NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
580665 | 2mk9 | 19764 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 H MET 1 12.210 2.453 1.087 2 HA MET 1 HA MET 1 13.015 -0.149 0.226 3 HB2 MET 1 HB2 MET 1 12.981 0.887 3.060 4 HB3 MET 1 HB3 MET 1 13.991 -0.391 2.399 5 HG2 MET 1 HG2 MET 1 15.208 1.200 1.063 6 HG3 MET 1 HG3 MET 1 14.135 2.499 1.577 7 HE1 MET 1 HE1 MET 1 17.158 2.916 1.733 8 HE2 MET 1 HE2 MET 1 16.064 4.092 2.461 9 HE3 MET 1 HE3 MET 1 17.443 3.485 3.378 10 H ASP 2 H ASP 2 10.229 0.143 -0.017 11 HA ASP 2 HA ASP 2 9.208 -1.637 2.095 12 HB2 ASP 2 HB2 ASP 2 7.884 0.436 0.374 13 HB3 ASP 2 HB3 ASP 2 6.934 -0.876 1.066 14 H SER 3 H SER 3 10.509 -1.854 -0.843 15 HA SER 3 HA SER 3 8.808 -4.137 -1.595 16 HB2 SER 3 HB2 SER 3 10.177 -2.254 -3.530 17 HB3 SER 3 HB3 SER 3 9.152 -3.626 -3.950 18 HG SER 3 HG SER 3 7.800 -1.931 -4.030 19 H ALA 4 H ALA 4 11.127 -4.218 0.040 20 HA ALA 4 HA ALA 4 13.434 -4.938 -1.455 21 HB1 ALA 4 HB1 ALA 4 13.583 -6.207 1.039 22 HB2 ALA 4 HB2 ALA 4 14.304 -4.668 0.568 23 HB3 ALA 4 HB3 ALA 4 12.705 -4.702 1.310 24 HA PRO 5 HA PRO 5 12.147 -9.492 -0.501 25 HB2 PRO 5 HB2 PRO 5 9.680 -9.904 0.555 26 HB3 PRO 5 HB3 PRO 5 11.117 -9.633 1.548 27 HG2 PRO 5 HG2 PRO 5 8.974 -7.701 0.750 28 HG3 PRO 5 HG3 PRO 5 9.756 -7.916 2.327 29 HD2 PRO 5 HD2 PRO 5 10.447 -5.934 0.616 30 HD3 PRO 5 HD3 PRO 5 11.615 -6.700 1.712 31 H PHE 6 H PHE 6 9.731 -7.212 -1.602 32 HA PHE 6 HA PHE 6 8.299 -9.063 -3.242 33 HB2 PHE 6 HB2 PHE 6 7.952 -6.401 -2.395 34 HB3 PHE 6 HB3 PHE 6 8.053 -6.337 -4.151 35 HD1 PHE 6 HD2 PHE 6 6.433 -7.590 -5.527 36 HD2 PHE 6 HD1 PHE 6 6.074 -7.341 -1.294 37 HE1 PHE 6 HE2 PHE 6 4.088 -8.317 -5.687 38 HE2 PHE 6 HE1 PHE 6 3.728 -8.069 -1.447 39 HZ PHE 6 HZ PHE 6 2.732 -8.556 -3.646 40 H GLU 7 H GLU 7 10.900 -6.739 -3.782 41 HA GLU 7 HA GLU 7 11.011 -6.788 -6.555 42 HB2 GLU 7 HB2 GLU 7 12.681 -5.894 -4.409 43 HB3 GLU 7 HB3 GLU 7 13.679 -6.716 -5.599 44 HG2 GLU 7 HG2 GLU 7 12.816 -5.262 -7.348 45 HG3 GLU 7 HG3 GLU 7 11.786 -4.448 -6.172 46 H LEU 8 H LEU 8 12.550 -8.959 -4.213 47 HA LEU 8 HA LEU 8 14.082 -10.497 -5.921 48 HB2 LEU 8 HB2 LEU 8 12.749 -10.964 -3.314 49 HB3 LEU 8 HB3 LEU 8 13.331 -12.380 -4.188 50 HG LEU 8 HG LEU 8 14.965 -11.653 -2.552 51 HD11 LEU 8 HD11 LEU 8 16.486 -10.752 -4.822 52 HD12 LEU 8 HD12 LEU 8 15.445 -12.105 -5.263 53 HD13 LEU 8 HD13 LEU 8 16.589 -12.271 -3.931 54 HD21 LEU 8 HD21 LEU 8 16.095 -9.471 -2.813 55 HD22 LEU 8 HD22 LEU 8 14.393 -9.315 -2.377 56 HD23 LEU 8 HD23 LEU 8 14.908 -9.031 -4.041 57 H PHE 9 H PHE 9 10.630 -10.647 -5.288 58 HA PHE 9 HA PHE 9 9.963 -13.085 -6.382 59 HB2 PHE 9 HB2 PHE 9 8.486 -11.194 -5.322 60 HB3 PHE 9 HB3 PHE 9 8.268 -10.692 -6.995 61 HD1 PHE 9 HD2 PHE 9 8.289 -13.941 -5.151 62 HD2 PHE 9 HD1 PHE 9 6.295 -11.388 -7.912 63 HE1 PHE 9 HE2 PHE 9 6.513 -15.622 -5.418 64 HE2 PHE 9 HE1 PHE 9 4.516 -13.065 -8.183 65 HZ PHE 9 HZ PHE 9 4.624 -15.186 -6.937 66 H PHE 10 H PHE 10 10.765 -10.085 -8.023 67 HA PHE 10 HA PHE 10 10.115 -11.153 -10.632 68 HB2 PHE 10 HB2 PHE 10 9.716 -8.818 -10.358 69 HB3 PHE 10 HB3 PHE 10 11.332 -8.550 -9.712 70 HD1 PHE 10 HD2 PHE 10 13.267 -8.492 -11.183 71 HD2 PHE 10 HD1 PHE 10 9.333 -9.015 -12.720 72 HE1 PHE 10 HE2 PHE 10 14.081 -7.949 -13.441 73 HE2 PHE 10 HE1 PHE 10 10.140 -8.474 -14.980 74 HZ PHE 10 HZ PHE 10 12.516 -7.939 -15.343 75 H MET 11 H MET 11 12.900 -10.821 -8.588 76 HA MET 11 HA MET 11 14.876 -11.144 -10.610 77 HB2 MET 11 HB2 MET 11 14.820 -11.199 -7.638 78 HB3 MET 11 HB3 MET 11 16.182 -11.979 -8.431 79 HG2 MET 11 HG2 MET 11 16.771 -9.724 -7.893 80 HG3 MET 11 HG3 MET 11 16.637 -9.882 -9.642 81 HE1 MET 11 HE1 MET 11 15.959 -7.635 -6.797 82 HE2 MET 11 HE2 MET 11 16.751 -7.083 -8.273 83 HE3 MET 11 HE3 MET 11 15.220 -6.364 -7.771 84 H ILE 12 H ILE 12 12.914 -13.332 -8.745 85 HA ILE 12 HA ILE 12 14.486 -15.658 -9.455 86 HB ILE 12 HB ILE 12 11.862 -15.363 -8.000 87 HG12 ILE 12 HG12 ILE 12 13.904 -16.678 -6.509 88 HG13 ILE 12 HG13 ILE 12 14.600 -15.220 -7.209 89 HG21 ILE 12 HG21 ILE 12 12.487 -17.875 -7.454 90 HG22 ILE 12 HG22 ILE 12 11.522 -17.444 -8.865 91 HG23 ILE 12 HG23 ILE 12 13.245 -17.773 -9.043 92 HD11 ILE 12 HD11 ILE 12 13.059 -15.427 -4.900 93 HD12 ILE 12 HD12 ILE 12 13.576 -13.951 -5.715 94 HD13 ILE 12 HD13 ILE 12 12.010 -14.666 -6.097 95 H ASN 13 H ASN 13 11.120 -14.625 -10.048 96 HA ASN 13 HA ASN 13 10.415 -16.576 -11.871 97 HB2 ASN 13 HB2 ASN 13 9.516 -13.766 -11.395 98 HB3 ASN 13 HB3 ASN 13 8.942 -14.598 -12.838 99 HD21 ASN 13 HD21 ASN 13 8.466 -14.086 -9.564 100 HD22 ASN 13 HD22 ASN 13 7.307 -15.334 -9.273 101 H THR 14 H THR 14 11.681 -13.328 -12.622 102 HA THR 14 HA THR 14 11.835 -13.562 -15.370 103 HB THR 14 HB THR 14 13.779 -12.095 -13.576 104 HG1 THR 14 HG1 THR 14 11.387 -11.621 -13.515 105 HG21 THR 14 HG21 THR 14 14.254 -10.710 -15.506 106 HG22 THR 14 HG22 THR 14 13.098 -11.618 -16.480 107 HG23 THR 14 HG23 THR 14 14.571 -12.398 -15.905 108 H SER 15 H SER 15 13.949 -14.873 -12.918 109 HA SER 15 HA SER 15 16.114 -15.521 -14.643 110 HB2 SER 15 HB2 SER 15 15.942 -15.408 -11.997 111 HB3 SER 15 HB3 SER 15 15.589 -17.126 -12.179 112 HG SER 15 HG SER 15 17.952 -15.855 -12.351 113 H ILE 16 H ILE 16 13.777 -17.689 -13.036 114 HA ILE 16 HA ILE 16 14.365 -20.000 -14.414 115 HB ILE 16 HB ILE 16 11.638 -19.120 -13.458 116 HG12 ILE 16 HG12 ILE 16 13.539 -20.957 -12.021 117 HG13 ILE 16 HG13 ILE 16 13.632 -19.211 -11.815 118 HG21 ILE 16 HG21 ILE 16 11.340 -21.657 -13.262 119 HG22 ILE 16 HG22 ILE 16 11.242 -20.938 -14.869 120 HG23 ILE 16 HG23 ILE 16 12.714 -21.768 -14.363 121 HD11 ILE 16 HD11 ILE 16 11.544 -21.121 -10.919 122 HD12 ILE 16 HD12 ILE 16 12.289 -19.770 -10.063 123 HD13 ILE 16 HD13 ILE 16 11.071 -19.466 -11.302 124 H LEU 17 H LEU 17 12.567 -17.224 -15.486 125 HA LEU 17 HA LEU 17 11.448 -18.559 -17.790 126 HB2 LEU 17 HB2 LEU 17 11.016 -16.118 -16.396 127 HB3 LEU 17 HB3 LEU 17 11.369 -15.736 -18.080 128 HG LEU 17 HG LEU 17 9.210 -17.644 -17.186 129 HD11 LEU 17 HD11 LEU 17 9.120 -15.010 -16.706 130 HD12 LEU 17 HD12 LEU 17 7.701 -15.966 -17.131 131 HD13 LEU 17 HD13 LEU 17 8.534 -15.026 -18.369 132 HD21 LEU 17 HD21 LEU 17 8.840 -16.473 -19.765 133 HD22 LEU 17 HD22 LEU 17 9.007 -18.174 -19.330 134 HD23 LEU 17 HD23 LEU 17 10.441 -17.209 -19.684 135 H LEU 18 H LEU 18 13.749 -15.866 -17.346 136 HA LEU 18 HA LEU 18 14.575 -15.588 -19.962 137 HB2 LEU 18 HB2 LEU 18 15.945 -15.148 -17.340 138 HB3 LEU 18 HB3 LEU 18 16.826 -14.916 -18.849 139 HG LEU 18 HG LEU 18 14.467 -13.367 -17.811 140 HD11 LEU 18 HD11 LEU 18 17.352 -12.895 -18.211 141 HD12 LEU 18 HD12 LEU 18 16.247 -12.236 -17.006 142 HD13 LEU 18 HD13 LEU 18 16.272 -11.567 -18.637 143 HD21 LEU 18 HD21 LEU 18 15.310 -13.851 -20.584 144 HD22 LEU 18 HD22 LEU 18 15.086 -12.156 -20.152 145 HD23 LEU 18 HD23 LEU 18 13.761 -13.302 -19.945 146 H ILE 19 H ILE 19 15.622 -17.928 -17.553 147 HA ILE 19 HA ILE 19 17.849 -18.964 -18.899 148 HB ILE 19 HB ILE 19 15.939 -20.358 -17.021 149 HG12 ILE 19 HG12 ILE 19 18.704 -19.481 -16.300 150 HG13 ILE 19 HG13 ILE 19 17.427 -18.271 -16.367 151 HG21 ILE 19 HG21 ILE 19 17.119 -22.012 -18.315 152 HG22 ILE 19 HG22 ILE 19 18.656 -21.202 -18.016 153 HG23 ILE 19 HG23 ILE 19 17.790 -21.969 -16.684 154 HD11 ILE 19 HD11 ILE 19 17.995 -20.249 -14.346 155 HD12 ILE 19 HD12 ILE 19 16.960 -18.823 -14.274 156 HD13 ILE 19 HD13 ILE 19 16.325 -20.344 -14.901 157 H PHE 20 H PHE 20 14.614 -20.462 -18.687 158 HA PHE 20 HA PHE 20 15.075 -22.323 -20.745 159 HB2 PHE 20 HB2 PHE 20 13.287 -22.491 -18.997 160 HB3 PHE 20 HB3 PHE 20 12.398 -21.236 -19.855 161 HD1 PHE 20 HD2 PHE 20 14.128 -24.434 -20.715 162 HD2 PHE 20 HD1 PHE 20 10.673 -21.987 -21.150 163 HE1 PHE 20 HE2 PHE 20 13.097 -26.150 -22.145 164 HE2 PHE 20 HE1 PHE 20 9.635 -23.699 -22.580 165 HZ PHE 20 HZ PHE 20 10.848 -25.784 -23.080 166 H ILE 21 H ILE 21 14.169 -18.994 -20.801 167 HA ILE 21 HA ILE 21 12.989 -18.967 -23.396 168 HB ILE 21 HB ILE 21 13.905 -16.904 -21.465 169 HG12 ILE 21 HG12 ILE 21 11.418 -17.099 -23.172 170 HG13 ILE 21 HG13 ILE 21 11.573 -17.832 -21.579 171 HG21 ILE 21 HG21 ILE 21 13.442 -15.142 -23.221 172 HG22 ILE 21 HG22 ILE 21 14.968 -16.011 -23.372 173 HG23 ILE 21 HG23 ILE 21 13.610 -16.426 -24.418 174 HD11 ILE 21 HD11 ILE 21 11.694 -14.898 -22.229 175 HD12 ILE 21 HD12 ILE 21 10.391 -15.752 -21.403 176 HD13 ILE 21 HD13 ILE 21 11.968 -15.591 -20.631 177 H PHE 22 H PHE 22 16.183 -17.937 -22.194 178 HA PHE 22 HA PHE 22 17.228 -17.404 -24.781 179 HB2 PHE 22 HB2 PHE 22 18.659 -17.923 -22.166 180 HB3 PHE 22 HB3 PHE 22 19.419 -17.298 -23.626 181 HD1 PHE 22 HD2 PHE 22 17.303 -15.411 -24.529 182 HD2 PHE 22 HD1 PHE 22 18.914 -16.163 -20.662 183 HE1 PHE 22 HE2 PHE 22 16.726 -13.119 -23.847 184 HE2 PHE 22 HE1 PHE 22 18.339 -13.872 -19.973 185 HZ PHE 22 HZ PHE 22 17.244 -12.347 -21.566 186 H ILE 23 H ILE 23 17.786 -20.082 -22.498 187 HA ILE 23 HA ILE 23 19.509 -21.621 -23.980 188 HB ILE 23 HB ILE 23 17.454 -22.252 -21.933 189 HG12 ILE 23 HG12 ILE 23 19.736 -23.572 -21.268 190 HG13 ILE 23 HG13 ILE 23 20.391 -22.269 -22.254 191 HG21 ILE 23 HG21 ILE 23 18.648 -24.283 -23.792 192 HG22 ILE 23 HG22 ILE 23 18.133 -24.706 -22.160 193 HG23 ILE 23 HG23 ILE 23 16.962 -24.075 -23.318 194 HD11 ILE 23 HD11 ILE 23 20.244 -21.861 -19.765 195 HD12 ILE 23 HD12 ILE 23 19.551 -20.621 -20.810 196 HD13 ILE 23 HD13 ILE 23 18.497 -21.768 -19.984 197 H VAL 24 H VAL 24 15.952 -21.741 -24.071 198 HA VAL 24 HA VAL 24 15.797 -23.699 -26.106 199 HB VAL 24 HB VAL 24 13.811 -21.658 -25.122 200 HG11 VAL 24 HG11 VAL 24 12.944 -21.913 -27.217 201 HG12 VAL 24 HG12 VAL 24 13.652 -23.515 -27.437 202 HG13 VAL 24 HG13 VAL 24 12.218 -23.314 -26.431 203 HG21 VAL 24 HG21 VAL 24 12.789 -23.460 -23.992 204 HG22 VAL 24 HG22 VAL 24 13.723 -24.656 -24.891 205 HG23 VAL 24 HG23 VAL 24 14.518 -23.633 -23.695 206 H LEU 25 H LEU 25 15.700 -20.158 -26.175 207 HA LEU 25 HA LEU 25 15.082 -19.762 -28.846 208 HB2 LEU 25 HB2 LEU 25 16.531 -18.223 -26.773 209 HB3 LEU 25 HB3 LEU 25 16.750 -17.712 -28.446 210 HG LEU 25 HG LEU 25 14.169 -17.821 -26.892 211 HD11 LEU 25 HD11 LEU 25 14.159 -15.394 -27.390 212 HD12 LEU 25 HD12 LEU 25 15.778 -15.561 -28.067 213 HD13 LEU 25 HD13 LEU 25 15.499 -15.894 -26.358 214 HD21 LEU 25 HD21 LEU 25 14.635 -18.008 -29.731 215 HD22 LEU 25 HD22 LEU 25 13.746 -16.538 -29.330 216 HD23 LEU 25 HD23 LEU 25 13.122 -18.110 -28.831 217 H LEU 26 H LEU 26 18.191 -20.481 -27.346 218 HA LEU 26 HA LEU 26 19.901 -20.017 -29.468 219 HB2 LEU 26 HB2 LEU 26 19.917 -21.762 -27.090 220 HB3 LEU 26 HB3 LEU 26 21.026 -22.215 -28.382 221 HG LEU 26 HG LEU 26 22.169 -20.870 -26.730 222 HD11 LEU 26 HD11 LEU 26 22.067 -20.336 -29.479 223 HD12 LEU 26 HD12 LEU 26 23.373 -19.965 -28.355 224 HD13 LEU 26 HD13 LEU 26 22.121 -18.766 -28.677 225 HD21 LEU 26 HD21 LEU 26 21.477 -18.431 -26.535 226 HD22 LEU 26 HD22 LEU 26 20.465 -19.615 -25.707 227 HD23 LEU 26 HD23 LEU 26 19.938 -18.924 -27.242 228 H ILE 27 H ILE 27 18.456 -23.170 -28.619 229 HA ILE 27 HA ILE 27 19.282 -24.560 -30.876 230 HB ILE 27 HB ILE 27 17.117 -24.927 -28.885 231 HG12 ILE 27 HG12 ILE 27 18.591 -27.271 -29.735 232 HG13 ILE 27 HG13 ILE 27 19.684 -25.940 -29.370 233 HG21 ILE 27 HG21 ILE 27 17.126 -26.262 -31.579 234 HG22 ILE 27 HG22 ILE 27 16.329 -26.959 -30.169 235 HG23 ILE 27 HG23 ILE 27 15.807 -25.395 -30.793 236 HD11 ILE 27 HD11 ILE 27 18.015 -27.559 -27.588 237 HD12 ILE 27 HD12 ILE 27 19.541 -26.728 -27.282 238 HD13 ILE 27 HD13 ILE 27 18.024 -25.830 -27.242 239 H HIS 28 H HIS 28 16.197 -22.866 -30.331 240 HA HIS 28 HA HIS 28 14.907 -23.397 -32.688 241 HB2 HIS 28 HB2 HIS 28 13.798 -22.146 -30.965 242 HB3 HIS 28 HB3 HIS 28 14.966 -20.834 -31.089 243 HD1 HIS 28 HD1 HIS 28 13.653 -18.913 -31.946 244 HD2 HIS 28 HD2 HIS 28 12.825 -22.415 -34.023 245 HE1 HIS 28 HE1 HIS 28 12.117 -18.237 -33.819 246 H PHE 29 H PHE 29 17.551 -21.161 -32.131 247 HA PHE 29 HA PHE 29 17.440 -20.256 -34.911 248 HB2 PHE 29 HB2 PHE 29 18.866 -19.279 -32.456 249 HB3 PHE 29 HB3 PHE 29 19.408 -18.784 -34.056 250 HD1 PHE 29 HD2 PHE 29 17.336 -18.023 -35.622 251 HD2 PHE 29 HD1 PHE 29 17.475 -17.829 -31.372 252 HE1 PHE 29 HE2 PHE 29 15.630 -16.250 -35.650 253 HE2 PHE 29 HE1 PHE 29 15.768 -16.057 -31.394 254 HZ PHE 29 HZ PHE 29 14.845 -15.264 -33.535 255 H GLU 30 H GLU 30 19.119 -22.434 -32.873 256 HA GLU 30 HA GLU 30 21.578 -22.544 -34.302 257 HB2 GLU 30 HB2 GLU 30 22.205 -23.998 -32.704 258 HB3 GLU 30 HB3 GLU 30 20.701 -23.541 -31.916 259 HG2 GLU 30 HG2 GLU 30 19.587 -25.446 -33.031 260 HG3 GLU 30 HG3 GLU 30 21.148 -25.928 -33.692 261 H GLY 31 H GLY 31 18.533 -23.362 -35.253 262 HA2 GLY 31 HA2 GLY 31 18.525 -24.197 -37.621 263 HA3 GLY 31 HA3 GLY 31 19.520 -25.515 -37.021 264 H TRP 32 H TRP 32 16.606 -24.005 -35.657 265 HA TRP 32 HA TRP 32 15.296 -26.641 -35.814 266 HB2 TRP 32 HB2 TRP 32 15.935 -25.173 -33.510 267 HB3 TRP 32 HB3 TRP 32 14.201 -24.958 -33.733 268 HD1 TRP 32 HD1 TRP 32 12.760 -26.785 -32.678 269 HE1 TRP 32 HE1 TRP 32 13.127 -29.214 -31.909 270 HE3 TRP 32 HE3 TRP 32 17.592 -27.405 -34.228 271 HZ2 TRP 32 HZ2 TRP 32 15.193 -31.138 -31.953 272 HZ3 TRP 32 HZ3 TRP 32 18.691 -29.570 -33.826 273 HH2 TRP 32 HH2 TRP 32 17.515 -31.396 -32.711 274 H ARG 33 H ARG 33 15.271 -24.089 -37.511 275 HA ARG 33 HA ARG 33 12.363 -23.625 -37.441 276 HB2 ARG 33 HB2 ARG 33 12.855 -21.512 -38.659 277 HB3 ARG 33 HB3 ARG 33 13.571 -21.576 -37.054 278 HG2 ARG 33 HG2 ARG 33 15.527 -21.074 -37.952 279 HG3 ARG 33 HG3 ARG 33 15.496 -22.614 -38.814 280 HD2 ARG 33 HD2 ARG 33 14.628 -21.654 -40.748 281 HD3 ARG 33 HD3 ARG 33 14.035 -20.233 -39.890 282 HE ARG 33 HE ARG 33 16.642 -20.608 -41.007 283 HH11 ARG 33 HH11 ARG 33 14.847 -18.995 -38.498 284 HH12 ARG 33 HH12 ARG 33 15.984 -17.698 -38.338 285 HH21 ARG 33 HH21 ARG 33 18.147 -18.906 -40.806 286 HH22 ARG 33 HH22 ARG 33 17.860 -17.648 -39.651 287 H ILE 34 H ILE 34 13.515 -25.906 -38.690 288 HA ILE 34 HA ILE 34 13.877 -25.564 -41.468 289 HB ILE 34 HB ILE 34 12.942 -28.017 -39.974 290 HG12 ILE 34 HG12 ILE 34 15.725 -27.432 -40.973 291 HG13 ILE 34 HG13 ILE 34 15.198 -26.956 -39.362 292 HG21 ILE 34 HG21 ILE 34 13.475 -27.480 -42.809 293 HG22 ILE 34 HG22 ILE 34 14.263 -28.919 -42.166 294 HG23 ILE 34 HG23 ILE 34 12.512 -28.749 -42.053 295 HD11 ILE 34 HD11 ILE 34 14.484 -29.634 -39.589 296 HD12 ILE 34 HD12 ILE 34 16.085 -29.515 -40.322 297 HD13 ILE 34 HD13 ILE 34 15.828 -28.958 -38.668 298 H1 MET 101 H MET 101 6.053 6.984 -8.750 299 HA MET 101 HA MET 101 7.175 5.529 -10.938 300 HB2 MET 101 HB2 MET 101 5.572 8.080 -11.096 301 HB3 MET 101 HB3 MET 101 5.750 6.847 -12.337 302 HG2 MET 101 HG2 MET 101 4.478 5.279 -11.029 303 HG3 MET 101 HG3 MET 101 4.396 6.417 -9.686 304 HE1 MET 101 HE1 MET 101 1.830 5.058 -10.654 305 HE2 MET 101 HE2 MET 101 1.754 6.368 -9.476 306 HE3 MET 101 HE3 MET 101 0.691 6.385 -10.884 307 H ASP 102 H ASP 102 9.204 6.786 -9.448 308 HA ASP 102 HA ASP 102 10.136 8.891 -11.284 309 HB2 ASP 102 HB2 ASP 102 10.653 8.360 -8.376 310 HB3 ASP 102 HB3 ASP 102 11.825 9.268 -9.327 311 H SER 103 H SER 103 10.385 5.700 -10.924 312 HA SER 103 HA SER 103 13.180 5.661 -11.848 313 HB2 SER 103 HB2 SER 103 11.874 3.543 -10.124 314 HB3 SER 103 HB3 SER 103 13.544 3.550 -10.691 315 HG SER 103 HG SER 103 13.677 4.388 -8.694 316 H ALA 104 H ALA 104 10.851 5.838 -13.466 317 HA ALA 104 HA ALA 104 10.082 3.287 -14.460 318 HB1 ALA 104 HB1 ALA 104 9.682 5.177 -16.492 319 HB2 ALA 104 HB2 ALA 104 8.498 4.574 -15.332 320 HB3 ALA 104 HB3 ALA 104 9.423 6.031 -14.970 321 HA PRO 105 HA PRO 105 13.111 4.240 -18.096 322 HB2 PRO 105 HB2 PRO 105 14.772 6.370 -17.820 323 HB3 PRO 105 HB3 PRO 105 13.163 6.494 -18.541 324 HG2 PRO 105 HG2 PRO 105 14.049 7.155 -15.759 325 HG3 PRO 105 HG3 PRO 105 12.964 8.059 -16.832 326 HD2 PRO 105 HD2 PRO 105 12.051 6.479 -14.831 327 HD3 PRO 105 HD3 PRO 105 11.158 6.711 -16.348 328 H PHE 106 H PHE 106 14.146 4.848 -14.805 329 HA PHE 106 HA PHE 106 16.843 3.987 -15.172 330 HB2 PHE 106 HB2 PHE 106 15.297 5.129 -13.078 331 HB3 PHE 106 HB3 PHE 106 16.010 3.643 -12.460 332 HD1 PHE 106 HD2 PHE 106 18.510 3.338 -12.654 333 HD2 PHE 106 HD1 PHE 106 16.573 7.069 -13.319 334 HE1 PHE 106 HE2 PHE 106 20.650 4.505 -12.318 335 HE2 PHE 106 HE1 PHE 106 18.710 8.242 -12.985 336 HZ PHE 106 HZ PHE 106 20.752 6.960 -12.482 337 H GLU 107 H GLU 107 13.860 2.440 -14.096 338 HA GLU 107 HA GLU 107 14.882 0.032 -13.168 339 HB2 GLU 107 HB2 GLU 107 12.317 1.078 -13.889 340 HB3 GLU 107 HB3 GLU 107 12.474 -0.542 -14.552 341 HG2 GLU 107 HG2 GLU 107 13.017 -1.409 -12.345 342 HG3 GLU 107 HG3 GLU 107 12.898 0.215 -11.670 343 H LEU 108 H LEU 108 13.970 0.952 -16.470 344 HA LEU 108 HA LEU 108 14.326 -1.468 -17.753 345 HB2 LEU 108 HB2 LEU 108 14.540 1.377 -18.561 346 HB3 LEU 108 HB3 LEU 108 15.202 0.171 -19.662 347 HG LEU 108 HG LEU 108 12.943 0.777 -20.306 348 HD11 LEU 108 HD11 LEU 108 12.225 -1.837 -19.345 349 HD12 LEU 108 HD12 LEU 108 13.900 -1.813 -19.895 350 HD13 LEU 108 HD13 LEU 108 12.607 -1.308 -20.983 351 HD21 LEU 108 HD21 LEU 108 11.042 0.213 -18.840 352 HD22 LEU 108 HD22 LEU 108 12.066 1.482 -18.168 353 HD23 LEU 108 HD23 LEU 108 12.179 -0.165 -17.545 354 H PHE 109 H PHE 109 