 HB3 TYR 41 HB3 TYR 41 -27.177 2.816 -15.738 332 HD1 TYR 41 HD2 TYR 41 -28.419 5.226 -13.154 333 HD2 TYR 41 HD1 TYR 41 -29.370 2.164 -15.950 334 HE1 TYR 41 HE2 TYR 41 -30.794 5.415 -12.544 335 HE2 TYR 41 HE1 TYR 41 -31.748 2.345 -15.348 336 HH TYR 41 HH TYR 41 -32.832 4.542 -12.787 337 H THR 42 H THR 42 -28.242 1.641 -13.099 338 HA THR 42 HA THR 42 -26.549 -0.736 -12.901 339 HB THR 42 HB THR 42 -28.241 -1.746 -11.598 340 HG1 THR 42 HG1 THR 42 -30.307 -0.395 -11.385 341 HG21 THR 42 HG21 THR 42 -28.721 -0.080 -9.840 342 HG22 THR 42 HG22 THR 42 -28.193 1.199 -10.932 343 HG23 THR 42 HG23 THR 42 -27.044 -0.019 -10.380 344 H GLU 43 H GLU 43 -27.907 0.654 -15.372 345 HA GLU 43 HA GLU 43 -28.135 -1.655 -16.945 346 HB2 GLU 43 HB2 GLU 43 -30.618 -1.457 -17.443 347 HB3 GLU 43 HB3 GLU 43 -30.188 -2.180 -15.899 348 HG2 GLU 43 HG2 GLU 43 -30.597 -0.004 -14.807 349 HG3 GLU 43 HG3 GLU 43 -31.125 0.643 -16.360 350 HA PRO 44 HA PRO 44 -27.657 2.471 -19.051 351 HB2 PRO 44 HB2 PRO 44 -25.336 1.833 -20.307 352 HB3 PRO 44 HB3 PRO 44 -25.391 2.506 -18.673 353 HG2 PRO 44 HG2 PRO 44 -25.069 -0.341 -19.538 354 HG3 PRO 44 HG3 PRO 44 -24.212 0.545 -18.263 355 HD2 PRO 44 HD2 PRO 44 -26.256 -1.150 -17.736 356 HD3 PRO 44 HD3 PRO 44 -25.936 0.295 -16.754 357 H LEU 45 H LEU 45 -27.714 -0.855 -20.002 358 HA LEU 45 HA LEU 45 -28.980 -0.124 -22.514 359 HB2 LEU 45 HB2 LEU 45 -26.702 -0.295 -23.209 360 HB3 LEU 45 HB3 LEU 45 -26.492 -1.809 -22.334 361 HG LEU 45 HG LEU 45 -28.157 -2.828 -23.932 362 HD11 LEU 45 HD11 LEU 45 -28.045 -0.075 -24.969 363 HD12 LEU 45 HD12 LEU 45 -29.330 -1.279 -25.069 364 HD13 LEU 45 HD13 LEU 45 -27.962 -1.356 -26.179 365 HD21 LEU 45 HD21 LEU 45 -26.076 -3.551 -24.460 366 HD22 LEU 45 HD22 LEU 45 -25.412 -1.920 -24.560 367 HD23 LEU 45 HD23 LEU 45 -26.365 -2.568 -25.896 368 H MET 46 H MET 46 -30.578 -1.499 -23.071 369 HA MET 46 HA MET 46 -30.965 -3.847 -21.354 370 HB2 MET 46 HB2 MET 46 -32.855 -2.136 -22.950 371 HB3 MET 46 HB3 MET 46 -33.333 -3.724 -22.364 372 HG2 MET 46 HG2 MET 46 -32.911 -3.022 -20.076 373 HG3 MET 46 HG3 MET 46 -32.386 -1.441 -20.647 374 HE1 MET 46 HE1 MET 46 -35.565 -2.157 -18.594 375 HE2 MET 46 HE2 MET 46 -36.372 -3.138 -19.817 376 HE3 MET 46 HE3 MET 46 -34.737 -3.547 -19.295 377 H ASN 47 H ASN 47 -29.798 -5.438 -22.353 378 HA ASN 47 HA ASN 47 -30.428 -6.004 -25.170 379 HB2 ASN 47 HB2 ASN 47 -27.999 -5.639 -24.357 380 HB3 ASN 47 HB3 ASN 47 -28.149 -7.244 -23.649 381 HD21 ASN 47 HD21 ASN 47 -26.886 -8.451 -24.905 382 HD22 ASN 47 HD22 ASN 47 -27.044 -8.608 -26.618 383 H TRP 48 H TRP 48 -30.325 -7.369 -21.939 384 HA TRP 48 HA TRP 48 -31.094 -10.006 -22.799 385 HB2 TRP 48 HB2 TRP 48 -29.725 -9.592 -20.757 386 HB3 TRP 48 HB3 TRP 48 -31.128 -8.834 -20.010 387 HD1 TRP 48 HD1 TRP 48 -32.670 -10.391 -18.672 388 HE1 TRP 48 HE1 TRP 48 -32.934 -12.940 -18.426 389 HE3 TRP 48 HE3 TRP 48 -29.408 -11.902 -22.307 390 HZ2 TRP 48 HZ2 TRP 48 -31.898 -15.281 -19.614 391 HZ3 TRP 48 HZ3 TRP 48 -29.101 -14.313 -22.689 392 HH2 TRP 48 HH2 TRP 48 -30.321 -15.965 -21.369 393 H THR 49 H THR 49 -33.014 -9.616 -23.969 394 HA THR 49 HA THR 49 -35.252 -8.241 -22.979 395 HB THR 49 HB THR 49 -36.484 -9.904 -24.625 396 HG1 THR 49 HG1 THR 49 -34.783 -11.350 -24.915 397 HG21 THR 49 HG21 THR 49 -34.601 -8.192 -26.115 398 HG22 THR 49 HG22 THR 49 -35.516 -7.386 -24.841 399 HG23 THR 49 HG23 THR 49 -36.364 -8.228 -26.139 400 H GLY 50 H GLY 50 -37.027 -8.862 -21.817 401 HA2 GLY 50 HA2 GLY 50 -38.318 -11.010 -21.203 402 HA3 GLY 50 HA3 GLY 50 -36.795 -11.457 -20.447 403 H SER 51 H SER 51 -39.654 -9.531 -20.213 404 HA SER 51 HA SER 51 -38.978 -7.776 -18.163 405 HB2 SER 51 HB2 SER 51 -41.589 -9.088 -18.906 406 HB3 SER 51 HB3 SER 51 -41.472 -7.930 -17.582 407 HG SER 51 HG SER 51 -41.904 -6.660 -19.269 408 H HIS 52 H HIS 52 -38.480 -8.041 -16.091 409 HA HIS 52 HA HIS 52 -39.043 -10.651 -14.847 410 HB2 HIS 52 HB2 HIS 52 -36.803 -8.687 -14.333 411 HB3 HIS 52 HB3 HIS 52 -37.113 -10.105 -13.335 412 HD1 HIS 52 HD1 HIS 52 -34.609 -9.361 -15.351 413 HD2 HIS 52 HD2 HIS 52 -37.543 -12.268 -15.799 414 HE1 HIS 52 HE1 HIS 52 -33.624 -11.076 -16.903 415 H ASP 53 H ASP 53 -38.957 -10.382 -12.314 416 HA ASP 53 HA ASP 53 -41.243 -8.926 -11.576 417 HB2 ASP 53 HB2 ASP 53 -39.080 -9.914 -9.710 418 HB3 ASP 53 HB3 ASP 53 -40.770 -9.613 -9.318 419 H THR 54 H THR 54 -40.993 -7.494 -9.424 420 HA THR 54 HA THR 54 -39.402 -5.195 -10.277 421 HB THR 54 HB THR 54 -40.737 -3.880 -8.721 422 HG1 THR 54 HG1 THR 54 -42.356 -6.101 -8.123 423 HG21 THR 54 HG21 THR 54 -42.839 -4.004 -9.837 424 HG22 THR 54 HG22 THR 54 -42.595 -5.703 -10.244 425 HG23 THR 54 HG23 THR 54 -41.609 -4.459 -11.015 426 H LYS 55 H LYS 55 -37.854 -7.229 -9.255 427 HA LYS 55 HA LYS 55 -37.088 -6.201 -6.601 428 HB2 LYS 55 HB2 LYS 55 -37.087 -8.969 -7.738 429 HB3 LYS 55 HB3 LYS 55 -35.897 -8.545 -6.513 430 HG2 LYS 55 HG2 LYS 55 -37.508 -8.216 -4.878 431 HG3 LYS 55 HG3 LYS 55 -38.805 -8.011 -6.059 432 HD2 LYS 55 HD2 LYS 55 -39.146 -10.146 -5.126 433 HD3 LYS 55 HD3 LYS 55 -38.393 -10.442 -6.695 434 HE2 LYS 55 HE2 LYS 55 -36.666 -10.175 -4.279 435 HE3 LYS 55 HE3 LYS 55 -37.550 -11.677 -4.537 436 HZ1 LYS 55 HZ1 LYS 55 -35.847 -12.255 -5.821 437 HZ2 LYS 55 HZ2 LYS 55 -35.223 -10.683 -5.876 438 HZ3 LYS 55 HZ3 LYS 55 -36.434 -11.151 -6.962 439 H GLN 56 H GLN 56 -35.010 -5.575 -6.269 440 HA GLN 56 HA GLN 56 -33.342 -5.302 -8.633 441 HB2 GLN 56 HB2 GLN 56 -33.687 -3.367 -7.147 442 HB3 GLN 56 HB3 GLN 56 -32.940 -4.255 -5.824 443 HG2 GLN 56 HG2 GLN 56 -31.262 -2.847 -6.617 444 HG3 GLN 56 HG3 GLN 56 -30.885 -4.424 -7.310 445 HE21 GLN 56 HE21 GLN 56 -29.717 -2.380 -8.483 446 HE22 GLN 56 HE22 GLN 56 -30.457 -1.991 -9.995 447 H GLN 57 H GLN 57 -32.690 -7.470 -8.924 448 HA GLN 57 HA GLN 57 -31.162 -8.751 -6.810 449 HB2 GLN 57 HB2 GLN 57 -32.433 -10.351 -7.885 450 HB3 GLN 57 HB3 GLN 57 -32.243 -9.595 -9.461 451 HG2 GLN 57 HG2 GLN 57 -30.128 -10.514 -9.782 452 HG3 GLN 57 HG3 GLN 57 -29.923 -10.874 -8.069 453 HE21 GLN 57 HE21 GLN 57 -32.232 -11.619 -10.664 454 HE22 GLN 57 HE22 GLN 57 -32.350 -13.305 -10.306 455 H VAL 58 H VAL 58 -28.995 -8.918 -6.728 456 HA VAL 58 HA VAL 58 -27.469 -7.514 -8.806 457 HB VAL 58 HB VAL 58 -25.615 -7.530 -7.117 458 HG11 VAL 58 HG11 VAL 58 -26.364 -5.471 -6.763 459 HG12 VAL 58 HG12 VAL 58 -28.008 -5.968 -7.171 460 HG13 VAL 58 HG13 VAL 58 -27.433 -6.098 -5.509 461 HG21 VAL 58 HG21 VAL 58 -26.115 -8.054 -4.812 462 HG22 VAL 58 HG22 VAL 58 -27.776 -8.468 -5.232 463 HG23 VAL 58 HG23 VAL 58 -26.444 -9.464 -5.818 464 H CYS 59 H CYS 59 -27.881 -10.607 -7.264 465 HA CYS 59 HA CYS 59 -25.492 -11.741 -8.434 466 HB2 CYS 59 HB2 CYS 59 -27.773 -13.133 -7.019 467 HB3 CYS 59 HB3 CYS 59 -26.193 -13.819 -7.379 468 HG CYS 59 HG CYS 59 -27.126 -11.791 -4.877 469 H LEU 60 H LEU 60 -25.343 -12.763 -10.329 470 HA LEU 60 HA LEU 60 -27.844 -13.363 -11.769 471 HB2 LEU 60 HB2 LEU 60 -26.845 -11.644 -12.976 472 HB3 LEU 60 HB3 LEU 60 -25.220 -12.270 -12.703 473 HG LEU 60 HG LEU 60 -25.663 -14.092 -14.281 474 HD11 LEU 60 HD11 LEU 60 -28.383 -12.885 -14.267 475 HD12 LEU 60 HD12 LEU 60 -27.897 -14.580 -14.284 476 HD13 LEU 60 HD13 LEU 60 -27.782 -13.616 -15.756 477 HD21 LEU 60 HD21 LEU 60 -26.027 -11.253 -15.168 478 HD22 LEU 60 HD22 LEU 60 -26.004 -12.574 -16.336 479 HD23 LEU 60 HD23 LEU 60 -24.605 -12.288 -15.299 480 H SER 61 H SER 61 -28.191 -15.423 -12.259 481 HA SER 61 HA SER 61 -26.050 -17.356 -11.833 482 HB2 SER 61 HB2 SER 61 -27.798 -19.041 -11.850 483 HB3 SER 61 HB3 SER 61 -28.287 -17.716 -10.794 484 HG SER 61 HG SER 61 -29.888 -18.548 -12.368 485 H PHE 62 H PHE 62 -25.688 -19.093 -13.365 486 HA PHE 62 HA PHE 62 -26.495 -18.540 -16.120 487 HB2 PHE 62 HB2 PHE 62 -23.690 -18.532 -15.074 488 HB3 PHE 62 HB3 PHE 62 -23.998 -19.102 -16.710 489 HD1 PHE 62 HD2 PHE 62 -25.401 -17.511 -18.217 490 HD2 PHE 62 HD1 PHE 62 -23.343 -16.286 -14.699 491 HE1 PHE 62 HE2 PHE 62 -25.411 -15.187 -19.025 492 HE2 PHE 62 HE1 PHE 62 -23.350 -13.960 -15.500 493 HZ PHE 62 HZ PHE 62 -24.384 -13.408 -17.667 494 H THR 63 H THR 63 -26.680 -20.335 -17.398 495 HA THR 63 HA THR 63 -26.886 -22.855 -16.078 496 HB THR 63 HB THR 63 -26.852 -22.776 -19.047 497 HG1 THR 63 HG1 THR 63 -29.126 -21.764 -17.720 498 HG21 THR 63 HG21 THR 63 -27.584 -24.817 -18.259 499 HG22 THR 63 HG22 THR 63 -29.115 -23.967 -18.468 500 HG23 THR 63 HG23 THR 63 -28.397 -24.107 -16.864 501 H THR 64 H THR 64 -24.614 -21.455 -18.398 502 HA THR 64 HA THR 64 -22.721 -23.598 -17.730 503 HB THR 64 HB THR 64 -21.952 -23.410 -20.198 504 HG1 THR 64 HG1 THR 64 -24.057 -23.077 -21.464 505 HG21 THR 64 HG21 THR 64 -23.002 -25.402 -19.130 506 HG22 THR 64 HG22 THR 64 -23.386 -25.233 -20.843 507 HG23 THR 64 HG23 THR 64 -24.577 -24.782 -19.623 508 H ARG 65 H ARG 65 -20.529 -23.024 -17.840 509 HA ARG 65 HA ARG 65 -19.859 -20.456 -17.046 510 HB2 ARG 65 HB2 ARG 65 -17.495 -21.132 -17.725 511 HB3 ARG 65 HB3 ARG 65 -18.313 -22.165 -16.561 512 HG2 ARG 65 HG2 ARG 65 -18.789 -23.797 -18.249 513 HG3 ARG 65 HG3 ARG 65 -18.174 -22.729 -19.512 514 HD2 ARG 65 HD2 ARG 65 -16.312 -23.992 -19.220 515 HD3 ARG 65 HD3 ARG 65 -16.014 -22.808 -17.947 516 HE ARG 65 HE ARG 65 -16.274 -24.473 -16.407 517 HH11 ARG 65 HH11 ARG 65 -17.683 -25.503 -19.419 518 HH12 ARG 65 HH12 ARG 65 -18.000 -27.115 -18.870 519 HH21 ARG 65 HH21 ARG 65 -16.686 -26.593 -15.672 520 HH22 ARG 65 HH22 ARG 65 -17.433 -27.734 -16.739 521 H GLU 66 H GLU 66 -19.799 -21.888 -20.279 522 HA GLU 66 HA GLU 66 -18.502 -19.905 -21.691 523 HB2 GLU 66 HB2 GLU 66 -19.669 -20.697 -23.658 524 HB3 GLU 66 HB3 GLU 66 -19.236 -22.067 -22.644 525 HG2 GLU 66 HG2 GLU 66 -21.573 -21.983 -21.722 526 HG3 GLU 66 HG3 GLU 66 -21.944 -20.814 -22.989 527 H LEU 67 H LEU 67 -21.753 -19.933 -20.414 528 HA LEU 67 HA LEU 67 -22.584 -17.585 -21.862 529 HB2 LEU 67 HB2 LEU 67 -23.777 -19.404 -19.847 530 HB3 LEU 67 HB3 LEU 67 -24.432 -17.771 -19.951 531 HG LEU 67 HG LEU 67 -24.216 -19.520 -22.381 532 HD11 LEU 67 HD11 LEU 67 -25.453 -20.751 -20.631 533 HD12 LEU 67 HD12 LEU 67 -26.460 -20.305 -22.008 534 HD13 LEU 67 HD13 LEU 67 -26.570 -19.391 -20.502 535 HD21 LEU 67 HD21 LEU 67 -24.656 -17.030 -22.503 536 HD22 LEU 67 HD22 LEU 67 -26.199 -17.359 -21.717 537 HD23 LEU 67 HD23 LEU 67 -25.842 -18.071 -23.291 538 H ALA 68 H ALA 68 -21.400 -18.339 -18.633 539 HA ALA 68 HA ALA 68 -21.875 -15.800 -17.481 540 HB1 ALA 68 HB1 ALA 68 -21.034 -18.216 -16.536 541 HB2 ALA 68 HB2 ALA 68 -19.559 -17.255 -16.442 542 HB3 ALA 68 HB3 ALA 68 -21.021 -16.708 -15.621 543 H ILE 69 H ILE 69 -18.754 -17.226 -18.472 544 HA ILE 69 HA ILE 69 -17.234 -14.919 -18.289 545 HB ILE 69 HB ILE 69 -16.886 -17.216 -20.220 546 HG12 ILE 69 HG12 ILE 69 -14.967 -17.355 -18.207 547 HG13 ILE 69 HG13 ILE 69 -16.440 -16.892 -17.361 548 HG21 ILE 69 HG21 ILE 69 -14.432 -16.417 -20.033 549 HG22 ILE 69 HG22 ILE 69 -15.532 -15.561 -21.113 550 HG23 ILE 69 HG23 ILE 69 -15.143 -14.883 -19.531 551 HD11 ILE 69 HD11 ILE 69 -16.960 -19.007 -19.240 552 HD12 ILE 69 HD12 ILE 69 -15.668 -19.447 -18.124 553 HD13 ILE 69 HD13 ILE 69 -17.240 -18.949 -17.500 554 H ALA 70 H ALA 70 -19.297 -16.037 -20.902 555 HA ALA 70 HA ALA 70 -18.449 -14.315 -22.932 556 HB1 ALA 70 HB1 ALA 70 -19.865 -15.995 -23.652 557 HB2 ALA 70 HB2 ALA 70 -21.029 -15.713 -22.357 558 HB3 ALA 70 HB3 ALA 70 -20.913 -14.577 -23.701 559 H TYR 71 H TYR 71 -20.260 -13.688 -20.066 560 HA TYR 71 HA TYR 71 -21.440 -11.233 -21.002 561 HB2 TYR 71 HB2 TYR 71 -22.392 -12.751 -19.189 562 HB3 TYR 71 HB3 TYR 71 -21.146 -12.103 -18.128 563 HD1 TYR 71 HD2 TYR 71 -23.210 -10.358 -20.693 564 HD2 TYR 71 HD1 TYR 71 -22.299 -10.821 -16.562 565 HE1 TYR 71 HE2 TYR 71 -24.663 -8.445 -20.164 566 HE2 TYR 71 HE1 TYR 71 -23.751 -8.910 -16.023 567 HH TYR 71 HH TYR 71 -25.986 -7.812 -17.540 568 H ALA 72 H ALA 72 -18.819 -12.101 -18.760 569 HA ALA 72 HA ALA 72 -18.049 -9.446 -18.172 570 HB1 ALA 72 HB1 ALA 72 -17.319 -11.032 -16.634 571 HB2 ALA 72 HB2 ALA 72 -16.699 -12.106 -17.889 572 HB3 ALA 72 HB3 ALA 72 -15.848 -10.608 -17.511 573 H VAL 73 H VAL 73 -16.601 -11.856 -20.369 574 HA VAL 73 HA VAL 73 -14.556 -10.328 -21.414 575 HB VAL 73 HB VAL 73 -16.246 -12.350 -22.893 576 HG11 VAL 73 HG11 VAL 73 -13.528 -11.203 -23.511 577 HG12 VAL 73 HG12 VAL 73 -14.218 -12.617 -24.309 578 HG13 VAL 73 HG13 VAL 73 -14.997 -11.043 -24.472 579 HG21 VAL 73 HG21 VAL 73 -15.070 -13.025 -20.718 580 HG22 VAL 73 HG22 VAL 73 -14.776 -14.012 -22.149 581 HG23 VAL 73 HG23 VAL 73 -13.569 -12.837 -21.626 582 H ALA 74 H ALA 74 -17.974 -10.188 -22.102 583 HA ALA 74 HA ALA 74 -18.005 -8.852 -24.529 584 HB1 ALA 74 HB1 ALA 74 -19.963 -9.746 -23.154 585 HB2 ALA 74 HB2 ALA 74 -19.924 -8.194 -22.316 586 HB3 ALA 74 HB3 ALA 74 -20.217 -8.251 -24.055 587 H HIS 75 H HIS 75 -17.158 -7.684 -21.368 588 HA HIS 75 HA HIS 75 -16.698 -5.014 -22.522 589 HB2 HIS 75 HB2 HIS 75 -17.640 -5.671 -19.724 590 HB3 HIS 75 HB3 HIS 75 -17.168 -4.064 -20.270 591 HD1 HIS 75 HD1 HIS 75 -19.798 -6.704 -20.940 592 HD2 HIS 75 HD2 HIS 75 -19.156 -2.636 -21.486 593 HE1 HIS 75 HE1 HIS 75 -21.985 -5.784 -21.774 594 H LYS 76 H LYS 76 -14.961 -7.417 -22.157 595 HA LYS 76 HA LYS 76 -12.860 -7.958 -21.460 596 HB2 LYS 76 HB2 LYS 76 -12.653 -5.659 -22.727 597 HB3 LYS 76 HB3 LYS 76 -12.246 -5.048 -21.129 598 HG2 LYS 76 HG2 LYS 76 -10.154 -5.572 -21.735 599 HG3 LYS 76 HG3 LYS 76 -10.626 -7.205 -21.256 600 HD2 LYS 76 HD2 LYS 76 -11.224 -6.344 -24.037 601 HD3 LYS 76 HD3 LYS 76 -9.542 -6.688 -23.623 602 HE2 LYS 76 HE2 LYS 76 -11.796 -8.592 -23.031 603 HE3 LYS 76 HE3 LYS 76 -10.896 -8.621 -24.547 604 HZ1 LYS 76 HZ1 LYS 76 -9.346 -9.821 -23.552 605 HZ2 LYS 76 HZ2 LYS 76 -10.195 -9.769 -22.090 606 HZ3 LYS 76 HZ3 LYS 76 -9.053 -8.573 -22.447 607 H ILE 77 H ILE 77 -14.768 -7.915 -19.399 608 HA ILE 77 HA ILE 77 -13.545 -6.605 -17.115 609 HB ILE 77 HB ILE 77 -15.954 -8.421 -17.253 610 HG12 ILE 77 HG12 ILE 77 -15.899 -5.431 -16.855 611 HG13 ILE 77 HG13 ILE 77 -16.067 -6.172 -18.443 612 HG21 ILE 77 HG21 ILE 77 -14.475 -7.240 -15.023 613 HG22 ILE 77 HG22 ILE 77 -16.209 -6.928 -14.985 614 HG23 ILE 77 HG23 ILE 77 -15.614 -8.586 -15.045 615 HD11 ILE 77 HD11 ILE 77 -18.088 -7.362 -17.560 616 HD12 ILE 77 HD12 ILE 77 -17.959 -6.351 -16.119 617 HD13 ILE 77 HD13 ILE 77 -18.236 -5.609 -17.695 618 H ASP 78 H ASP 78 -12.520 -7.611 -15.430 619 HA ASP 78 HA ASP 78 -11.212 -10.079 -15.992 620 HB2 ASP 78 HB2 ASP 78 -10.436 -8.037 -14.541 621 HB3 ASP 78 HB3 ASP 78 -11.280 -8.882 -13.246 622 H TYR 79 H TYR 79 -12.454 -11.864 -16.056 623 HA TYR 79 HA TYR 79 -14.383 -12.328 -13.899 624 HB2 TYR 79 HB2 TYR 79 -15.295 -14.090 -15.327 625 HB3 TYR 79 HB3 TYR 79 -15.205 -12.569 -16.208 626 HD1 TYR 79 HD1 TYR 79 -13.725 -15.921 -15.845 627 HD2 TYR 79 HD2 TYR 79 -13.773 -12.324 -18.116 628 HE1 TYR 79 HE1 TYR 79 -12.447 -17.036 -17.626 629 HE2 TYR 79 HE2 TYR 79 -12.496 -13.428 -19.904 630 HH TYR 79 HH TYR 79 -11.778 -16.872 -19.791 631 H THR 80 H THR 80 -14.193 -13.968 -12.463 632 HA THR 80 HA THR 80 -11.804 -15.682 -12.697 633 HB THR 80 HB THR 80 -11.471 -14.125 -10.880 634 HG1 THR 80 HG1 THR 80 -10.716 -16.173 -10.400 635 HG21 THR 80 HG21 THR 80 -13.476 -14.939 -9.022 636 HG22 THR 80 HG22 THR 80 -14.266 -14.421 -10.511 637 HG23 THR 80 HG23 THR 80 -13.163 -13.331 -9.672 638 H VAL 81 H VAL 81 -12.233 -17.773 -12.884 639 HA VAL 81 HA VAL 81 -14.899 -18.755 -12.184 640 HB VAL 81 HB VAL 81 -12.714 -20.218 -13.667 641 HG11 VAL 81 HG11 VAL 81 -14.331 -21.806 -14.245 642 HG12 VAL 81 HG12 VAL 81 -14.638 -21.479 -12.539 643 HG13 VAL 81 HG13 VAL 81 -15.665 -20.752 -13.776 644 HG21 VAL 81 HG21 VAL 81 -14.621 -18.163 -14.549 645 HG22 VAL 81 HG22 VAL 81 -13.091 -18.674 -15.262 646 HG23 VAL 81 HG23 VAL 81 -14.558 -19.609 -15.555 647 H LEU 82 H LEU 82 -15.243 -19.867 -10.384 648 HA LEU 82 HA LEU 82 -12.927 -21.021 -8.982 649 HB2 LEU 82 HB2 LEU 82 -14.034 -19.300 -7.708 650 HB3 LEU 82 HB3 LEU 82 -15.595 -20.086 -7.938 651 HG LEU 82 HG LEU 82 -14.686 -22.025 -6.606 652 HD11 LEU 82 HD11 LEU 82 -12.272 -21.112 -6.983 653 HD12 LEU 82 HD12 LEU 82 -12.694 -21.903 -5.464 654 HD13 LEU 82 HD13 LEU 82 -12.626 -20.143 -5.552 655 HD21 LEU 82 HD21 LEU 82 -15.505 -19.386 -5.695 656 HD22 LEU 82 HD22 LEU 82 -14.577 -20.273 -4.483 657 HD23 LEU 82 HD23 LEU 82 -16.039 -20.984 -5.170 658 H GLN 83 H GLN 83 -12.753 -23.144 -9.213 659 HA GLN 83 HA GLN 83 -15.156 -24.743 -9.696 660 HB2 GLN 83 HB2 GLN 83 -12.298 -25.689 -9.848 661 HB3 GLN 83 HB3 GLN 83 -13.724 -26.439 -10.553 662 HG2 GLN 83 HG2 GLN 83 -12.815 -25.465 -12.399 663 HG3 GLN 83 HG3 GLN 83 -13.886 -24.173 -11.858 664 HE21 GLN 83 HE21 GLN 83 -12.010 -23.348 -13.452 665 HE22 GLN 83 HE22 GLN 83 -10.722 -22.556 -12.616 666 H ASP 84 H ASP 84 -15.609 -26.625 -8.498 667 HA ASP 84 HA ASP 84 -14.325 -26.704 -5.846 668 HB2 ASP 84 HB2 ASP 84 -16.754 -25.936 -5.959 669 HB3 ASP 84 HB3 ASP 84 -17.150 -27.587 -6.427 670 H ASN 85 H ASN 85 -13.231 -28.497 -5.427 671 HA ASN 85 HA ASN 85 -12.471 -30.639 -5.497 672 HB2 ASN 85 HB2 ASN 85 -14.927 -30.986 -4.814 673 HB3 ASN 85 HB3 ASN 85 -15.190 -31.478 -6.485 674 HD21 ASN 85 HD21 ASN 85 -15.851 -33.431 -5.155 675 HD22 ASN 85 HD22 ASN 85 -14.626 -34.621 -4.886 676 HA PRO 86 HA PRO 86 -11.973 -30.273 -10.112 677 HB2 PRO 86 HB2 PRO 86 -9.274 -29.988 -10.042 678 HB3 PRO 86 HB3 PRO 86 -10.388 -28.623 -9.905 679 HG2 PRO 86 HG2 PRO 86 -8.936 -30.105 -7.748 680 HG3 PRO 86 HG3 PRO 86 -9.181 -28.359 -7.935 681 HD2 PRO 86 HD2 PRO 86 -10.669 -29.866 -6.248 682 HD3 PRO 86 HD3 PRO 86 -11.320 -28.440 -7.081 683 H ARG 87 H ARG 87 -10.202 -31.536 -11.430 684 HA ARG 87 HA ARG 87 -9.199 -33.934 -10.220 685 HB2 ARG 87 HB2 ARG 87 -11.731 -34.288 -10.635 686 HB3 ARG 87 HB3 ARG 87 -11.288 -34.374 -12.334 687 HG2 ARG 87 HG2 ARG 87 -9.956 -36.299 -11.984 688 HG3 ARG 87 HG3 ARG 87 -10.036 -36.116 -10.231 689 HD2 ARG 87 HD2 ARG 87 -12.186 -36.913 -10.109 690 HD3 ARG 87 HD3 ARG 87 -12.575 -36.421 -11.758 691 HE ARG 87 HE ARG 87 -11.791 -38.439 -12.518 692 HH11 ARG 87 HH11 ARG 87 -10.820 -37.987 -9.205 693 HH12 ARG 87 HH12 ARG 87 -10.242 -39.610 -9.016 694 HH21 ARG 87 HH21 ARG 87 -11.032 -40.578 -12.281 695 HH22 ARG 87 HH22 ARG 87 -10.362 -41.082 -10.767 696 H THR 88 H THR 88 -7.797 -35.087 -11.580 697 HA THR 88 HA THR 88 -6.329 -33.628 -13.411 698 HB THR 88 HB THR 88 -6.583 -36.640 -13.406 699 HG1 THR 88 HG1 THR 88 -4.823 -36.516 -11.908 700 HG21 THR 88 HG21 THR 88 -4.318 -36.611 -14.287 701 HG22 THR 88 HG22 THR 88 -4.293 -34.848 -14.227 702 HG23 THR 88 HG23 THR 88 -5.384 -35.678 -15.337 703 H ILE 89 H ILE 89 -6.911 -32.836 -15.317 704 HA ILE 89 HA ILE 89 -9.165 -33.791 -16.772 705 HB ILE 89 HB ILE 89 -8.819 -32.042 -18.263 706 HG12 ILE 89 HG12 ILE 89 -6.609 -32.599 -19.052 707 HG13 ILE 89 HG13 ILE 89 -6.606 -30.912 -18.550 708 HG21 ILE 89 HG21 ILE 89 -8.775 -31.506 -15.618 709 HG22 ILE 89 HG22 ILE 89 -7.312 -30.672 -16.142 710 HG23 ILE 89 HG23 ILE 89 -8.866 -30.271 -16.873 711 HD11 ILE 89 HD11 ILE 89 -4.585 -31.992 -17.823 712 HD12 ILE 89 HD12 ILE 89 -5.572 -31.585 -16.419 713 HD13 ILE 89 HD13 ILE 89 -5.512 -33.248 -17.001 714 H VAL 90 H VAL 90 -8.766 -34.026 -19.303 715 HA VAL 90 HA VAL 90 -6.448 -35.305 -20.231 716 HB VAL 90 HB VAL 90 -6.973 -37.136 -18.770 717 HG11 VAL 90 HG11 VAL 90 -9.374 -38.212 -19.679 718 HG12 VAL 90 HG12 VAL 90 -9.085 -37.422 -18.127 719 HG13 VAL 90 HG13 VAL 90 -9.692 -36.487 -19.494 720 HG21 VAL 90 HG21 VAL 90 -8.009 -38.189 -21.353 721 HG22 VAL 90 HG22 VAL 90 -6.406 -37.453 -21.327 722 HG23 VAL 90 HG23 VAL 90 -6.759 -38.835 -20.290 723 HA PRO 91 HA PRO 91 -9.556 -33.955 -23.383 724 HB2 PRO 91 HB2 PRO 91 -7.768 -32.549 -24.865 725 HB3 PRO 91 HB3 PRO 91 -8.617 -31.860 -23.476 726 HG2 PRO 91 HG2 PRO 91 -5.841 -32.968 -23.641 727 HG3 PRO 91 HG3 PRO 91 -6.414 -31.503 -22.823 728 HD2 PRO 91 HD2 PRO 91 -5.919 -33.812 -21.498 729 HD3 PRO 91 HD3 PRO 91 -7.185 -32.673 -20.993 730 H LYS 92 H LYS 92 -9.105 -33.995 -25.907 731 HA LYS 92 HA LYS 92 -7.201 -35.941 -26.800 732 HB2 LYS 92 HB2 LYS 92 -9.138 -37.259 -25.731 733 HB3 LYS 92 HB3 LYS 92 -10.087 -36.735 -27.116 734 HG2 LYS 92 HG2 LYS 92 -8.695 -37.904 -28.631 735 HG3 LYS 92 HG3 LYS 92 -7.478 -38.202 -27.386 736 HD2 LYS 92 HD2 LYS 92 -8.693 -40.230 -27.701 737 HD3 LYS 92 HD3 LYS 92 -9.200 -39.546 -26.155 738 HE2 LYS 92 HE2 LYS 92 -11.172 -38.564 -27.303 739 HE3 LYS 92 HE3 LYS 92 -10.683 -39.397 -28.777 740 HZ1 LYS 92 HZ1 LYS 92 -11.664 -40.558 -26.247 741 HZ2 LYS 92 HZ2 LYS 92 -10.769 -41.488 -27.339 742 HZ3 LYS 92 HZ3 LYS 92 -12.240 -40.805 -27.818 743 H SER 93 H SER 93 -6.639 -35.395 -28.799 744 HA SER 93 HA SER 93 -8.648 -34.175 -30.562 745 HB2 SER 93 HB2 SER 93 -7.100 -32.461 -29.459 746 HB3 SER 93 HB3 SER 93 -5.808 -33.164 -30.432 747 HG SER 93 HG SER 93 -7.776 -31.446 -31.160 748 H TYR 94 H TYR 94 -7.466 -33.881 -32.850 749 HA TYR 94 HA TYR 94 -5.709 -36.090 -33.488 750 HB2 TYR 94 HB2 TYR 94 -8.589 -36.010 -34.351 751 HB3 TYR 94 HB3 TYR 94 -7.375 -36.829 -35.325 752 HD1 TYR 94 HD1 TYR 94 -5.971 -38.649 -34.157 753 HD2 TYR 94 HD2 TYR 94 -9.612 -37.121 -32.574 754 HE1 TYR 94 HE1 TYR 94 -6.196 -40.657 -32.757 755 HE2 TYR 94 HE2 TYR 94 -9.848 -39.125 -31.168 756 HH TYR 94 HH TYR 94 -8.106 -41.920 -31.644 757 H ALA 95 H ALA 95 -4.224 -35.101 -34.679 758 HA ALA 95 HA ALA 95 -4.849 -32.784 -36.275 759 HB1 ALA 95 HB1 ALA 95 -2.760 -32.408 -35.558 760 HB2 ALA 95 HB2 ALA 95 -2.428 -34.123 -35.318 761 HB3 ALA 95 HB3 ALA 95 -2.281 -33.414 -36.926 762 H ASP 96 H ASP 96 -4.705 -32.600 -38.512 763 HA ASP 96 HA ASP 96 -4.299 -35.024 -40.084 764 HB2 ASP 96 HB2 ASP 96 -6.779 -34.738 -39.474 765 HB3 ASP 96 HB3 ASP 96 -6.758 -33.350 -40.558 766 H ASN 97 H ASN 97 -3.743 -34.645 -42.247 767 HA ASN 97 HA ASN 97 -2.835 -31.907 -42.765 768 HB2 ASN 97 HB2 ASN 97 -1.183 -33.783 -42.858 769 HB3 ASN 97 HB3 ASN 97 -2.078 -34.447 -44.222 770 HD21 ASN 97 HD21 ASN 97 -0.093 -31.802 -43.109 771 HD22 ASN 97 HD22 ASN 97 0.348 -31.219 -44.675 772 H PHE 98 H PHE 98 -5.318 -31.662 -43.143 773 HA PHE 98 HA PHE 98 -6.221 -32.553 -45.741 774 HB2 PHE 98 HB2 PHE 98 -7.661 -32.233 -43.617 775 HB3 PHE 98 HB3 PHE 98 -7.627 -30.520 -44.027 776 HD1 PHE 98 HD1 PHE 98 -8.690 -29.715 -46.085 777 HD2 PHE 98 HD2 PHE 98 -8.968 -33.785 -44.868 778 HE1 PHE 98 HE1 PHE 98 -10.568 -30.048 -47.640 779 HE2 PHE 98 HE2 PHE 98 -10.845 -34.125 -46.421 780 HZ PHE 98 HZ PHE 98 -11.647 -32.255 -47.810 781 H THR 99 H THR 99 -4.872 -31.583 -47.237 782 HA THR 99 HA THR 99 -5.273 -28.690 -47.566 783 HB THR 99 HB THR 99 -2.842 -28.806 -48.594 784 HG1 THR 99 HG1 THR 99 -2.560 -30.676 -46.484 785 HG21 THR 99 HG21 THR 99 -2.000 -27.838 -46.615 786 HG22 THR 99 HG22 THR 99 -3.099 -28.767 -45.597 787 HG23 THR 99 HG23 THR 99 -3.724 -27.467 -46.610 788 H LYS 100 H LYS 100 -6.236 -28.323 -49.442 789 HA LYS 100 HA LYS 100 -5.632 -30.109 -51.709 790 HB2 LYS 100 HB2 LYS 100 -8.221 -28.617 -51.263 791 HB3 LYS 100 HB3 LYS 100 -7.886 -29.815 -52.506 792 HG2 LYS 100 HG2 LYS 100 -7.872 -30.410 -49.557 793 HG3 LYS 100 HG3 LYS 100 -9.270 -30.641 -50.610 794 HD2 LYS 100 HD2 LYS 100 -6.626 -31.882 -51.279 795 HD3 LYS 100 HD3 LYS 100 -7.720 -32.655 -50.129 796 HE2 LYS 100 HE2 LYS 100 -9.489 -32.639 -51.841 797 HE3 LYS 100 HE3 LYS 100 -8.360 -31.914 -52.985 798 HZ1 LYS 100 HZ1 LYS 100 -8.761 -34.594 -52.550 799 HZ2 LYS 100 HZ2 LYS 100 -7.278 -34.268 -51.807 800 HZ3 LYS 100 HZ3 LYS 100 -7.505 -33.894 -53.441 801 HA PRO 101 HA PRO 101 -4.354 -25.748 -52.750 802 HB2 PRO 101 HB2 PRO 101 -1.900 -26.428 -53.692 803 HB3 PRO 101 HB3 PRO 101 -2.212 -26.081 -51.987 804 HG2 PRO 101 HG2 PRO 101 -1.990 -28.726 -53.371 805 HG3 PRO 101 HG3 PRO 101 -1.322 -28.221 -51.809 806 HD2 PRO 101 HD2 PRO 101 -3.577 -29.704 -52.018 807 HD3 PRO 101 HD3 PRO 101 -3.325 -28.531 -50.711 808 H ARG 102 H ARG 102 -5.462 -25.269 -54.554 809 HA ARG 102 HA ARG 102 -4.859 -26.803 -56.997 810 HB2 ARG 102 HB2 ARG 102 -7.261 -26.810 -55.923 811 HB3 ARG 102 HB3 ARG 102 -7.390 -25.238 -56.701 812 HG2 ARG 102 HG2 ARG 102 -6.578 -27.701 -58.209 813 HG3 ARG 102 HG3 ARG 102 -8.267 -27.241 -57.983 814 HD2 ARG 102 HD2 ARG 102 -7.855 -26.207 -59.975 815 HD3 ARG 102 HD3 ARG 102 -7.380 -24.917 -58.872 816 HE ARG 102 HE ARG 102 -5.201 -26.638 -59.554 817 HH11 ARG 102 HH11 ARG 102 -7.097 -23.922 -60.625 818 HH12 ARG 102 HH12 ARG 102 -5.839 -23.272 -61.623 819 HH21 ARG 102 HH21 ARG 102 -3.537 -25.792 -60.865 820 HH22 ARG 102 HH22 ARG 102 -3.815 -24.336 -61.759 821 H ASP 103 H ASP 103 -3.146 -25.435 -57.585 822 HA ASP 103 HA ASP 103 -3.909 -23.163 -59.116 823 HB2 ASP 103 HB2 ASP 103 -2.865 -21.404 -57.915 824 HB3 ASP 103 HB3 ASP 103 -3.859 -22.259 -56.739 825 H MET 104 H MET 104 -2.090 -22.213 -60.278 826 HA MET 104 HA MET 104 0.089 -24.161 -60.580 827 HB2 MET 104 HB2 MET 104 -1.446 -23.570 -62.537 828 HB3 MET 104 