16.732 0.871 -16.713 355 HA PHE 109 HA PHE 109 18.965 0.024 -18.085 356 HB2 PHE 109 HB2 PHE 109 18.636 1.914 -16.294 357 HB3 PHE 109 HB3 PHE 109 19.200 0.681 -15.171 358 HD1 PHE 109 HD2 PHE 109 20.178 1.845 -18.584 359 HD2 PHE 109 HD1 PHE 109 21.408 0.883 -14.624 360 HE1 PHE 109 HE2 PHE 109 22.505 2.372 -19.183 361 HE2 PHE 109 HE1 PHE 109 23.737 1.409 -15.216 362 HZ PHE 109 HZ PHE 109 24.289 2.153 -17.498 363 H PHE 110 H PHE 110 17.409 -1.439 -15.299 364 HA PHE 110 HA PHE 110 19.503 -3.409 -14.965 365 HB2 PHE 110 HB2 PHE 110 18.435 -2.691 -12.953 366 HB3 PHE 110 HB3 PHE 110 16.834 -2.991 -13.619 367 HD1 PHE 110 HD2 PHE 110 15.973 -5.261 -13.814 368 HD2 PHE 110 HD1 PHE 110 19.775 -4.473 -12.071 369 HE1 PHE 110 HE2 PHE 110 15.995 -7.523 -12.846 370 HE2 PHE 110 HE1 PHE 110 19.803 -6.734 -11.101 371 HZ PHE 110 HZ PHE 110 17.911 -8.262 -11.488 372 H MET 111 H MET 111 16.443 -3.124 -16.575 373 HA MET 111 HA MET 111 15.946 -5.909 -16.898 374 HB2 MET 111 HB2 MET 111 14.828 -3.387 -18.007 375 HB3 MET 111 HB3 MET 111 14.546 -4.862 -18.922 376 HG2 MET 111 HG2 MET 111 12.689 -4.466 -17.461 377 HG3 MET 111 HG3 MET 111 13.568 -5.891 -16.911 378 HE1 MET 111 HE1 MET 111 11.761 -2.880 -15.778 379 HE2 MET 111 HE2 MET 111 11.450 -4.478 -15.101 380 HE3 MET 111 HE3 MET 111 12.020 -3.174 -14.058 381 H ILE 112 H ILE 112 17.820 -3.539 -18.631 382 HA ILE 112 HA ILE 112 18.174 -5.232 -20.953 383 HB ILE 112 HB ILE 112 19.395 -2.583 -20.182 384 HG12 ILE 112 HG12 ILE 112 17.959 -2.558 -22.646 385 HG13 ILE 112 HG13 ILE 112 16.951 -3.348 -21.438 386 HG21 ILE 112 HG21 ILE 112 20.028 -2.739 -22.749 387 HG22 ILE 112 HG22 ILE 112 21.093 -3.358 -21.488 388 HG23 ILE 112 HG23 ILE 112 20.051 -4.464 -22.383 389 HD11 ILE 112 HD11 ILE 112 17.274 -0.620 -21.843 390 HD12 ILE 112 HD12 ILE 112 16.462 -1.410 -20.491 391 HD13 ILE 112 HD13 ILE 112 18.166 -0.972 -20.363 392 H ASN 113 H ASN 113 20.375 -3.821 -18.520 393 HA ASN 113 HA ASN 113 22.669 -5.193 -19.205 394 HB2 ASN 113 HB2 ASN 113 21.652 -4.009 -16.656 395 HB3 ASN 113 HB3 ASN 113 23.106 -5.002 -16.601 396 HD21 ASN 113 HD21 ASN 113 21.863 -1.946 -17.166 397 HD22 ASN 113 HD22 ASN 113 23.270 -1.218 -17.857 398 H THR 114 H THR 114 20.293 -6.139 -16.720 399 HA THR 114 HA THR 114 21.410 -8.556 -15.975 400 HB THR 114 HB THR 114 18.462 -7.908 -16.170 401 HG1 THR 114 HG1 THR 114 19.978 -6.552 -14.826 402 HG21 THR 114 HG21 THR 114 18.136 -9.640 -14.512 403 HG22 THR 114 HG22 THR 114 19.871 -9.953 -14.451 404 HG23 THR 114 HG23 THR 114 18.959 -10.325 -15.914 405 H SER 115 H SER 115 19.536 -7.761 -18.815 406 HA SER 115 HA SER 115 18.957 -10.432 -19.601 407 HB2 SER 115 HB2 SER 115 17.960 -8.105 -20.397 408 HB3 SER 115 HB3 SER 115 19.207 -8.258 -21.635 409 HG SER 115 HG SER 115 16.838 -9.518 -21.451 410 H ILE 116 H ILE 116 21.203 -8.080 -21.072 411 HA ILE 116 HA ILE 116 22.541 -9.806 -22.751 412 HB ILE 116 HB ILE 116 23.727 -7.457 -21.267 413 HG12 ILE 116 HG12 ILE 116 22.704 -7.462 -24.097 414 HG13 ILE 116 HG13 ILE 116 21.624 -7.149 -22.743 415 HG21 ILE 116 HG21 ILE 116 25.215 -7.415 -23.354 416 HG22 ILE 116 HG22 ILE 116 25.553 -8.632 -22.124 417 HG23 ILE 116 HG23 ILE 116 24.691 -9.082 -23.596 418 HD11 ILE 116 HD11 ILE 116 23.833 -5.494 -23.834 419 HD12 ILE 116 HD12 ILE 116 22.215 -5.025 -23.310 420 HD13 ILE 116 HD13 ILE 116 23.460 -5.383 -22.114 421 H LEU 117 H LEU 117 22.850 -9.441 -19.306 422 HA LEU 117 HA LEU 117 25.318 -10.932 -19.145 423 HB2 LEU 117 HB2 LEU 117 23.792 -9.258 -17.426 424 HB3 LEU 117 HB3 LEU 117 24.002 -10.817 -16.632 425 HG LEU 117 HG LEU 117 26.264 -9.131 -17.700 426 HD11 LEU 117 HD11 LEU 117 24.748 -8.396 -15.617 427 HD12 LEU 117 HD12 LEU 117 26.485 -8.104 -15.702 428 HD13 LEU 117 HD13 LEU 117 25.867 -9.486 -14.797 429 HD21 LEU 117 HD21 LEU 117 26.965 -10.977 -15.637 430 HD22 LEU 117 HD22 LEU 117 27.559 -10.885 -17.295 431 HD23 LEU 117 HD23 LEU 117 26.121 -11.838 -16.924 432 H LEU 118 H LEU 118 21.996 -11.480 -17.960 433 HA LEU 118 HA LEU 118 22.283 -14.083 -17.101 434 HB2 LEU 118 HB2 LEU 118 19.973 -12.560 -18.235 435 HB3 LEU 118 HB3 LEU 118 19.798 -14.269 -17.843 436 HG LEU 118 HG LEU 118 20.322 -11.972 -15.975 437 HD11 LEU 118 HD11 LEU 118 18.079 -13.788 -16.588 438 HD12 LEU 118 HD12 LEU 118 18.070 -12.117 -16.027 439 HD13 LEU 118 HD13 LEU 118 18.354 -13.429 -14.883 440 HD21 LEU 118 HD21 LEU 118 21.064 -14.804 -15.708 441 HD22 LEU 118 HD22 LEU 118 20.161 -14.132 -14.350 442 HD23 LEU 118 HD23 LEU 118 21.674 -13.382 -14.861 443 H ILE 119 H ILE 119 21.775 -12.880 -20.367 444 HA ILE 119 HA ILE 119 21.201 -15.310 -21.636 445 HB ILE 119 HB ILE 119 22.609 -12.873 -22.730 446 HG12 ILE 119 HG12 ILE 119 19.790 -13.648 -23.359 447 HG13 ILE 119 HG13 ILE 119 20.131 -12.879 -21.812 448 HG21 ILE 119 HG21 ILE 119 23.130 -14.769 -24.119 449 HG22 ILE 119 HG22 ILE 119 21.435 -15.250 -24.163 450 HG23 ILE 119 HG23 ILE 119 21.948 -13.757 -24.948 451 HD11 ILE 119 HD11 ILE 119 19.930 -11.723 -24.446 452 HD12 ILE 119 HD12 ILE 119 19.930 -10.942 -22.865 453 HD13 ILE 119 HD13 ILE 119 21.457 -11.307 -23.668 454 H PHE 120 H PHE 120 24.324 -13.581 -21.680 455 HA PHE 120 HA PHE 120 25.794 -15.760 -22.678 456 HB2 PHE 120 HB2 PHE 120 26.516 -13.359 -22.733 457 HB3 PHE 120 HB3 PHE 120 26.860 -13.475 -21.010 458 HD1 PHE 120 HD2 PHE 120 27.602 -15.476 -24.077 459 HD2 PHE 120 HD1 PHE 120 29.071 -13.719 -20.489 460 HE1 PHE 120 HE2 PHE 120 29.856 -16.319 -24.590 461 HE2 PHE 120 HE1 PHE 120 31.327 -14.559 -20.997 462 HZ PHE 120 HZ PHE 120 31.722 -15.862 -23.049 463 H ILE 121 H ILE 121 24.726 -14.962 -19.495 464 HA ILE 121 HA ILE 121 26.634 -16.517 -18.056 465 HB ILE 121 HB ILE 121 24.082 -15.149 -17.391 466 HG12 ILE 121 HG12 ILE 121 26.731 -15.289 -15.940 467 HG13 ILE 121 HG13 ILE 121 26.361 -14.111 -17.195 468 HG21 ILE 121 HG21 ILE 121 24.204 -16.186 -15.084 469 HG22 ILE 121 HG22 ILE 121 23.577 -17.214 -16.371 470 HG23 ILE 121 HG23 ILE 121 25.233 -17.425 -15.801 471 HD11 ILE 121 HD11 ILE 121 24.978 -14.401 -14.540 472 HD12 ILE 121 HD12 ILE 121 26.076 -13.111 -15.032 473 HD13 ILE 121 HD13 ILE 121 24.503 -13.275 -15.811 474 H PHE 122 H PHE 122 23.215 -17.080 -18.898 475 HA PHE 122 HA PHE 122 23.187 -19.749 -17.933 476 HB2 PHE 122 HB2 PHE 122 21.347 -18.367 -19.898 477 HB3 PHE 122 HB3 PHE 122 21.031 -19.925 -19.142 478 HD1 PHE 122 HD2 PHE 122 21.980 -19.341 -16.380 479 HD2 PHE 122 HD1 PHE 122 19.616 -17.044 -19.072 480 HE1 PHE 122 HE2 PHE 122 20.925 -18.199 -14.473 481 HE2 PHE 122 HE1 PHE 122 18.556 -15.898 -17.170 482 HZ PHE 122 HZ PHE 122 19.210 -16.476 -14.867 483 H ILE 123 H ILE 123 23.274 -18.425 -21.241 484 HA ILE 123 HA ILE 123 23.396 -20.756 -22.684 485 HB ILE 123 HB ILE 123 24.449 -18.018 -23.137 486 HG12 ILE 123 HG12 ILE 123 23.171 -18.802 -25.401 487 HG13 ILE 123 HG13 ILE 123 22.391 -19.845 -24.216 488 HG21 ILE 123 HG21 ILE 123 25.366 -20.440 -24.654 489 HG22 ILE 123 HG22 ILE 123 25.331 -18.838 -25.388 490 HG23 ILE 123 HG23 ILE 123 26.334 -19.136 -23.968 491 HD11 ILE 123 HD11 ILE 123 21.274 -17.634 -24.697 492 HD12 ILE 123 HD12 ILE 123 21.570 -18.010 -22.998 493 HD13 ILE 123 HD13 ILE 123 22.621 -16.877 -23.847 494 H VAL 124 H VAL 124 26.157 -18.959 -21.332 495 HA VAL 124 HA VAL 124 28.122 -20.812 -22.171 496 HB VAL 124 HB VAL 124 28.140 -18.698 -20.024 497 HG11 VAL 124 HG11 VAL 124 29.770 -20.025 -19.136 498 HG12 VAL 124 HG12 VAL 124 30.166 -20.768 -20.687 499 HG13 VAL 124 HG13 VAL 124 30.732 -19.138 -20.319 500 HG21 VAL 124 HG21 VAL 124 29.395 -17.409 -21.550 501 HG22 VAL 124 HG22 VAL 124 29.685 -18.793 -22.603 502 HG23 VAL 124 HG23 VAL 124 28.069 -18.096 -22.488 503 H LEU 125 H LEU 125 26.343 -20.412 -19.135 504 HA LEU 125 HA LEU 125 27.669 -22.278 -17.572 505 HB2 LEU 125 HB2 LEU 125 24.940 -21.130 -17.617 506 HB3 LEU 125 HB3 LEU 125 25.175 -22.591 -16.661 507 HG LEU 125 HG LEU 125 26.553 -19.934 -16.296 508 HD11 LEU 125 HD11 LEU 125 25.458 -20.048 -14.076 509 HD12 LEU 125 HD12 LEU 125 24.596 -21.489 -14.614 510 HD13 LEU 125 HD13 LEU 125 24.318 -19.945 -15.418 511 HD21 LEU 125 HD21 LEU 125 27.407 -22.593 -15.576 512 HD22 LEU 125 HD22 LEU 125 27.135 -21.604 -14.142 513 HD23 LEU 125 HD23 LEU 125 28.248 -21.053 -15.395 514 H LEU 126 H LEU 126 25.121 -22.755 -19.963 515 HA LEU 126 HA LEU 126 24.444 -25.389 -19.476 516 HB2 LEU 126 HB2 LEU 126 24.416 -23.607 -21.824 517 HB3 LEU 126 HB3 LEU 126 24.346 -25.333 -22.171 518 HG LEU 126 HG LEU 126 22.117 -24.395 -22.114 519 HD11 LEU 126 HD11 LEU 126 23.006 -26.585 -20.601 520 HD12 LEU 126 HD12 LEU 126 21.391 -26.301 -21.247 521 HD13 LEU 126 HD13 LEU 126 21.796 -25.762 -19.618 522 HD21 LEU 126 HD21 LEU 126 21.255 -23.583 -19.864 523 HD22 LEU 126 HD22 LEU 126 22.312 -22.488 -20.754 524 HD23 LEU 126 HD23 LEU 126 22.947 -23.418 -19.396 525 H ILE 127 H ILE 127 26.883 -24.270 -21.831 526 HA ILE 127 HA ILE 127 27.900 -26.771 -22.496 527 HB ILE 127 HB ILE 127 28.920 -23.994 -22.677 528 HG12 ILE 127 HG12 ILE 127 29.394 -25.790 -24.909 529 HG13 ILE 127 HG13 ILE 127 27.719 -25.861 -24.372 530 HG21 ILE 127 HG21 ILE 127 30.694 -26.418 -22.797 531 HG22 ILE 127 HG22 ILE 127 31.101 -24.897 -23.589 532 HG23 ILE 127 HG23 ILE 127 30.907 -24.953 -21.838 533 HD11 ILE 127 HD11 ILE 127 29.186 -23.707 -25.719 534 HD12 ILE 127 HD12 ILE 127 27.475 -24.134 -25.776 535 HD13 ILE 127 HD13 ILE 127 28.105 -23.194 -24.424 536 H HIS 128 H HIS 128 29.085 -24.473 -20.048 537 HA HIS 128 HA HIS 128 31.266 -25.832 -19.099 538 HB2 HIS 128 HB2 HIS 128 30.756 -23.646 -18.253 539 HB3 HIS 128 HB3 HIS 128 29.228 -24.201 -17.578 540 HD1 HIS 128 HD1 HIS 128 29.521 -23.986 -15.125 541 HD2 HIS 128 HD2 HIS 128 32.822 -25.737 -16.939 542 HE1 HIS 128 HE1 HIS 128 31.042 -24.666 -13.241 543 H PHE 129 H PHE 129 27.878 -26.502 -18.507 544 HA PHE 129 HA PHE 129 28.566 -28.646 -16.641 545 HB2 PHE 129 HB2 PHE 129 26.017 -27.236 -17.360 546 HB3 PHE 129 HB3 PHE 129 25.960 -28.813 -16.579 547 HD1 PHE 129 HD2 PHE 129 27.652 -28.963 -14.482 548 HD2 PHE 129 HD1 PHE 129 25.847 -25.416 -15.991 549 HE1 PHE 129 HE2 PHE 129 27.943 -27.886 -12.289 550 HE2 PHE 129 HE1 PHE 129 26.136 -24.333 -13.801 551 HZ PHE 129 HZ PHE 129 27.184 -25.569 -11.946 552 H GLU 130 H GLU 130 27.670 -28.125 -19.913 553 HA GLU 130 HA GLU 130 26.524 -30.679 -20.434 554 HB2 GLU 130 HB2 GLU 130 26.176 -29.880 -22.512 555 HB3 GLU 130 HB3 GLU 130 26.669 -28.340 -21.821 556 HG2 GLU 130 HG2 GLU 130 28.987 -28.806 -22.543 557 HG3 GLU 130 HG3 GLU 130 28.412 -30.276 -23.327 558 H GLY 131 H GLY 131 29.587 -29.876 -19.551 559 HA2 GLY 131 HA2 GLY 131 31.031 -31.924 -19.369 560 HA3 GLY 131 HA3 GLY 131 30.766 -32.101 -21.098 561 H TRP 132 H TRP 132 31.496 -29.209 -19.169 562 HA TRP 132 HA TRP 132 34.015 -28.949 -20.670 563 HB2 TRP 132 HB2 TRP 132 31.758 -27.268 -20.876 564 HB3 TRP 132 HB3 TRP 132 32.961 -26.369 -19.955 565 HD1 TRP 132 HD1 TRP 132 34.655 -25.075 -21.368 566 HE1 TRP 132 HE1 TRP 132 35.472 -25.161 -23.807 567 HE3 TRP 132 HE3 TRP 132 32.100 -29.218 -22.932 568 HZ2 TRP 132 HZ2 TRP 132 35.084 -26.773 -26.092 569 HZ3 TRP 132 HZ3 TRP 132 32.378 -29.965 -25.260 570 HH2 TRP 132 HH2 TRP 132 33.839 -28.766 -26.806 571 H ARG 133 H ARG 133 33.143 -29.815 -17.863 572 HA ARG 133 HA ARG 133 34.820 -27.925 -16.350 573 HB2 ARG 133 HB2 ARG 133 33.679 -28.839 -14.326 574 HB3 ARG 133 HB3 ARG 133 32.601 -28.001 -15.434 575 HG2 ARG 133 HG2 ARG 133 31.288 -29.781 -15.400 576 HG3 ARG 133 HG3 ARG 133 32.559 -30.678 -16.233 577 HD2 ARG 133 HD2 ARG 133 33.336 -31.644 -14.293 578 HD3 ARG 133 HD3 ARG 133 32.713 -30.347 -13.274 579 HE ARG 133 HE ARG 133 31.333 -32.726 -14.076 580 HH11 ARG 133 HH11 ARG 133 30.941 -29.405 -13.110 581 HH12 ARG 133 HH12 ARG 133 29.329 -29.633 -12.514 582 HH21 ARG 133 HH21 ARG 133 29.213 -33.039 -13.296 583 HH22 ARG 133 HH22 ARG 133 28.348 -31.700 -12.620 584 H ILE 134 H ILE 134 35.971 -29.933 -17.965 585 HA ILE 134 HA ILE 134 36.591 -32.311 -16.628 586 HB ILE 134 HB ILE 134 38.320 -30.792 -18.584 587 HG12 ILE 134 HG12 ILE 134 36.474 -33.103 -19.174 588 HG13 ILE 134 HG13 ILE 134 35.948 -31.427 -19.296 589 HG21 ILE 134 HG21 ILE 134 38.603 -33.380 -17.226 590 HG22 ILE 134 HG22 ILE 134 38.872 -33.416 -18.968 591 HG23 ILE 134 HG23 ILE 134 39.826 -32.337 -17.951 592 HD11 ILE 134 HD11 ILE 134 38.332 -31.563 -20.737 593 HD12 ILE 134 HD12 ILE 134 37.428 -33.016 -21.166 594 HD13 ILE 134 HD13 ILE 134 36.694 -31.426 -21.375 Start of MODEL 2 1 H1 MET 1 H MET 1 1.808 0.000 0.855 2 HA MET 1 HA MET 1 1.641 -0.721 -1.908 3 HB2 MET 1 HB2 MET 1 1.557 2.069 -1.222 4 HB3 MET 1 HB3 MET 1 3.054 1.718 -2.075 5 HG2 MET 1 HG2 MET 1 1.499 2.335 -3.721 6 HG3 MET 1 HG3 MET 1 1.649 0.583 -3.830 7 HE1 MET 1 HE1 MET 1 -0.918 2.791 -1.260 8 HE2 MET 1 HE2 MET 1 -0.158 3.566 -2.650 9 HE3 MET 1 HE3 MET 1 -1.872 3.148 -2.699 10 H ASP 2 H ASP 2 3.189 -2.236 -1.710 11 HA ASP 2 HA ASP 2 5.914 -1.348 -1.325 12 HB2 ASP 2 HB2 ASP 2 4.620 -3.333 0.551 13 HB3 ASP 2 HB3 ASP 2 6.364 -3.147 0.386 14 H SER 3 H SER 3 6.992 -2.231 -2.947 15 HA SER 3 HA SER 3 6.096 -4.822 -4.005 16 HB2 SER 3 HB2 SER 3 7.613 -4.101 -5.978 17 HB3 SER 3 HB3 SER 3 6.068 -3.277 -5.771 18 HG SER 3 HG SER 3 8.666 -2.343 -5.331 19 H ALA 4 H ALA 4 7.670 -4.687 -1.629 20 HA ALA 4 HA ALA 4 10.415 -5.184 -2.212 21 HB1 ALA 4 HB1 ALA 4 10.004 -6.338 0.229 22 HB2 ALA 4 HB2 ALA 4 10.381 -4.637 -0.042 23 HB3 ALA 4 HB3 ALA 4 8.705 -5.148 0.158 24 HA PRO 5 HA PRO 5 9.279 -9.820 -1.502 25 HB2 PRO 5 HB2 PRO 5 6.648 -10.453 -1.293 26 HB3 PRO 5 HB3 PRO 5 7.645 -10.019 0.101 27 HG2 PRO 5 HG2 PRO 5 5.728 -8.328 -1.457 28 HG3 PRO 5 HG3 PRO 5 5.959 -8.430 0.298 29 HD2 PRO 5 HD2 PRO 5 7.002 -6.426 -1.194 30 HD3 PRO 5 HD3 PRO 5 7.803 -7.049 0.263 31 H PHE 6 H PHE 6 6.742 -8.078 -3.285 32 HA PHE 6 HA PHE 6 6.302 -10.033 -5.251 33 HB2 PHE 6 HB2 PHE 6 4.758 -8.164 -4.861 34 HB3 PHE 6 HB3 PHE 6 5.971 -7.032 -5.450 35 HD1 PHE 6 HD2 PHE 6 4.610 -10.280 -6.694 36 HD2 PHE 6 HD1 PHE 6 5.404 -6.175 -7.494 37 HE1 PHE 6 HE2 PHE 6 3.756 -10.564 -8.984 38 HE2 PHE 6 HE1 PHE 6 4.550 -6.453 -9.785 39 HZ PHE 6 HZ PHE 6 3.726 -8.650 -10.533 40 H GLU 7 H GLU 7 8.805 -7.670 -4.862 41 HA GLU 7 HA GLU 7 9.702 -7.554 -7.541 42 HB2 GLU 7 HB2 GLU 7 10.614 -6.625 -4.936 43 HB3 GLU 7 HB3 GLU 7 11.947 -7.128 -5.965 44 HG2 GLU 7 HG2 GLU 7 11.341 -5.574 -7.654 45 HG3 GLU 7 HG3 GLU 7 9.814 -5.207 -6.852 46 H LEU 8 H LEU 8 10.909 -9.413 -4.750 47 HA LEU 8 HA LEU 8 12.947 -10.800 -5.970 48 HB2 LEU 8 HB2 LEU 8 11.157 -11.302 -3.676 49 HB3 LEU 8 HB3 LEU 8 12.011 -12.704 -4.317 50 HG LEU 8 HG LEU 8 13.184 -11.690 -2.419 51 HD11 LEU 8 HD11 LEU 8 15.000 -11.000 -4.625 52 HD12 LEU 8 HD12 LEU 8 14.268 -12.601 -4.719 53 HD13 LEU 8 HD13 LEU 8 15.203 -12.142 -3.296 54 HD21 LEU 8 HD21 LEU 8 14.223 -9.490 -2.651 55 HD22 LEU 8 HD22 LEU 8 12.464 -9.381 -2.729 56 HD23 LEU 8 HD23 LEU 8 13.421 -9.272 -4.207 57 H PHE 9 H PHE 9 9.491 -11.518 -5.997 58 HA PHE 9 HA PHE 9 9.454 -14.032 -7.096 59 HB2 PHE 9 HB2 PHE 9 7.626 -11.736 -7.057 60 HB3 PHE 9 HB3 PHE 9 7.381 -12.818 -8.425 61 HD1 PHE 9 HD1 PHE 9 7.264 -15.362 -7.828 62 HD2 PHE 9 HD2 PHE 9 6.582 -12.200 -5.062 63 HE1 PHE 9 HE1 PHE 9 6.000 -16.903 -6.385 64 HE2 PHE 9 HE2 PHE 9 5.317 -13.736 -3.614 65 HZ PHE 9 HZ PHE 9 5.025 -16.090 -4.274 66 H PHE 10 H PHE 10 9.615 -10.948 -8.860 67 HA PHE 10 HA PHE 10 9.791 -12.135 -11.427 68 HB2 PHE 10 HB2 PHE 10 9.051 -9.872 -11.304 69 HB3 PHE 10 HB3 PHE 10 10.482 -9.383 -10.403 70 HD1 PHE 10 HD1 PHE 10 12.625 -9.100 -11.527 71 HD2 PHE 10 HD2 PHE 10 9.102 -10.122 -13.687 72 HE1 PHE 10 HE1 PHE 10 13.738 -8.476 -13.631 73 HE2 PHE 10 HE2 PHE 10 10.210 -9.501 -15.794 74 HZ PHE 10 HZ PHE 10 12.530 -8.677 -15.768 75 H MET 11 H MET 11 12.194 -11.038 -9.092 76 HA MET 11 HA MET 11 14.477 -11.204 -10.680 77 HB2 MET 11 HB2 MET 11 13.917 -11.324 -7.766 78 HB3 MET 11 HB3 MET 11 15.488 -11.908 -8.298 79 HG2 MET 11 HG2 MET 11 15.607 -9.578 -7.657 80 HG3 MET 11 HG3 MET 11 15.925 -9.769 -9.379 81 HE1 MET 11 HE1 MET 11 15.361 -7.114 -7.943 82 HE2 MET 11 HE2 MET 11 13.754 -6.417 -8.153 83 HE3 MET 11 HE3 MET 11 14.049 -7.582 -6.861 84 H ILE 12 H ILE 12 12.766 -13.705 -8.871 85 HA ILE 12 HA ILE 12 14.708 -15.733 -9.571 86 HB ILE 12 HB ILE 12 12.054 -15.902 -8.146 87 HG12 ILE 12 HG12 ILE 12 14.230 -16.788 -6.567 88 HG13 ILE 12 HG13 ILE 12 14.736 -15.282 -7.325 89 HG21 ILE 12 HG21 ILE 12 12.225 -18.000 -9.137 90 HG22 ILE 12 HG22 ILE 12 13.980 -18.041 -8.974 91 HG23 ILE 12 HG23 ILE 12 12.957 -18.240 -7.551 92 HD11 ILE 12 HD11 ILE 12 12.051 -15.106 -6.267 93 HD12 ILE 12 HD12 ILE 12 13.229 -15.550 -5.032 94 HD13 ILE 12 HD13 ILE 12 13.454 -14.078 -5.977 95 H ASN 13 H ASN 13 11.241 -15.209 -10.233 96 HA ASN 13 HA ASN 13 10.807 -17.278 -11.993 97 HB2 ASN 13 HB2 ASN 13 9.621 -14.534 -11.752 98 HB3 ASN 13 HB3 ASN 13 9.137 -15.582 -13.082 99 HD21 ASN 13 HD21 ASN 13 8.480 -17.821 -12.405 100 HD22 ASN 13 HD22 ASN 13 7.510 -17.951 -10.981 101 H THR 14 H THR 14 11.932 -13.996 -12.775 102 HA THR 14 HA THR 14 12.108 -14.202 -15.519 103 HB THR 14 HB THR 14 13.893 -12.708 -13.596 104 HG1 THR 14 HG1 THR 14 11.538 -12.201 -13.985 105 HG21 THR 14 HG21 THR 14 15.196 -12.998 -15.581 106 HG22 THR 14 HG22 THR 14 14.541 -11.360 -15.614 107 HG23 