HB3 MET 104 -0.648 -22.003 -62.549 829 HG2 MET 104 HG2 MET 104 1.532 -23.272 -62.773 830 HG3 MET 104 HG3 MET 104 0.549 -24.700 -63.091 831 HE1 MET 104 HE1 MET 104 2.387 -21.903 -64.277 832 HE2 MET 104 HE2 MET 104 2.770 -23.206 -65.402 833 HE3 MET 104 HE3 MET 104 2.011 -21.726 -65.991 Start of MODEL 20 1 H1 MET 1 H MET 1 0.124 -4.417 -1.478 2 HA MET 1 HA MET 1 0.292 -1.905 -2.775 3 HB2 MET 1 HB2 MET 1 1.840 -3.960 -2.991 4 HB3 MET 1 HB3 MET 1 0.670 -4.543 -4.166 5 HG2 MET 1 HG2 MET 1 2.210 -3.495 -5.505 6 HG3 MET 1 HG3 MET 1 1.004 -2.231 -5.279 7 HE1 MET 1 HE1 MET 1 4.239 -3.591 -4.994 8 HE2 MET 1 HE2 MET 1 5.205 -2.116 -5.014 9 HE3 MET 1 HE3 MET 1 4.953 -2.985 -3.499 10 H GLN 2 H GLN 2 -1.906 -1.219 -2.903 11 HA GLN 2 HA GLN 2 -3.535 -2.651 -4.889 12 HB2 GLN 2 HB2 GLN 2 -5.438 -1.345 -3.972 13 HB3 GLN 2 HB3 GLN 2 -4.672 -2.384 -2.779 14 HG2 GLN 2 HG2 GLN 2 -3.501 -0.493 -1.832 15 HG3 GLN 2 HG3 GLN 2 -4.168 0.567 -3.074 16 HE21 GLN 2 HE21 GLN 2 -4.396 0.174 -0.002 17 HE22 GLN 2 HE22 GLN 2 -6.092 0.356 0.278 18 H GLU 3 H GLU 3 -4.853 -1.280 -6.347 19 HA GLU 3 HA GLU 3 -3.663 1.331 -6.930 20 HB2 GLU 3 HB2 GLU 3 -3.521 0.789 -9.331 21 HB3 GLU 3 HB3 GLU 3 -2.457 -0.218 -8.359 22 HG2 GLU 3 HG2 GLU 3 -5.185 -1.175 -9.121 23 HG3 GLU 3 HG3 GLU 3 -3.834 -1.299 -10.247 24 H GLN 4 H GLN 4 -4.956 2.292 -8.921 25 HA GLN 4 HA GLN 4 -7.694 2.413 -8.047 26 HB2 GLN 4 HB2 GLN 4 -6.072 3.845 -10.126 27 HB3 GLN 4 HB3 GLN 4 -7.825 3.998 -10.109 28 HG2 GLN 4 HG2 GLN 4 -6.883 5.843 -8.925 29 HG3 GLN 4 HG3 GLN 4 -7.688 4.784 -7.768 30 HE21 GLN 4 HE21 GLN 4 -4.563 5.705 -9.085 31 HE22 GLN 4 HE22 GLN 4 -3.637 5.253 -7.698 32 H VAL 5 H VAL 5 -9.540 1.979 -9.325 33 HA VAL 5 HA VAL 5 -9.170 0.434 -11.771 34 HB VAL 5 HB VAL 5 -9.151 -1.237 -9.946 35 HG11 VAL 5 HG11 VAL 5 -10.893 -1.533 -8.440 36 HG12 VAL 5 HG12 VAL 5 -10.742 0.223 -8.523 37 HG13 VAL 5 HG13 VAL 5 -12.027 -0.596 -9.413 38 HG21 VAL 5 HG21 VAL 5 -9.973 -1.904 -12.111 39 HG22 VAL 5 HG22 VAL 5 -10.958 -2.668 -10.863 40 HG23 VAL 5 HG23 VAL 5 -11.576 -1.269 -11.740 41 H SER 6 H SER 6 -10.757 0.767 -13.221 42 HA SER 6 HA SER 6 -13.046 2.396 -12.349 43 HB2 SER 6 HB2 SER 6 -13.185 3.205 -14.639 44 HB3 SER 6 HB3 SER 6 -11.536 3.410 -14.048 45 HG SER 6 HG SER 6 -11.024 1.434 -15.147 46 H ASN 7 H ASN 7 -12.149 -0.339 -14.418 47 HA ASN 7 HA ASN 7 -14.880 -0.996 -15.023 48 HB2 ASN 7 HB2 ASN 7 -13.985 -2.864 -16.243 49 HB3 ASN 7 HB3 ASN 7 -12.952 -1.473 -16.557 50 HD21 ASN 7 HD21 ASN 7 -12.976 -4.674 -15.808 51 HD22 ASN 7 HD22 ASN 7 -11.388 -4.826 -15.144 52 H VAL 8 H VAL 8 -16.104 -2.681 -14.223 53 HA VAL 8 HA VAL 8 -15.583 -3.438 -11.514 54 HB VAL 8 HB VAL 8 -17.681 -4.689 -11.644 55 HG11 VAL 8 HG11 VAL 8 -17.983 -2.417 -11.131 56 HG12 VAL 8 HG12 VAL 8 -17.655 -1.912 -12.789 57 HG13 VAL 8 HG13 VAL 8 -19.156 -2.755 -12.404 58 HG21 VAL 8 HG21 VAL 8 -18.075 -5.669 -13.625 59 HG22 VAL 8 HG22 VAL 8 -18.838 -4.135 -14.044 60 HG23 VAL 8 HG23 VAL 8 -17.170 -4.449 -14.523 61 H ARG 9 H ARG 9 -16.285 -5.950 -11.117 62 HA ARG 9 HA ARG 9 -14.574 -7.613 -12.833 63 HB2 ARG 9 HB2 ARG 9 -14.573 -7.600 -9.809 64 HB3 ARG 9 HB3 ARG 9 -13.713 -8.758 -10.815 65 HG2 ARG 9 HG2 ARG 9 -12.278 -7.050 -11.673 66 HG3 ARG 9 HG3 ARG 9 -13.230 -5.790 -10.885 67 HD2 ARG 9 HD2 ARG 9 -11.247 -6.177 -9.589 68 HD3 ARG 9 HD3 ARG 9 -12.636 -6.791 -8.692 69 HE ARG 9 HE ARG 9 -11.308 -8.776 -10.295 70 HH11 ARG 9 HH11 ARG 9 -11.397 -7.161 -7.213 71 HH12 ARG 9 HH12 ARG 9 -10.607 -8.449 -6.368 72 HH21 ARG 9 HH21 ARG 9 -10.265 -10.480 -9.194 73 HH22 ARG 9 HH22 ARG 9 -9.961 -10.336 -7.495 74 H ALA 10 H ALA 10 -15.221 -9.734 -13.092 75 HA ALA 10 HA ALA 10 -17.942 -10.319 -12.159 76 HB1 ALA 10 HB1 ALA 10 -18.190 -10.716 -14.348 77 HB2 ALA 10 HB2 ALA 10 -16.453 -10.878 -14.616 78 HB3 ALA 10 HB3 ALA 10 -17.383 -12.247 -14.005 79 H ARG 11 H ARG 11 -18.189 -11.699 -10.540 80 HA ARG 11 HA ARG 11 -15.995 -13.527 -9.878 81 HB2 ARG 11 HB2 ARG 11 -17.150 -11.875 -8.210 82 HB3 ARG 11 HB3 ARG 11 -18.404 -13.106 -8.146 83 HG2 ARG 11 HG2 ARG 11 -16.735 -14.756 -7.440 84 HG3 ARG 11 HG3 ARG 11 -15.495 -13.502 -7.477 85 HD2 ARG 11 HD2 ARG 11 -16.386 -12.391 -5.644 86 HD3 ARG 11 HD3 ARG 11 -17.975 -13.127 -5.848 87 HE ARG 11 HE ARG 11 -16.096 -15.131 -5.260 88 HH11 ARG 11 HH11 ARG 11 -17.715 -12.438 -3.759 89 HH12 ARG 11 HH12 ARG 11 -17.646 -13.117 -2.167 90 HH21 ARG 11 HH21 ARG 11 -16.000 -16.035 -3.168 91 HH22 ARG 11 HH22 ARG 11 -16.670 -15.162 -1.831 92 H ILE 12 H ILE 12 -16.215 -15.361 -11.028 93 HA ILE 12 HA ILE 12 -18.867 -16.615 -11.186 94 HB ILE 12 HB ILE 12 -16.357 -17.271 -12.734 95 HG12 ILE 12 HG12 ILE 12 -18.873 -15.983 -13.787 96 HG13 ILE 12 HG13 ILE 12 -17.516 -15.035 -13.189 97 HG21 ILE 12 HG21 ILE 12 -19.106 -18.437 -12.687 98 HG22 ILE 12 HG22 ILE 12 -18.170 -18.453 -14.180 99 HG23 ILE 12 HG23 ILE 12 -17.543 -19.251 -12.739 100 HD11 ILE 12 HD11 ILE 12 -17.622 -16.843 -15.573 101 HD12 ILE 12 HD12 ILE 12 -17.232 -15.124 -15.504 102 HD13 ILE 12 HD13 ILE 12 -16.097 -16.312 -14.865 103 H TYR 13 H TYR 13 -19.322 -18.414 -10.087 104 HA TYR 13 HA TYR 13 -17.179 -20.165 -9.177 105 HB2 TYR 13 HB2 TYR 13 -18.073 -20.173 -6.851 106 HB3 TYR 13 HB3 TYR 13 -17.363 -18.631 -7.320 107 HD1 TYR 13 HD1 TYR 13 -18.908 -16.741 -7.979 108 HD2 TYR 13 HD2 TYR 13 -20.312 -20.310 -6.133 109 HE1 TYR 13 HE1 TYR 13 -20.987 -15.589 -7.345 110 HE2 TYR 13 HE2 TYR 13 -22.395 -19.166 -5.496 111 HH TYR 13 HH TYR 13 -22.776 -15.778 -5.726 112 H LYS 14 H LYS 14 -17.858 -22.267 -8.675 113 HA LYS 14 HA LYS 14 -20.628 -22.881 -9.475 114 HB2 LYS 14 HB2 LYS 14 -19.655 -25.145 -10.125 115 HB3 LYS 14 HB3 LYS 14 -19.241 -23.783 -11.156 116 HG2 LYS 14 HG2 LYS 14 -17.049 -23.756 -10.475 117 HG3 LYS 14 HG3 LYS 14 -17.408 -24.522 -8.926 118 HD2 LYS 14 HD2 LYS 14 -17.900 -26.076 -11.416 119 HD3 LYS 14 HD3 LYS 14 -16.230 -25.844 -10.894 120 HE2 LYS 14 HE2 LYS 14 -16.737 -27.781 -9.786 121 HE3 LYS 14 HE3 LYS 14 -17.202 -26.596 -8.568 122 HZ1 LYS 14 HZ1 LYS 14 -19.255 -27.390 -10.477 123 HZ2 LYS 14 HZ2 LYS 14 -19.386 -27.052 -8.825 124 HZ3 LYS 14 HZ3 LYS 14 -18.795 -28.552 -9.336 125 HA PRO 15 HA PRO 15 -20.393 -24.187 -5.101 126 HB2 PRO 15 HB2 PRO 15 -23.043 -23.822 -4.639 127 HB3 PRO 15 HB3 PRO 15 -21.864 -22.507 -4.560 128 HG2 PRO 15 HG2 PRO 15 -23.730 -23.246 -6.780 129 HG3 PRO 15 HG3 PRO 15 -23.330 -21.640 -6.141 130 HD2 PRO 15 HD2 PRO 15 -22.228 -22.619 -8.413 131 HD3 PRO 15 HD3 PRO 15 -21.355 -21.522 -7.324 132 H ALA 16 H ALA 16 -21.643 -25.885 -3.936 133 HA ALA 16 HA ALA 16 -21.761 -28.262 -5.402 134 HB1 ALA 16 HB1 ALA 16 -23.331 -28.749 -3.190 135 HB2 ALA 16 HB2 ALA 16 -21.579 -28.925 -3.281 136 HB3 ALA 16 HB3 ALA 16 -22.283 -27.430 -2.666 137 H LYS 17 H LYS 17 -23.556 -29.625 -5.911 138 HA LYS 17 HA LYS 17 -25.775 -28.156 -7.018 139 HB2 LYS 17 HB2 LYS 17 -24.610 -30.123 -8.124 140 HB3 LYS 17 HB3 LYS 17 -25.426 -31.152 -6.955 141 HG2 LYS 17 HG2 LYS 17 -27.581 -30.471 -7.795 142 HG3 LYS 17 HG3 LYS 17 -26.819 -29.320 -8.896 143 HD2 LYS 17 HD2 LYS 17 -27.135 -31.073 -10.329 144 HD3 LYS 17 HD3 LYS 17 -25.538 -31.489 -9.703 145 HE2 LYS 17 HE2 LYS 17 -26.712 -33.489 -9.540 146 HE3 LYS 17 HE3 LYS 17 -26.831 -32.819 -7.913 147 HZ1 LYS 17 HZ1 LYS 17 -28.911 -33.620 -9.514 148 HZ2 LYS 17 HZ2 LYS 17 -28.972 -31.929 -9.565 149 HZ3 LYS 17 HZ3 LYS 17 -29.029 -32.733 -8.078 150 H SER 18 H SER 18 -27.906 -28.243 -6.409 151 HA SER 18 HA SER 18 -28.747 -29.959 -4.233 152 HB2 SER 18 HB2 SER 18 -29.009 -26.969 -3.886 153 HB3 SER 18 HB3 SER 18 -29.373 -28.229 -2.707 154 HG SER 18 HG SER 18 -27.146 -28.709 -2.640 155 H THR 19 H THR 19 -31.014 -30.072 -3.995 156 HA THR 19 HA THR 19 -32.569 -28.705 -6.088 157 HB THR 19 HB THR 19 -32.319 -30.907 -6.942 158 HG1 THR 19 HG1 THR 19 -34.795 -31.113 -5.588 159 HG21 THR 19 HG21 THR 19 -32.400 -31.651 -4.123 160 HG22 THR 19 HG22 THR 19 -31.667 -32.487 -5.493 161 HG23 THR 19 HG23 THR 19 -33.382 -32.704 -5.142 162 H MET 20 H MET 20 -32.994 -27.278 -4.197 163 HA MET 20 HA MET 20 -34.500 -28.241 -1.984 164 HB2 MET 20 HB2 MET 20 -33.114 -26.036 -2.273 165 HB3 MET 20 HB3 MET 20 -34.625 -25.392 -2.902 166 HG2 MET 20 HG2 MET 20 -35.681 -26.260 -0.745 167 HG3 MET 20 HG3 MET 20 -34.030 -26.421 -0.154 168 HE1 MET 20 HE1 MET 20 -35.227 -23.215 1.717 169 HE2 MET 20 HE2 MET 20 -36.237 -24.605 1.317 170 HE3 MET 20 HE3 MET 20 -34.578 -24.849 1.869 171 H GLN 21 H GLN 21 -35.410 -26.402 -4.897 172 HA GLN 21 HA GLN 21 -38.033 -27.652 -4.844 173 HB2 GLN 21 HB2 GLN 21 -37.951 -25.374 -3.525 174 HB3 GLN 21 HB3 GLN 21 -37.990 -24.676 -5.140 175 HG2 GLN 21 HG2 GLN 21 -40.219 -24.746 -4.419 176 HG3 GLN 21 HG3 GLN 21 -40.045 -26.079 -5.560 177 HE21 GLN 21 HE21 GLN 21 -41.934 -26.974 -4.574 178 HE22 GLN 21 HE22 GLN 21 -41.808 -27.849 -3.090 179 H SER 22 H SER 22 -39.055 -27.702 -6.841 180 HA SER 22 HA SER 22 -37.834 -26.320 -9.092 181 HB2 SER 22 HB2 SER 22 -37.758 -29.292 -8.696 182 HB3 SER 22 HB3 SER 22 -37.883 -28.634 -10.327 183 HG SER 22 HG SER 22 -35.772 -28.588 -10.103 184 H GLY 23 H GLY 23 -39.091 -26.733 -11.139 185 HA2 GLY 23 HA2 GLY 23 -41.313 -27.789 -11.839 186 HA3 GLY 23 HA3 GLY 23 -41.951 -26.918 -10.453 187 H HIS 24 H HIS 24 -41.068 -26.744 -13.749 188 HA HIS 24 HA HIS 24 -41.315 -25.135 -15.339 189 HB2 HIS 24 HB2 HIS 24 -43.544 -24.953 -13.918 190 HB3 HIS 24 HB3 HIS 24 -42.867 -23.388 -13.478 191 HD1 HIS 24 HD1 HIS 24 -43.527 -25.316 -16.699 192 HD2 HIS 24 HD2 HIS 24 -43.598 -21.443 -15.197 193 HE1 HIS 24 HE1 HIS 24 -44.374 -23.881 -18.582 194 H SER 25 H SER 25 -39.047 -25.024 -13.603 195 HA SER 25 HA SER 25 -38.497 -22.129 -13.677 196 HB2 SER 25 HB2 SER 25 -37.360 -22.199 -11.655 197 HB3 SER 25 HB3 SER 25 -38.653 -23.361 -11.361 198 HG SER 25 HG SER 25 -37.229 -25.022 -11.702 199 H LYS 26 H LYS 26 -36.248 -21.556 -14.049 200 HA LYS 26 HA LYS 26 -35.076 -23.237 -16.084 201 HB2 LYS 26 HB2 LYS 26 -34.052 -20.623 -14.963 202 HB3 LYS 26 HB3 LYS 26 -33.545 -21.394 -16.460 203 HG2 LYS 26 HG2 LYS 26 -35.945 -21.151 -17.233 204 HG3 LYS 26 HG3 LYS 26 -36.178 -20.093 -15.839 205 HD2 LYS 26 HD2 LYS 26 -34.143 -19.694 -18.033 206 HD3 LYS 26 HD3 LYS 26 -35.669 -18.822 -17.875 207 HE2 LYS 26 HE2 LYS 26 -34.923 -17.942 -15.707 208 HE3 LYS 26 HE3 LYS 26 -33.393 -18.797 -15.893 209 HZ1 LYS 26 HZ1 LYS 26 -34.288 -16.893 -17.956 210 HZ2 LYS 26 HZ2 LYS 26 -32.718 -17.396 -17.580 211 HZ3 LYS 26 HZ3 LYS 26 -33.533 -16.328 -16.552 212 H LEU 27 H LEU 27 -33.093 -24.253 -16.014 213 HA LEU 27 HA LEU 27 -32.118 -24.882 -13.349 214 HB2 LEU 27 HB2 LEU 27 -31.658 -26.015 -16.082 215 HB3 LEU 27 HB3 LEU 27 -30.595 -26.438 -14.742 216 HG LEU 27 HG LEU 27 -33.575 -26.872 -14.684 217 HD11 LEU 27 HD11 LEU 27 -32.291 -28.108 -16.528 218 HD12 LEU 27 HD12 LEU 27 -33.296 -29.059 -15.434 219 HD13 LEU 27 HD13 LEU 27 -31.547 -29.015 -15.210 220 HD21 LEU 27 HD21 LEU 27 -32.623 -28.659 -12.999 221 HD22 LEU 27 HD22 LEU 27 -32.912 -26.992 -12.498 222 HD23 LEU 27 HD23 LEU 27 -31.279 -27.520 -12.906 223 H LYS 28 H LYS 28 -29.882 -24.777 -12.777 224 HA LYS 28 HA LYS 28 -28.149 -23.119 -14.432 225 HB2 LYS 28 HB2 LYS 28 -27.628 -21.610 -12.536 226 HB3 LYS 28 HB3 LYS 28 -29.292 -21.464 -13.086 227 HG2 LYS 28 HG2 LYS 28 -28.678 -23.309 -10.832 228 HG3 LYS 28 HG3 LYS 28 -28.719 -21.570 -10.536 229 HD2 LYS 28 HD2 LYS 28 -30.995 -21.805 -11.909 230 HD3 LYS 28 HD3 LYS 28 -30.914 -23.436 -11.238 231 HE2 LYS 28 HE2 LYS 28 -30.373 -22.093 -9.019 232 HE3 LYS 28 HE3 LYS 28 -31.255 -20.822 -9.864 233 HZ1 LYS 28 HZ1 LYS 28 -32.231 -23.264 -8.683 234 HZ2 LYS 28 HZ2 LYS 28 -32.841 -22.965 -10.232 235 HZ3 LYS 28 HZ3 LYS 28 -33.046 -21.816 -9.006 236 H ALA 29 H ALA 29 -25.974 -23.450 -14.075 237 HA ALA 29 HA ALA 29 -25.293 -25.488 -12.057 238 HB1 ALA 29 HB1 ALA 29 -25.253 -26.306 -14.424 239 HB2 ALA 29 HB2 ALA 29 -23.936 -25.171 -14.726 240 HB3 ALA 29 HB3 ALA 29 -23.727 -26.474 -13.555 241 H TRP 30 H TRP 30 -24.244 -22.626 -13.821 242 HA TRP 30 HA TRP 30 -22.036 -22.301 -11.901 243 HB2 TRP 30 HB2 TRP 30 -22.404 -21.286 -14.717 244 HB3 TRP 30 HB3 TRP 30 -21.178 -20.632 -13.634 245 HD1 TRP 30 HD1 TRP 30 -22.104 -23.893 -15.459 246 HE1 TRP 30 HE1 TRP 30 -19.980 -25.330 -15.675 247 HE3 TRP 30 HE3 TRP 30 -18.909 -21.041 -12.668 248 HZ2 TRP 30 HZ2 TRP 30 -17.303 -25.263 -14.780 249 HZ3 TRP 30 HZ3 TRP 30 -16.584 -21.798 -12.396 250 HH2 TRP 30 HH2 TRP 30 -15.800 -23.865 -13.431 251 H LYS 31 H LYS 31 -21.664 -20.242 -10.973 252 HA LYS 31 HA LYS 31 -24.032 -18.484 -10.985 253 HB2 LYS 31 HB2 LYS 31 -23.267 -19.876 -8.848 254 HB3 LYS 31 HB3 LYS 31 -22.172 -18.513 -8.656 255 HG2 LYS 31 HG2 LYS 31 -24.152 -18.118 -7.367 256 HG3 LYS 31 HG3 LYS 31 -24.119 -16.990 -8.724 257 HD2 LYS 31 HD2 LYS 31 -26.222 -17.667 -9.101 258 HD3 LYS 31 HD3 LYS 31 -25.482 -19.124 -9.769 259 HE2 LYS 31 HE2 LYS 31 -25.940 -18.992 -6.833 260 HE3 LYS 31 HE3 LYS 31 -27.334 -19.238 -7.884 261 HZ1 LYS 31 HZ1 LYS 31 -25.191 -21.047 -7.217 262 HZ2 LYS 31 HZ2 LYS 31 -25.553 -20.999 -8.869 263 HZ3 LYS 31 HZ3 LYS 31 -26.763 -21.380 -7.748 264 H LEU 32 H LEU 32 -23.725 -16.281 -11.072 265 HA LEU 32 HA LEU 32 -20.953 -15.339 -11.377 266 HB2 LEU 32 HB2 LEU 32 -21.985 -15.586 -13.580 267 HB3 LEU 32 HB3 LEU 32 -23.320 -14.553 -13.072 268 HG LEU 32 HG LEU 32 -21.472 -13.554 -14.559 269 HD11 LEU 32 HD11 LEU 32 -22.546 -11.713 -13.962 270 HD12 LEU 32 HD12 LEU 32 -21.555 -11.615 -12.506 271 HD13 LEU 32 HD13 LEU 32 -23.088 -12.488 -12.472 272 HD21 LEU 32 HD21 LEU 32 -19.769 -14.528 -12.750 273 HD22 LEU 32 HD22 LEU 32 -20.025 -12.928 -12.053 274 HD23 LEU 32 HD23 LEU 32 -19.424 -13.086 -13.704 275 H GLU 33 H GLU 33 -20.457 -13.553 -10.260 276 HA GLU 33 HA GLU 33 -22.617 -11.810 -9.319 277 HB2 GLU 33 HB2 GLU 33 -22.275 -13.254 -7.448 278 HB3 GLU 33 HB3 GLU 33 -20.527 -13.129 -7.591 279 HG2 GLU 33 HG2 GLU 33 -21.285 -11.822 -5.724 280 HG3 GLU 33 HG3 GLU 33 -20.666 -10.754 -6.981 281 H PHE 34 H PHE 34 -22.096 -9.988 -10.369 282 HA PHE 34 HA PHE 34 -19.336 -9.181 -10.697 283 HB2 PHE 34 HB2 PHE 34 -20.276 -7.283 -11.957 284 HB3 PHE 34 HB3 PHE 34 -20.909 -8.822 -12.533 285 HD1 PHE 34 HD2 PHE 34 -21.694 -5.808 -10.562 286 HD2 PHE 34 HD1 PHE 34 -23.220 -9.318 -12.424 287 HE1 PHE 34 HE2 PHE 34 -23.986 -4.974 -10.245 288 HE2 PHE 34 HE1 PHE 34 -25.515 -8.490 -12.110 289 HZ PHE 34 HZ PHE 34 -25.901 -6.316 -11.019 290 H GLU 35 H GLU 35 -18.325 -7.471 -9.719 291 HA GLU 35 HA GLU 35 -19.695 -6.367 -7.365 292 HB2 GLU 35 HB2 GLU 35 -16.737 -6.553 -7.965 293 HB3 GLU 35 HB3 GLU 35 -17.440 -5.894 -6.494 294 HG2 GLU 35 HG2 GLU 35 -17.945 -8.714 -7.383 295 HG3 GLU 35 HG3 GLU 35 -16.554 -8.267 -6.396 296 HA PRO 36 HA PRO 36 -19.690 -2.685 -10.019 297 HB2 PRO 36 HB2 PRO 36 -21.665 -1.435 -8.638 298 HB3 PRO 36 HB3 PRO 36 -21.983 -2.667 -9.865 299 HG2 PRO 36 HG2 PRO 36 -21.915 -2.936 -6.884 300 HG3 PRO 36 HG3 PRO 36 -23.070 -3.620 -8.043 301 HD2 PRO 36 HD2 PRO 36 -21.047 -5.069 -6.974 302 HD3 PRO 36 HD3 PRO 36 -21.661 -5.353 -8.616 303 H SER 37 H SER 37 -18.761 -0.699 -9.728 304 HA SER 37 HA SER 37 -17.236 -0.301 -7.338 305 HB2 SER 37 HB2 SER 37 -16.379 0.322 -9.575 306 HB3 SER 37 HB3 SER 37 -17.630 1.559 -9.696 307 HG SER 37 HG SER 37 -15.664 2.442 -8.963 308 H CYS 38 H CYS 38 -19.948 1.403 -8.874 309 HA CYS 38 HA CYS 38 -20.534 2.630 -6.264 310 HB2 CYS 38 HB2 CYS 38 -21.211 4.680 -7.354 311 HB3 CYS 38 HB3 CYS 38 -19.570 4.287 -7.851 312 HG CYS 38 HG CYS 38 -22.427 4.129 -9.696 313 H THR 39 H THR 39 -22.817 3.310 -6.033 314 HA THR 39 HA THR 39 -24.616 1.528 -7.541 315 HB THR 39 HB THR 39 -24.504 0.652 -5.330 316 HG1 THR 39 HG1 THR 39 -26.605 0.518 -5.593 317 HG21 THR 39 HG21 THR 39 -25.229 2.260 -3.408 318 HG22 THR 39 HG22 THR 39 -24.677 3.524 -4.508 319 HG23 THR 39 HG23 THR 39 -23.558 2.271 -3.971 320 H GLN 40 H GLN 40 -26.800 2.267 -7.825 321 HA GLN 40 HA GLN 40 -27.449 5.010 -7.209 322 HB2 GLN 40 HB2 GLN 40 -26.029 4.869 -9.413 323 HB3 GLN 40 HB3 GLN 40 -27.543 4.322 -10.120 324 HG2 GLN 40 HG2 GLN 40 -27.575 6.797 -8.483 325 HG3 GLN 40 HG3 GLN 40 -26.858 6.865 -10.092 326 HE21 GLN 40 HE21 GLN 40 -29.433 7.859 -8.748 327 HE22 GLN 40 HE22 GLN 40 -30.663 7.436 -9.886 328 H TYR 41 H TYR 41 -29.659 5.565 -7.805 329 HA TYR 41 HA TYR 41 -31.475 3.515 -7.212 330 HB2 TYR 41 HB2 TYR 41 -31.745 6.323 -8.216 331 HB3 TYR 41 HB3 TYR 41 -33.162 5.279 -8.180 332 HD1 TYR 41 HD1 TYR 41 -33.033 3.813 -5.759 333 HD2 TYR 41 HD2 TYR 41 -31.789 7.820 -6.467 334 HE1 TYR 41 HE1 TYR 41 -33.356 4.329 -3.376 335 HE2 TYR 41 HE2 TYR 41 -32.107 8.346 -4.085 336 HH TYR 41 HH TYR 41 -33.869 6.706 -2.061 337 H THR 42 H THR 42 -32.602 2.115 -8.423 338 HA THR 42 HA THR 42 -31.847 1.628 -11.108 339 HB THR 42 HB THR 42 -33.774 -0.005 -11.093 340 HG1 THR 42 HG1 THR 42 -33.967 0.703 -8.343 341 HG21 THR 42 HG21 THR 42 -32.670 -1.151 -8.878 342 HG22 THR 42 HG22 THR 42 -31.418 0.002 -9.342 343 HG23 THR 42 HG23 THR 42 -31.971 -1.213 -10.496 344 H GLU 43 H GLU 43 -32.522 2.593 -12.899 345 HA GLU 43 HA GLU 43 -34.497 4.596 -12.933 346 HB2 GLU 43 HB2 GLU 43 -32.884 3.167 -14.986 347 HB3 GLU 43 HB3 GLU 43 -34.303 4.048 -15.537 348 HG2 GLU 43 HG2 GLU 43 -33.339 6.022 -14.206 349 HG3 GLU 43 HG3 GLU 43 -31.836 5.100 -14.212 350 HA PRO 44 HA PRO 44 -38.297 2.511 -13.606 351 HB2 PRO 44 HB2 PRO 44 -39.522 4.099 -15.435 352 HB3 PRO 44 HB3 PRO 44 -39.297 4.575 -13.748 353 HG2 PRO 44 HG2 PRO 44 -37.693 5.330 -16.161 354 HG3 PRO 44 HG3 PRO 44 -38.237 6.349 -14.816 355 HD2 PRO 44 HD2 PRO 44 -35.714 5.381 -14.982 356 HD3 PRO 44 HD3 PRO 44 -36.535 5.647 -13.430 357 H LEU 45 H LEU 45 -36.243 3.129 -16.344 358 HA LEU 45 HA LEU 45 -37.755 1.396 -18.112 359 HB2 LEU 45 HB2 LEU 45 -35.351 3.133 -18.363 360 HB3 LEU 45 HB3 LEU 45 -35.564 1.820 -19.521 361 HG LEU 45 HG LEU 45 -37.895 2.849 -19.925 362 HD11 LEU 45 HD11 LEU 45 -36.909 4.619 -17.945 363 HD12 LEU 45 HD12 LEU 45 -38.448 4.673 -18.801 364 HD13 LEU 45 HD13 LEU 45 -37.045 5.515 -19.458 365 HD21 LEU 45 HD21 LEU 45 -36.499 2.990 -21.736 366 HD22 LEU 45 HD22 LEU 45 -35.247 3.855 -20.845 367 HD23 LEU 45 HD23 LEU 45 -36.708 4.701 -21.360 368 H MET 46 H MET 46 -37.639 -0.717 -17.685 369 HA MET 46 HA MET 46 -34.967 -1.908 -17.395 370 HB2 MET 46 HB2 MET 46 -37.433 -2.572 -15.784 371 HB3 MET 46 HB3 MET 46 -35.995 -3.584 -15.827 372 HG2 MET 46 HG2 MET 46 -34.778 -1.391 -15.119 373 HG3 MET 46 HG3 MET 46 -36.389 -0.900 -14.597 374 HE1 MET 46 HE1 MET 46 -33.468 -3.223 -12.226 375 HE2 MET 46 HE2 MET 46 -33.289 -3.029 -13.970 376 HE3 MET 46 HE3 MET 46 -33.442 -1.609 -12.935 377 H ASN 47 H ASN 47 -35.112 -4.370 -17.731 378 HA ASN 47 HA ASN 47 -36.113 -4.839 -20.327 379 HB2 ASN 47 HB2 ASN 47 -34.780 -6.470 -18.225 380 HB3 ASN 47 HB3 ASN 47 -35.639 -7.338 -19.494 381 HD21 ASN 47 HD21 ASN 47 -35.187 -6.092 -21.733 382 HD22 ASN 47 HD22 ASN 47 -33.501 -5.945 -22.081 383 H TRP 48 H TRP 48 -37.018 -6.552 -17.331 384 HA TRP 48 HA TRP 48 -39.827 -6.324 -17.973 385 HB2 TRP 48 HB2 TRP 48 -38.784 -8.359 -19.237 386 HB3 TRP 48 HB3 TRP 48 -38.796 -9.123 -17.650 387 HD1 TRP 48 HD1 TRP 48 -40.915 -10.458 -17.157 388 HE1 TRP 48 HE1 TRP 48 -43.348 -10.445 -17.999 389 HE3 TRP 48 HE3 TRP 48 -40.666 -6.433 -20.299 390 HZ2 TRP 48 HZ2 TRP 48 -44.949 -8.929 -19.762 391 HZ3 TRP 48 HZ3 TRP 48 -42.691 -5.767 -21.526 392 HH2 TRP 48 HH2 TRP 48 -44.788 -6.990 -21.262 393 H THR 49 H THR 49 -41.207 -6.995 -16.247 394 HA THR 49 HA THR 49 -41.765 -6.916 -14.030 395 HB THR 49 HB THR 49 -40.326 -8.638 -12.647 396 HG1 THR 49 HG1 THR 49 -38.878 -9.677 -13.781 397 HG21 THR 49 HG21 THR 49 -42.401 -9.049 -14.727 398 HG22 THR 49 HG22 THR 49 -42.449 -9.386 -12.996 399 HG23 THR 49 HG23 THR 49 -41.606 -10.486 -14.086 400 H GLY 50 H GLY 50 -40.850 -4.683 -13.986 401 HA2 GLY 50 HA2 GLY 50 -38.934 -4.504 -11.800 402 HA3 GLY 50 HA3 GLY 50 -38.446 -3.755 -13.313 403 H SER 51 H SER 51 -41.777 -3.825 -12.276 404 HA SER 51 HA SER 51 -41.951 -0.973 -12.433 405 HB2 SER 51 HB2 SER 51 -44.335 -1.490 -11.518 406 HB3 SER 51 HB3 SER 51 -43.907 -2.036 -13.140 407 HG SER 51 HG SER 51 -44.908 -3.557 -11.445 408 H HIS 52 H HIS 52 -42.351 -3.318 -9.784 409 HA HIS 52 HA HIS 52 -41.454 -1.261 -7.906 410 HB2 HIS 52 HB2 HIS 52 -44.010 -1.406 -8.004 411 HB3 HIS 52 HB3 HIS 52 -43.834 -2.994 -7.261 412 HD1 HIS 52 HD1 HIS 52 -45.125 -2.072 -5.174 413 HD2 HIS 52 HD2 HIS 52 -41.475 -0.234 -5.924 414 HE1 HIS 52 HE1 HIS 52 -44.569 -0.801 -3.077 415 H ASP 53 H ASP 53 -39.732 -2.084 -6.935 416 HA ASP 53 HA ASP 53 -39.856 -4.593 -5.561 417 HB2 ASP 53 HB2 ASP 53 -39.250 -5.033 -8.089 418 HB3 ASP 53 HB3 ASP 53 -37.652 -4.496 -7.582 419 H THR 54 H THR 54 -39.018 -3.974 -3.685 420 HA THR 54 HA THR 54 -37.275 -1.814 -3.306 421 HB THR 54 HB THR 54 -37.612 -4.179 -1.453 422 HG1 THR 54 HG1 THR 54 -39.642 -3.326 -1.868 423 HG21 THR 54 HG21 THR 54 -36.343 -3.057 -0.003 424 HG22 THR 54 HG22 THR 54 -37.327 -1.605 -0.199 425 HG23 THR 54 HG23 THR 54 -35.973 -1.907 -1.287 426 H LYS 55 H LYS 55 -36.642 -5.289 -3.562 427 HA LYS 55 HA LYS 55 -33.879 -5.161 -3.000 428 HB2 LYS 55 HB2 LYS 55 -35.714 -7.159 -4.229 429 HB3 LYS 55 HB3 LYS 55 -33.988 -7.369 -4.490 430 HG2 LYS 55 HG2 LYS 55 -34.569 -8.662 -2.597 431 HG3 LYS 55 HG3 LYS 55 -33.692 -7.250 -2.004 432 HD2 LYS 55 HD2 LYS 55 -35.588 -7.619 -0.581 433 HD3 LYS 55 HD3 LYS 55 -35.885 -6.165 -1.537 434 HE2 LYS 55 HE2 LYS 55 -37.865 -7.627 -1.388 435 HE3 LYS 55 HE3 LYS 55 -37.310 -7.401 -3.046 436 HZ1 LYS 55 HZ1 LYS 55 -37.905 -9.726 -2.467 437 HZ2 LYS 55 HZ2 LYS 55 -36.607 -9.755 -1.382 438 HZ3 LYS 55 HZ3 LYS 55 -36.322 -9.548 -3.037 439 H GLN 56 H GLN 56 -32.153 -5.714 -4.596 440 HA GLN 56 HA GLN 56 -32.664 -4.591 -7.259 441 HB2 GLN 56 HB2 GLN 56 -30.440 -3.798 -5.377 442 HB3 GLN 56 HB3 GLN 56 -30.426 -3.434 -7.098 443 HG2 GLN 56 HG2 GLN 56 -32.353 -2.047 -6.896 444 HG3 GLN 56 HG3 GLN 56 -32.606 -2.552 -5.226 445 HE21 GLN 56 HE21 GLN 56 -31.742 -1.361 -3.668 446 HE22 GLN 56 HE22 GLN 56 -30.568 -0.113 -3.890 447 H GLN 57 H GLN 57 -32.109 -6.042 -8.730 448 HA GLN 57 HA GLN 57 -30.766 -8.418 -8.245 449 HB2 GLN 57 HB2 GLN 57 -32.106 -7.367 -10.368 450 HB3 GLN 57 HB3 GLN 57 -30.453 -7.337 -10.969 451 HG2 GLN 57 HG2 GLN 57 -30.401 -9.803 -10.130 452 HG3 GLN 57 HG3 GLN 57 -32.156 -9.666 -10.225 453 HE21 GLN 57 HE21 GLN 57 -29.448 -8.539 -12.226 454 HE22 GLN 57 HE22 GLN 57 -30.048 -9.194 -13.707 455 H VAL 58 H VAL 58 -28.769 -8.564 -7.448 456 HA VAL 58 HA VAL 58 -26.666 -6.873 -8.634 457 HB VAL 58 HB VAL 58 -25.385 -7.352 -6.516 458 HG11 VAL 58 HG11 VAL 58 -27.188 -5.386 -7.102 459 HG12 VAL 58 HG12 VAL 58 -27.760 -5.959 -5.533 460 HG13 VAL 58 HG13 VAL 58 -26.102 -5.388 -5.713 461 HG21 VAL 58 HG21 VAL 58 -26.569 -8.131 -4.574 462 HG22 VAL 58 HG22 VAL 58 -28.077 -8.238 -5.483 463 HG23 VAL 58 HG23 VAL 58 -26.742 -9.327 -5.858 464 H CYS 59 H CYS 59 -27.631 -10.112 -7.760 465 HA CYS 59 HA CYS 59 -25.221 -11.140 -9.109 466 HB2 CYS 59 HB2 CYS 59 -25.175 -13.023 -7.626 467 HB3 CYS 59 HB3 CYS 59 -25.276 -11.574 -6.634 468 HG CYS 59 HG CYS 59 -26.840 -13.811 -5.663 469 H LEU 60 H LEU 60 -25.482 -13.119 -10.290 470 HA LEU 60 HA LEU 60 -28.199 -14.009 -10.832 471 HB2 LEU 60 HB2 LEU 60 -28.057 -13.686 -13.203 472 HB3 LEU 60 HB3 LEU 60 -27.789 -12.143 -12.395 473 HG LEU 60 HG LEU 60 -25.381 -13.700 -13.140 474 HD11 LEU 60 HD11 LEU 60 -25.517 -12.662 -15.445 475 HD12 LEU 60 HD12 LEU 60 -27.236 -12.429 -15.134 476 HD13 LEU 60 HD13 LEU 60 -26.556 -14.056 -15.150 477 HD21 LEU 60 HD21 LEU 60 -24.617 -11.402 -13.734 478 HD22 LEU 60 HD22 LEU 60 -25.094 -11.592 -12.046 479 HD23 LEU 60 HD23 LEU 60 -26.180 -10.795 -13.186 480 H SER 61 H SER 61 -28.163 -15.886 -12.423 481 HA SER 61 HA SER 61 -25.749 -17.508 -11.940 482 HB2 SER 61 HB2 SER 61 -27.266 -19.489 -12.032 483 HB3 SER 61 HB3 SER 61 -27.625 -18.401 -10.692 484 HG SER 61 HG SER 61 -29.344 -17.564 -11.892 485 H PHE 62 H PHE 62 -25.508 -19.326 -13.561 486 HA PHE 62 HA PHE 62 -26.513 -18.666 -16.221 487 HB2 PHE 62 HB2 PHE 62 -23.631 -18.609 -15.391 488 HB3 PHE 62 HB3 PHE 62 -24.063 -19.060 -17.037 489 HD1 PHE 62 HD1 PHE 62 -25.623 -17.410 -18.296 490 HD2 PHE 62 HD2 PHE 62 -23.336 -16.387 -14.855 491 HE1 PHE 62 HE1 PHE 62 -25.773 -15.031 -18.907 492 HE2 PHE 62 HE2 PHE 62 -23.484 -14.007 -15.459 493 HZ PHE 62 HZ PHE 62 -24.704 -13.326 -17.488 494 H THR 63 H THR 63 -27.033 -20.436 -17.340 495 HA THR 63 HA THR 63 -27.009 -22.985 -16.230 496 HB THR 63 HB THR 63 -27.019 -22.543 -19.208 497 HG1 THR 63 HG1 THR 63 -29.267 -22.065 -18.960 498 HG21 THR 63 HG21 THR 63 -28.829 -24.351 -17.656 499 HG22 THR 63 HG22 THR 63 -27.170 -24.845 -17.992 500 HG23 THR 63 HG23 THR 63 -28.272 -24.489 -19.322 501 H THR 64 H THR 64 -24.805 -21.555 -18.618 502 HA THR 64 HA THR 64 -22.879 -23.691 -17.987 503 HB THR 64 HB THR 64 -22.117 -23.168 -20.488 504 HG1 THR 64 HG1 THR 64 -24.926 -22.682 -20.458 505 