THR 14 HG23 THR 14 13.814 -12.621 -16.610 108 H SER 15 H SER 15 14.287 -15.456 -13.071 109 HA SER 15 HA SER 15 16.412 -16.123 -14.833 110 HB2 SER 15 HB2 SER 15 16.297 -15.960 -12.185 111 HB3 SER 15 HB3 SER 15 15.964 -17.686 -12.327 112 HG SER 15 HG SER 15 18.291 -16.677 -12.282 113 H ILE 16 H ILE 16 14.142 -18.286 -13.127 114 HA ILE 16 HA ILE 16 14.722 -20.618 -14.469 115 HB ILE 16 HB ILE 16 12.010 -19.737 -13.471 116 HG12 ILE 16 HG12 ILE 16 13.033 -21.566 -11.687 117 HG13 ILE 16 HG13 ILE 16 14.465 -20.654 -12.152 118 HG21 ILE 16 HG21 ILE 16 11.820 -22.324 -13.211 119 HG22 ILE 16 HG22 ILE 16 11.504 -21.569 -14.773 120 HG23 ILE 16 HG23 ILE 16 13.056 -22.349 -14.468 121 HD11 ILE 16 HD11 ILE 16 12.564 -19.961 -10.247 122 HD12 ILE 16 HD12 ILE 16 13.863 -18.949 -10.878 123 HD13 ILE 16 HD13 ILE 16 12.261 -18.888 -11.612 124 H LEU 17 H LEU 17 12.877 -17.883 -15.566 125 HA LEU 17 HA LEU 17 11.725 -19.278 -17.817 126 HB2 LEU 17 HB2 LEU 17 11.304 -16.808 -16.472 127 HB3 LEU 17 HB3 LEU 17 11.624 -16.462 -18.170 128 HG LEU 17 HG LEU 17 9.475 -18.322 -17.154 129 HD11 LEU 17 HD11 LEU 17 8.037 -16.421 -18.175 130 HD12 LEU 17 HD12 LEU 17 9.470 -15.430 -17.908 131 HD13 LEU 17 HD13 LEU 17 8.691 -16.237 -16.547 132 HD21 LEU 17 HD21 LEU 17 10.684 -18.331 -19.602 133 HD22 LEU 17 HD22 LEU 17 9.322 -17.242 -19.870 134 HD23 LEU 17 HD23 LEU 17 9.039 -18.881 -19.279 135 H LEU 18 H LEU 18 13.983 -16.529 -17.510 136 HA LEU 18 HA LEU 18 14.765 -16.349 -20.148 137 HB2 LEU 18 HB2 LEU 18 16.198 -15.777 -17.579 138 HB3 LEU 18 HB3 LEU 18 16.994 -15.537 -19.132 139 HG LEU 18 HG LEU 18 14.590 -14.090 -18.043 140 HD11 LEU 18 HD11 LEU 18 16.318 -12.869 -17.256 141 HD12 LEU 18 HD12 LEU 18 16.302 -12.209 -18.891 142 HD13 LEU 18 HD13 LEU 18 17.446 -13.481 -18.466 143 HD21 LEU 18 HD21 LEU 18 15.378 -14.592 -20.811 144 HD22 LEU 18 HD22 LEU 18 15.198 -12.882 -20.421 145 HD23 LEU 18 HD23 LEU 18 13.855 -13.994 -20.154 146 H ILE 19 H ILE 19 15.887 -18.560 -17.656 147 HA ILE 19 HA ILE 19 18.127 -19.596 -18.991 148 HB ILE 19 HB ILE 19 16.292 -20.925 -16.995 149 HG12 ILE 19 HG12 ILE 19 19.069 -19.968 -16.421 150 HG13 ILE 19 HG13 ILE 19 17.759 -18.795 -16.481 151 HG21 ILE 19 HG21 ILE 19 18.151 -22.509 -16.635 152 HG22 ILE 19 HG22 ILE 19 17.458 -22.625 -18.251 153 HG23 ILE 19 HG23 ILE 19 18.994 -21.795 -18.010 154 HD11 ILE 19 HD11 ILE 19 16.718 -20.746 -14.880 155 HD12 ILE 19 HD12 ILE 19 18.426 -20.759 -14.440 156 HD13 ILE 19 HD13 ILE 19 17.496 -19.265 -14.323 157 H PHE 20 H PHE 20 14.956 -21.193 -18.620 158 HA PHE 20 HA PHE 20 15.422 -23.131 -20.598 159 HB2 PHE 20 HB2 PHE 20 13.679 -23.268 -18.806 160 HB3 PHE 20 HB3 PHE 20 12.736 -22.077 -19.696 161 HD1 PHE 20 HD2 PHE 20 14.519 -25.277 -20.430 162 HD2 PHE 20 HD1 PHE 20 11.014 -22.916 -20.941 163 HE1 PHE 20 HE2 PHE 20 13.501 -27.082 -21.757 164 HE2 PHE 20 HE1 PHE 20 9.990 -24.718 -22.267 165 HZ PHE 20 HZ PHE 20 11.234 -26.803 -22.678 166 H ILE 21 H ILE 21 14.419 -19.836 -20.800 167 HA ILE 21 HA ILE 21 13.181 -19.974 -23.365 168 HB ILE 21 HB ILE 21 14.081 -17.790 -21.562 169 HG12 ILE 21 HG12 ILE 21 11.560 -18.154 -23.191 170 HG13 ILE 21 HG13 ILE 21 11.777 -18.785 -21.562 171 HG21 ILE 21 HG21 ILE 21 13.708 -17.479 -24.528 172 HG22 ILE 21 HG22 ILE 21 13.511 -16.139 -23.400 173 HG23 ILE 21 HG23 ILE 21 15.068 -16.957 -23.535 174 HD11 ILE 21 HD11 ILE 21 11.704 -15.908 -22.421 175 HD12 ILE 21 HD12 ILE 21 10.556 -16.765 -21.391 176 HD13 ILE 21 HD13 ILE 21 12.188 -16.436 -20.809 177 H PHE 22 H PHE 22 16.366 -18.779 -22.294 178 HA PHE 22 HA PHE 22 17.336 -18.364 -24.931 179 HB2 PHE 22 HB2 PHE 22 18.850 -18.683 -22.330 180 HB3 PHE 22 HB3 PHE 22 19.540 -18.098 -23.841 181 HD1 PHE 22 HD1 PHE 22 17.244 -16.381 -24.739 182 HD2 PHE 22 HD2 PHE 22 19.143 -16.811 -20.954 183 HE1 PHE 22 HE1 PHE 22 16.584 -14.085 -24.151 184 HE2 PHE 22 HE2 PHE 22 18.486 -14.516 -20.360 185 HZ PHE 22 HZ PHE 22 17.204 -13.150 -21.959 186 H ILE 23 H ILE 23 18.010 -20.889 -22.511 187 HA ILE 23 HA ILE 23 19.768 -22.451 -23.931 188 HB ILE 23 HB ILE 23 17.768 -23.028 -21.816 189 HG12 ILE 23 HG12 ILE 23 20.063 -24.218 -21.063 190 HG13 ILE 23 HG13 ILE 23 20.711 -23.041 -22.200 191 HG21 ILE 23 HG21 ILE 23 17.308 -24.943 -23.078 192 HG22 ILE 23 HG22 ILE 23 18.988 -25.121 -23.584 193 HG23 ILE 23 HG23 ILE 23 18.527 -25.470 -21.918 194 HD11 ILE 23 HD11 ILE 23 18.878 -22.302 -19.940 195 HD12 ILE 23 HD12 ILE 23 20.636 -22.317 -19.805 196 HD13 ILE 23 HD13 ILE 23 19.849 -21.230 -20.948 197 H VAL 24 H VAL 24 16.216 -22.659 -23.974 198 HA VAL 24 HA VAL 24 16.106 -24.741 -25.898 199 HB VAL 24 HB VAL 24 14.049 -22.741 -24.975 200 HG11 VAL 24 HG11 VAL 24 12.462 -24.435 -26.144 201 HG12 VAL 24 HG12 VAL 24 13.250 -23.178 -27.101 202 HG13 VAL 24 HG13 VAL 24 13.883 -24.825 -27.112 203 HG21 VAL 24 HG21 VAL 24 13.386 -24.296 -23.481 204 HG22 VAL 24 HG22 VAL 24 13.704 -25.641 -24.577 205 HG23 VAL 24 HG23 VAL 24 15.032 -24.897 -23.685 206 H LEU 25 H LEU 25 16.001 -21.222 -26.116 207 HA LEU 25 HA LEU 25 15.269 -20.981 -28.803 208 HB2 LEU 25 HB2 LEU 25 16.672 -19.275 -26.827 209 HB3 LEU 25 HB3 LEU 25 16.827 -18.834 -28.526 210 HG LEU 25 HG LEU 25 14.259 -19.054 -26.957 211 HD11 LEU 25 HD11 LEU 25 15.762 -16.692 -28.070 212 HD12 LEU 25 HD12 LEU 25 15.497 -17.077 -26.369 213 HD13 LEU 25 HD13 LEU 25 14.135 -16.624 -27.394 214 HD21 LEU 25 HD21 LEU 25 13.784 -17.748 -29.360 215 HD22 LEU 25 HD22 LEU 25 13.274 -19.379 -28.925 216 HD23 LEU 25 HD23 LEU 25 14.786 -19.131 -29.800 217 H LEU 26 H LEU 26 18.370 -21.639 -27.306 218 HA LEU 26 HA LEU 26 20.069 -21.142 -29.454 219 HB2 LEU 26 HB2 LEU 26 20.159 -22.781 -27.008 220 HB3 LEU 26 HB3 LEU 26 21.266 -23.267 -28.290 221 HG LEU 26 HG LEU 26 22.396 -21.820 -26.721 222 HD11 LEU 26 HD11 LEU 26 22.132 -19.862 -28.865 223 HD12 LEU 26 HD12 LEU 26 22.375 -21.511 -29.443 224 HD13 LEU 26 HD13 LEU 26 23.538 -20.785 -28.334 225 HD21 LEU 26 HD21 LEU 26 20.007 -20.092 -27.160 226 HD22 LEU 26 HD22 LEU 26 21.557 -19.335 -26.792 227 HD23 LEU 26 HD23 LEU 26 20.851 -20.493 -25.664 228 H ILE 27 H ILE 27 18.308 -24.103 -28.605 229 HA ILE 27 HA ILE 27 19.303 -25.643 -30.768 230 HB ILE 27 HB ILE 27 17.133 -25.954 -28.770 231 HG12 ILE 27 HG12 ILE 27 18.293 -28.353 -28.970 232 HG13 ILE 27 HG13 ILE 27 19.577 -27.387 -29.688 233 HG21 ILE 27 HG21 ILE 27 16.384 -28.047 -29.997 234 HG22 ILE 27 HG22 ILE 27 15.828 -26.507 -30.650 235 HG23 ILE 27 HG23 ILE 27 17.161 -27.363 -31.424 236 HD11 ILE 27 HD11 ILE 27 20.150 -26.459 -27.727 237 HD12 ILE 27 HD12 ILE 27 18.482 -26.364 -27.160 238 HD13 ILE 27 HD13 ILE 27 19.361 -27.889 -27.061 239 H HIS 28 H HIS 28 16.177 -24.004 -30.270 240 HA HIS 28 HA HIS 28 14.937 -24.600 -32.643 241 HB2 HIS 28 HB2 HIS 28 13.773 -23.384 -30.917 242 HB3 HIS 28 HB3 HIS 28 14.873 -22.017 -31.073 243 HD1 HIS 28 HD1 HIS 28 11.761 -23.428 -32.423 244 HD2 HIS 28 HD2 HIS 28 14.513 -20.509 -33.504 245 HE1 HIS 28 HE1 HIS 28 10.619 -22.046 -34.187 246 H PHE 29 H PHE 29 17.520 -22.313 -32.064 247 HA PHE 29 HA PHE 29 17.382 -21.340 -34.815 248 HB2 PHE 29 HB2 PHE 29 18.794 -20.442 -32.334 249 HB3 PHE 29 HB3 PHE 29 19.427 -19.956 -33.903 250 HD1 PHE 29 HD1 PHE 29 17.412 -19.145 -35.552 251 HD2 PHE 29 HD2 PHE 29 17.460 -18.903 -31.303 252 HE1 PHE 29 HE1 PHE 29 15.779 -17.306 -35.641 253 HE2 PHE 29 HE2 PHE 29 15.827 -17.065 -31.385 254 HZ PHE 29 HZ PHE 29 14.984 -16.265 -33.556 255 H GLU 30 H GLU 30 19.198 -23.484 -32.800 256 HA GLU 30 HA GLU 30 21.533 -23.610 -34.439 257 HB2 GLU 30 HB2 GLU 30 20.487 -25.040 -32.070 258 HB3 GLU 30 HB3 GLU 30 21.600 -25.948 -33.084 259 HG2 GLU 30 HG2 GLU 30 23.363 -24.525 -32.660 260 HG3 GLU 30 HG3 GLU 30 22.310 -23.187 -32.207 261 H GLY 31 H GLY 31 18.481 -24.472 -35.140 262 HA2 GLY 31 HA2 GLY 31 18.337 -25.525 -37.414 263 HA3 GLY 31 HA3 GLY 31 19.324 -26.811 -36.737 264 H TRP 32 H TRP 32 16.469 -25.074 -35.507 265 HA TRP 32 HA TRP 32 14.908 -27.528 -35.643 266 HB2 TRP 32 HB2 TRP 32 16.021 -26.426 -33.166 267 HB3 TRP 32 HB3 TRP 32 14.277 -26.670 -33.102 268 HD1 TRP 32 HD1 TRP 32 13.386 -29.158 -33.063 269 HE1 TRP 32 HE1 TRP 32 14.547 -31.429 -32.720 270 HE3 TRP 32 HE3 TRP 32 18.245 -27.688 -33.673 271 HZ2 TRP 32 HZ2 TRP 32 17.174 -32.462 -32.708 272 HZ3 TRP 32 HZ3 TRP 32 20.021 -29.379 -33.479 273 HH2 TRP 32 HH2 TRP 32 19.495 -31.716 -33.006 274 H ARG 33 H ARG 33 13.658 -26.381 -37.163 275 HA ARG 33 HA ARG 33 11.731 -24.562 -35.933 276 HB2 ARG 33 HB2 ARG 33 13.672 -23.352 -37.206 277 HB3 ARG 33 HB3 ARG 33 12.800 -23.868 -38.644 278 HG2 ARG 33 HG2 ARG 33 11.042 -22.638 -36.700 279 HG3 ARG 33 HG3 ARG 33 12.360 -21.567 -37.180 280 HD2 ARG 33 HD2 ARG 33 11.716 -22.383 -39.591 281 HD3 ARG 33 HD3 ARG 33 10.171 -22.749 -38.824 282 HE ARG 33 HE ARG 33 9.734 -20.505 -38.713 283 HH11 ARG 33 HH11 ARG 33 13.123 -20.978 -39.357 284 HH12 ARG 33 HH12 ARG 33 13.436 -19.299 -39.647 285 HH21 ARG 33 HH21 ARG 33 10.134 -18.291 -39.093 286 HH22 ARG 33 HH22 ARG 33 11.735 -17.772 -39.496 287 H ILE 34 H ILE 34 10.429 -26.501 -36.083 288 HA ILE 34 HA ILE 34 9.840 -27.963 -38.334 289 HB ILE 34 HB ILE 34 7.887 -27.114 -36.191 290 HG12 ILE 34 HG12 ILE 34 9.384 -29.723 -36.361 291 HG13 ILE 34 HG13 ILE 34 10.057 -28.326 -35.528 292 HG21 ILE 34 HG21 ILE 34 7.030 -29.533 -36.973 293 HG22 ILE 34 HG22 ILE 34 6.432 -28.024 -37.660 294 HG23 ILE 34 HG23 ILE 34 7.683 -28.939 -38.500 295 HD11 ILE 34 HD11 ILE 34 9.057 -29.538 -33.833 296 HD12 ILE 34 HD12 ILE 34 7.841 -28.321 -34.221 297 HD13 ILE 34 HD13 ILE 34 7.664 -29.968 -34.825 298 H1 MET 101 H MET 101 14.239 11.189 -5.336 299 HA MET 101 HA MET 101 15.995 8.941 -5.093 300 HB2 MET 101 HB2 MET 101 14.429 9.635 -2.824 301 HB3 MET 101 HB3 MET 101 13.742 8.172 -3.515 302 HG2 MET 101 HG2 MET 101 15.322 7.482 -1.911 303 HG3 MET 101 HG3 MET 101 16.052 7.195 -3.489 304 HE1 MET 101 HE1 MET 101 16.101 10.772 -1.201 305 HE2 MET 101 HE2 MET 101 15.707 9.229 -0.443 306 HE3 MET 101 HE3 MET 101 17.284 9.970 -0.168 307 H ASP 102 H ASP 102 15.542 8.194 -7.079 308 HA ASP 102 HA ASP 102 12.891 7.129 -7.565 309 HB2 ASP 102 HB2 ASP 102 14.121 9.245 -9.337 310 HB3 ASP 102 HB3 ASP 102 12.793 8.205 -9.844 311 H SER 103 H SER 103 13.244 5.113 -8.185 312 HA SER 103 HA SER 103 15.702 4.486 -9.664 313 HB2 SER 103 HB2 SER 103 15.005 2.075 -9.032 314 HB3 SER 103 HB3 SER 103 15.619 3.122 -7.754 315 HG SER 103 HG SER 103 13.021 2.201 -8.216 316 H ALA 104 H ALA 104 13.500 5.696 -11.008 317 HA ALA 104 HA ALA 104 11.955 3.733 -12.381 318 HB1 ALA 104 HB1 ALA 104 11.888 5.930 -14.004 319 HB2 ALA 104 HB2 ALA 104 10.813 5.641 -12.635 320 HB3 ALA 104 HB3 ALA 104 12.252 6.640 -12.431 321 HA PRO 105 HA PRO 105 14.976 4.551 -16.054 322 HB2 PRO 105 HB2 PRO 105 17.187 6.046 -15.556 323 HB3 PRO 105 HB3 PRO 105 15.651 6.748 -16.077 324 HG2 PRO 105 HG2 PRO 105 16.810 6.557 -13.323 325 HG3 PRO 105 HG3 PRO 105 15.982 7.921 -14.097 326 HD2 PRO 105 HD2 PRO 105 14.745 6.272 -12.342 327 HD3 PRO 105 HD3 PRO 105 13.890 7.044 -13.693 328 H PHE 106 H PHE 106 16.655 4.490 -12.920 329 HA PHE 106 HA PHE 106 18.821 2.893 -13.721 330 HB2 PHE 106 HB2 PHE 106 18.819 4.170 -11.627 331 HB3 PHE 106 HB3 PHE 106 17.545 3.137 -10.988 332 HD1 PHE 106 HD2 PHE 106 20.795 2.517 -12.720 333 HD2 PHE 106 HD1 PHE 106 18.319 1.749 -9.344 334 HE1 PHE 106 HE2 PHE 106 22.497 0.981 -11.825 335 HE2 PHE 106 HE1 PHE 106 20.017 0.212 -8.444 336 HZ PHE 106 HZ PHE 106 22.108 -0.174 -9.685 337 H GLU 107 H GLU 107 15.544 2.108 -12.900 338 HA GLU 107 HA GLU 107 15.897 -0.626 -12.286 339 HB2 GLU 107 HB2 GLU 107 13.674 1.190 -12.764 340 HB3 GLU 107 HB3 GLU 107 13.367 -0.414 -13.417 341 HG2 GLU 107 HG2 GLU 107 13.660 -1.428 -11.291 342 HG3 GLU 107 HG3 GLU 107 14.278 0.068 -10.595 343 H LEU 108 H LEU 108 14.842 0.956 -15.301 344 HA LEU 108 HA LEU 108 14.590 -1.264 -16.908 345 HB2 LEU 108 HB2 LEU 108 15.206 1.590 -17.365 346 HB3 LEU 108 HB3 LEU 108 15.578 0.488 -18.689 347 HG LEU 108 HG LEU 108 13.377 1.543 -18.940 348 HD11 LEU 108 HD11 LEU 108 12.607 -1.238 -18.375 349 HD12 LEU 108 HD12 LEU 108 14.026 -1.037 -19.403 350 HD13 LEU 108 HD13 LEU 108 12.491 -0.303 -19.867 351 HD21 LEU 108 HD21 LEU 108 11.555 0.949 -17.425 352 HD22 LEU 108 HD22 LEU 108 12.832 1.823 -16.579 353 HD23 LEU 108 HD23 LEU 108 12.690 0.074 -16.396 354 H PHE 109 H PHE 109 17.521 0.513 -16.065 355 HA PHE 109 HA PHE 109 19.344 -0.572 -17.809 356 HB2 PHE 109 HB2 PHE 109 19.458 0.612 -15.125 357 HB3 PHE 109 HB3 PHE 109 20.791 -0.482 -15.478 358 HD1 PHE 109 HD1 PHE 109 21.972 -0.100 -17.779 359 HD2 PHE 109 HD2 PHE 109 19.613 2.815 -15.766 360 HE1 PHE 109 HE1 PHE 109 23.098 1.682 -19.047 361 HE2 PHE 109 HE2 PHE 109 20.735 4.602 -17.031 362 HZ PHE 109 HZ PHE 109 22.479 4.037 -18.675 363 H PHE 110 H PHE 110 18.334 -1.915 -14.674 364 HA PHE 110 HA PHE 110 19.928 -4.248 -14.869 365 HB2 PHE 110 HB2 PHE 110 19.199 -3.587 -12.699 366 HB3 PHE 110 HB3 PHE 110 17.511 -3.563 -13.198 367 HD1 PHE 110 HD1 PHE 110 16.280 -5.652 -13.513 368 HD2 PHE 110 HD2 PHE 110 20.288 -5.622 -12.082 369 HE1 PHE 110 HE1 PHE 110 16.017 -7.973 -12.739 370 HE2 PHE 110 HE2 PHE 110 20.032 -7.943 -11.306 371 HZ PHE 110 HZ PHE 110 17.895 -9.121 -11.635 372 H MET 111 H MET 111 16.588 -3.517 -15.741 373 HA MET 111 HA MET 111 15.689 -6.090 -16.302 374 HB2 MET 111 HB2 MET 111 14.928 -3.353 -17.168 375 HB3 MET 111 HB3 MET 111 14.321 -4.690 -18.136 376 HG2 MET 111 HG2 MET 111 12.711 -4.049 -16.449 377 HG3 MET 111 HG3 MET 111 13.311 -5.678 -16.150 378 HE1 MET 111 HE1 MET 111 11.685 -4.001 -14.170 379 HE2 MET 111 HE2 MET 111 12.566 -3.251 -12.839 380 HE3 MET 111 HE3 MET 111 12.417 -2.410 -14.383 381 H ILE 112 H ILE 112 17.498 -3.823 -18.317 382 HA ILE 112 HA ILE 112 17.479 -5.620 -20.586 383 HB ILE 112 HB ILE 112 18.880 -2.987 -20.125 384 HG12 ILE 112 HG12 ILE 112 17.086 -2.918 -22.308 385 HG13 ILE 112 HG13 ILE 112 16.242 -3.732 -20.995 386 HG21 ILE 112 HG21 ILE 112 20.298 -4.068 -21.624 387 HG22 ILE 112 HG22 ILE 112 18.966 -4.882 -22.444 388 HG23 ILE 112 HG23 ILE 112 19.213 -3.151 -22.670 389 HD11 ILE 112 HD11 ILE 112 17.636 -1.371 -20.079 390 HD12 ILE 112 HD12 ILE 112 16.485 -1.010 -21.366 391 HD13 ILE 112 HD13 ILE 112 15.943 -1.829 -19.901 392 H ASN 113 H ASN 113 19.998 -4.224 -18.479 393 HA ASN 113 HA ASN 113 22.185 -5.593 -19.429 394 HB2 ASN 113 HB2 ASN 113 21.464 -4.556 -16.708 395 HB3 ASN 113 HB3 ASN 113 22.954 -5.468 -16.930 396 HD21 ASN 113 HD21 ASN 113 24.337 -4.693 -18.773 397 HD22 ASN 113 HD22 ASN 113 24.491 -2.983 -18.964 398 H THR 114 H THR 114 19.962 -6.639 -16.856 399 HA THR 114 HA THR 114 21.130 -9.034 -16.164 400 HB THR 114 HB THR 114 18.198 -8.331 -16.328 401 HG1 THR 114 HG1 THR 114 19.785 -7.291 -14.792 402 HG21 THR 114 HG21 THR 114 18.293 -10.718 -16.401 403 HG22 THR 114 HG22 THR 114 17.900 -10.260 -14.744 404 HG23 THR 114 HG23 THR 114 19.539 -10.764 -15.155 405 H SER 115 H SER 115 19.188 -8.276 -18.983 406 HA SER 115 HA SER 115 18.772 -10.959 -19.824 407 HB2 SER 115 HB2 SER 115 17.618 -8.682 -20.553 408 HB3 SER 115 HB3 SER 115 18.852 -8.731 -21.812 409 HG SER 115 HG SER 115 16.608 -9.910 -21.956 410 H ILE 116 H ILE 116 20.840 -8.434 -21.269 411 HA ILE 116 HA ILE 116 22.263 -10.036 -23.003 412 HB ILE 116 HB ILE 116 23.314 -7.641 -21.491 413 HG12 ILE 116 HG12 ILE 116 22.749 -6.861 -24.074 414 HG13 ILE 116 HG13 ILE 116 21.426 -7.963 -23.708 415 HG21 ILE 116 HG21 ILE 116 24.704 -7.495 -23.690 416 HG22 ILE 116 HG22 ILE 116 25.221 -8.570 -22.392 417 HG23 ILE 116 HG23 ILE 116 24.371 -9.224 -23.791 418 HD11 ILE 116 HD11 ILE 116 21.622 -5.279 -23.024 419 HD12 ILE 116 HD12 ILE 116 20.425 -6.442 -22.452 420 HD13 ILE 116 HD13 ILE 116 21.894 -6.156 -21.518 421 H LEU 117 H LEU 117 22.593 -9.721 -19.557 422 HA LEU 117 HA LEU 117 25.160 -11.040 -19.457 423 HB2 LEU 117 HB2 LEU 117 23.544 -9.512 -17.684 424 HB3 LEU 117 HB3 LEU 117 23.875 -11.069 -16.926 425 HG LEU 117 HG LEU 117 25.975 -9.165 -17.963 426 HD11 LEU 117 HD11 LEU 117 26.437 -9.059 -15.416 427 HD12 LEU 117 HD12 LEU 117 24.757 -9.573 -15.264 428 HD13 LEU 117 HD13 LEU 117 25.147 -8.072 -16.103 429 HD21 LEU 117 HD21 LEU 117 26.184 -11.862 -17.602 430 HD22 LEU 117 HD22 LEU 117 26.697 -11.242 -16.032 431 HD23 LEU 117 HD23 LEU 117 27.522 -10.717 -17.501 432 H LEU 118 H LEU 118 21.917 -11.841 -18.197 433 HA LEU 118 HA LEU 118 22.395 -14.437 -17.419 434 HB2 LEU 118 HB2 LEU 118 19.958 -13.060 -18.477 435 HB3 LEU 118 HB3 LEU 118 19.915 -14.780 -18.098 436 HG LEU 118 HG LEU 118 20.362 -12.480 -16.208 437 HD11 LEU 118 HD11 LEU 118 18.113 -12.691 -16.244 438 HD12 LEU 118 HD12 LEU 118 18.451 -14.001 -15.113 439 HD13 LEU 118 HD13 LEU 118 18.165 -14.358 -16.817 440 HD21 LEU 118 HD21 LEU 118 21.267 -15.248 -16.027 441 HD22 LEU 118 HD22 LEU 118 20.258 -14.747 -14.670 442 HD23 LEU 118 HD23 LEU 118 21.718 -13.840 -15.065 443 H ILE 119 H ILE 119 21.752 -13.195 -20.643 444 HA ILE 119 HA ILE 119 21.307 -15.630 -21.958 445 HB ILE 119 HB ILE 119 22.511 -13.070 -23.012 446 HG12 ILE 119 HG12 ILE 119 19.758 -14.060 -23.631 447 HG13 ILE 119 HG13 ILE 119 20.054 -13.297 -22.073 448 HG21 ILE 119 HG21 ILE 119 21.911 -13.945 -25.246 449 HG22 ILE 119 HG22 ILE 119 23.169 -14.890 -24.450 450 HG23 ILE 119 HG23 ILE 119 21.512 -15.493 -24.502 451 HD11 ILE 119 HD11 ILE 119 21.215 -11.541 -23.815 452 HD12 ILE 119 HD12 ILE 119 19.817 -12.119 -24.722 453 HD13 ILE 119 HD13 ILE 119 19.596 -11.395 -23.130 454 H PHE 120 H PHE 120 24.303 -13.692 -22.056 455 HA PHE 120 HA PHE 120 25.892 -15.752 -23.119 456 HB2 PHE 120 HB2 PHE 120 26.457 -13.318 -23.171 457 HB3 PHE 120 HB3 PHE 120 26.828 -13.409 -21.452 458 HD1 PHE 120 HD2 PHE 120 27.680 -15.320 -24.547 459 HD2 PHE 120 HD1 PHE 120 29.050 -13.530 -20.937 460 HE1 PHE 120 HE2 PHE 120 29.982 -16.003 -25.086 461 HE2 PHE 120 HE1 PHE 120 31.354 -14.209 -21.470 462 HZ PHE 120 HZ PHE 120 31.822 -15.448 -23.546 463 H ILE 121 H ILE 121 24.855 -15.072 -19.899 464 HA ILE 121 HA ILE 121 26.903 -16.514 -18.535 465 HB ILE 121 HB ILE 121 24.287 -15.326 -17.779 466 HG12 ILE 121 HG12 ILE 121 26.978 -15.305 -16.402 467 HG13 ILE 121 HG13 ILE 121 26.501 -14.144 -17.636 468 HG21 ILE 121 HG21 ILE 121 25.632 -17.543 -16.259 469 HG22 ILE 121 HG22 ILE 121 24.555 -16.379 -15.488 470 HG23 ILE 121 HG23 ILE 121 23.947 -17.428 -16.769 471 HD11 ILE 121 HD11 ILE 121 25.296 -14.527 -14.912 472 HD12 ILE 121 HD12 ILE 121 26.173 -13.125 -15.525 473 HD13 ILE 121 HD13 ILE 121 24.578 -13.517 -16.166 474 H PHE 122 H PHE 122 23.503 -17.288 -19.281 475 HA PHE 122 HA PHE 122 23.682 -19.967 -18.361 476 HB2 PHE 122 HB2 PHE 122 21.690 -18.668 -20.230 477 HB3 PHE 122 HB3 PHE 122 21.503 -20.265 -19.514 478 HD1 PHE 122 HD1 PHE 122 22.517 -19.686 -16.767 479 HD2 PHE 122 HD2 PHE 122 19.888 -17.506 -19.307 480 HE1 PHE 122 HE1 PHE 122 21.452 -18.676 -14.792 481 HE2 PHE 122 HE2 PHE 122 18.819 -16.492 -17.337 482 HZ PHE 122 HZ PHE 122 19.601 -17.076 -15.076 483 H ILE 123 H ILE 123 23.606 -18.576 -21.638 484 HA ILE 123 HA ILE 123 23.818 -20.877 -23.130 485 HB ILE 123 HB ILE 123 24.673 -18.068 -23.565 486 HG12 ILE 123 HG12 ILE 123 23.382 -18.855 -25.798 487 HG13 ILE 123 HG13 ILE 123 22.735 -20.029 -24.657 488 HG21 ILE 123 HG21 ILE 123 26.604 -19.034 -24.470 489 HG22 ILE 123 HG22 ILE 123 25.713 -20.399 -25.141 490 HG23 ILE 123 HG23 ILE 123 25.540 -18.796 -25.856 491 HD11 ILE 123 HD11 ILE 123 22.691 -17.065 -24.176 492 HD12 ILE 123 HD12 ILE 123 21.378 -17.952 -24.951 493 HD13 ILE 123 HD13 ILE 123 21.831 -18.322 -23.287 494 H VAL 124 H VAL 124 26.479 -18.952 -21.765 495 HA VAL 124 HA VAL 124 28.535 -20.669 -22.714 496 HB VAL 124 HB VAL 124 28.501 -18.559 -20.563 497 HG11 VAL 124 HG11 VAL 124 31.072 -18.795 -20.845 498 HG12 VAL 124 HG12 VAL 124 30.212 -19.902 -19.774 499 HG13 VAL 124 HG13 VAL 124 30.684 -20.426 -21.391 500 HG21 VAL 124 HG21 VAL 124 29.212 -17.113 -22.142 501 HG22 VAL 124 HG22 VAL 124 30.198 -18.324 -22.960 502 HG23 VAL 124 HG23 VAL 124 28.459 -18.266 -23.245 503 H LEU 125 H LEU 125 26.754 -20.433 -19.676 504 HA LEU 125 HA LEU 125 28.268 -22.200 -18.139 505 HB2 LEU 125 HB2 LEU 125 25.473 -21.219 -18.094 506 HB3 LEU 125 HB3 LEU 125 25.837 -22.655 -17.140 507 HG LEU 125 HG LEU 125 27.122 -19.940 -16.847 508 HD11 LEU 125 HD11 LEU 125 25.174 -21.459 -15.121 509 HD12 LEU 125 HD12 LEU 125 24.876 -19.952 -15.985 510 HD13 LEU 125 HD13 LEU 125 26.012 -19.985 -14.636 511 HD21 LEU 125 HD21 LEU 125 27.717 -21.513 -14.637 512 HD22 LEU 125 HD22 LEU 125 28.825 -21.033 -15.922 513 HD23 LEU 125 HD23 LEU 125 27.976 -22.576 -16.020 514 H LEU 126 H LEU 126 25.826 -22.799 -20.577 515 HA LEU 126 HA LEU 126 25.243 -25.470 -20.051 516 HB2 LEU 126 HB2 LEU 126 25.085 -23.676 -22.380 517 HB3 LEU 126 HB3 LEU 126 25.135 -25.398 -22.755 518 HG LEU 126 HG LEU 126 22.846 -24.632 -22.676 519 HD11 LEU 126 HD11 LEU 126 22.816 -26.059 -20.135 520 HD12 LEU 126 HD12 LEU 126 23.843 -26.815 -21.353 521 HD13 LEU 126 HD13 LEU 126 22.141 -26.511 -21.700 522 HD21 LEU 126 HD21 LEU 126 23.717 -23.465 -20.078 523 HD22 LEU 126 HD22 LEU 126 22.045 -23.997 -20.253 524 HD23 LEU 126 HD23 LEU 126 22.700 -22.775 -21.343 525 H ILE 127 H ILE 127 27.839 -24.063 -22.016 526 HA ILE 127 HA ILE 127 28.920 -26.549 -22.857 527 HB ILE 127 HB ILE 127 29.793 -23.717 -22.958 528 HG12 ILE 127 HG12 ILE 127 30.445 -24.773 -25.326 529 HG13 ILE 127 HG13 ILE 127 29.281 -25.989 -24.813 530 HG21 ILE 127 HG21 ILE 127 32.038 -24.497 -23.847 531 HG22 ILE 127 HG22 ILE 127 31.811 -24.574 -22.100 532 HG23 ILE 127 HG23 ILE 127 31.693 -26.042 -23.070 533 HD11 ILE 127 HD11 ILE 127 27.531 -24.612 -25.086 534 HD12 ILE 127 HD12 ILE 127 28.415 -23.198 -24.508 535 HD13 ILE 127 HD13 ILE 127 28.637 -23.761 -26.165 536 H HIS 128 H HIS 128 29.964 -24.223 -20.366 537 HA HIS 128 HA HIS 128 32.170 -25.530 -19.386 538 HB2 HIS 128 HB2 HIS 128 31.577 -23.339 -18.576 539 HB3 HIS 128 HB3 HIS 128 30.080 -23.950 -17.878 540 HD1 HIS 128 HD1 HIS 128 33.634 -23.422 -17.140 541 HD2 HIS 128 HD2 HIS 128 30.483 -25.618 -15.554 542 HE1 HIS 128 HE1 HIS 128 34.378 -24.097 -14.834 543 H PHE 129 H PHE 129 28.794 -26.286 -18.874 544 HA PHE 129 HA PHE 129 29.470 -28.366 -16.938 545 HB2 PHE 129 HB2 PHE 129 26.933 -27.035 -17.800 546 HB3 PHE 129 HB3 PHE 129 26.851 -28.635 -17.070 547 HD1 PHE 129 HD1 PHE 129 28.469 -28.794 -14.884 548 HD2 PHE 129 HD2 PHE 129 26.566 -25.290 -16.374 549 HE1 PHE 129 HE1 PHE 129 28.591 -27.780 -12.646 550 HE2 PHE 129 HE2 PHE 129 26.685 -24.270 -14.139 551 HZ PHE 129 HZ PHE 129 27.699 -25.515 -12.271 552 H GLU 130 H GLU 130 28.598 -27.953 -20.258 553 HA GLU 130 HA GLU 130 27.709 -30.627 -20.721 554 HB2 GLU 130 HB2 GLU 130 28.292 -28.238 -22.367 555 HB3 GLU 130 HB3 GLU 130 28.449 -29.788 -23.180 556 HG2 GLU 130 HG2 GLU 130 26.211 -30.286 -22.960 557 HG3 GLU 130 HG3 GLU 130 25.995 -29.193 -21.594 558 H GLY 131 H GLY 131 30.645 -29.555 -19.828 559 HA2 GLY 131 HA2 GLY 131 32.296 -31.448 -19.717 560 HA3 GLY 131 HA3 GLY 131 32.067 -31.571 -21.455 561 H TRP 132 H TRP 132 32.569 -28.798 -19.277 562 HA TRP 132 HA TRP 132 35.144 -28.267 -20.518 563 HB2 TRP 132 HB2 TRP 132 32.704 -26.752 -21.117 564 HB3 TRP 132 HB3 TRP 132 34.053 -25.746 -20.597 565 HD1 TRP 132 HD1 TRP 132 36.132 -25.535 -22.230 566 HE1 TRP 132 HE1 TRP 132 36.473 -26.152 -24.706 567 HE3 TRP 132 HE3 TRP 132 32.028 -28.510 -22.898 568 HZ2 TRP 132 HZ2 TRP 132 35.174 -27.695 -26.680 569 HZ3 TRP 132 HZ3 TRP 132 31.650 -29.518 -25.111 570 HH2 TRP 132 HH2 TRP 132 33.191 -29.117 -26.962 571 H ARG 133 H ARG 133 35.965 -28.677 -18.435 572 HA ARG 133 HA ARG 133 35.699 -26.398 -16.620 573 HB2 ARG 133 HB2 ARG 133 34.228 -28.464 -15.983 574 HB3 ARG 133 HB3 ARG 133 35.756 -29.161 -15.462 575 HG2 ARG 133 HG2 ARG 133 35.412 -26.473 -14.452 576 HG3 ARG 133 HG3 ARG 133 34.082 -27.532 -13.979 577 HD2 ARG 133 HD2 ARG 133 36.035 -29.195 -13.413 578 HD3 ARG 133 HD3 ARG 133 36.984 -27.712 -13.324 579 HE ARG 133 HE ARG 133 35.929 -27.196 -11.361 580 HH11 ARG 133 HH11 ARG 133 34.134 -29.689 -12.998 581 HH12 ARG 133 HH12 ARG 133 33.058 -29.969 -11.670 582 HH21 ARG 133 HH21 ARG 133 34.518 -27.555 -9.605 583 HH22 ARG 133 HH22 ARG 133 33.277 -28.753 -9.740 584 H ILE 134 H ILE 134 37.789 -25.964 -17.654 585 HA ILE 134 HA ILE 134 40.022 -27.588 -17.576 586 HB ILE 134 HB ILE 134 39.954 -24.594 -17.185 587 HG12 ILE 134 HG12 ILE 134 40.477 -26.077 -19.754 588 HG13 ILE 134 HG13 ILE 134 38.846 -25.629 -19.264 589 HG21 ILE 134 HG21 ILE 134 42.271 -25.051 -18.445 590 HG22 ILE 134 HG22 ILE 134 42.125 -24.987 -16.689 591 HG23 ILE 134 HG23 ILE 134 42.146 -26.545 -17.516 592 HD11 ILE 134 HD11 ILE 134 39.490 -23.906 -20.667 593 HD12 ILE 134 HD12 ILE 134 39.798 -23.251 -19.059 594 HD13 ILE 134 HD13 ILE 134 41.134 -23.868 -20.030 Start of MODEL 3 1 H1 MET 1 H MET 1 6.375 1.765 2.586 2 HA MET 1 HA MET 1 5.609 1.295 -0.132 3 HB2 MET 1 HB2 MET 1 6.804 3.910 0.666 4 HB3 MET 1 HB3 MET 1 7.320 3.188 -0.853 5 HG2 MET 1 HG2 MET 1 5.585 4.533 -1.524 6 HG3 MET 1 HG3 MET 1 4.785 2.976 -1.326 7 HE1 MET 1 HE1 MET 1 3.937 6.896 0.197 8 HE2 MET 1 HE2 MET 1 4.390 6.172 -1.346 9 HE3 MET 1 HE3 MET 1 2.721 6.078 -0.785 10 H ASP 2 H ASP 2 6.705 -0.619 -0.027 11 HA ASP 2 HA ASP 2 9.584 -0.461 -0.248 12 HB2 ASP 2 HB2 ASP 2 8.230 -1.899 2.028 13 HB3 ASP 2 HB3 ASP 2 9.839 -2.347 1.469 14 H SER 3 H SER 3 10.034 -1.621 -1.987 15 HA SER 3 HA SER 3 8.427 -4.032 -2.528 16 HB2 SER 3 HB2 SER 3 9.955 -2.508 -4.630 17 HB3 SER 3 HB3 SER 3 8.623 -3.643 -4.846 18 HG SER 3 HG SER 3 7.419 -1.927 -4.851 19 H ALA 4 H ALA 4 10.693 -4.047 -0.820 20 HA ALA 4 HA ALA 4 13.026 -4.908 -2.203 21 HB1 ALA 4 HB1 ALA 4 13.901 -4.589 -0.192 22 HB2 ALA 4 HB2 ALA 4 12.287 -4.367 0.485 23 HB3 ALA 4 HB3 ALA 4 13.003 -5.978 0.422 24 HA PRO 5 HA PRO 5 11.639 -9.354 -0.938 25 HB2 PRO 5 HB2 PRO 5 9.149 -9.646 0.103 26 HB3 PRO 5 HB3 PRO 5 10.575 -9.325 1.098 27 HG2 PRO 5 HG2 PRO 5 8.479 -7.423 0.122 28 HG3 PRO 5 HG3 PRO 5 9.232 -7.533 1.724 29 HD2 PRO 5 HD2 PRO 5 9.984 -5.696 -0.118 30 HD3 PRO 5 HD3 PRO 5 11.122 -6.397 1.051 31 H PHE 6 H PHE 6 9.303 -7.117 -2.264 32 HA PHE 6 HA PHE 6 7.888 -9.084 -3.799 33 HB2 PHE 6 HB2 PHE 6 7.879 -6.085 -3.679 34 HB3 PHE 6 HB3 PHE 6 7.057 -6.919 -4.994 35 HD1 PHE 6 HD2 PHE 6 5.257 -8.595 -4.413 36 HD2 PHE 6 HD1 PHE 6 6.877 -5.860 -1.583 37 HE1 PHE 6 HE2 PHE 6 3.288 -8.922 -2.975 38 HE2 PHE 6 HE1 PHE 6 4.911 -6.183 -0.140 39 HZ PHE 6 HZ PHE 6 3.112 -7.714 -0.836 40 H GLU 7 H GLU 7 10.582 -6.911 -4.335 41 HA GLU 7 HA GLU 7 10.699 -7.059 -7.138 42 HB2 GLU 7 HB2 GLU 7 12.382 -6.093 -4.983 43 HB3 GLU 7 HB3 GLU 7 13.340 -6.838 -6.255 44 HG2 GLU 7 HG2 GLU 7 12.263 -5.377 -7.905 45 HG3 GLU 7 HG3 GLU 7 11.347 -4.611 -6.609 46 H LEU 8 H LEU 8 11.888 -9.193 -4.623 47 HA LEU 8 HA LEU 8 13.605 -10.772 -6.189 48 HB2 LEU 8 HB2 LEU 8 12.172 -11.108 -3.609 49 HB3 LEU 8 HB3 LEU 8 12.831 -12.551 -4.378 50 HG LEU 8 HG LEU 8 14.428 -10.112 -3.597 51 HD11 LEU 8 HD11 LEU 8 14.950 -12.672 -2.278 52 HD12 LEU 8 HD12 LEU 8 13.383 -11.960 -1.894 53 HD13 LEU 8 HD13 LEU 8 14.862 -11.042 -1.608 54 HD21 LEU 8 HD21 LEU 8 15.704 -10.998 -5.264 55 HD22 LEU 8 HD22 LEU 8 15.053 -12.624 -5.054 56 HD23 LEU 8 HD23 LEU 8 16.255 -12.001 -3.921 57 H PHE 9 H PHE 9 10.149 -11.063 -5.477 58 HA PHE 9 HA PHE 9 9.601 -13.521 -6.587 59 HB2 PHE 9 HB2 PHE 9 8.064 -11.039 -6.130 60 HB3 PHE 9 HB3 PHE 9 7.389 -12.134 -7.331 61 HD1 PHE 9 HD1 PHE 9 7.380 -14.684 -6.545 62 HD2 PHE 9 HD2 PHE 9 7.384 -11.301 -3.961 63 HE1 PHE 9 HE1 PHE 9 6.411 -16.059 -4.749 64 HE2 PHE 9 HE2 PHE 9 6.416 -12.671 -2.161 65 HZ PHE 9 HZ PHE 9 5.929 -15.053 -2.553 66 H PHE 10 H PHE 10 10.054 -10.430 -8.215 67 HA PHE 10 HA PHE 10 9.385 -11.493 -10.808 68 HB2 PHE 10 HB2 PHE 10 8.893 -9.187 -10.482 69 HB3 PHE 10 HB3 PHE 10 10.514 -8.853 -9.883 70 HD1 PHE 10 HD2 PHE 10 8.463 -9.439 -12.850 71 HD2 PHE 10 HD1 PHE 10 12.372 -8.586 -11.398 72 HE1 PHE 10 HE2 PHE 10 9.167 -8.813 -15.123 73 HE2 PHE 10 HE1 PHE 10 13.082 -7.958 -13.668 74 HZ PHE 10 HZ PHE 10 11.479 -8.072 -15.535 75 H MET 11 H MET 11 12.243 -11.080 -8.887 76 HA MET 11 HA MET 11 14.138 -11.266 -11.000 77 HB2 MET 11 HB2 MET 11 14.217 -11.395 -8.031 78 HB3 MET 11 HB3 MET 11 15.574 -12.098 -8.902 79 HG2 MET 11 HG2 MET 11 16.074 -10.021 -9.953 80 HG3 MET 11 HG3 MET 11 14.588 -9.294 -9.346 81 HE1 MET 11 HE1 MET 11 15.158 -7.753 -6.381 82 HE2 MET 11 HE2 MET 11 16.238 -7.061 -7.591 83 HE3 MET 11 HE3 MET 11 14.673 -7.714 -8.077 84 H ILE 12 H ILE 12 12.592 -13.611 -8.868 85 HA ILE 12 HA ILE 12 14.154 -15.827 -9.798 86 HB ILE 12 HB ILE 12 11.588 -15.721 -8.213 87 HG12 ILE 12 HG12 ILE 12 13.742 -16.860 -6.774 88 HG13 ILE 12 HG13 ILE 12 14.366 -15.408 -7.549 89 HG21 ILE 12 HG21 ILE 12 11.429 -17.816 -9.160 90 HG22 ILE 12 HG22 ILE 12 13.177 -18.029 -9.240 91 HG23 ILE 12 HG23 ILE 12 12.343 -18.161 -7.692 92 HD11 ILE 12 HD11 ILE 12 11.794 -14.912 -6.358 93 HD12 ILE 12 HD12 ILE 12 12.931 -15.567 -5.179 94 HD13 ILE 12 HD13 ILE 12 13.339 -14.109 -6.083 95 H ASN 13 H ASN 13 10.793 -14.770 -10.316 96 HA ASN 13 HA ASN 13 9.950 -16.774 -12.016 97 HB2 ASN 13 HB2 ASN 13 9.207 -13.906 -11.661 98 HB3 ASN 13 HB3 ASN 13 8.578 -14.757 -13.069 99 HD21 ASN 13 HD21 ASN 13 9.103 -15.540 -9.645 100 HD22 ASN 13 HD22 ASN 13 7.513 -16.156 -9.369 101 H THR 14 H THR 14 11.290 -13.620 -13.010 102 HA THR 14 HA THR 14 11.425 -14.131 -15.740 103 HB THR 14 HB THR 14 11.771 -11.896 -14.680 104 HG1 THR 14 HG1 THR 14 12.992 -11.245 -16.366 105 HG21 THR 14 HG21 THR 14 13.485 -12.911 -13.015 106 HG22 THR 14 HG22 THR 14 13.756 -11.282 -13.636 107 HG23 THR 14 HG23 THR 14 14.649 -12.644 -14.312 108 H SER 15 H SER 15 13.443 -15.248 -13.161 109 HA SER 15 HA SER 15 15.752 -15.874 -14.680 110 HB2 SER 15 HB2 SER 15 15.335 -15.774 -12.064 111 HB3 SER 15 HB3 SER 15 15.023 -17.496 -12.279 112 HG SER 15 HG SER 15 17.324 -16.348 -13.406 113 H ILE 16 H ILE 16 13.327 -18.099 -13.300 114 HA ILE 16 HA ILE 16 14.098 -20.374 -14.675 115 HB ILE 16 HB ILE 16 11.294 -19.621 -13.841 116 HG12 ILE 16 HG12 ILE 16 13.261 -21.358 -12.353 117 HG13 ILE 16 HG13 ILE 16 13.138 -19.625 -12.073 118 HG21 ILE 16 HG21 ILE 16 10.999 -21.428 -15.262 119 HG22 ILE 16 HG22 ILE 16 12.522 -22.179 -14.788 120 HG23 ILE 16 HG23 ILE 16 11.147 -22.199 -13.683 121 HD11 ILE 16 HD11 ILE 16 10.526 -20.632 -11.924 122 HD12 ILE 16 HD12 ILE 16 11.549 -21.746 -11.016 123 HD13 ILE 16 HD13 ILE 16 11.536 -20.030 -10.610 124 H LEU 17 H LEU 17 12.370 -17.609 -15.815 125 HA LEU 17 HA LEU 17 11.318 -18.922 -18.163 126 HB2 LEU 17 HB2 LEU 17 10.890 -16.465 -16.792 127 HB3 LEU 17 HB3 LEU 17 11.315 -16.101 -18.463 128 HG LEU 17 HG LEU 17 9.020 -17.821 -17.527 129 HD11 LEU 17 HD11 LEU 17 8.183 -15.734 -17.238 130 HD12 LEU 17 HD12 LEU 17 7.891 -15.891 -18.970 131 HD13 LEU 17 HD13 LEU 17 9.300 -15.002 -18.391 132 HD21 LEU 17 HD21 LEU 17 9.060 -18.773 -19.530 133 HD22 LEU 17 HD22 LEU 17 10.431 -17.778 -20.023 134 HD23 LEU 17 HD23 LEU 17 8.784 -17.188 -20.251 135 H LEU 18 H LEU 18 13.644 -16.265 -17.641 136 HA LEU 18 HA LEU 18 14.590 -16.027 -20.218 137 HB2 LEU 18 HB2 LEU 18 15.904 -15.622 -17.555 138 HB3 LEU 18 HB3 LEU 18 16.785 -15.345 -19.055 139 HG LEU 18 HG LEU 18 14.410 -13.842 -17.985 140 HD11 LEU 18 HD11 LEU 18 17.290 -13.362 -18.301 141 HD12 LEU 18 HD12 LEU 18 16.137 -12.666 -17.163 142 HD13 LEU 18 HD13 LEU 18 16.246 -12.032 -18.805 143 HD21 LEU 18 HD21 LEU 18 15.272 -14.243 -20.768 144 HD22 LEU 18 HD22 LEU 18 15.019 -12.564 -20.289 145 HD23 LEU 18 HD23 LEU 18 13.711 -13.737 -20.121 146 H ILE 19 H ILE 19 15.460 -18.383 -17.762 147 HA ILE 19 HA ILE 19 17.731 -19.466 -19.006 148 HB ILE 19 HB ILE 19 15.732 -20.834 -17.203 149 HG12 ILE 19 HG12 ILE 19 18.439 -19.920 -16.331 150 HG13 ILE 19 HG13 ILE 19 17.162 -18.719 -16.494 151 HG21 ILE 19 HG21 ILE 19 17.005 -22.483 -18.412 152 HG22 ILE 19 HG22 ILE 19 18.512 -21.651 -18.031 153 HG23 ILE 19 HG23 ILE 19 17.578 -22.418 -16.746 154 HD11 ILE 19 HD11 ILE 19 17.632 -20.620 -14.395 155 HD12 ILE 19 HD12 ILE 19 16.524 -19.249 -14.445 156 HD13 ILE 19 HD13 ILE 19 16.014 -20.818 -15.067 157 H PHE 20 H PHE 20 14.467 -20.907 -18.891 158 HA PHE 20 HA PHE 20 14.969 -22.795 -20.915 159 HB2 PHE 20 HB2 PHE 20 13.126 -22.940 -19.233 160 HB3 PHE 20 HB3 PHE 20 12.286 -21.661 -20.103 161 HD1 PHE 20 HD1 PHE 20 13.946 -24.910 -20.901 162 HD2 PHE 20 HD2 PHE 20 10.605 -22.341 -21.493 163 HE1 PHE 20 HE1 PHE 20 12.916 -26.594 -22.371 164 HE2 PHE 20 HE2 PHE 20 9.569 -24.021 -22.963 165 HZ PHE 20 HZ PHE 20 10.725 -26.151 -23.403 166 H ILE 21 H ILE 21 14.119 -19.454 -21.032 167 HA ILE 21 HA ILE 21 13.018 -19.434 -23.661 168 HB ILE 21 HB ILE 21 13.911 -17.368 -21.722 169 HG12 ILE 21 HG12 ILE 21 11.481 -17.478 -23.511 170 HG13 ILE 21 HG13 ILE 21 11.560 -18.287 -21.950 171 HG21 ILE 21 HG21 ILE 21 13.535 -15.616 -23.510 172 HG22 ILE 21 HG22 ILE 21 15.050 -16.512 -23.603 173 HG23 ILE 21 HG23 ILE 21 13.720 -16.915 -24.688 174 HD11 ILE 21 HD11 ILE 21 11.773 -15.331 -22.457 175 HD12 ILE 21 HD12 ILE 21 10.421 -16.189 -21.718 176 HD13 ILE 21 HD13 ILE 21 11.973 -16.103 -20.884 177 H PHE 22 H PHE 22 16.197 -18.473 -22.369 178 HA PHE 22 HA PHE 22 17.325 -17.986 -24.934 179 HB2 PHE 22 HB2 PHE 22 18.685 -18.488 -22.279 180 HB3 PHE 22 HB3 PHE 22 19.474 -17.865 -23.724 181 HD1 PHE 22 HD2 PHE 22 17.240 -16.030 -24.623 182 HD2 PHE 22 HD1 PHE 22 19.049 -16.674 -20.824 183 HE1 PHE 22 HE2 PHE 22 16.649 -13.736 -23.956 184 HE2 PHE 22 HE1 PHE 22 18.460 -14.382 -20.151 185 HZ PHE 22 HZ PHE 22 17.260 -12.909 -21.718 186 H ILE 23 H ILE 23 17.751 -20.634 -22.591 187 HA ILE 23 HA ILE 23 19.506 -22.223 -23.984 188 HB ILE 23 HB ILE 23 17.372 -22.785 -21.999 189 HG12 ILE 23 HG12 ILE 23 19.588 -24.123 -21.208 190 HG13 ILE 23 HG13 ILE 23 20.322 -22.888 -22.225 191 HG21 ILE 23 HG21 ILE 23 18.010 -25.252 -22.159 192 HG22 ILE 23 HG22 ILE 23 16.897 -24.622 -23.373 193 HG23 ILE 23 HG23 ILE 23 18.596 -24.870 -23.778 194 HD11 ILE 23 HD11 ILE 23 18.390 -22.252 -20.018 195 HD12 ILE 23 HD12 ILE 23 20.137 -22.335 -19.787 196 HD13 ILE 23 HD13 ILE 23 19.448 -21.146 -20.892 197 H VAL 24 H VAL 24 15.959 -22.215 -24.238 198 HA VAL 24 HA VAL 24 15.839 -24.231 -26.232 199 HB VAL 24 HB VAL 24 13.861 -22.141 -25.342 200 HG11 VAL 24 HG11 VAL 24 13.663 -24.128 -27.576 201 HG12 VAL 24 HG12 VAL 24 12.226 -23.606 -26.694 202 HG13 VAL 24 HG13 VAL 24 13.210 -22.424 -27.558 203 HG21 VAL 24 HG21 VAL 24 12.846 -23.823 -24.126 204 HG22 VAL 24 HG22 VAL 24 13.526 -25.104 -25.129 205 HG23 VAL 24 HG23 VAL 24 14.551 -24.250 -23.975 206 H LEU 25 H LEU 25 15.769 -20.687 -26.364 207 HA LEU 25 HA LEU 25 15.274 -20.326 -29.060 208 HB2 LEU 25 HB2 LEU 25 16.674 -18.776 -26.960 209 HB3 LEU 25 HB3 LEU 25 16.952 -18.294 -28.632 210 HG LEU 25 HG LEU 25 14.331 -18.330 -27.146 211 HD11 LEU 25 HD11 LEU 25 15.672 -16.402 -26.650 212 HD12 LEU 25 HD12 LEU 25 14.364 -15.920 -27.730 213 HD13 LEU 25 HD13 LEU 25 15.996 -16.133 -28.362 214 HD21 LEU 25 HD21 LEU 25 13.494 -18.894 -29.169 215 HD22 LEU 25 HD22 LEU 25 14.927 -18.347 -30.039 216 HD23 LEU 25 HD23 LEU 25 13.728 -17.175 -29.489 217 H LEU 26 H LEU 26 18.279 -21.157 -27.438 218 HA LEU 26 HA LEU 26 20.097 -20.723 -29.486 219 HB2 LEU 26 HB2 LEU 26 19.968 -22.435 -27.096 220 HB3 LEU 26 HB3 LEU 26 21.098 -22.963 -28.342 221 HG LEU 26 HG LEU 26 22.263 -21.644 -26.698 222 HD11 LEU 26 HD11 LEU 26 23.366 -20.137 -28.124 223 HD12 LEU 26 HD12 LEU 26 21.922 -19.875 -29.101 224 HD13 LEU 26 HD13 LEU 26 22.768 -21.420 -29.175 225 HD21 LEU 26 HD21 LEU 26 20.034 -19.708 -27.175 226 HD22 LEU 26 HD22 LEU 26 21.609 -19.133 -26.628 227 HD23 LEU 26 HD23 LEU 26 20.705 -20.292 -25.652 228 H ILE 27 H ILE 27 18.610 -23.866 -28.675 229 HA ILE 27 HA ILE 27 19.467 -25.276 -30.890 230 HB ILE 27 HB ILE 27 17.199 -25.571 -29.004 231 HG12 ILE 27 HG12 ILE 27 18.637 -27.964 -29.763 232 HG13 ILE 27 HG13 ILE 27 19.758 -26.664 -29.373 233 HG21 ILE 27 HG21 ILE 27 17.298 -26.916 -31.691 234 HG22 ILE 27 HG22 ILE 27 16.422 -27.591 -30.318 235 HG23 ILE 27 HG23 ILE 27 15.966 -26.016 -30.966 236 HD11 ILE 27 HD11 ILE 27 17.971 -26.497 -27.325 237 HD12 ILE 27 HD12 ILE 27 18.021 -28.233 -27.635 238 HD13 ILE 27 HD13 ILE 27 19.509 -27.359 -27.272 239 H HIS 28 H HIS 28 16.404 -23.500 -30.504 240 HA HIS 28 HA HIS 28 15.206 -24.006 -32.909 241 HB2 HIS 28 HB2 HIS 28 14.063 -22.691 -31.263 242 HB3 HIS 28 HB3 HIS 28 15.292 -21.431 -31.333 243 HD1 HIS 28 HD1 HIS 28 15.043 -19.653 -33.118 244 HD2 HIS 28 HD2 HIS 28 12.300 -22.749 -33.510 245 HE1 HIS 28 HE1 HIS 28 13.398 -18.877 -34.854 246 H PHE 29 H PHE 29 17.861 -21.792 -32.259 247 HA PHE 29 HA PHE 29 17.927 -20.979 -35.067 248 HB2 PHE 29 HB2 PHE 29 19.245 -19.950 -32.569 249 HB3 PHE 29 HB3 PHE 29 19.850 -19.494 -34.159 250 HD1 PHE 29 HD2 PHE 29 17.847 -18.756 -35.820 251 HD2 PHE 29 HD1 PHE 29 17.817 -18.473 -31.573 252 HE1 PHE 29 HE2 PHE 29 16.153 -16.977 -35.954 253 HE2 PHE 29 HE1 PHE 29 16.122 -16.694 -31.701 254 HZ PHE 29 HZ PHE 29 15.288 -15.943 -33.893 255 H GLU 30 H GLU 30 19.435 -23.134 -32.888 256 HA GLU 30 HA GLU 30 21.976 -23.312 -34.171 257 HB2 GLU 30 HB2 GLU 30 20.853 -24.295 -31.825 258 HB3 GLU 30 HB3 GLU 30 21.139 -25.734 -32.793 259 HG2 GLU 30 HG2 GLU 30 23.309 -23.714 -32.520 260 HG3 GLU 30 HG3 GLU 30 22.976 -24.814 -31.183 261 H GLY 31 H GLY 31 18.998 -24.079 -35.297 262 HA2 GLY 31 HA2 GLY 31 19.099 -25.013 -37.615 263 HA3 GLY 31 HA3 GLY 31 20.035 -26.325 -36.915 264 H TRP 32 H TRP 32 17.049 -24.706 -35.853 265 HA TRP 32 HA TRP 32 15.721 -27.336 -35.943 266 HB2 TRP 32 HB2 TRP 32 16.206 -25.724 -33.687 267 HB3 TRP 32 HB3 TRP 32 14.489 -25.550 -34.043 268 HD1 TRP 32 HD1 TRP 32 16.705 -28.731 -34.275 269 HE1 TRP 32 HE1 TRP 32 15.608 -30.562 -32.837 270 HE3 TRP 32 HE3 TRP 32 12.802 -26.035 -32.367 271 HZ2 TRP 32 HZ2 TRP 32 13.382 -30.829 -31.122 272 HZ3 TRP 32 HZ3 TRP 32 11.234 -27.154 -30.835 273 HH2 TRP 32 HH2 TRP 32 11.519 -29.501 -30.227 274 H ARG 33 H ARG 33 15.851 -24.893 -37.782 275 HA ARG 33 HA ARG 33 12.981 -24.266 -37.879 276 HB2 ARG 33 HB2 ARG 33 15.436 -22.851 -38.851 277 HB3 ARG 33 HB3 ARG 33 13.889 -22.537 -39.627 278 HG2 ARG 33 HG2 ARG 33 13.016 -22.077 -37.262 279 HG3 ARG 33 HG3 ARG 33 14.718 -21.986 -36.804 280 HD2 ARG 33 HD2 ARG 33 15.089 -20.083 -38.042 281 HD3 ARG 33 HD3 ARG 33 13.764 -20.423 -39.155 282 HE ARG 33 HE ARG 33 13.626 -18.876 -36.786 283 HH11 ARG 33 HH11 ARG 33 11.814 -21.159 -38.690 284 HH12 ARG 33 HH12 ARG 33 10.271 -20.571 -38.164 285 HH21 ARG 33 HH21 ARG 33 11.601 -18.094 -36.085 286 HH22 ARG 33 HH22 ARG 33 10.152 -18.828 -36.683 287 H ILE 34 H ILE 34 13.879 -26.805 -38.744 288 HA ILE 34 HA ILE 34 14.415 -27.087 -41.445 289 HB ILE 34 HB ILE 34 12.680 -28.879 -39.741 290 HG12 ILE 34 HG12 ILE 34 15.595 -29.258 -40.403 291 HG13 ILE 34 HG13 ILE 34 15.079 -28.351 -38.985 292 HG21 ILE 34 HG21 ILE 34 14.073 -30.352 -41.682 293 HG22 ILE 34 HG22 ILE 34 12.337 -30.063 -41.586 294 HG23 ILE 34 HG23 ILE 34 13.361 -28.975 -42.522 295 HD11 ILE 34 HD11 ILE 34 15.642 -30.914 -38.860 296 HD12 ILE 34 HD12 ILE 34 14.342 -30.210 -37.898 297 HD13 ILE 34 HD13 ILE 34 13.968 -31.072 -39.390 298 H1 MET 101 H MET 101 9.643 10.782 -7.024 299 HA MET 101 HA MET 101 11.519 8.807 -6.138 300 HB2 MET 101 HB2 MET 101 8.918 9.163 -4.721 301 HB3 MET 101 HB3 MET 101 9.495 7.526 -5.000 302 HG2 MET 101 HG2 MET 101 10.344 7.988 -2.918 303 HG3 MET 101 HG3 MET 101 11.702 8.392 -3.965 304 HE1 MET 101 HE1 MET 101 9.673 10.559 -0.869 305 HE2 MET 101 HE2 MET 101 10.306 8.931 -1.114 306 HE3 MET 101 HE3 MET 101 11.402 10.252 -0.705 307 H ASP 102 H ASP 102 11.673 8.125 -8.232 308 HA ASP 102 HA ASP 102 9.500 6.484 -9.209 309 HB2 ASP 102 HB2 ASP 102 10.428 8.952 -10.669 310 HB3 ASP 102 HB3 ASP 102 9.667 7.604 -11.509 311 H SER 103 H SER 103 10.434 4.640 -9.757 312 HA SER 103 HA SER 103 13.150 4.721 -10.900 313 HB2 SER 103 HB2 SER 103 11.957 2.314 -9.535 314 HB3 SER 103 HB3 SER 103 13.656 2.676 -9.840 315 HG SER 103 HG SER 103 13.635 3.462 -7.897 316 H ALA 104 H ALA 104 10.823 5.052 -12.482 317 HA ALA 104 HA ALA 104 10.034 2.604 -13.698 318 HB1 ALA 104 HB1 ALA 104 8.465 3.931 -14.525 319 HB2 ALA 104 HB2 ALA 104 9.312 5.342 -13.889 320 HB3 ALA 104 HB3 ALA 104 9.673 4.754 -15.512 321 HA PRO 105 HA PRO 105 13.034 3.878 -17.258 322 HB2 PRO 105 HB2 PRO 105 14.694 5.979 -16.812 323 HB3 PRO 105 HB3 PRO 105 13.078 6.161 -17.505 324 HG2 PRO 105 HG2 PRO 105 13.987 6.581 -14.684 325 HG3 PRO 105 HG3 PRO 105 12.891 7.571 -15.665 326 HD2 PRO 105 HD2 PRO 105 11.998 5.821 -13.802 327 HD3 PRO 105 HD3 PRO 105 11.092 6.181 -15.285 328 H PHE 106 H PHE 106 14.080 4.170 -13.932 329 HA PHE 106 HA PHE 106 16.776 3.326 -14.420 330 HB2 PHE 106 HB2 PHE 106 15.110 3.771 -11.963 331 HB3 PHE 106 HB3 PHE 106 16.666 2.957 -11.840 332 HD1 PHE 106 HD2 PHE 106 18.722 4.167 -12.675 333 HD2 PHE 106 HD1 PHE 106 14.973 6.097 -12.095 334 HE1 PHE 106 HE2 PHE 106 19.858 6.349 -12.621 335 HE2 PHE 106 HE1 PHE 106 16.103 8.282 -12.041 336 HZ PHE 106 HZ PHE 106 18.548 8.410 -12.302 337 H GLU 107 H GLU 107 13.758 1.768 -13.562 338 HA GLU 107 HA GLU 107 14.770 -0.714 -12.734 339 HB2 GLU 107 HB2 GLU 107 12.191 0.407 -13.429 340 HB3 GLU 107 HB3 GLU 107 12.341 -1.244 -14.014 341 HG2 GLU 107 HG2 GLU 107 12.949 -1.975 -11.753 342 HG3 GLU 107 HG3 GLU 107 12.745 -0.321 -11.178 343 H LEU 108 H LEU 108 14.100 0.593 -15.922 344 HA LEU 108 HA LEU 108 14.281 -1.798 -17.389 345 HB2 LEU 108 HB2 LEU 108 14.529 1.097 -18.005 346 HB3 LEU 108 HB3 LEU 108 15.119 -0.053 -19.203 347 HG LEU 108 HG LEU 108 12.303 0.040 -18.122 348 HD11 LEU 108 HD11 LEU 108 12.787 0.612 -20.950 349 HD12 LEU 108 HD12 LEU 108 13.425 1.827 -19.844 350 HD13 LEU 108 HD13 LEU 108 11.714 1.403 -19.796 351 HD21 LEU 108 HD21 LEU 108 12.480 -2.131 -18.791 352 HD22 LEU 108 HD22 LEU 108 13.766 -1.788 -19.949 353 HD23 LEU 108 HD23 LEU 108 12.094 -1.387 -20.343 354 H PHE 109 H PHE 109 16.735 0.572 -16.444 355 HA PHE 109 HA PHE 109 18.909 -0.346 -17.860 356 HB2 PHE 109 HB2 PHE 109 18.527 1.107 -15.316 357 HB3 PHE 109 HB3 PHE 109 20.092 0.323 -15.510 358 HD1 PHE 109 HD1 PHE 109 21.174 0.719 -17.919 359 HD2 PHE 109 HD2 PHE 109 18.337 3.272 -16.033 360 HE1 PHE 109 HE1 PHE 109 21.943 2.597 -19.311 361 HE2 PHE 109 HE2 PHE 109 19.101 5.153 -17.423 362 HZ PHE 109 HZ PHE 109 20.906 4.817 -19.065 363 H PHE 110 H PHE 110 17.527 -1.629 -14.884 364 HA PHE 110 HA PHE 110 19.610 -3.589 -14.545 365 HB2 PHE 110 HB2 PHE 110 18.591 -2.813 -12.539 366 HB3 PHE 110 HB3 PHE 110 16.972 -3.112 -13.163 367 HD1 PHE 110 HD2 PHE 110 19.960 -4.620 -11.699 368 HD2 PHE 110 HD1 PHE 110 16.035 -5.337 -13.182 369 HE1 PHE 110 HE2 PHE 110 19.974 -6.847 -10.652 370 HE2 PHE 110 HE1 PHE 110 16.043 -7.564 -12.136 371 HZ PHE 110 HZ PHE 110 18.014 -8.322 -10.870 372 H MET 111 H MET 111 16.507 -3.413 -16.091 373 HA MET 111 HA MET 111 16.027 -6.209 -16.279 374 HB2 MET 111 HB2 MET 111 14.884 -3.751 -17.498 375 HB3 MET 111 HB3 MET 111 14.599 -5.270 -18.337 376 HG2 MET 111 HG2 MET 111 13.505 -6.201 -16.438 377 HG3 MET 111 HG3 MET 111 13.972 -4.832 -15.431 378 HE1 MET 111 HE1 MET 111 11.565 -2.456 -15.473 379 HE2 MET 111 HE2 MET 111 10.840 -3.964 -14.915 380 HE3 MET 111 HE3 MET 111 12.549 -3.642 -14.615 381 H ILE 112 H ILE 112 17.626 -3.848 -18.353 382 HA ILE 112 HA ILE 112 18.043 -5.700 -20.505 383 HB ILE 112 HB ILE 112 19.245 -2.988 -19.949 384 HG12 ILE 112 HG12 ILE 112 17.687 -3.045 -22.308 385 HG13 ILE 112 HG13 ILE 112 16.753 -3.880 -21.071 386 HG21 ILE 112 HG21 ILE 112 20.870 -3.943 -21.284 387 HG22 ILE 112 HG22 ILE 112 19.711 -4.941 -22.161 388 HG23 ILE 112 HG23 ILE 112 19.801 -3.209 -22.480 389 HD11 ILE 112 HD11 ILE 112 17.901 -1.466 -20.017 390 HD12 ILE 112 HD12 ILE 112 16.958 -1.138 -21.471 391 HD13 ILE 112 HD13 ILE 112 16.213 -1.968 -20.105 392 H ASN 113 H ASN 113 20.151 -4.217 -18.048 393 HA ASN 113 HA ASN 113 22.546 -5.401 -18.735 394 HB2 ASN 113 HB2 ASN 113 21.387 -4.402 -16.174 395 HB3 ASN 113 HB3 ASN 113 22.879 -5.335 -16.099 396 HD21 ASN 113 HD21 ASN 113 21.534 -2.818 -18.215 397 HD22 ASN 113 HD22 ASN 113 22.932 -1.804 -18.178 398 H THR 114 H THR 114 20.248 -6.617 -16.291 399 HA THR 114 HA THR 114 21.520 -9.027 -15.756 400 HB THR 114 HB THR 114 19.596 -8.081 -14.461 401 HG1 THR 114 HG1 THR 114 19.047 -10.077 -13.777 402 HG21 THR 114 HG21 THR 114 18.240 -7.774 -16.660 403 HG22 THR 114 HG22 THR 114 17.394 -8.236 -15.182 404 HG23 THR 114 HG23 THR 114 17.773 -9.454 -16.400 405 H SER 115 H SER 115 19.576 -8.090 -18.473 406 HA SER 115 HA SER 115 18.882 -10.676 -19.393 407 HB2 SER 115 HB2 SER 115 18.033 -8.266 -20.097 408 HB3 SER 115 HB3 SER 115 19.287 -8.433 -21.326 409 HG SER 115 HG SER 115 17.458 -10.523 -20.902 410 H ILE 116 H ILE 116 21.281 -8.406 -20.746 411 HA ILE 116 HA ILE 116 22.533 -10.182 -22.461 412 HB ILE 116 HB ILE 116 23.820 -7.889 -20.973 413 HG12 ILE 116 HG12 ILE 116 22.703 -7.871 -23.775 414 HG13 ILE 116 HG13 ILE 116 21.734 -7.421 -22.375 415 HG21 ILE 116 HG21 ILE 116 25.602 -9.088 -21.855 416 HG22 ILE 116 HG22 ILE 116 24.698 -9.568 -23.290 417 HG23 ILE 116 HG23 ILE 116 25.260 -7.906 -23.117 418 HD11 ILE 116 HD11 ILE 116 24.120 -5.960 -22.184 419 HD12 ILE 116 HD12 ILE 116 23.596 -5.855 -23.865 420 HD13 ILE 116 HD13 ILE 116 22.506 -5.363 -22.568 421 H LEU 117 H LEU 117 22.757 -9.934 -19.023 422 HA LEU 117 HA LEU 117 25.219 -11.432 -18.825 423 HB2 LEU 117 HB2 LEU 117 23.662 -9.804 -17.113 424 HB3 LEU 117 HB3 LEU 117 23.761 -11.400 -16.372 425 HG LEU 117 HG LEU 117 26.065 -9.606 -17.126 426 HD11 LEU 117 HD11 LEU 117 25.423 -8.754 -15.126 427 HD12 LEU 117 HD12 LEU 117 26.384 -10.106 -14.530 428 HD13 LEU 117 HD13 LEU 117 24.628 -10.243 -14.617 429 HD21 LEU 117 HD21 LEU 117 27.339 -11.418 -17.229 430 HD22 LEU 117 HD22 LEU 117 25.958 -12.455 -16.869 431 HD23 LEU 117 HD23 LEU 117 26.920 -11.777 -15.554 432 H LEU 118 H LEU 118 21.851 -12.024 -17.800 433 HA LEU 118 HA LEU 118 22.108 -14.663 -17.041 434 HB2 LEU 118 HB2 LEU 118 19.827 -13.128 -18.233 435 HB3 LEU 118 HB3 LEU 118 19.659 -14.834 -17.820 436 HG LEU 118 HG LEU 118 20.110 -12.504 -15.973 437 HD11 LEU 118 HD11 LEU 118 17.891 -14.299 -16.662 438 HD12 LEU 118 HD12 LEU 118 17.871 -12.658 -16.019 439 HD13 LEU 118 HD13 LEU 118 18.127 -14.026 -14.936 440 HD21 LEU 118 HD21 LEU 118 20.861 -15.328 -15.641 441 HD22 LEU 118 HD22 LEU 118 19.928 -14.633 -14.316 442 HD23 LEU 118 HD23 LEU 118 21.449 -13.888 -14.809 443 H ILE 119 H ILE 119 21.743 -13.315 -20.265 444 HA ILE 119 HA ILE 119 21.212 -15.694 -21.656 445 HB ILE 119 HB ILE 119 22.664 -13.230 -22.627 446 HG12 ILE 119 HG12 ILE 119 19.829 -13.880 -23.305 447 HG13 ILE 119 HG13 ILE 119 20.174 -13.220 -21.710 448 HG21 ILE 119 HG21 ILE 119 23.124 -15.095 -24.085 449 HG22 ILE 119 HG22 ILE 119 21.412 -15.507 -24.154 450 HG23 ILE 119 HG23 ILE 119 21.987 -14.004 -24.876 451 HD11 ILE 119 HD11 ILE 119 19.997 -11.885 -24.242 452 HD12 ILE 119 HD12 ILE 119 20.090 -11.207 -22.617 453 HD13 ILE 119 HD13 ILE 119 21.568 -11.597 -23.496 454 H PHE 120 H PHE 120 24.319 -13.940 -21.532 455 HA PHE 120 HA PHE 120 25.837 -16.068 -22.570 456 HB2 PHE 120 HB2 PHE 120 26.549 -13.673 -22.533 457 HB3 PHE 120 HB3 PHE 120 26.817 -13.821 -20.799 458 HD1 PHE 120 HD1 PHE 120 27.735 -15.684 -23.904 459 HD2 PHE 120 HD2 PHE 120 28.988 -14.120 -20.149 460 HE1 PHE 120 HE1 PHE 120 30.018 -16.495 -24.332 461 HE2 PHE 120 HE2 PHE 120 31.274 -14.926 -20.572 462 HZ PHE 120 HZ PHE 120 31.791 -16.115 -22.666 463 H ILE 121 H ILE 121 24.674 -15.393 -19.392 464 HA ILE 121 HA ILE 121 26.555 -16.980 -17.954 465 HB ILE 121 HB ILE 121 23.969 -15.664 -17.319 466 HG12 ILE 121 HG12 ILE 121 26.539 -15.842 -15.742 467 HG13 ILE 121 HG13 ILE 121 26.272 -14.654 -17.013 468 HG21 ILE 121 HG21 ILE 121 24.027 -16.790 -15.050 469 HG22 ILE 121 HG22 ILE 121 23.449 -17.770 -16.396 470 HG23 ILE 121 HG23 ILE 121 25.087 -17.994 -15.783 471 HD11 ILE 121 HD11 ILE 121 24.706 -14.935 -14.460 472 HD12 ILE 121 HD12 ILE 121 25.858 -13.662 -14.865 473 HD13 ILE 121 HD13 ILE 121 24.340 -13.793 -15.753 474 H PHE 122 H PHE 122 23.179 -17.554 -18.944 475 HA PHE 122 HA PHE 122 23.161 -20.260 -18.074 476 HB2 PHE 122 HB2 PHE 122 21.349 -18.841 -20.039 477 HB3 PHE 122 HB3 PHE 122 21.034 -20.417 -19.322 478 HD1 PHE 122 HD2 PHE 122 22.013 -19.777 -16.531 479 HD2 PHE 122 HD1 PHE 122 19.488 -17.658 -19.223 480 HE1 PHE 122 HE2 PHE 122 20.903 -18.687 -14.625 481 HE2 PHE 122 HE1 PHE 122 18.374 -16.563 -17.321 482 HZ PHE 122 HZ PHE 122 19.080 -17.079 -15.019 483 H ILE 123 H ILE 123 23.339 -18.790 -21.314 484 HA ILE 123 HA ILE 123 23.521 -21.060 -22.853 485 HB ILE 123 HB ILE 123 24.544 -18.291 -23.161 486 HG12 ILE 123 HG12 ILE 123 23.349 -18.985 -25.491 487 HG13 ILE 123 HG13 ILE 123 22.560 -20.110 -24.391 488 HG21 ILE 123 HG21 ILE 123 25.500 -19.015 -25.422 489 HG22 ILE 123 HG22 ILE 123 26.472 -19.324 -23.985 490 HG23 ILE 123 HG23 ILE 123 25.560 -20.636 -24.732 491 HD11 ILE 123 HD11 ILE 123 22.695 -17.154 -23.885 492 HD12 ILE 123 HD12 ILE 123 21.381 -17.928 -24.771 493 HD13 ILE 123 HD13 ILE 123 21.679 -18.352 -23.085 494 H VAL 124 H VAL 124 26.192 -19.318 -21.279 495 HA VAL 124 HA VAL 124 28.218 -21.096 -22.164 496 HB VAL 124 HB VAL 124 28.132 -19.075 -19.932 497 HG11 VAL 124 HG11 VAL 124 30.299 -21.005 -20.678 498 HG12 VAL 124 HG12 VAL 124 30.685 -19.435 -19.971 499 HG13 VAL 124 HG13 VAL 124 29.685 -20.583 -19.080 500 HG21 VAL 124 HG21 VAL 124 29.288 -17.666 -21.355 501 HG22 VAL 124 HG22 VAL 124 29.903 -18.993 -22.340 502 HG23 VAL 124 HG23 VAL 124 28.213 -18.509 -22.471 503 H LEU 125 H LEU 125 26.366 -20.843 -19.152 504 HA LEU 125 HA LEU 125 27.655 -22.770 -17.643 505 HB2 LEU 125 HB2 LEU 125 24.910 -21.660 -17.724 506 HB3 LEU 125 HB3 LEU 125 25.143 -23.155 -16.822 507 HG LEU 125 HG LEU 125 26.438 -20.484 -16.305 508 HD11 LEU 125 HD11 LEU 125 24.196 -20.614 -15.462 509 HD12 LEU 125 HD12 LEU 125 25.316 -20.754 -14.108 510 HD13 LEU 125 HD13 LEU 125 24.511 -22.191 -14.739 511 HD21 LEU 125 HD21 LEU 125 28.188 -21.761 -15.659 512 HD22 LEU 125 HD22 LEU 125 27.206 -23.216 -15.483 513 HD23 LEU 125 HD23 LEU 125 27.196 -21.986 -14.218 514 H LEU 126 H LEU 126 25.250 -23.162 -20.180 515 HA LEU 126 HA LEU 126 24.562 -25.821 -19.827 516 HB2 LEU 126 HB2 LEU 126 24.608 -23.930 -22.083 517 HB3 LEU 126 HB3 LEU 126 24.601 -25.636 -22.526 518 HG LEU 126 HG LEU 126 22.348 -24.778 -22.535 519 HD11 LEU 126 HD11 LEU 126 21.309 -26.433 -21.232 520 HD12 LEU 126 HD12 LEU 126 22.610 -26.433 -20.042 521 HD13 LEU 126 HD13 LEU 126 22.887 -27.097 -21.652 522 HD21 LEU 126 HD21 LEU 126 23.089 -23.783 -19.814 523 HD22 LEU 126 HD22 LEU 126 21.405 -24.138 -20.202 524 HD23 LEU 126 HD23 LEU 126 22.292 -22.935 -21.140 525 H ILE 127 H ILE 127 27.046 -24.616 -22.091 526 HA ILE 127 HA ILE 127 28.129 -27.061 -22.796 527 HB ILE 127 HB ILE 127 29.137 -24.274 -22.797 528 HG12 ILE 127 HG12 ILE 127 29.744 -25.929 -25.093 529 HG13 ILE 127 HG13 ILE 127 28.053 -26.095 -24.634 530 HG21 ILE 127 HG21 ILE 127 30.934 -26.679 -22.938 531 HG22 ILE 127 HG22 ILE 127 31.365 -25.125 -23.651 532 HG23 ILE 127 HG23 ILE 127 31.092 -25.252 -21.914 533 HD11 ILE 127 HD11 ILE 127 28.387 -23.401 -24.520 534 HD12 ILE 127 HD12 ILE 127 29.463 -23.845 -25.845 535 HD13 ILE 127 HD13 ILE 127 27.758 -24.289 -25.907 536 H HIS 128 H HIS 128 29.193 -24.881 -20.189 537 HA HIS 128 HA HIS 128 31.340 -26.259 -19.207 538 HB2 HIS 128 HB2 HIS 128 30.745 -24.136 -18.261 539 HB3 HIS 128 HB3 HIS 128 29.198 -24.759 -17.696 540 HD1 HIS 128 HD1 HIS 128 29.150 -25.852 -15.426 541 HD2 HIS 128 HD2 HIS 128 33.008 -25.093 -16.768 542 HE1 HIS 128 HE1 HIS 128 30.649 -26.318 -13.461 543 H PHE 129 H PHE 129 27.930 -26.976 -18.734 544 HA PHE 129 HA PHE 129 28.598 -29.254 -17.026 545 HB2 PHE 129 HB2 PHE 129 26.043 -27.817 -17.683 546 HB3 PHE 129 HB3 PHE 129 26.005 -29.428 -16.975 547 HD1 PHE 129 HD2 PHE 129 27.695 -29.653 -14.882 548 HD2 PHE 129 HD1 PHE 129 25.843 -26.066 -16.230 549 HE1 PHE 129 HE2 PHE 129 27.965 -28.675 -12.641 550 HE2 PHE 129 HE1 PHE 129 26.111 -25.082 -13.991 551 HZ PHE 129 HZ PHE 129 27.173 -26.387 -12.193 552 H GLU 130 H GLU 130 27.798 -28.503 -20.266 553 HA GLU 130 HA GLU 130 26.632 -31.004 -20.987 554 HB2 GLU 130 HB2 GLU 130 27.007 -28.524 -22.221 555 HB3 GLU 130 HB3 GLU 130 27.957 -29.650 -23.181 556 HG2 GLU 130 HG2 GLU 130 25.154 -30.346 -22.444 557 HG3 GLU 130 HG3 GLU 130 25.461 -29.210 -23.757 558 H GLY 131 H GLY 131 29.660 -30.326 -19.954 559 HA2 GLY 131 HA2 GLY 131 31.099 -32.372 -19.907 560 HA3 GLY 131 HA3 GLY 131 30.864 -32.428 -21.648 561 H TRP 132 H TRP 132 31.636 -29.748 -19.436 562 HA TRP 132 HA TRP 132 34.116 -29.330 -20.971 563 HB2 TRP 132 HB2 TRP 132 31.891 -27.602 -20.831 564 HB3 TRP 132 HB3 TRP 132 33.146 -26.868 -19.836 565 HD1 TRP 132 HD1 TRP 132 33.494 -28.735 -23.225 566 HE1 TRP 132 HE1 TRP 132 34.729 -27.176 -24.859 567 HE3 TRP 132 HE3 TRP 132 33.943 -24.614 -20.233 568 HZ2 TRP 132 HZ2 TRP 132 35.757 -24.547 -24.877 569 HZ3 TRP 132 HZ3 TRP 132 35.066 -22.619 -21.134 570 HH2 TRP 132 HH2 TRP 132 35.954 -22.588 -23.408 571 H ARG 133 H ARG 133 33.354 -30.597 -18.293 572 HA ARG 133 HA ARG 133 34.920 -28.904 -16.486 573 HB2 ARG 133 HB2 ARG 133 32.978 -31.147 -16.092 574 HB3 ARG 133 HB3 ARG 133 34.164 -30.807 -14.839 575 HG2 ARG 133 HG2 ARG 133 33.319 -28.397 -14.950 576 HG3 ARG 133 HG3 ARG 133 31.952 -29.058 -15.848 577 HD2 ARG 133 HD2 ARG 133 31.144 -30.212 -14.036 578 HD3 ARG 133 HD3 ARG 133 32.730 -30.341 -13.276 579 HE ARG 133 HE ARG 133 30.806 -28.309 -12.838 580 HH11 ARG 133 HH11 ARG 133 34.236 -28.832 -13.121 581 HH12 ARG 133 HH12 ARG 133 34.656 -27.484 -12.117 582 HH21 ARG 133 HH21 ARG 133 31.347 -26.532 -11.514 583 HH22 ARG 133 HH22 ARG 133 33.012 -26.177 -11.203 584 H ILE 134 H ILE 134 36.290 -30.204 -18.591 585 HA ILE 134 HA ILE 134 37.438 -32.655 -18.005 586 HB ILE 134 HB ILE 134 38.771 -30.287 -19.325 587 HG12 ILE 134 HG12 ILE 134 37.464 -32.650 -20.666 588 HG13 ILE 134 HG13 ILE 134 36.575 -31.177 -20.294 589 HG21 ILE 134 HG21 ILE 134 39.735 -32.703 -20.373 590 HG22 ILE 134 HG22 ILE 134 40.607 -31.532 -19.386 591 HG23 ILE 134 HG23 ILE 134 39.769 -32.880 -18.619 592 HD11 ILE 134 HD11 ILE 134 37.684 -31.555 -22.640 593 HD12 ILE 134 HD12 ILE 134 37.659 -29.960 -21.886 594 HD13 ILE 134 HD13 ILE 134 39.117 -30.949 -21.811 Start of MODEL 4 1 H1 MET 1 H MET 1 4.573 -1.634 3.198 2 HA MET 1 HA MET 1 5.541 0.227 2.318 3 HB2 MET 1 HB2 MET 1 6.564 0.533 5.147 4 HB3 MET 1 HB3 MET 1 6.597 1.792 3.920 5 HG2 MET 1 HG2 MET 1 4.281 2.038 3.935 6 HG3 MET 1 HG3 MET 1 4.031 0.484 4.726 7 HE1 MET 1 HE1 MET 1 2.514 2.508 7.320 8 HE2 MET 1 HE2 MET 1 2.451 1.248 6.088 9 HE3 MET 1 HE3 MET 1 3.168 0.907 7.663 10 H ASP 2 H ASP 2 7.015 -2.327 2.298 11 HA ASP 2 HA ASP 2 9.533 -1.281 1.372 12 HB2 ASP 2 HB2 ASP 2 9.363 -2.988 3.841 13 HB3 ASP 2 HB3 ASP 2 10.793 -3.025 2.814 14 H SER 3 H SER 3 9.803 -2.258 -0.512 15 HA SER 3 HA SER 3 8.731 -4.962 -0.887 16 HB2 SER 3 HB2 SER 3 9.811 -3.388 -3.176 17 HB3 SER 3 HB3 SER 3 8.416 -4.464 -3.108 18 HG SER 3 HG SER 3 7.632 -2.401 -3.253 19 H ALA 4 H ALA 4 11.137 -4.637 0.584 20 HA ALA 4 HA ALA 4 13.424 -5.085 -1.045 21 HB1 ALA 4 HB1 ALA 4 13.971 -6.191 1.448 22 HB2 ALA 4 HB2 ALA 4 14.337 -4.552 0.910 23 HB3 ALA 4 HB3 ALA 4 12.836 -4.882 1.774 24 HA PRO 5 HA PRO 5 12.887 -9.726 0.168 25 HB2 PRO 5 HB2 PRO 5 10.588 -10.440 1.423 26 HB3 PRO 5 HB3 PRO 5 12.035 -9.918 2.293 27 HG2 PRO 5 HG2 PRO 5 9.580 -8.355 1.590 28 HG3 PRO 5 HG3 PRO 5 10.494 -8.380 3.110 29 HD2 PRO 5 HD2 PRO 5 10.764 -6.402 1.281 30 HD3 PRO 5 HD3 PRO 5 12.106 -6.939 2.311 31 H PHE 6 H PHE 6 10.091 -7.873 -0.830 32 HA PHE 6 HA PHE 6 8.846 -9.991 -2.293 33 HB2 PHE 6 HB2 PHE 6 8.169 -7.357 -1.519 34 HB3 PHE 6 HB3 PHE 6 8.088 -7.401 -3.277 35 HD1 PHE 6 HD1 PHE 6 7.166 -9.728 -0.504 36 HD2 PHE 6 HD2 PHE 6 5.975 -7.744 -4.076 37 HE1 PHE 6 HE1 PHE 6 4.963 -10.814 -0.368 38 HE2 PHE 6 HE2 PHE 6 3.770 -8.827 -3.946 39 HZ PHE 6 HZ PHE 6 3.261 -10.364 -2.091 40 H GLU 7 H GLU 7 11.062 -7.369 -3.071 41 HA GLU 7 HA GLU 7 10.967 -7.470 -5.848 42 HB2 GLU 7 HB2 GLU 7 12.653 -6.303 -3.850 43 HB3 GLU 7 HB3 GLU 7 13.664 -7.020 -5.097 44 HG2 GLU 7 HG2 GLU 7 11.397 -5.139 -5.688 45 HG3 GLU 7 HG3 GLU 7 13.060 -4.613 -5.436 46 H LEU 8 H LEU 8 12.848 -9.415 -3.574 47 HA LEU 8 HA LEU 8 14.487 -10.766 -5.361 48 HB2 LEU 8 HB2 LEU 8 14.084 -10.845 -2.682 49 HB3 LEU 8 HB3 LEU 8 13.386 -12.389 -3.168 50 HG LEU 8 HG LEU 8 15.553 -12.947 -4.266 51 HD11 LEU 8 HD11 LEU 8 16.155 -10.211 -3.383 52 HD12 LEU 8 HD12 LEU 8 16.830 -11.154 -4.711 53 HD13 LEU 8 HD13 LEU 8 17.417 -11.401 -3.066 54 HD21 LEU 8 HD21 LEU 8 15.580 -14.051 -2.312 55 HD22 LEU 8 HD22 LEU 8 15.075 -12.636 -1.387 56 HD23 LEU 8 HD23 LEU 8 16.769 -12.836 -1.841 57 H PHE 9 H PHE 9 11.135 -11.366 -4.475 58 HA PHE 9 HA PHE 9 10.732 -13.880 -5.525 59 HB2 PHE 9 HB2 PHE 9 9.091 -12.224 -4.337 60 HB3 PHE 9 HB3 PHE 9 8.683 -11.739 -5.980 61 HD1 PHE 9 HD1 PHE 9 9.272 -14.968 -4.196 62 HD2 PHE 9 HD2 PHE 9 6.766 -12.693 -6.778 63 HE1 PHE 9 HE1 PHE 9 7.724 -16.874 -4.368 64 HE2 PHE 9 HE2 PHE 9 5.215 -14.594 -6.953 65 HZ PHE 9 HZ PHE 9 5.692 -16.687 -5.747 66 H PHE 10 H PHE 10 10.676 -10.771 -7.225 67 HA PHE 10 HA PHE 10 10.057 -11.931 -9.764 68 HB2 PHE 10 HB2 PHE 10 9.411 -9.657 -9.414 69 HB3 PHE 10 HB3 PHE 10 11.045 -9.198 -8.946 70 HD1 PHE 10 HD2 PHE 10 8.844 -10.043 -11.749 71 HD2 PHE 10 HD1 PHE 10 12.740 -8.780 -10.592 72 HE1 PHE 10 HE2 PHE 10 9.329 -9.418 -14.079 73 HE2 PHE 10 HE1 PHE 10 13.232 -8.151 -12.919 74 HZ PHE 10 HZ PHE 10 11.526 -8.471 -14.667 75 H MET 11 H MET 11 12.962 -11.284 -7.986 76 HA MET 11 HA MET 11 14.772 -11.334 -10.175 77 HB2 MET 11 HB2 MET 11 14.986 -11.484 -7.213 78 HB3 MET 11 HB3 MET 11 16.350 -12.082 -8.148 79 HG2 MET 11 HG2 MET 11 16.719 -9.981 -9.145 80 HG3 MET 11 HG3 MET 11 15.164 -9.363 -8.592 81 HE1 MET 11 HE1 MET 11 15.348 -8.100 -5.428 82 HE2 MET 11 HE2 MET 11 16.215 -7.060 -6.558 83 HE3 MET 11 HE3 MET 11 14.838 -8.012 -7.114 84 H ILE 12 H ILE 12 13.326 -13.795 -8.151 85 HA ILE 12 HA ILE 12 15.043 -15.891 -9.168 86 HB ILE 12 HB ILE 12 12.612 -15.988 -7.382 87 HG12 ILE 12 HG12 ILE 12 14.986 -16.975 -6.164 88 HG13 ILE 12 HG13 ILE 12 15.378 -15.434 -6.920 89 HG21 ILE 12 HG21 ILE 12 12.508 -18.088 -8.278 90 HG22 ILE 12 HG22 ILE 12 14.235 -18.146 -8.625 91 HG23 ILE 12 HG23 ILE 12 13.660 -18.373 -6.974 92 HD11 ILE 12 HD11 ILE 12 13.007 -14.895 -5.667 93 HD12 ILE 12 HD12 ILE 12 13.798 -16.008 -4.550 94 HD13 ILE 12 HD13 ILE 12 14.614 -14.525 -5.042 95 H ASN 13 H ASN 13 11.608 -15.003 -9.425 96 HA ASN 13 HA ASN 13 10.719 -17.043 -11.053 97 HB2 ASN 13 HB2 ASN 13 9.914 -14.168 -10.761 98 HB3 ASN 13 HB3 ASN 13 9.156 -15.167 -11.998 99 HD21 ASN 13 HD21 ASN 13 8.772 -17.527 -10.897 100 HD22 ASN 13 HD22 ASN 13 7.783 -17.424 -9.483 101 H THR 14 H THR 14 11.925 -13.866 -12.139 102 HA THR 14 HA THR 14 11.860 -14.357 -14.873 103 HB THR 14 HB THR 14 12.293 -12.133 -13.785 104 HG1 THR 14 HG1 THR 14 12.707 -11.879 -15.858 105 HG21 THR 14 HG21 THR 14 15.206 -12.717 -13.812 106 HG22 THR 14 HG22 THR 14 14.270 -13.295 -12.434 107 HG23 THR 14 HG23 THR 14 14.291 -11.576 -12.828 108 H SER 15 H SER 15 14.103 -15.448 -12.462 109 HA SER 15 HA SER 15 16.245 -16.101 -14.219 110 HB2 SER 15 HB2 SER 15 16.141 -15.870 -11.576 111 HB3 SER 15 HB3 SER 15 15.842 -17.606 -11.670 112 HG SER 15 HG SER 15 18.110 -16.142 -12.458 113 H ILE 16 H ILE 16 14.031 -18.266 -12.444 114 HA ILE 16 HA ILE 16 14.656 -20.615 -13.745 115 HB ILE 16 HB ILE 16 11.934 -19.796 -12.723 116 HG12 ILE 16 HG12 ILE 16 14.142 -21.335 -11.339 117 HG13 ILE 16 HG13 ILE 16 13.785 -19.634 -11.060 118 HG21 ILE 16 HG21 ILE 16 11.649 -22.279 -12.438 119 HG22 ILE 16 HG22 ILE 16 11.661 -21.705 -14.105 120 HG23 ILE 16 HG23 ILE 16 13.094 -22.481 -13.429 121 HD11 ILE 16 HD11 ILE 16 11.353 -20.819 -10.664 122 HD12 ILE 16 HD12 ILE 16 12.480 -22.016 -10.024 123 HD13 ILE 16 HD13 ILE 16 12.499 -20.366 -9.402 124 H LEU 17 H LEU 17 12.717 -17.951 -14.857 125 HA LEU 17 HA LEU 17 11.564 -19.424 -17.059 126 HB2 LEU 17 HB2 LEU 17 11.120 -16.915 -15.761 127 HB3 LEU 17 HB3 LEU 17 11.325 -16.646 -17.491 128 HG LEU 17 HG LEU 17 9.348 -18.606 -16.335 129 HD11 LEU 17 HD11 LEU 17 7.724 -16.737 -17.118 130 HD12 LEU 17 HD12 LEU 17 9.118 -15.681 -16.897 131 HD13 LEU 17 HD13 LEU 17 8.497 -16.616 -15.537 132 HD21 LEU 17 HD21 LEU 17 8.828 -17.417 -18.937 133 HD22 LEU 17 HD22 LEU 17 8.818 -19.110 -18.442 134 HD23 LEU 17 HD23 LEU 17 10.336 -18.332 -18.894 135 H LEU 18 H LEU 18 13.760 -16.621 -16.814 136 HA LEU 18 HA LEU 18 14.474 -16.395 -19.460 137 HB2 LEU 18 HB2 LEU 18 15.932 -15.846 -16.910 138 HB3 LEU 18 HB3 LEU 18 16.759 -15.647 -18.453 139 HG LEU 18 HG LEU 18 14.381 -14.122 -17.414 140 HD11 LEU 18 HD11 LEU 18 16.159 -12.961 -16.628 141 HD12 LEU 18 HD12 LEU 18 16.122 -12.287 -18.257 142 HD13 LEU 18 HD13 LEU 18 17.255 -13.581 -17.863 143 HD21 LEU 18 HD21 LEU 18 13.662 -14.044 -19.530 144 HD22 LEU 18 HD22 LEU 18 15.172 -14.695 -20.168 145 HD23 LEU 18 HD23 LEU 18 15.035 -12.973 -19.809 146 H ILE 19 H ILE 19 15.647 -18.678 -17.066 147 HA ILE 19 HA ILE 19 17.867 -19.676 -18.445 148 HB ILE 19 HB ILE 19 16.012 -21.083 -16.524 149 HG12 ILE 19 HG12 ILE 19 18.796 -20.231 -15.868 150 HG13 ILE 19 HG13 ILE 19 17.544 -18.995 -15.934 151 HG21 ILE 19 HG21 ILE 19 18.699 -21.936 -17.593 152 HG22 ILE 19 HG22 ILE 19 17.869 -22.696 -16.236 153 HG23 ILE 19 HG23 ILE 19 17.152 -22.743 -17.846 154 HD11 ILE 19 HD11 ILE 19 17.022 -19.512 -13.851 155 HD12 ILE 19 HD12 ILE 19 16.471 -21.088 -14.422 156 HD13 ILE 19 HD13 ILE 19 18.132 -20.882 -13.866 157 H PHE 20 H PHE 20 14.660 -21.224 -18.193 158 HA PHE 20 HA PHE 20 15.148 -23.056 -20.288 159 HB2 PHE 20 HB2 PHE 20 13.462 -23.440 -18.531 160 HB3 PHE 20 HB3 PHE 20 12.502 -22.109 -19.168 161 HD1 PHE 20 HD1 PHE 20 14.113 -25.240 -20.408 162 HD2 PHE 20 HD2 PHE 20 10.730 -22.659 -20.507 163 HE1 PHE 20 HE1 PHE 20 12.974 -26.798 -21.933 164 HE2 PHE 20 HE2 PHE 20 9.584 -24.214 -22.031 165 HZ PHE 20 HZ PHE 20 10.706 -26.287 -22.746 166 H ILE 21 H ILE 21 14.073 -19.777 -20.238 167 HA ILE 21 HA ILE 21 12.794 -19.762 -22.787 168 HB ILE 21 HB ILE 21 13.669 -17.693 -20.844 169 HG12 ILE 21 HG12 ILE 21 11.137 -17.911 -22.475 170 HG13 ILE 21 HG13 ILE 21 11.376 -18.782 -20.963 171 HG21 ILE 21 HG21 ILE 21 14.617 -16.709 -22.770 172 HG22 ILE 21 HG22 ILE 21 13.242 -17.169 -23.773 173 HG23 ILE 21 HG23 ILE 21 13.056 -15.921 -22.541 174 HD11 ILE 21 HD11 ILE 21 11.373 -15.796 -21.327 175 HD12 ILE 21 HD12 ILE 21 10.111 -16.772 -20.574 176 HD13 ILE 21 HD13 ILE 21 11.695 -16.635 -19.810 177 H PHE 22 H PHE 22 16.030 -18.845 -21.652 178 HA PHE 22 HA PHE 22 16.933 -18.134 -24.283 179 HB2 PHE 22 HB2 PHE 22 18.425 -18.547 -21.686 180 HB3 PHE 22 HB3 PHE 22 19.173 -17.977 -23.175 181 HD1 PHE 22 HD1 PHE 22 17.039 -16.161 -24.161 182 HD2 PHE 22 HD2 PHE 22 18.648 -16.720 -20.261 183 HE1 PHE 22 HE1 PHE 22 16.430 -13.848 -23.582 184 HE2 PHE 22 HE2 PHE 22 18.041 -14.409 -19.675 185 HZ PHE 22 HZ PHE 22 16.930 -12.970 -21.336 186 H ILE 23 H ILE 23 17.664 -20.796 -22.034 187 HA ILE 23 HA ILE 23 19.428 -22.241 -23.569 188 HB ILE 23 HB ILE 23 17.474 -22.966 -21.460 189 HG12 ILE 23 HG12 ILE 23 19.853 -24.223 -20.941 190 HG13 ILE 23 HG13 ILE 23 20.382 -22.831 -21.879 191 HG21 ILE 23 HG21 ILE 23 16.991 -24.792 -22.850 192 HG22 ILE 23 HG22 ILE 23 18.668 -24.950 -23.370 193 HG23 ILE 23 HG23 ILE 23 18.210 -25.394 -21.726 194 HD11 ILE 23 HD11 ILE 23 19.564 -21.318 -20.310 195 HD12 ILE 23 HD12 ILE 23 18.533 -22.528 -19.545 196 HD13 ILE 23 HD13 ILE 23 20.283 -22.605 -19.342 197 H VAL 24 H VAL 24 15.896 -22.243 -23.726 198 HA VAL 24 HA VAL 24 15.698 -24.324 -25.653 199 HB VAL 24 HB VAL 24 13.792 -22.218 -24.681 200 HG11 VAL 24 HG11 VAL 24 13.512 -24.000 -27.065 201 HG12 VAL 24 HG12 VAL 24 12.094 -23.574 -26.105 202 HG13 VAL 24 HG13 VAL 24 13.055 -22.308 -26.871 203 HG21 VAL 24 HG21 VAL 24 12.951 -23.842 -23.378 204 HG22 VAL 24 HG22 VAL 24 13.068 -25.060 -24.647 205 HG23 VAL 24 HG23 VAL 24 14.487 -24.653 -23.682 206 H LEU 25 H LEU 25 15.370 -20.785 -25.930 207 HA LEU 25 HA LEU 25 15.031 -20.661 -28.690 208 HB2 LEU 25 HB2 LEU 25 16.190 -18.732 -26.705 209 HB3 LEU 25 HB3 LEU 25 16.072 -18.335 -28.418 210 HG LEU 25 HG LEU 25 13.794 -18.895 -26.522 211 HD11 LEU 25 HD11 LEU 25 14.845 -16.430 -27.875 212 HD12 LEU 25 HD12 LEU 25 14.541 -16.704 -26.159 213 HD13 LEU 25 HD13 LEU 25 13.188 -16.539 -27.279 214 HD21 LEU 25 HD21 LEU 25 12.996 -19.798 -28.493 215 HD22 LEU 25 HD22 LEU 25 13.904 -18.670 -29.501 216 HD23 LEU 25 HD23 LEU 25 12.478 -18.117 -28.622 217 H LEU 26 H LEU 26 17.951 -20.930 -26.764 218 HA LEU 26 HA LEU 26 19.871 -20.276 -28.660 219 HB2 LEU 26 HB2 LEU 26 20.697 -20.572 -26.525 220 HB3 LEU 26 HB3 LEU 26 19.829 -22.088 -26.290 221 HG LEU 26 HG LEU 26 21.423 -23.179 -27.855 222 HD11 LEU 26 HD11 LEU 26 23.400 -22.079 -28.571 223 HD12 LEU 26 HD12 LEU 26 23.032 -20.648 -27.609 224 HD13 LEU 26 HD13 LEU 26 22.045 -21.041 -29.016 225 HD21 LEU 26 HD21 LEU 26 23.237 -22.042 -25.860 226 HD22 LEU 26 HD22 LEU 26 22.741 -23.714 -26.124 227 HD23 LEU 26 HD23 LEU 26 21.708 -22.622 -25.199 228 H ILE 27 H ILE 27 18.312 -23.400 -28.032 229 HA ILE 27 HA ILE 27 19.764 -24.817 -30.023 230 HB ILE 27 HB ILE 27 17.413 -25.383 -28.308 231 HG12 ILE 27 HG12 ILE 27 18.904 -27.647 -28.442 232 HG13 ILE 27 HG13 ILE 27 20.122 -26.441 -28.843 233 HG21 ILE 27 HG21 ILE 27 16.419 -26.065 -30.332 234 HG22 ILE 27 HG22 ILE 27 17.923 -26.767 -30.925 235 HG23 ILE 27 HG23 ILE 27 17.054 -27.538 -29.598 236 HD11 ILE 27 HD11 ILE 27 18.445 -25.802 -26.521 237 HD12 ILE 27 HD12 ILE 27 19.504 -27.201 -26.338 238 HD13 ILE 27 HD13 ILE 27 20.184 -25.629 -26.756 239 H HIS 28 H HIS 28 16.460 -23.491 -29.946 240 HA HIS 28 HA HIS 28 15.593 -24.238 -32.448 241 HB2 HIS 28 HB2 HIS 28 14.098 -23.155 -30.894 242 HB3 HIS 28 HB3 HIS 28 15.051 -21.675 -30.939 243 HD1 HIS 28 HD1 HIS 28 15.032 -20.397 -33.320 244 HD2 HIS 28 HD2 HIS 28 12.092 -23.273 -32.733 245 HE1 HIS 28 HE1 HIS 28 13.278 -19.931 -35.061 246 H PHE 29 H PHE 29 17.831 -21.697 -31.579 247 HA PHE 29 HA PHE 29 17.946 -20.761 -34.349 248 HB2 PHE 29 HB2 PHE 29 18.879 -19.663 -31.725 249 HB3 PHE 29 HB3 PHE 29 19.650 -19.114 -33.210 250 HD1 PHE 29 HD1 PHE 29 17.847 -18.520 -35.126 251 HD2 PHE 29 HD2 PHE 29 17.174 -18.368 -30.926 252 HE1 PHE 29 HE1 PHE 29 16.021 -16.909 -35.480 253 HE2 PHE 29 HE2 PHE 29 15.347 -16.758 -31.274 254 HZ PHE 29 HZ PHE 29 14.767 -16.028 -33.553 255 H GLU 30 H GLU 30 19.667 -22.693 -32.078 256 HA GLU 30 HA GLU 30 22.241 -22.516 -33.287 257 HB2 GLU 30 HB2 GLU 30 20.962 -24.136 -31.174 258 HB3 GLU 30 HB3 GLU 30 22.306 -24.906 -32.007 259 HG2 GLU 30 HG2 GLU 30 22.498 -22.160 -30.809 260 HG3 GLU 30 HG3 GLU 30 22.864 -23.629 -29.906 261 H GLY 31 H GLY 31 19.445 -23.722 -34.488 262 HA2 GLY 31 HA2 GLY 31 19.795 -24.655 -36.796 263 HA3 GLY 31 HA3 GLY 31 20.834 -25.838 -36.014 264 H TRP 32 H TRP 32 17.591 -24.543 -35.294 265 HA TRP 32 HA TRP 32 16.530 -27.271 -35.516 266 HB2 TRP 32 HB2 TRP 32 16.895 -25.847 -33.075 267 HB3 TRP 32 HB3 TRP 32 15.165 -25.950 -33.387 268 HD1 TRP 32 HD1 TRP 32 18.082 -28.514 -33.689 269 HE1 TRP 32 HE1 TRP 32 17.310 -30.708 -32.586 270 HE3 TRP 32 HE3 TRP 32 13.405 -27.077 -32.208 271 HZ2 TRP 32 HZ2 TRP 32 15.022 -31.699 -31.264 272 HZ3 TRP 32 HZ3 TRP 32 11.988 -28.708 -31.030 273 HH2 TRP 32 HH2 TRP 32 12.781 -30.971 -30.570 274 H ARG 33 H ARG 33 16.399 -24.832 -37.191 275 HA ARG 33 HA ARG 33 13.520 -24.829 -37.559 276 HB2 ARG 33 HB2 ARG 33 14.255 -22.896 -35.983 277 HB3 ARG 33 HB3 ARG 33 14.890 -22.161 -37.449 278 HG2 ARG 33 HG2 ARG 33 12.065 -23.117 -37.377 279 HG3 ARG 33 HG3 ARG 33 12.497 -21.578 -36.631 280 HD2 ARG 33 HD2 ARG 33 13.071 -22.349 -39.490 281 HD3 ARG 33 HD3 ARG 33 11.732 -21.330 -38.963 282 HE ARG 33 HE ARG 33 14.494 -20.571 -39.224 283 HH11 ARG 33 HH11 ARG 33 11.456 -19.865 -37.676 284 HH12 ARG 33 HH12 ARG 33 11.845 -18.203 -37.380 285 HH21 ARG 33 HH21 ARG 33 15.017 -18.384 -38.839 286 HH22 ARG 33 HH22 ARG 33 13.870 -17.361 -38.042 287 H ILE 34 H ILE 34 14.155 -25.979 -39.460 288 HA ILE 34 HA ILE 34 15.930 -25.036 -41.402 289 HB ILE 34 HB ILE 34 13.456 -26.721 -41.811 290 HG12 ILE 34 HG12 ILE 34 16.316 -27.651 -41.556 291 HG13 ILE 34 HG13 ILE 34 15.230 -27.543 -40.174 292 HG21 ILE 34 HG21 ILE 34 15.850 -26.240 -43.576 293 HG22 ILE 34 HG22 ILE 34 14.661 -27.515 -43.839 294 HG23 ILE 34 HG23 ILE 34 14.171 -25.823 -43.915 295 HD11 ILE 34 HD11 ILE 34 15.347 -29.513 -42.337 296 HD12 ILE 34 HD12 ILE 34 14.782 -29.675 -40.674 297 HD13 ILE 34 HD13 ILE 34 13.723 -28.979 -41.900 298 H1 MET 101 H MET 101 11.757 11.716 -10.092 299 HA MET 101 HA MET 101 10.432 10.702 -8.547 300 HB2 MET 101 HB2 MET 101 8.278 12.323 -9.918 301 HB3 MET 101 HB3 MET 101 8.111 11.532 -8.356 302 HG2 MET 101 HG2 MET 101 9.602 12.996 -7.320 303 HG3 MET 101 HG3 MET 101 10.262 13.551 -8.857 304 HE1 MET 101 HE1 MET 101 9.028 16.777 -7.764 305 HE2 MET 101 HE2 MET 101 10.326 15.686 -8.249 306 HE3 MET 101 HE3 MET 101 9.285 16.416 -9.472 307 H ASP 102 H ASP 102 10.847 9.416 -11.158 308 HA ASP 102 HA ASP 102 8.884 7.327 -10.852 309 HB2 ASP 102 HB2 ASP 102 8.942 9.089 -13.288 310 HB3 ASP 102 HB3 ASP 102 8.397 7.417 -13.392 311 H SER 103 H SER 103 10.017 5.515 -10.925 312 HA SER 103 HA SER 103 12.524 5.459 -12.442 313 HB2 SER 103 HB2 SER 103 11.834 3.143 -10.746 314 HB3 SER 103 HB3 SER 103 13.347 4.040 -10.872 315 HG SER 103 HG SER 103 12.515 4.470 -8.871 316 H ALA 104 H ALA 104 10.083 5.308 -13.876 317 HA ALA 104 HA ALA 104 9.404 2.618 -14.500 318 HB1 ALA 104 HB1 ALA 104 8.706 4.168 -16.703 319 HB2 ALA 104 HB2 ALA 104 7.677 3.742 -15.334 320 HB3 ALA 104 HB3 ALA 104 8.577 5.258 -15.323 321 HA PRO 105 HA PRO 105 12.089 3.280 -18.456 322 HB2 PRO 105 HB2 PRO 105 13.619 5.519 -18.576 323 HB3 PRO 105 HB3 PRO 105 11.957 5.459 -19.173 324 HG2 PRO 105 HG2 PRO 105 13.000 6.515 -16.573 325 HG3 PRO 105 HG3 PRO 105 11.780 7.212 -17.655 326 HD2 PRO 105 HD2 PRO 105 11.126 5.847 -15.410 327 HD3 PRO 105 HD3 PRO 105 10.110 5.834 -16.866 328 H PHE 106 H PHE 106 13.272 4.258 -15.326 329 HA PHE 106 HA PHE 106 16.004 3.535 -15.818 330 HB2 PHE 106 HB2 PHE 106 14.525 4.820 -13.731 331 HB3 PHE 106 HB3 PHE 106 15.465 3.506 -13.032 332 HD1 PHE 106 HD1 PHE 106 15.977 6.162 -15.608 333 HD2 PHE 106 HD2 PHE 106 17.510 4.107 -12.210 334 HE1 PHE 106 HE1 PHE 106 17.988 7.578 -15.664 335 HE2 PHE 106 HE2 PHE 106 19.523 5.521 -12.260 336 HZ PHE 106 HZ PHE 106 19.764 7.259 -13.987 337 H GLU 107 H GLU 107 13.194 1.990 -14.360 338 HA GLU 107 HA GLU 107 14.439 -0.227 -13.217 339 HB2 GLU 107 HB2 GLU 107 11.762 0.605 -13.811 340 HB3 GLU 107 HB3 GLU 107 11.951 -1.082 -14.270 341 HG2 GLU 107 HG2 GLU 107 12.730 -0.007 -11.575 342 HG3 GLU 107 HG3 GLU 107 11.140 -0.677 -11.936 343 H LEU 108 H LEU 108 13.225 0.261 -16.508 344 HA LEU 108 HA LEU 108 13.578 -2.296 -17.517 345 HB2 LEU 108 HB2 LEU 108 12.772 0.071 -18.543 346 HB3 LEU 108 HB3 LEU 108 14.349 -0.092 -19.313 347 HG LEU 108 HG LEU 108 13.612 -2.317 -20.179 348 HD11 LEU 108 HD11 LEU 108 11.231 -1.590 -18.607 349 HD12 LEU 108 HD12 LEU 108 11.872 -3.175 -19.039 350 HD13 LEU 108 HD13 LEU 108 10.920 -2.261 -20.208 351 HD21 LEU 108 HD21 LEU 108 13.402 -0.921 -21.920 352 HD22 LEU 108 HD22 LEU 108 12.590 0.316 -20.960 353 HD23 LEU 108 HD23 LEU 108 11.671 -1.045 -21.604 354 H PHE 109 H PHE 109 15.932 0.273 -17.037 355 HA PHE 109 HA PHE 109 18.075 -0.640 -18.495 356 HB2 PHE 109 HB2 PHE 109 17.819 1.444 -16.939 357 HB3 PHE 109 HB3 PHE 109 18.512 0.390 -15.711 358 HD1 PHE 109 HD1 PHE 109 19.198 1.098 -19.314 359 HD2 PHE 109 HD2 PHE 109 20.740 0.754 -15.362 360 HE1 PHE 109 HE1 PHE 109 21.454 1.613 -20.153 361 HE2 PHE 109 HE2 PHE 109 22.998 1.269 -16.194 362 HZ PHE 109 HZ PHE 109 23.357 1.700 -18.592 363 H PHE 110 H PHE 110 17.095 -1.638 -15.236 364 HA PHE 110 HA PHE 110 19.244 -3.496 -14.930 365 HB2 PHE 110 HB2 PHE 110 18.300 -2.597 -12.933 366 HB3 PHE 110 HB3 PHE 110 16.671 -3.063 -13.413 367 HD1 PHE 110 HD1 PHE 110 15.920 -5.357 -13.207 368 HD2 PHE 110 HD2 PHE 110 19.837 -4.204 -12.006 369 HE1 PHE 110 HE1 PHE 110 16.162 -7.473 -11.976 370 HE2 PHE 110 HE2 PHE 110 20.086 -6.319 -10.774 371 HZ PHE 110 HZ PHE 110 18.247 -7.957 -10.758 372 H MET 111 H MET 111 16.063 -3.615 -16.300 373 HA MET 111 HA MET 111 15.724 -6.438 -16.212 374 HB2 MET 111 HB2 MET 111 14.384 -4.158 -17.571 375 HB3 MET 111 HB3 MET 111 14.135 -5.760 -18.254 376 HG2 MET 111 HG2 MET 111 13.168 -6.564 -16.250 377 HG3 MET 111 HG3 MET 111 13.667 -5.130 -15.356 378 HE1 MET 111 HE1 MET 111 11.415 -2.594 -15.658 379 HE2 MET 111 HE2 MET 111 10.723 -3.907 -14.706 380 HE3 MET 111 HE3 MET 111 12.466 -3.636 -14.699 381 H ILE 112 H ILE 112 17.316 -4.236 -18.396 382 HA ILE 112 HA ILE 112 17.631 -6.221 -20.478 383 HB ILE 112 HB ILE 112 18.749 -3.434 -20.178 384 HG12 ILE 112 HG12 ILE 112 17.108 -3.804 -22.478 385 HG13 ILE 112 HG13 ILE 112 16.251 -4.468 -21.091 386 HG21 ILE 112 HG21 ILE 112 20.371 -4.347 -21.508 387 HG22 ILE 112 HG22 ILE 112 19.287 -5.563 -22.183 388 HG23 ILE 112 HG23 ILE 112 19.189 -3.890 -22.734 389 HD11 ILE 112 HD11 ILE 112 17.215 -2.064 -20.158 390 HD12 ILE 112 HD12 ILE 112 16.751 -1.713 -21.823 391 HD13 ILE 112 HD13 ILE 112 15.571 -2.394 -20.703 392 H ASN 113 H ASN 113 19.728 -4.547 -18.147 393 HA ASN 113 HA ASN 113 22.168 -5.627 -18.843 394 HB2 ASN 113 HB2 ASN 113 21.012 -4.717 -16.228 395 HB3 ASN 113 HB3 ASN 113 22.615 -5.445 -16.270 396 HD21 ASN 113 HD21 ASN 113 23.799 -4.507 -18.419 397 HD22 ASN 113 HD22 ASN 113 23.891 -2.782 -18.405 398 H THR 114 H THR 114 19.952 -6.907 -16.356 399 HA THR 114 HA THR 114 21.372 -9.251 -15.822 400 HB THR 114 HB THR 114 19.472 -8.332 -14.451 401 HG1 THR 114 HG1 THR 114 19.848 -10.285 -13.698 402 HG21 THR 114 HG21 THR 114 17.573 -9.910 -16.109 403 HG22 THR 114 HG22 THR 114 18.014 -8.297 -16.671 404 HG23 THR 114 HG23 THR 114 17.281 -8.508 -15.081 405 H SER 115 H SER 115 19.269 -8.426 -18.449 406 HA SER 115 HA SER 115 18.650 -11.074 -19.283 407 HB2 SER 115 HB2 SER 115 17.587 -8.729 -19.929 408 HB3 SER 115 HB3 SER 115 18.745 -8.833 -21.255 409 HG SER 115 HG SER 115 16.553 -10.487 -20.667 410 H ILE 116 H ILE 116 20.767 -8.655 -20.834 411 HA ILE 116 HA ILE 116 22.003 -10.336 -22.642 412 HB ILE 116 HB ILE 116 23.253 -7.980 -21.223 413 HG12 ILE 116 HG12 ILE 116 21.812 -8.101 -23.880 414 HG13 ILE 116 HG13 ILE 116 21.103 -7.496 -22.387 415 HG21 ILE 116 HG21 ILE 116 24.630 -7.856 -23.326 416 HG22 ILE 116 HG22 ILE 116 24.987 -9.218 -22.265 417 HG23 ILE 116 HG23 ILE 116 24.027 -9.465 -23.723 418 HD11 ILE 116 HD11 ILE 116 23.416 -6.043 -22.586 419 HD12 ILE 116 HD12 ILE 116 22.899 -6.198 -24.265 420 HD13 ILE 116 HD13 ILE 116 21.808 -5.502 -23.067 421 H LEU 117 H LEU 117 22.538 -10.021 -19.225 422 HA LEU 117 HA LEU 117 25.053 -11.443 -19.259 423 HB2 LEU 117 HB2 LEU 117 23.576 -9.861 -17.396 424 HB3 LEU 117 HB3 LEU 117 23.945 -11.418 -16.658 425 HG LEU 117 HG LEU 117 26.011 -9.594 -17.882 426 HD11 LEU 117 HD11 LEU 117 26.597 -9.360 -15.358 427 HD12 LEU 117 HD12 LEU 117 24.901 -9.778 -15.116 428 HD13 LEU 117 HD13 LEU 117 25.331 -8.354 -16.063 429 HD21 LEU 117 HD21 LEU 117 26.822 -11.524 -15.860 430 HD22 LEU 117 HD22 LEU 117 27.517 -11.182 -17.444 431 HD23 LEU 117 HD23 LEU 117 26.144 -12.281 -17.302 432 H LEU 118 H LEU 118 21.843 -12.101 -17.842 433 HA LEU 118 HA LEU 118 22.248 -14.705 -17.052 434 HB2 LEU 118 HB2 LEU 118 19.833 -13.232 -18.018 435 HB3 LEU 118 HB3 LEU 118 19.728 -14.951 -17.645 436 HG LEU 118 HG LEU 118 20.343 -12.683 -15.765 437 HD11 LEU 118 HD11 LEU 118 18.084 -12.806 -15.730 438 HD12 LEU 118 HD12 LEU 118 18.416 -14.115 -14.597 439 HD13 LEU 118 HD13 LEU 118 18.053 -14.480 -16.284 440 HD21 LEU 118 HD21 LEU 118 21.695 -14.108 -14.695 441 HD22 LEU 118 HD22 LEU 118 21.128 -15.494 -15.625 442 HD23 LEU 118 HD23 LEU 118 20.213 -14.939 -14.223 443 H ILE 119 H ILE 119 21.550 -13.472 -20.265 444 HA ILE 119 HA ILE 119 20.929 -15.880 -21.545 445 HB ILE 119 HB ILE 119 22.272 -13.411 -22.645 446 HG12 ILE 119 HG12 ILE 119 19.461 -14.230 -23.237 447 HG13 ILE 119 HG13 ILE 119 19.810 -13.509 -21.669 448 HG21 ILE 119 HG21 ILE 119 21.120 -15.790 -24.093 449 HG22 ILE 119 HG22 ILE 119 21.574 -14.270 -24.862 450 HG23 ILE 119 HG23 ILE 119 22.804 -15.266 -24.083 451 HD11 ILE 119 HD11 ILE 119 19.591 -11.529 -22.626 452 HD12 ILE 119 HD12 ILE 119 21.066 -11.862 -23.535 453 HD13 ILE 119 HD13 ILE 119 19.494 -12.256 -24.230 454 H PHE 120 H PHE 120 24.051 -14.154 -21.688 455 HA PHE 120 HA PHE 120 25.462 -16.353 -22.759 456 HB2 PHE 120 HB2 PHE 120 26.209 -13.999 -22.966 457 HB3 PHE 120 HB3 PHE 120 26.563 -13.978 -21.241 458 HD1 PHE 120 HD1 PHE 120 27.342 -16.080 -24.227 459 HD2 PHE 120 HD2 PHE 120 28.749 -14.277 -20.638 460 HE1 PHE 120 HE1 PHE 120 29.603 -16.936 -24.688 461 HE2 PHE 120 HE2 PHE 120 31.012 -15.129 -21.093 462 HZ PHE 120 HZ PHE 120 31.442 -16.459 -23.120 463 H ILE 121 H ILE 121 24.585 -15.476 -19.538 464 HA ILE 121 HA ILE 121 26.579 -16.989 -18.177 465 HB ILE 121 HB ILE 121 24.068 -15.609 -17.398 466 HG12 ILE 121 HG12 ILE 121 26.758 -15.722 -16.030 467 HG13 ILE 121 HG13 ILE 121 26.407 -14.621 -17.358 468 HG21 ILE 121 HG21 ILE 121 23.621 -17.657 -16.312 469 HG22 ILE 121 HG22 ILE 121 25.303 -17.850 -15.822 470 HG23 ILE 121 HG23 ILE 121 24.309 -16.597 -15.081 471 HD11 ILE 121 HD11 ILE 121 25.040 -14.695 -14.679 472 HD12 ILE 121 HD12 ILE 121 26.176 -13.476 -15.258 473 HD13 ILE 121 HD13 ILE 121 24.593 -13.637 -16.017 474 H PHE 122 H PHE 122 23.195 -17.613 -19.051 475 HA PHE 122 HA PHE 122 23.227 -20.266 -17.952 476 HB2 PHE 122 HB2 PHE 122 21.243 -18.866 -19.755 477 HB3 PHE 122 HB3 PHE 122 20.996 -20.464 -19.059 478 HD1 PHE 122 HD1 PHE 122 22.101 -20.014 -16.337 479 HD2 PHE 122 HD2 PHE 122 19.561 -17.603 -18.756 480 HE1 PHE 122 HE1 PHE 122 21.154 -18.986 -14.312 481 HE2 PHE 122 HE2 PHE 122 18.610 -16.571 -16.735 482 HZ PHE 122 HZ PHE 122 19.408 -17.261 -14.509 483 H ILE 123 H ILE 123 23.129 -18.935 -21.253 484 HA ILE 123 HA ILE 123 23.150 -21.277 -22.700 485 HB ILE 123 HB ILE 123 24.131 -18.528 -23.226 486 HG12 ILE 123 HG12 ILE 123 22.750 -19.397 -25.418 487 HG13 ILE 123 HG13 ILE 123 22.037 -20.385 -24.147 488 HG21 ILE 123 HG21 ILE 123 25.992 -19.604 -24.156 489 HG22 ILE 123 HG22 ILE 123 25.020 -20.937 -24.778 490 HG23 ILE 123 HG23 ILE 123 24.906 -19.342 -25.520 491 HD11 ILE 123 HD11 ILE 123 21.239 -18.524 -22.993 492 HD12 ILE 123 HD12 ILE 123 22.297 -17.416 -23.867 493 HD13 ILE 123 HD13 ILE 123 20.927 -18.162 -24.691 494 H VAL 124 H VAL 124 25.883 -19.584 -21.231 495 HA VAL 124 HA VAL 124 27.879 -21.307 -22.310 496 HB VAL 124 HB VAL 124 27.876 -19.292 -20.082 497 HG11 VAL 124 HG11 VAL 124 29.971 -21.318 -20.748 498 HG12 VAL 124 HG12 VAL 124 30.436 -19.726 -20.147 499 HG13 VAL 124 HG13 VAL 124 29.403 -20.771 -19.171 500 HG21 VAL 124 HG21 VAL 124 28.776 -17.887 -21.587 501 HG22 VAL 124 HG22 VAL 124 29.809 -19.135 -22.284 502 HG23 VAL 124 HG23 VAL 124 28.120 -19.013 -22.776 503 H LEU 125 H LEU 125 26.453 -21.027 -19.055 504 HA LEU 125 HA LEU 125 27.787 -23.172 -17.883 505 HB2 LEU 125 HB2 LEU 125 25.133 -21.885 -17.348 506 HB3 LEU 125 HB3 LEU 125 25.685 -23.263 -16.399 507 HG LEU 125 HG LEU 125 26.993 -20.551 -16.587 508 HD11 LEU 125 HD11 LEU 125 25.433 -21.981 -14.459 509 HD12 LEU 125 HD12 LEU 125 25.149 -20.384 -15.150 510 HD13 LEU 125 HD13 LEU 125 26.529 -20.651 -14.086 511 HD21 LEU 125 HD21 LEU 125 28.815 -21.964 -16.375 512 HD22 LEU 125 HD22 LEU 125 27.920 -23.146 -15.420 513 HD23 LEU 125 HD23 LEU 125 28.409 -21.614 -14.695 514 H LEU 126 H LEU 126 24.930 -23.099 -19.912 515 HA LEU 126 HA LEU 126 23.925 -25.652 -19.446 516 HB2 LEU 126 HB2 LEU 126 22.551 -24.315 -20.727 517 HB3 LEU 126 HB3 LEU 126 23.869 -23.782 -21.769 518 HG LEU 126 HG LEU 126 23.877 -26.041 -22.814 519 HD11 LEU 126 HD11 LEU 126 22.075 -27.566 -22.427 520 HD12 LEU 126 HD12 LEU 126 21.302 -26.447 -21.305 521 HD13 LEU 126 HD13 LEU 126 22.836 -27.205 -20.877 522 HD21 LEU 126 HD21 LEU 126 21.101 -25.202 -23.209 523 HD22 LEU 126 HD22 LEU 126 22.430 -25.316 -24.363 524 HD23 LEU 126 HD23 LEU 126 22.278 -23.894 -23.330 525 H ILE 127 H ILE 127 26.396 -24.587 -21.760 526 HA ILE 127 HA ILE 127 26.836 -27.163 -22.873 527 HB ILE 127 HB ILE 127 28.198 -24.531 -23.021 528 HG12 ILE 127 HG12 ILE 127 28.225 -25.606 -25.508 529 HG13 ILE 127 HG13 ILE 127 26.875 -26.489 -24.803 530 HG21 ILE 127 HG21 ILE 127 30.132 -25.800 -22.579 531 HG22 ILE 127 HG22 ILE 127 29.570 -27.148 -23.567 532 HG23 ILE 127 HG23 ILE 127 30.066 -25.639 -24.333 533 HD11 ILE 127 HD11 ILE 127 26.860 -23.586 -24.354 534 HD12 ILE 127 HD12 ILE 127 26.648 -24.109 -26.025 535 HD13 ILE 127 HD13 ILE 127 25.545 -24.683 -24.774 536 H HIS 128 H HIS 128 28.697 -25.232 -20.525 537 HA HIS 128 HA HIS 128 30.753 -26.974 -19.999 538 HB2 HIS 128 HB2 HIS 128 30.726 -24.770 -19.022 539 HB3 HIS 128 HB3 HIS 128 29.281 -25.149 -18.090 540 HD1 HIS 128 HD1 HIS 128 29.622 -26.958 -16.139 541 HD2 HIS 128 HD2 HIS 128 33.089 -25.364 -17.783 542 HE1 HIS 128 HE1 HIS 128 31.451 -27.489 -14.497 543 H PHE 129 H PHE 129 27.430 -27.146 -18.923 544 HA PHE 129 HA PHE 129 28.019 -29.437 -17.208 545 HB2 PHE 129 HB2 PHE 129 25.660 -27.630 -17.568 546 HB3 PHE 129 HB3 PHE 129 25.419 -29.229 -16.872 547 HD1 PHE 129 HD1 PHE 129 27.257 -29.802 -14.985 548 HD2 PHE 129 HD2 PHE 129 25.942 -25.908 -16.093 549 HE1 PHE 129 HE1 PHE 129 27.944 -28.947 -12.782 550 HE2 PHE 129 HE2 PHE 129 26.627 -25.047 -13.892 551 HZ PHE 129 HZ PHE 129 27.630 -26.567 -12.234 552 H GLU 130 H GLU 130 26.699 -28.658 -20.306 553 HA GLU 130 HA GLU 130 25.260 -31.096 -20.694 554 HB2 GLU 130 HB2 GLU 130 26.008 -28.753 -22.350 555 HB3 GLU 130 HB3 GLU 130 25.695 -30.252 -23.213 556 HG2 GLU 130 HG2 GLU 130 23.774 -29.085 -21.223 557 HG3 GLU 130 HG3 GLU 130 23.740 -28.692 -22.941 558 H GLY 131 H GLY 131 28.454 -30.618 -20.305 559 HA2 GLY 131 HA2 GLY 131 29.720 -32.776 -20.554 560 HA3 GLY 131 HA3 GLY 131 29.181 -32.743 -22.226 561 H TRP 132 H TRP 132 30.526 -30.225 -20.101 562 HA TRP 132 HA TRP 132 32.910 -30.081 -21.768 563 HB2 TRP 132 HB2 TRP 132 30.714 -28.215 -21.982 564 HB3 TRP 132 HB3 TRP 132 32.173 -27.391 -21.440 565 HD1 TRP 132 HD1 TRP 132 31.154 -29.820 -24.298 566 HE1 TRP 132 HE1 TRP 132 32.493 -29.169 -26.397 567 HE3 TRP 132 HE3 TRP 132 33.988 -26.054 -22.318 568 HZ2 TRP 132 HZ2 TRP 132 34.487 -27.306 -27.119 569 HZ3 TRP 132 HZ3 TRP 132 35.587 -24.888 -23.780 570 HH2 TRP 132 HH2 TRP 132 35.830 -25.503 -26.130 571 H ARG 133 H ARG 133 33.922 -30.825 -19.840 572 HA ARG 133 HA ARG 133 34.612 -28.653 -18.038 573 HB2 ARG 133 HB2 ARG 133 32.605 -30.052 -17.130 574 HB3 ARG 133 HB3 ARG 133 33.830 -31.265 -16.788 575 HG2 ARG 133 HG2 ARG 133 34.179 -28.456 -15.831 576 HG3 ARG 133 HG3 ARG 133 33.157 -29.590 -14.945 577 HD2 ARG 133 HD2 ARG 133 36.054 -30.031 -15.661 578 HD3 ARG 133 HD3 ARG 133 35.458 -29.529 -14.079 579 HE ARG 133 HE ARG 133 35.426 -32.179 -15.179 580 HH11 ARG 133 HH11 ARG 133 33.899 -30.009 -12.926 581 HH12 ARG 133 HH12 ARG 133 33.282 -31.278 -11.921 582 HH21 ARG 133 HH21 ARG 133 34.620 -33.859 -13.864 583 HH22 ARG 133 HH22 ARG 133 33.694 -33.468 -12.454 584 H ILE 134 H ILE 134 36.567 -28.986 -19.338 585 HA ILE 134 HA ILE 134 38.076 -31.296 -19.461 586 HB ILE 134 HB ILE 134 39.108 -28.468 -19.207 587 HG12 ILE 134 HG12 ILE 134 38.689 -30.089 -21.720 588 HG13 ILE 134 HG13 ILE 134 37.475 -28.984 -21.086 589 HG21 ILE 134 HG21 ILE 134 40.448 -30.980 -20.197 590 HG22 ILE 134 HG22 ILE 134 41.106 -29.354 -20.371 591 HG23 ILE 134 HG23 ILE 134 40.875 -30.044 -18.765 592 HD11 ILE 134 HD11 ILE 134 39.947 -28.434 -22.542 593 HD12 ILE 134 HD12 ILE 134 38.461 -27.492 -22.421 594 HD13 ILE 134 HD13 ILE 134 39.674 -27.393 -21.145 Start of MODEL 5 1 H1 MET 1 H MET 1 6.210 -0.679 4.288 2 HA MET 1 HA MET 1 6.747 1.013 2.021 3 HB2 MET 1 HB2 MET 1 7.724 1.121 4.878 4 HB3 MET 1 HB3 MET 1 8.065 2.348 3.666 5 HG2 MET 1 HG2 MET 1 6.244 3.365 4.430 6 HG3 MET 1 HG3 MET 1 5.346 2.145 3.531 7 HE1 MET 1 HE1 MET 1 3.263 0.587 5.481 8 HE2 MET 1 HE2 MET 1 3.012 2.225 6.085 9 HE3 MET 1 HE3 MET 1 3.471 1.966 4.401 10 H ASP 2 H ASP 2 7.769 -1.711 1.898 11 HA ASP 2 HA ASP 2 10.471 -1.077 1.111 12 HB2 ASP 2 HB2 ASP 2 9.892 -2.938 3.406 13 HB3 ASP 2 HB3 ASP 2 11.354 -3.098 2.437 14 H SER 3 H SER 3 10.666 -1.958 -0.828 15 HA SER 3 HA SER 3 9.165 -4.414 -1.427 16 HB2 SER 3 HB2 SER 3 10.365 -2.389 -3.333 17 HB3 SER 3 HB3 SER 3 9.389 -3.786 -3.788 18 HG SER 3 HG SER 3 8.406 -1.846 -1.994 19 H ALA 4 H ALA 4 11.588 -4.565 0.035 20 HA ALA 4 HA ALA 4 13.787 -5.192 -1.657 21 HB1 ALA 4 HB1 ALA 4 14.770 -4.948 0.322 22 HB2 ALA 4 HB2 ALA 4 13.240 -5.140 1.179 23 HB3 ALA 4 HB3 ALA 4 14.183 -6.561 0.731 24 HA PRO 5 HA PRO 5 12.600 -9.794 -0.810 25 HB2 PRO 5 HB2 PRO 5 10.225 -10.274 0.414 26 HB3 PRO 5 HB3 PRO 5 11.733 -10.033 1.304 27 HG2 PRO 5 HG2 PRO 5 9.524 -8.088 0.761 28 HG3 PRO 5 HG3 PRO 5 10.428 -8.364 2.262 29 HD2 PRO 5 HD2 PRO 5 10.972 -6.303 0.592 30 HD3 PRO 5 HD3 PRO 5 12.226 -7.106 1.559 31 H PHE 6 H PHE 6 10.043 -7.515 -1.576 32 HA PHE 6 HA PHE 6 8.530 -9.305 -3.203 33 HB2 PHE 6 HB2 PHE 6 8.513 -6.361 -2.689 34 HB3 PHE 6 HB3 PHE 6 7.646 -6.980 -4.090 35 HD1 PHE 6 HD2 PHE 6 5.850 -8.705 -3.736 36 HD2 PHE 6 HD1 PHE 6 7.608 -6.517 -0.536 37 HE1 PHE 6 HE2 PHE 6 3.934 -9.272 -2.301 38 HE2 PHE 6 HE1 PHE 6 5.695 -7.082 0.905 39 HZ PHE 6 HZ PHE 6 3.854 -8.460 0.023 40 H GLU 7 H GLU 7 11.123 -7.011 -3.778 41 HA GLU 7 HA GLU 7 10.980 -6.869 -6.570 42 HB2 GLU 7 HB2 GLU 7 12.841 -6.102 -4.502 43 HB3 GLU 7 HB3 GLU 7 13.704 -6.755 -5.887 44 HG2 GLU 7 HG2 GLU 7 11.667 -4.971 -6.797 45 HG3 GLU 7 HG3 GLU 7 12.643 -4.176 -5.563 46 H LEU 8 H LEU 8 12.872 -9.049 -4.492 47 HA LEU 8 HA LEU 8 14.220 -10.484 -6.419 48 HB2 LEU 8 HB2 LEU 8 13.204 -11.115 -3.698 49 HB3 LEU 8 HB3 LEU 8 13.795 -12.446 -4.691 50 HG LEU 8 HG LEU 8 15.484 -11.552 -3.117 51 HD11 LEU 8 HD11 LEU 8 16.294 -12.703 -5.029 52 HD12 LEU 8 HD12 LEU 8 17.281 -11.254 -4.843 53 HD13 LEU 8 HD13 LEU 8 16.015 -11.307 -6.070 54 HD21 