HG21 THR 64 HG21 THR 64 -23.036 -25.223 -21.108 506 HG22 THR 64 HG22 THR 64 -24.474 -24.987 -20.114 507 HG23 THR 64 HG23 THR 64 -22.923 -25.343 -19.353 508 H ARG 65 H ARG 65 -20.708 -23.103 -17.954 509 HA ARG 65 HA ARG 65 -20.055 -20.583 -17.024 510 HB2 ARG 65 HB2 ARG 65 -17.692 -21.201 -17.527 511 HB3 ARG 65 HB3 ARG 65 -18.577 -22.443 -16.652 512 HG2 ARG 65 HG2 ARG 65 -17.761 -23.842 -18.182 513 HG3 ARG 65 HG3 ARG 65 -18.994 -23.171 -19.251 514 HD2 ARG 65 HD2 ARG 65 -17.491 -21.830 -20.365 515 HD3 ARG 65 HD3 ARG 65 -16.367 -21.781 -19.007 516 HE ARG 65 HE ARG 65 -16.433 -23.709 -21.126 517 HH11 ARG 65 HH11 ARG 65 -15.553 -23.178 -17.798 518 HH12 ARG 65 HH12 ARG 65 -14.352 -24.426 -17.781 519 HH21 ARG 65 HH21 ARG 65 -14.853 -25.354 -21.114 520 HH22 ARG 65 HH22 ARG 65 -13.954 -25.663 -19.668 521 H GLU 66 H GLU 66 -19.916 -21.838 -20.327 522 HA GLU 66 HA GLU 66 -18.583 -19.773 -21.589 523 HB2 GLU 66 HB2 GLU 66 -20.807 -21.569 -22.537 524 HB3 GLU 66 HB3 GLU 66 -20.043 -20.396 -23.599 525 HG2 GLU 66 HG2 GLU 66 -18.394 -22.386 -22.099 526 HG3 GLU 66 HG3 GLU 66 -19.206 -22.834 -23.599 527 H LEU 67 H LEU 67 -21.871 -19.900 -20.420 528 HA LEU 67 HA LEU 67 -22.749 -17.545 -21.792 529 HB2 LEU 67 HB2 LEU 67 -24.043 -19.578 -20.610 530 HB3 LEU 67 HB3 LEU 67 -24.112 -18.391 -19.310 531 HG LEU 67 HG LEU 67 -25.248 -16.820 -20.811 532 HD11 LEU 67 HD11 LEU 67 -24.965 -19.065 -22.791 533 HD12 LEU 67 HD12 LEU 67 -24.410 -17.398 -22.945 534 HD13 LEU 67 HD13 LEU 67 -26.136 -17.760 -22.975 535 HD21 LEU 67 HD21 LEU 67 -26.303 -19.413 -19.986 536 HD22 LEU 67 HD22 LEU 67 -27.217 -18.664 -21.295 537 HD23 LEU 67 HD23 LEU 67 -26.974 -17.795 -19.779 538 H ALA 68 H ALA 68 -21.489 -18.268 -18.581 539 HA ALA 68 HA ALA 68 -21.946 -15.714 -17.454 540 HB1 ALA 68 HB1 ALA 68 -19.624 -17.060 -16.365 541 HB2 ALA 68 HB2 ALA 68 -21.165 -16.669 -15.600 542 HB3 ALA 68 HB3 ALA 68 -20.998 -18.151 -16.541 543 H ILE 69 H ILE 69 -18.832 -17.158 -18.439 544 HA ILE 69 HA ILE 69 -17.300 -14.865 -18.310 545 HB ILE 69 HB ILE 69 -17.001 -17.166 -20.243 546 HG12 ILE 69 HG12 ILE 69 -15.055 -17.329 -18.263 547 HG13 ILE 69 HG13 ILE 69 -16.506 -16.845 -17.391 548 HG21 ILE 69 HG21 ILE 69 -15.653 -15.505 -21.150 549 HG22 ILE 69 HG22 ILE 69 -15.218 -14.859 -19.568 550 HG23 ILE 69 HG23 ILE 69 -14.542 -16.395 -20.109 551 HD11 ILE 69 HD11 ILE 69 -17.130 -18.941 -19.239 552 HD12 ILE 69 HD12 ILE 69 -15.778 -19.413 -18.209 553 HD13 ILE 69 HD13 ILE 69 -17.302 -18.902 -17.485 554 H ALA 70 H ALA 70 -19.424 -15.969 -20.877 555 HA ALA 70 HA ALA 70 -18.616 -14.317 -22.958 556 HB1 ALA 70 HB1 ALA 70 -21.219 -14.419 -23.469 557 HB2 ALA 70 HB2 ALA 70 -20.162 -15.816 -23.686 558 HB3 ALA 70 HB3 ALA 70 -21.150 -15.674 -22.231 559 H TYR 71 H TYR 71 -20.340 -13.550 -20.051 560 HA TYR 71 HA TYR 71 -21.366 -11.033 -20.982 561 HB2 TYR 71 HB2 TYR 71 -22.534 -12.229 -19.214 562 HB3 TYR 71 HB3 TYR 71 -21.104 -12.169 -18.190 563 HD1 TYR 71 HD2 TYR 71 -23.040 -9.657 -20.182 564 HD2 TYR 71 HD1 TYR 71 -21.344 -10.714 -16.426 565 HE1 TYR 71 HE2 TYR 71 -23.811 -7.521 -19.238 566 HE2 TYR 71 HE1 TYR 71 -22.112 -8.582 -15.472 567 HH TYR 71 HH TYR 71 -22.740 -6.075 -16.839 568 H ALA 72 H ALA 72 -18.832 -11.958 -18.650 569 HA ALA 72 HA ALA 72 -17.856 -9.385 -18.162 570 HB1 ALA 72 HB1 ALA 72 -17.338 -11.720 -17.053 571 HB2 ALA 72 HB2 ALA 72 -15.962 -11.679 -18.155 572 HB3 ALA 72 HB3 ALA 72 -16.183 -10.390 -16.972 573 H VAL 73 H VAL 73 -16.584 -11.857 -20.399 574 HA VAL 73 HA VAL 73 -14.521 -10.399 -21.517 575 HB VAL 73 HB VAL 73 -16.307 -12.389 -22.925 576 HG11 VAL 73 HG11 VAL 73 -15.016 -11.070 -24.509 577 HG12 VAL 73 HG12 VAL 73 -13.534 -11.416 -23.615 578 HG13 VAL 73 HG13 VAL 73 -14.399 -12.719 -24.432 579 HG21 VAL 73 HG21 VAL 73 -15.192 -13.166 -20.816 580 HG22 VAL 73 HG22 VAL 73 -14.752 -14.069 -22.265 581 HG23 VAL 73 HG23 VAL 73 -13.642 -12.868 -21.604 582 H ALA 74 H ALA 74 -17.954 -10.192 -22.125 583 HA ALA 74 HA ALA 74 -17.971 -8.844 -24.561 584 HB1 ALA 74 HB1 ALA 74 -19.995 -7.885 -22.694 585 HB2 ALA 74 HB2 ALA 74 -20.178 -8.734 -24.230 586 HB3 ALA 74 HB3 ALA 74 -19.873 -9.644 -22.750 587 H HIS 75 H HIS 75 -17.097 -7.737 -21.398 588 HA HIS 75 HA HIS 75 -16.686 -5.035 -22.494 589 HB2 HIS 75 HB2 HIS 75 -17.715 -5.824 -19.770 590 HB3 HIS 75 HB3 HIS 75 -17.063 -4.222 -20.109 591 HD1 HIS 75 HD1 HIS 75 -18.629 -2.556 -21.120 592 HD2 HIS 75 HD2 HIS 75 -20.102 -6.437 -21.312 593 HE1 HIS 75 HE1 HIS 75 -20.991 -2.339 -21.956 594 H LYS 76 H LYS 76 -14.930 -7.443 -22.183 595 HA LYS 76 HA LYS 76 -12.816 -7.979 -21.520 596 HB2 LYS 76 HB2 LYS 76 -12.729 -4.984 -21.738 597 HB3 LYS 76 HB3 LYS 76 -11.304 -5.887 -21.238 598 HG2 LYS 76 HG2 LYS 76 -11.095 -5.546 -23.559 599 HG3 LYS 76 HG3 LYS 76 -11.560 -7.236 -23.351 600 HD2 LYS 76 HD2 LYS 76 -13.833 -6.748 -23.946 601 HD3 LYS 76 HD3 LYS 76 -13.506 -5.013 -23.956 602 HE2 LYS 76 HE2 LYS 76 -13.596 -5.947 -26.224 603 HE3 LYS 76 HE3 LYS 76 -12.008 -5.281 -25.846 604 HZ1 LYS 76 HZ1 LYS 76 -11.865 -7.424 -26.978 605 HZ2 LYS 76 HZ2 LYS 76 -12.726 -8.160 -25.723 606 HZ3 LYS 76 HZ3 LYS 76 -11.196 -7.503 -25.426 607 H ILE 77 H ILE 77 -14.717 -7.950 -19.437 608 HA ILE 77 HA ILE 77 -13.436 -6.692 -17.151 609 HB ILE 77 HB ILE 77 -15.903 -8.430 -17.282 610 HG12 ILE 77 HG12 ILE 77 -15.780 -5.455 -16.817 611 HG13 ILE 77 HG13 ILE 77 -15.921 -6.138 -18.433 612 HG21 ILE 77 HG21 ILE 77 -14.352 -7.355 -15.058 613 HG22 ILE 77 HG22 ILE 77 -16.063 -6.934 -14.992 614 HG23 ILE 77 HG23 ILE 77 -15.574 -8.627 -15.080 615 HD11 ILE 77 HD11 ILE 77 -18.099 -5.562 -17.717 616 HD12 ILE 77 HD12 ILE 77 -17.983 -7.321 -17.638 617 HD13 ILE 77 HD13 ILE 77 -17.872 -6.362 -16.162 618 H ASP 78 H ASP 78 -12.378 -7.740 -15.525 619 HA ASP 78 HA ASP 78 -11.196 -10.260 -16.126 620 HB2 ASP 78 HB2 ASP 78 -11.148 -8.903 -13.435 621 HB3 ASP 78 HB3 ASP 78 -9.943 -9.983 -14.129 622 H TYR 79 H TYR 79 -12.447 -12.028 -16.105 623 HA TYR 79 HA TYR 79 -14.371 -12.389 -13.923 624 HB2 TYR 79 HB2 TYR 79 -15.289 -14.214 -15.306 625 HB3 TYR 79 HB3 TYR 79 -15.258 -12.685 -16.176 626 HD1 TYR 79 HD1 TYR 79 -13.794 -16.038 -15.934 627 HD2 TYR 79 HD2 TYR 79 -13.794 -12.363 -18.077 628 HE1 TYR 79 HE1 TYR 79 -12.549 -17.112 -17.763 629 HE2 TYR 79 HE2 TYR 79 -12.549 -13.426 -19.912 630 HH TYR 79 HH TYR 79 -11.774 -16.883 -19.846 631 H THR 80 H THR 80 -14.121 -13.892 -12.381 632 HA THR 80 HA THR 80 -11.770 -15.658 -12.575 633 HB THR 80 HB THR 80 -11.500 -14.093 -10.760 634 HG1 THR 80 HG1 THR 80 -10.709 -15.772 -9.756 635 HG21 THR 80 HG21 THR 80 -13.257 -13.271 -9.667 636 HG22 THR 80 HG22 THR 80 -13.537 -14.853 -8.940 637 HG23 THR 80 HG23 THR 80 -14.316 -14.434 -10.466 638 H VAL 81 H VAL 81 -12.125 -17.774 -12.658 639 HA VAL 81 HA VAL 81 -14.820 -18.774 -12.097 640 HB VAL 81 HB VAL 81 -14.036 -20.850 -13.243 641 HG11 VAL 81 HG11 VAL 81 -13.641 -18.394 -14.939 642 HG12 VAL 81 HG12 VAL 81 -14.243 -19.974 -15.445 643 HG13 VAL 81 HG13 VAL 81 -15.220 -18.954 -14.388 644 HG21 VAL 81 HG21 VAL 81 -11.811 -19.768 -14.640 645 HG22 VAL 81 HG22 VAL 81 -11.503 -19.614 -12.910 646 HG23 VAL 81 HG23 VAL 81 -11.872 -21.193 -13.603 647 H LEU 82 H LEU 82 -15.241 -19.824 -10.277 648 HA LEU 82 HA LEU 82 -12.989 -20.926 -8.736 649 HB2 LEU 82 HB2 LEU 82 -14.162 -19.168 -7.570 650 HB3 LEU 82 HB3 LEU 82 -15.705 -19.975 -7.840 651 HG LEU 82 HG LEU 82 -14.853 -21.858 -6.405 652 HD11 LEU 82 HD11 LEU 82 -12.917 -20.177 -5.043 653 HD12 LEU 82 HD12 LEU 82 -12.426 -20.579 -6.688 654 HD13 LEU 82 HD13 LEU 82 -12.801 -21.865 -5.541 655 HD21 LEU 82 HD21 LEU 82 -16.310 -20.693 -5.149 656 HD22 LEU 82 HD22 LEU 82 -15.581 -19.139 -5.555 657 HD23 LEU 82 HD23 LEU 82 -14.859 -20.153 -4.304 658 H GLN 83 H GLN 83 -12.800 -23.053 -8.894 659 HA GLN 83 HA GLN 83 -15.255 -24.679 -8.958 660 HB2 GLN 83 HB2 GLN 83 -12.690 -25.462 -10.333 661 HB3 GLN 83 HB3 GLN 83 -14.280 -26.193 -10.507 662 HG2 GLN 83 HG2 GLN 83 -15.090 -24.141 -11.582 663 HG3 GLN 83 HG3 GLN 83 -13.473 -23.450 -11.444 664 HE21 GLN 83 HE21 GLN 83 -12.278 -23.603 -13.191 665 HE22 GLN 83 HE22 GLN 83 -12.413 -24.808 -14.420 666 H ASP 84 H ASP 84 -15.273 -26.544 -7.745 667 HA ASP 84 HA ASP 84 -13.835 -26.636 -5.389 668 HB2 ASP 84 HB2 ASP 84 -14.758 -28.804 -5.030 669 HB3 ASP 84 HB3 ASP 84 -15.957 -27.896 -5.945 670 H ASN 85 H ASN 85 -12.421 -28.533 -4.686 671 HA ASN 85 HA ASN 85 -9.968 -28.400 -5.985 672 HB2 ASN 85 HB2 ASN 85 -11.137 -30.168 -3.890 673 HB3 ASN 85 HB3 ASN 85 -9.629 -30.675 -4.642 674 HD21 ASN 85 HD21 ASN 85 -8.133 -30.291 -3.156 675 HD22 ASN 85 HD22 ASN 85 -7.872 -28.777 -2.365 676 HA PRO 86 HA PRO 86 -10.048 -31.284 -9.289 677 HB2 PRO 86 HB2 PRO 86 -7.598 -32.441 -9.121 678 HB3 PRO 86 HB3 PRO 86 -7.839 -30.777 -9.664 679 HG2 PRO 86 HG2 PRO 86 -7.014 -31.789 -6.970 680 HG3 PRO 86 HG3 PRO 86 -6.374 -30.418 -7.893 681 HD2 PRO 86 HD2 PRO 86 -8.135 -30.110 -5.860 682 HD3 PRO 86 HD3 PRO 86 -8.103 -29.027 -7.267 683 H ARG 87 H ARG 87 -10.682 -33.339 -9.724 684 HA ARG 87 HA ARG 87 -11.106 -35.113 -7.484 685 HB2 ARG 87 HB2 ARG 87 -11.981 -35.026 -10.337 686 HB3 ARG 87 HB3 ARG 87 -12.038 -36.565 -9.490 687 HG2 ARG 87 HG2 ARG 87 -13.304 -34.097 -8.352 688 HG3 ARG 87 HG3 ARG 87 -14.148 -35.134 -9.506 689 HD2 ARG 87 HD2 ARG 87 -12.885 -36.268 -7.034 690 HD3 ARG 87 HD3 ARG 87 -14.494 -35.549 -6.986 691 HE ARG 87 HE ARG 87 -14.268 -37.471 -9.072 692 HH11 ARG 87 HH11 ARG 87 -14.684 -37.127 -5.632 693 HH12 ARG 87 HH12 ARG 87 -15.513 -38.638 -5.450 694 HH21 ARG 87 HH21 ARG 87 -15.357 -39.462 -8.845 695 HH22 ARG 87 HH22 ARG 87 -15.894 -39.966 -7.277 696 H THR 88 H THR 88 -10.342 -37.245 -7.315 697 HA THR 88 HA THR 88 -7.650 -37.606 -8.211 698 HB THR 88 HB THR 88 -7.880 -39.872 -7.106 699 HG1 THR 88 HG1 THR 88 -9.797 -40.088 -5.795 700 HG21 THR 88 HG21 THR 88 -7.746 -38.990 -4.898 701 HG22 THR 88 HG22 THR 88 -8.712 -37.580 -5.334 702 HG23 THR 88 HG23 THR 88 -7.081 -37.762 -5.974 703 H ILE 89 H ILE 89 -7.298 -38.054 -10.299 704 HA ILE 89 HA ILE 89 -9.125 -39.622 -11.869 705 HB ILE 89 HB ILE 89 -7.434 -39.390 -13.668 706 HG12 ILE 89 HG12 ILE 89 -5.899 -37.743 -11.648 707 HG13 ILE 89 HG13 ILE 89 -5.455 -39.375 -12.135 708 HG21 ILE 89 HG21 ILE 89 -7.545 -36.856 -13.762 709 HG22 ILE 89 HG22 ILE 89 -9.079 -37.709 -13.597 710 HG23 ILE 89 HG23 ILE 89 -8.345 -36.936 -12.191 711 HD11 ILE 89 HD11 ILE 89 -5.746 -37.937 -14.510 712 HD12 ILE 89 HD12 ILE 89 -4.879 -36.872 -13.403 713 HD13 ILE 89 HD13 ILE 89 -4.249 -38.481 -13.755 714 H VAL 90 H VAL 90 -8.159 -41.429 -13.272 715 HA VAL 90 HA VAL 90 -6.164 -43.051 -11.914 716 HB VAL 90 HB VAL 90 -7.691 -45.070 -12.020 717 HG11 VAL 90 HG11 VAL 90 -8.604 -42.958 -10.079 718 HG12 VAL 90 HG12 VAL 90 -8.555 -44.706 -9.841 719 HG13 VAL 90 HG13 VAL 90 -7.053 -43.785 -9.946 720 HG21 VAL 90 HG21 VAL 90 -9.910 -44.903 -12.449 721 HG22 VAL 90 HG22 VAL 90 -10.031 -43.277 -11.779 722 HG23 VAL 90 HG23 VAL 90 -9.377 -43.516 -13.398 723 HA PRO 91 HA PRO 91 -6.148 -43.248 -16.574 724 HB2 PRO 91 HB2 PRO 91 -3.519 -42.623 -16.839 725 HB3 PRO 91 HB3 PRO 91 -4.794 -41.400 -16.753 726 HG2 PRO 91 HG2 PRO 91 -2.957 -42.377 -14.600 727 HG3 PRO 91 HG3 PRO 91 -3.456 -40.717 -14.977 728 HD2 PRO 91 HD2 PRO 91 -4.559 -42.147 -12.959 729 HD3 PRO 91 HD3 PRO 91 -5.475 -40.944 -13.889 730 H LYS 92 H LYS 92 -4.770 -44.646 -17.946 731 HA LYS 92 HA LYS 92 -3.522 -46.832 -16.415 732 HB2 LYS 92 HB2 LYS 92 -5.723 -47.547 -17.205 733 HB3 LYS 92 HB3 LYS 92 -5.299 -47.088 -18.849 734 HG2 LYS 92 HG2 LYS 92 -3.883 -48.882 -19.131 735 HG3 LYS 92 HG3 LYS 92 -3.620 -49.081 -17.397 736 HD2 LYS 92 HD2 LYS 92 -5.928 -49.881 -17.151 737 HD3 LYS 92 HD3 LYS 92 -6.169 -49.702 -18.890 738 HE2 LYS 92 HE2 LYS 92 -4.501 -51.375 -19.344 739 HE3 LYS 92 HE3 LYS 92 -4.074 -51.471 -17.636 740 HZ1 LYS 92 HZ1 LYS 92 -6.668 -52.010 -17.513 741 HZ2 LYS 92 HZ2 LYS 92 -5.486 -53.205 -17.702 742 HZ3 LYS 92 HZ3 LYS 92 -6.331 -52.632 -19.051 743 H SER 93 H SER 93 -1.647 -47.667 -17.216 744 HA SER 93 HA SER 93 -0.360 -46.137 -19.326 745 HB2 SER 93 HB2 SER 93 0.720 -48.297 -17.498 746 HB3 SER 93 HB3 SER 93 1.684 -47.363 -18.641 747 HG SER 93 HG SER 93 0.269 -46.394 -16.382 748 H TYR 94 H TYR 94 0.647 -47.087 -21.148 749 HA TYR 94 HA TYR 94 0.301 -49.845 -21.800 750 HB2 TYR 94 HB2 TYR 94 -1.217 -49.520 -23.720 751 HB3 TYR 94 HB3 TYR 94 -1.996 -49.131 -22.190 752 HD1 TYR 94 HD1 TYR 94 -2.237 -46.698 -21.540 753 HD2 TYR 94 HD2 TYR 94 -1.072 -47.923 -25.446 754 HE1 TYR 94 HE1 TYR 94 -2.854 -44.483 -22.413 755 HE2 TYR 94 HE2 TYR 94 -1.685 -45.711 -26.328 756 HH TYR 94 HH TYR 94 -2.222 -43.043 -24.393 757 H ALA 95 H ALA 95 2.022 -50.341 -22.970 758 HA ALA 95 HA ALA 95 3.534 -48.261 -24.301 759 HB1 ALA 95 HB1 ALA 95 4.180 -50.669 -23.043 760 HB2 ALA 95 HB2 ALA 95 4.558 -50.913 -24.748 761 HB3 ALA 95 HB3 ALA 95 5.279 -49.564 -23.869 762 H ASP 96 H ASP 96 3.988 -48.152 -26.492 763 HA ASP 96 HA ASP 96 2.224 -49.764 -28.217 764 HB2 ASP 96 HB2 ASP 96 3.284 -46.972 -28.710 765 HB3 ASP 96 HB3 ASP 96 2.219 -47.876 -29.783 766 H ASN 97 H ASN 97 3.030 -50.225 -30.383 767 HA ASN 97 HA ASN 97 5.665 -51.264 -30.321 768 HB2 ASN 97 HB2 ASN 97 3.547 -51.027 -32.435 769 HB3 ASN 97 HB3 ASN 97 5.169 -51.564 -32.866 770 HD21 ASN 97 HD21 ASN 97 5.989 -53.219 -31.073 771 HD22 ASN 97 HD22 ASN 97 4.901 -54.537 -30.815 772 H PHE 98 H PHE 98 7.430 -50.043 -30.394 773 HA PHE 98 HA PHE 98 7.572 -47.406 -31.295 774 HB2 PHE 98 HB2 PHE 98 9.987 -47.640 -31.138 775 HB3 PHE 98 HB3 PHE 98 9.224 -48.459 -29.780 776 HD1 PHE 98 HD1 PHE 98 9.050 -50.945 -29.792 777 HD2 PHE 98 HD2 PHE 98 11.340 -48.806 -32.673 778 HE1 PHE 98 HE1 PHE 98 10.265 -53.010 -30.353 779 HE2 PHE 98 HE2 PHE 98 12.557 -50.867 -33.240 780 HZ PHE 98 HZ PHE 98 12.020 -52.973 -32.080 781 H THR 99 H THR 99 8.823 -46.550 -33.112 782 HA THR 99 HA THR 99 8.839 -48.305 -35.470 783 HB THR 99 HB THR 99 8.078 -46.190 -36.768 784 HG1 THR 99 HG1 THR 99 6.534 -45.003 -35.340 785 HG21 THR 99 HG21 THR 99 6.660 -48.347 -35.537 786 HG22 THR 99 HG22 THR 99 6.312 -47.516 -37.053 787 HG23 THR 99 HG23 THR 99 5.637 -46.911 -35.542 788 H LYS 100 H LYS 100 10.621 -48.140 -36.688 789 HA LYS 100 HA LYS 100 12.908 -46.839 -35.860 790 HB2 LYS 100 HB2 LYS 100 13.647 -47.115 -38.299 791 HB3 LYS 100 HB3 LYS 100 13.198 -48.570 -37.420 792 HG2 LYS 100 HG2 LYS 100 11.164 -48.769 -38.560 793 HG3 LYS 100 HG3 LYS 100 11.233 -47.108 -39.151 794 HD2 LYS 100 HD2 LYS 100 13.219 -47.729 -40.507 795 HD3 LYS 100 HD3 LYS 100 13.006 -49.402 -39.986 796 HE2 LYS 100 HE2 LYS 100 11.932 -49.362 -42.040 797 HE3 LYS 100 HE3 LYS 100 10.605 -49.135 -40.902 798 HZ1 LYS 100 HZ1 LYS 100 11.950 -46.768 -41.998 799 HZ2 LYS 100 HZ2 LYS 100 10.347 -46.956 -41.492 800 HZ3 LYS 100 HZ3 LYS 100 10.846 -47.600 -42.974 801 HA PRO 101 HA PRO 101 12.593 -42.614 -37.008 802 HB2 PRO 101 HB2 PRO 101 15.140 -42.058 -37.766 803 HB3 PRO 101 HB3 PRO 101 14.676 -42.321 -36.081 804 HG2 PRO 101 HG2 PRO 101 15.947 -44.220 -38.015 805 HG3 PRO 101 HG3 PRO 101 16.328 -43.942 -36.305 806 HD2 PRO 101 HD2 PRO 101 14.837 -46.042 -37.144 807 HD3 PRO 101 HD3 PRO 101 14.580 -45.254 -35.573 808 H ARG 102 H ARG 102 13.412 -41.050 -38.842 809 HA ARG 102 HA ARG 102 12.184 -41.854 -41.232 810 HB2 ARG 102 HB2 ARG 102 12.380 -39.506 -40.567 811 HB3 ARG 102 HB3 ARG 102 14.127 -39.588 -40.754 812 HG2 ARG 102 HG2 ARG 102 13.807 -40.071 -43.158 813 HG3 ARG 102 HG3 ARG 102 12.070 -39.854 -42.935 814 HD2 ARG 102 HD2 ARG 102 14.186 -37.774 -42.392 815 HD3 ARG 102 HD3 ARG 102 13.147 -37.832 -43.815 816 HE ARG 102 HE ARG 102 11.537 -37.815 -41.521 817 HH11 ARG 102 HH11 ARG 102 13.699 -35.730 -43.280 818 HH12 ARG 102 HH12 ARG 102 12.907 -34.272 -42.783 819 HH21 ARG 102 HH21 ARG 102 10.485 -35.902 -40.858 820 HH22 ARG 102 HH22 ARG 102 11.080 -34.370 -41.404 821 H ASP 103 H ASP 103 12.907 -42.834 -43.023 822 HA ASP 103 HA ASP 103 15.580 -43.932 -43.010 823 HB2 ASP 103 HB2 ASP 103 13.347 -45.057 -43.796 824 HB3 ASP 103 HB3 ASP 103 13.684 -44.225 -45.312 825 H MET 104 H MET 104 16.229 -41.472 -43.100 826 HA MET 104 HA MET 104 16.132 -40.165 -45.614 827 HB2 MET 104 HB2 MET 104 17.792 -38.639 -44.669 828 HB3 MET 104 HB3 MET 104 16.498 -38.948 -43.518 829 HG2 MET 104 HG2 MET 104 17.869 -40.376 -42.221 830 HG3 MET 104 HG3 MET 104 19.116 -40.417 -43.468 831 HE1 MET 104 HE1 MET 104 21.143 -38.856 -43.489 832 HE2 MET 104 HE2 MET 104 21.532 -38.113 -41.938 833 HE3 MET 104 HE3 MET 104 21.081 -39.817 -42.011
Contact the webmaster for help, if required. Saturday, June 1, 2024 3:32:46 AM GMT (wattos1)