LEU 8 HD21 LEU 8 16.518 -9.371 -3.643 55 HD22 LEU 8 HD22 LEU 8 14.849 -9.223 -3.093 56 HD23 LEU 8 HD23 LEU 8 15.231 -9.068 -4.809 57 H PHE 9 H PHE 9 10.878 -10.790 -5.383 58 HA PHE 9 HA PHE 9 10.167 -13.217 -6.464 59 HB2 PHE 9 HB2 PHE 9 8.764 -11.397 -5.192 60 HB3 PHE 9 HB3 PHE 9 8.332 -10.877 -6.817 61 HD1 PHE 9 HD1 PHE 9 8.656 -14.125 -5.001 62 HD2 PHE 9 HD2 PHE 9 6.319 -11.658 -7.564 63 HE1 PHE 9 HE1 PHE 9 6.921 -15.868 -5.091 64 HE2 PHE 9 HE2 PHE 9 4.581 -13.396 -7.658 65 HZ PHE 9 HZ PHE 9 4.880 -15.504 -6.420 66 H PHE 10 H PHE 10 10.449 -10.097 -8.107 67 HA PHE 10 HA PHE 10 9.598 -11.135 -10.642 68 HB2 PHE 10 HB2 PHE 10 9.195 -8.814 -10.226 69 HB3 PHE 10 HB3 PHE 10 10.885 -8.530 -9.821 70 HD1 PHE 10 HD2 PHE 10 8.481 -9.031 -12.526 71 HD2 PHE 10 HD1 PHE 10 12.562 -8.320 -11.546 72 HE1 PHE 10 HE2 PHE 10 8.932 -8.415 -14.865 73 HE2 PHE 10 HE1 PHE 10 13.019 -7.702 -13.883 74 HZ PHE 10 HZ PHE 10 11.203 -7.750 -15.546 75 H MET 11 H MET 11 12.609 -10.820 -8.955 76 HA MET 11 HA MET 11 14.330 -11.007 -11.209 77 HB2 MET 11 HB2 MET 11 14.629 -11.220 -8.260 78 HB3 MET 11 HB3 MET 11 15.894 -11.938 -9.248 79 HG2 MET 11 HG2 MET 11 16.503 -9.693 -8.645 80 HG3 MET 11 HG3 MET 11 16.211 -9.786 -10.380 81 HE1 MET 11 HE1 MET 11 15.189 -6.241 -8.783 82 HE2 MET 11 HE2 MET 11 15.495 -7.321 -7.422 83 HE3 MET 11 HE3 MET 11 16.581 -7.324 -8.812 84 H ILE 12 H ILE 12 12.767 -13.352 -9.120 85 HA ILE 12 HA ILE 12 14.233 -15.599 -10.138 86 HB ILE 12 HB ILE 12 11.715 -15.431 -8.486 87 HG12 ILE 12 HG12 ILE 12 13.879 -16.737 -7.181 88 HG13 ILE 12 HG13 ILE 12 14.504 -15.248 -7.883 89 HG21 ILE 12 HG21 ILE 12 11.421 -17.477 -9.509 90 HG22 ILE 12 HG22 ILE 12 13.153 -17.781 -9.635 91 HG23 ILE 12 HG23 ILE 12 12.344 -17.924 -8.074 92 HD11 ILE 12 HD11 ILE 12 13.055 -15.576 -5.498 93 HD12 ILE 12 HD12 ILE 12 13.612 -14.075 -6.240 94 HD13 ILE 12 HD13 ILE 12 12.009 -14.704 -6.619 95 H ASN 13 H ASN 13 10.956 -14.310 -10.615 96 HA ASN 13 HA ASN 13 9.930 -16.236 -12.301 97 HB2 ASN 13 HB2 ASN 13 9.477 -13.273 -12.095 98 HB3 ASN 13 HB3 ASN 13 8.656 -14.216 -13.336 99 HD21 ASN 13 HD21 ASN 13 7.632 -16.286 -12.427 100 HD22 ASN 13 HD22 ASN 13 6.722 -16.086 -10.971 101 H THR 14 H THR 14 11.527 -13.215 -13.330 102 HA THR 14 HA THR 14 11.625 -13.820 -16.058 103 HB THR 14 HB THR 14 12.042 -11.560 -15.077 104 HG1 THR 14 HG1 THR 14 13.665 -11.049 -16.643 105 HG21 THR 14 HG21 THR 14 13.720 -12.585 -13.372 106 HG22 THR 14 HG22 THR 14 14.032 -10.980 -14.032 107 HG23 THR 14 HG23 THR 14 14.893 -12.379 -14.671 108 H SER 15 H SER 15 13.491 -15.017 -13.436 109 HA SER 15 HA SER 15 15.830 -15.740 -14.886 110 HB2 SER 15 HB2 SER 15 15.361 -15.569 -12.282 111 HB3 SER 15 HB3 SER 15 14.981 -17.281 -12.471 112 HG SER 15 HG SER 15 17.350 -16.232 -12.207 113 H ILE 16 H ILE 16 13.287 -17.835 -13.514 114 HA ILE 16 HA ILE 16 13.989 -20.166 -14.830 115 HB ILE 16 HB ILE 16 11.200 -19.284 -14.076 116 HG12 ILE 16 HG12 ILE 16 13.159 -20.981 -12.517 117 HG13 ILE 16 HG13 ILE 16 12.894 -19.265 -12.227 118 HG21 ILE 16 HG21 ILE 16 10.886 -21.115 -15.472 119 HG22 ILE 16 HG22 ILE 16 12.351 -21.919 -14.910 120 HG23 ILE 16 HG23 ILE 16 10.933 -21.840 -13.865 121 HD11 ILE 16 HD11 ILE 16 11.535 -20.186 -10.645 122 HD12 ILE 16 HD12 ILE 16 10.397 -20.020 -11.983 123 HD13 ILE 16 HD13 ILE 16 11.136 -21.585 -11.641 124 H LEU 17 H LEU 17 12.338 -17.369 -16.040 125 HA LEU 17 HA LEU 17 11.334 -18.696 -18.403 126 HB2 LEU 17 HB2 LEU 17 10.854 -16.250 -17.054 127 HB3 LEU 17 HB3 LEU 17 11.370 -15.863 -18.694 128 HG LEU 17 HG LEU 17 9.081 -17.706 -18.013 129 HD11 LEU 17 HD11 LEU 17 7.842 -15.651 -19.091 130 HD12 LEU 17 HD12 LEU 17 9.227 -14.768 -18.451 131 HD13 LEU 17 HD13 LEU 17 8.199 -15.700 -17.364 132 HD21 LEU 17 HD21 LEU 17 8.929 -18.158 -20.188 133 HD22 LEU 17 HD22 LEU 17 10.548 -17.476 -20.345 134 HD23 LEU 17 HD23 LEU 17 9.132 -16.464 -20.634 135 H LEU 18 H LEU 18 13.631 -16.015 -17.870 136 HA LEU 18 HA LEU 18 14.649 -15.807 -20.412 137 HB2 LEU 18 HB2 LEU 18 15.871 -15.374 -17.714 138 HB3 LEU 18 HB3 LEU 18 16.831 -15.156 -19.176 139 HG LEU 18 HG LEU 18 14.417 -13.586 -18.296 140 HD11 LEU 18 HD11 LEU 18 16.135 -12.497 -17.311 141 HD12 LEU 18 HD12 LEU 18 16.299 -11.791 -18.918 142 HD13 LEU 18 HD13 LEU 18 17.334 -13.135 -18.436 143 HD21 LEU 18 HD21 LEU 18 15.324 -12.375 -20.573 144 HD22 LEU 18 HD22 LEU 18 13.904 -13.416 -20.468 145 HD23 LEU 18 HD23 LEU 18 15.452 -14.085 -20.984 146 H ILE 19 H ILE 19 15.472 -18.144 -17.917 147 HA ILE 19 HA ILE 19 17.761 -19.245 -19.103 148 HB ILE 19 HB ILE 19 15.705 -20.544 -17.316 149 HG12 ILE 19 HG12 ILE 19 18.473 -19.762 -16.491 150 HG13 ILE 19 HG13 ILE 19 17.232 -18.519 -16.604 151 HG21 ILE 19 HG21 ILE 19 17.466 -22.229 -16.867 152 HG22 ILE 19 HG22 ILE 19 16.861 -22.274 -18.522 153 HG23 ILE 19 HG23 ILE 19 18.421 -21.529 -18.174 154 HD11 ILE 19 HD11 ILE 19 16.627 -19.054 -14.548 155 HD12 ILE 19 HD12 ILE 19 16.062 -20.604 -15.172 156 HD13 ILE 19 HD13 ILE 19 17.701 -20.453 -14.540 157 H PHE 20 H PHE 20 14.505 -20.707 -19.054 158 HA PHE 20 HA PHE 20 15.048 -22.591 -21.063 159 HB2 PHE 20 HB2 PHE 20 13.138 -22.631 -19.395 160 HB3 PHE 20 HB3 PHE 20 12.322 -21.461 -20.427 161 HD1 PHE 20 HD1 PHE 20 14.203 -24.639 -20.989 162 HD2 PHE 20 HD2 PHE 20 10.655 -22.392 -21.683 163 HE1 PHE 20 HE1 PHE 20 13.310 -26.478 -22.359 164 HE2 PHE 20 HE2 PHE 20 9.757 -24.227 -23.053 165 HZ PHE 20 HZ PHE 20 11.084 -26.274 -23.392 166 H ILE 21 H ILE 21 14.207 -19.248 -21.219 167 HA ILE 21 HA ILE 21 13.192 -19.241 -23.884 168 HB ILE 21 HB ILE 21 13.989 -17.173 -21.912 169 HG12 ILE 21 HG12 ILE 21 11.658 -17.302 -23.831 170 HG13 ILE 21 HG13 ILE 21 11.655 -18.077 -22.251 171 HG21 ILE 21 HG21 ILE 21 15.230 -16.314 -23.726 172 HG22 ILE 21 HG22 ILE 21 13.962 -16.714 -24.883 173 HG23 ILE 21 HG23 ILE 21 13.712 -15.416 -23.715 174 HD11 ILE 21 HD11 ILE 21 10.505 -15.982 -22.113 175 HD12 ILE 21 HD12 ILE 21 12.021 -15.861 -21.219 176 HD13 ILE 21 HD13 ILE 21 11.880 -15.132 -22.819 177 H PHE 22 H PHE 22 16.350 -18.475 -22.453 178 HA PHE 22 HA PHE 22 17.548 -17.970 -25.022 179 HB2 PHE 22 HB2 PHE 22 18.797 -18.277 -22.284 180 HB3 PHE 22 HB3 PHE 22 19.649 -17.747 -23.730 181 HD1 PHE 22 HD2 PHE 22 17.531 -15.978 -24.892 182 HD2 PHE 22 HD1 PHE 22 18.984 -16.393 -20.913 183 HE1 PHE 22 HE2 PHE 22 16.886 -13.652 -24.418 184 HE2 PHE 22 HE1 PHE 22 18.340 -14.067 -20.432 185 HZ PHE 22 HZ PHE 22 17.291 -12.693 -22.186 186 H ILE 23 H ILE 23 17.126 -20.681 -22.919 187 HA ILE 23 HA ILE 23 19.226 -22.268 -24.089 188 HB ILE 23 HB ILE 23 17.190 -22.660 -21.980 189 HG12 ILE 23 HG12 ILE 23 19.353 -24.058 -21.217 190 HG13 ILE 23 HG13 ILE 23 20.114 -22.993 -22.393 191 HG21 ILE 23 HG21 ILE 23 18.209 -24.908 -23.694 192 HG22 ILE 23 HG22 ILE 23 17.652 -25.156 -22.040 193 HG23 ILE 23 HG23 ILE 23 16.543 -24.528 -23.258 194 HD11 ILE 23 HD11 ILE 23 19.429 -21.059 -21.189 195 HD12 ILE 23 HD12 ILE 23 18.418 -22.022 -20.111 196 HD13 ILE 23 HD13 ILE 23 20.173 -22.175 -20.045 197 H VAL 24 H VAL 24 15.792 -21.810 -24.563 198 HA VAL 24 HA VAL 24 15.508 -24.099 -26.298 199 HB VAL 24 HB VAL 24 13.666 -21.862 -25.498 200 HG11 VAL 24 HG11 VAL 24 13.113 -22.157 -27.779 201 HG12 VAL 24 HG12 VAL 24 13.256 -23.912 -27.663 202 HG13 VAL 24 HG13 VAL 24 11.922 -23.079 -26.863 203 HG21 VAL 24 HG21 VAL 24 14.139 -23.911 -24.050 204 HG22 VAL 24 HG22 VAL 24 12.449 -23.525 -24.374 205 HG23 VAL 24 HG23 VAL 24 13.241 -24.827 -25.261 206 H LEU 25 H LEU 25 15.939 -20.627 -26.639 207 HA LEU 25 HA LEU 25 15.405 -20.462 -29.407 208 HB2 LEU 25 HB2 LEU 25 16.838 -18.751 -27.427 209 HB3 LEU 25 HB3 LEU 25 16.981 -18.388 -29.145 210 HG LEU 25 HG LEU 25 14.449 -18.411 -27.506 211 HD11 LEU 25 HD11 LEU 25 15.707 -16.439 -27.076 212 HD12 LEU 25 HD12 LEU 25 14.418 -16.004 -28.198 213 HD13 LEU 25 HD13 LEU 25 16.066 -16.220 -28.789 214 HD21 LEU 25 HD21 LEU 25 14.917 -18.540 -30.404 215 HD22 LEU 25 HD22 LEU 25 13.784 -17.293 -29.882 216 HD23 LEU 25 HD23 LEU 25 13.494 -18.981 -29.459 217 H LEU 26 H LEU 26 18.256 -21.311 -27.573 218 HA LEU 26 HA LEU 26 20.208 -21.024 -29.548 219 HB2 LEU 26 HB2 LEU 26 19.933 -22.422 -27.002 220 HB3 LEU 26 HB3 LEU 26 21.011 -23.240 -28.131 221 HG LEU 26 HG LEU 26 22.461 -21.345 -28.234 222 HD11 LEU 26 HD11 LEU 26 20.117 -19.930 -27.330 223 HD12 LEU 26 HD12 LEU 26 21.582 -19.311 -28.091 224 HD13 LEU 26 HD13 LEU 26 21.523 -19.533 -26.342 225 HD21 LEU 26 HD21 LEU 26 22.650 -22.868 -26.277 226 HD22 LEU 26 HD22 LEU 26 21.672 -21.730 -25.350 227 HD23 LEU 26 HD23 LEU 26 23.248 -21.237 -25.971 228 H ILE 27 H ILE 27 18.128 -23.792 -28.778 229 HA ILE 27 HA ILE 27 19.220 -25.504 -30.763 230 HB ILE 27 HB ILE 27 16.856 -25.570 -28.975 231 HG12 ILE 27 HG12 ILE 27 17.941 -28.094 -29.171 232 HG13 ILE 27 HG13 ILE 27 19.332 -27.060 -29.476 233 HG21 ILE 27 HG21 ILE 27 15.697 -26.098 -30.961 234 HG22 ILE 27 HG22 ILE 27 17.019 -27.099 -31.558 235 HG23 ILE 27 HG23 ILE 27 16.051 -27.643 -30.188 236 HD11 ILE 27 HD11 ILE 27 19.464 -26.430 -27.345 237 HD12 ILE 27 HD12 ILE 27 17.721 -26.204 -27.204 238 HD13 ILE 27 HD13 ILE 27 18.419 -27.813 -27.022 239 H HIS 28 H HIS 28 16.225 -23.580 -30.646 240 HA HIS 28 HA HIS 28 15.160 -24.208 -33.102 241 HB2 HIS 28 HB2 HIS 28 13.970 -22.812 -31.513 242 HB3 HIS 28 HB3 HIS 28 15.164 -21.530 -31.695 243 HD1 HIS 28 HD1 HIS 28 12.981 -23.468 -34.152 244 HD2 HIS 28 HD2 HIS 28 14.137 -19.582 -33.241 245 HE1 HIS 28 HE1 HIS 28 11.813 -22.008 -35.834 246 H PHE 29 H PHE 29 17.862 -22.114 -32.367 247 HA PHE 29 HA PHE 29 18.073 -21.303 -35.171 248 HB2 PHE 29 HB2 PHE 29 19.291 -20.315 -32.614 249 HB3 PHE 29 HB3 PHE 29 20.054 -19.934 -34.155 250 HD1 PHE 29 HD1 PHE 29 18.227 -19.122 -35.990 251 HD2 PHE 29 HD2 PHE 29 17.911 -18.705 -31.766 252 HE1 PHE 29 HE1 PHE 29 16.674 -17.238 -36.296 253 HE2 PHE 29 HE2 PHE 29 16.357 -16.822 -32.065 254 HZ PHE 29 HZ PHE 29 15.735 -16.086 -34.331 255 H GLU 30 H GLU 30 19.444 -23.461 -32.877 256 HA GLU 30 HA GLU 30 21.995 -23.787 -34.099 257 HB2 GLU 30 HB2 GLU 30 20.452 -25.100 -31.956 258 HB3 GLU 30 HB3 GLU 30 21.598 -26.138 -32.792 259 HG2 GLU 30 HG2 GLU 30 22.464 -23.466 -31.784 260 HG3 GLU 30 HG3 GLU 30 22.336 -24.834 -30.680 261 H GLY 31 H GLY 31 19.002 -24.485 -35.257 262 HA2 GLY 31 HA2 GLY 31 19.143 -25.481 -37.559 263 HA3 GLY 31 HA3 GLY 31 19.980 -26.818 -36.784 264 H TRP 32 H TRP 32 17.032 -24.992 -35.969 265 HA TRP 32 HA TRP 32 15.553 -27.537 -36.051 266 HB2 TRP 32 HB2 TRP 32 16.093 -25.966 -33.761 267 HB3 TRP 32 HB3 TRP 32 14.386 -25.743 -34.136 268 HD1 TRP 32 HD1 TRP 32 12.830 -27.512 -33.141 269 HE1 TRP 32 HE1 TRP 32 13.101 -29.899 -32.219 270 HE3 TRP 32 HE3 TRP 32 17.780 -28.235 -34.199 271 HZ2 TRP 32 HZ2 TRP 32 15.142 -31.833 -31.972 272 HZ3 TRP 32 HZ3 TRP 32 18.815 -30.381 -33.587 273 HH2 TRP 32 HH2 TRP 32 17.522 -32.142 -32.496 274 H ARG 33 H ARG 33 15.875 -25.100 -37.856 275 HA ARG 33 HA ARG 33 13.034 -24.341 -38.016 276 HB2 ARG 33 HB2 ARG 33 14.762 -22.517 -37.699 277 HB3 ARG 33 HB3 ARG 33 15.353 -22.908 -39.308 278 HG2 ARG 33 HG2 ARG 33 13.939 -21.266 -39.909 279 HG3 ARG 33 HG3 ARG 33 12.754 -22.573 -39.863 280 HD2 ARG 33 HD2 ARG 33 11.896 -21.891 -37.814 281 HD3 ARG 33 HD3 ARG 33 13.344 -20.972 -37.405 282 HE ARG 33 HE ARG 33 11.098 -20.075 -38.980 283 HH11 ARG 33 HH11 ARG 33 14.442 -19.571 -38.154 284 HH12 ARG 33 HH12 ARG 33 14.441 -17.902 -38.621 285 HH21 ARG 33 HH21 ARG 33 11.083 -17.880 -39.597 286 HH22 ARG 33 HH22 ARG 33 12.530 -16.941 -39.441 287 H ILE 34 H ILE 34 13.807 -26.824 -39.003 288 HA ILE 34 HA ILE 34 14.510 -26.886 -41.712 289 HB ILE 34 HB ILE 34 12.762 -28.836 -40.206 290 HG12 ILE 34 HG12 ILE 34 15.707 -29.098 -40.792 291 HG13 ILE 34 HG13 ILE 34 15.118 -28.331 -39.322 292 HG21 ILE 34 HG21 ILE 34 12.504 -29.878 -42.148 293 HG22 ILE 34 HG22 ILE 34 13.536 -28.702 -42.960 294 HG23 ILE 34 HG23 ILE 34 14.249 -30.127 -42.207 295 HD11 ILE 34 HD11 ILE 34 15.666 -30.986 -39.626 296 HD12 ILE 34 HD12 ILE 34 14.648 -30.287 -38.367 297 HD13 ILE 34 HD13 ILE 34 13.916 -30.934 -39.835 298 H1 MET 101 H MET 101 10.705 12.012 -9.152 299 HA MET 101 HA MET 101 10.241 9.984 -7.158 300 HB2 MET 101 HB2 MET 101 8.401 11.989 -8.468 301 HB3 MET 101 HB3 MET 101 7.902 10.887 -7.193 302 HG2 MET 101 HG2 MET 101 8.454 12.513 -5.787 303 HG3 MET 101 HG3 MET 101 10.126 12.069 -6.121 304 HE1 MET 101 HE1 MET 101 11.825 14.605 -7.220 305 HE2 MET 101 HE2 MET 101 10.955 15.417 -5.918 306 HE3 MET 101 HE3 MET 101 11.346 13.702 -5.783 307 H ASP 102 H ASP 102 10.938 9.138 -9.893 308 HA ASP 102 HA ASP 102 8.891 7.128 -10.180 309 HB2 ASP 102 HB2 ASP 102 9.313 9.253 -12.271 310 HB3 ASP 102 HB3 ASP 102 8.690 7.660 -12.692 311 H SER 103 H SER 103 9.997 5.310 -10.395 312 HA SER 103 HA SER 103 12.619 5.387 -11.718 313 HB2 SER 103 HB2 SER 103 11.458 3.285 -9.873 314 HB3 SER 103 HB3 SER 103 13.090 3.285 -10.540 315 HG SER 103 HG SER 103 12.136 5.467 -9.031 316 H ALA 104 H ALA 104 10.256 5.397 -13.287 317 HA ALA 104 HA ALA 104 9.601 2.784 -14.199 318 HB1 ALA 104 HB1 ALA 104 7.923 4.003 -15.000 319 HB2 ALA 104 HB2 ALA 104 8.835 5.502 -14.816 320 HB3 ALA 104 HB3 ALA 104 9.017 4.532 -16.278 321 HA PRO 105 HA PRO 105 12.493 3.799 -17.928 322 HB2 PRO 105 HB2 PRO 105 14.038 6.024 -17.751 323 HB3 PRO 105 HB3 PRO 105 12.409 6.038 -18.436 324 HG2 PRO 105 HG2 PRO 105 13.317 6.828 -15.695 325 HG3 PRO 105 HG3 PRO 105 12.160 7.638 -16.767 326 HD2 PRO 105 HD2 PRO 105 11.382 6.069 -14.702 327 HD3 PRO 105 HD3 PRO 105 10.444 6.207 -16.203 328 H PHE 106 H PHE 106 13.575 4.576 -14.685 329 HA PHE 106 HA PHE 106 16.302 3.835 -15.099 330 HB2 PHE 106 HB2 PHE 106 14.605 4.488 -12.729 331 HB3 PHE 106 HB3 PHE 106 16.141 3.671 -12.464 332 HD1 PHE 106 HD2 PHE 106 18.248 4.755 -13.320 333 HD2 PHE 106 HD1 PHE 106 14.512 6.788 -13.146 334 HE1 PHE 106 HE2 PHE 106 19.420 6.913 -13.460 335 HE2 PHE 106 HE1 PHE 106 15.679 8.950 -13.286 336 HZ PHE 106 HZ PHE 106 18.136 9.014 -13.442 337 H GLU 107 H GLU 107 13.408 2.180 -13.988 338 HA GLU 107 HA GLU 107 14.575 -0.134 -12.949 339 HB2 GLU 107 HB2 GLU 107 11.939 0.748 -13.700 340 HB3 GLU 107 HB3 GLU 107 12.182 -0.914 -14.218 341 HG2 GLU 107 HG2 GLU 107 13.182 -0.643 -11.572 342 HG3 GLU 107 HG3 GLU 107 11.565 0.054 -11.639 343 H LEU 108 H LEU 108 13.471 0.562 -16.255 344 HA LEU 108 HA LEU 108 13.953 -1.874 -17.445 345 HB2 LEU 108 HB2 LEU 108 13.956 0.938 -18.380 346 HB3 LEU 108 HB3 LEU 108 14.670 -0.267 -19.451 347 HG LEU 108 HG LEU 108 12.303 0.245 -19.966 348 HD11 LEU 108 HD11 LEU 108 13.156 -1.860 -20.686 349 HD12 LEU 108 HD12 LEU 108 11.546 -2.136 -20.021 350 HD13 LEU 108 HD13 LEU 108 12.974 -2.551 -19.073 351 HD21 LEU 108 HD21 LEU 108 10.570 -0.666 -18.452 352 HD22 LEU 108 HD22 LEU 108 11.460 0.687 -17.753 353 HD23 LEU 108 HD23 LEU 108 11.822 -0.964 -17.246 354 H PHE 109 H PHE 109 16.244 0.649 -16.593 355 HA PHE 109 HA PHE 109 18.479 -0.116 -18.004 356 HB2 PHE 109 HB2 PHE 109 18.092 1.816 -16.269 357 HB3 PHE 109 HB3 PHE 109 18.767 0.661 -15.125 358 HD1 PHE 109 HD1 PHE 109 19.542 1.836 -18.586 359 HD2 PHE 109 HD2 PHE 109 20.992 0.936 -14.686 360 HE1 PHE 109 HE1 PHE 109 21.811 2.479 -19.285 361 HE2 PHE 109 HE2 PHE 109 23.264 1.580 -15.379 362 HZ PHE 109 HZ PHE 109 23.676 2.353 -17.681 363 H PHE 110 H PHE 110 17.292 -1.419 -14.930 364 HA PHE 110 HA PHE 110 19.451 -3.276 -14.648 365 HB2 PHE 110 HB2 PHE 110 18.352 -2.537 -12.650 366 HB3 PHE 110 HB3 PHE 110 16.777 -3.029 -13.265 367 HD1 PHE 110 HD2 PHE 110 19.942 -4.182 -11.831 368 HD2 PHE 110 HD1 PHE 110 16.079 -5.327 -13.201 369 HE1 PHE 110 HE2 PHE 110 20.211 -6.375 -10.748 370 HE2 PHE 110 HE1 PHE 110 16.341 -7.521 -12.120 371 HZ PHE 110 HZ PHE 110 18.410 -8.048 -10.892 372 H MET 111 H MET 111 16.356 -3.294 -16.210 373 HA MET 111 HA MET 111 16.027 -6.109 -16.388 374 HB2 MET 111 HB2 MET 111 14.786 -3.721 -17.648 375 HB3 MET 111 HB3 MET 111 14.601 -5.255 -18.488 376 HG2 MET 111 HG2 MET 111 12.706 -4.861 -17.057 377 HG3 MET 111 HG3 MET 111 13.634 -6.237 -16.464 378 HE1 MET 111 HE1 MET 111 11.909 -4.118 -13.521 379 HE2 MET 111 HE2 MET 111 11.725 -3.159 -14.989 380 HE3 MET 111 HE3 MET 111 11.448 -4.901 -15.034 381 H ILE 112 H ILE 112 17.623 -3.705 -18.394 382 HA ILE 112 HA ILE 112 18.130 -5.508 -20.567 383 HB ILE 112 HB ILE 112 19.268 -2.793 -19.907 384 HG12 ILE 112 HG12 ILE 112 17.837 -2.877 -22.359 385 HG13 ILE 112 HG13 ILE 112 16.852 -3.697 -21.151 386 HG21 ILE 112 HG21 ILE 112 20.986 -3.687 -21.162 387 HG22 ILE 112 HG22 ILE 112 19.903 -4.700 -22.115 388 HG23 ILE 112 HG23 ILE 112 19.969 -2.962 -22.407 389 HD11 ILE 112 HD11 ILE 112 17.106 -0.947 -21.581 390 HD12 ILE 112 HD12 ILE 112 16.244 -1.763 -20.276 391 HD13 ILE 112 HD13 ILE 112 17.926 -1.280 -20.056 392 H ASN 113 H ASN 113 20.125 -4.088 -17.984 393 HA ASN 113 HA ASN 113 22.560 -5.226 -18.619 394 HB2 ASN 113 HB2 ASN 113 21.307 -4.439 -16.004 395 HB3 ASN 113 HB3 ASN 113 22.901 -5.186 -16.038 396 HD21 ASN 113 HD21 ASN 113 24.394 -4.152 -17.730 397 HD22 ASN 113 HD22 ASN 113 24.421 -2.425 -17.738 398 H THR 114 H THR 114 20.168 -6.541 -16.321 399 HA THR 114 HA THR 114 21.453 -8.961 -15.824 400 HB THR 114 HB THR 114 19.504 -8.073 -14.532 401 HG1 THR 114 HG1 THR 114 18.625 -10.184 -14.184 402 HG21 THR 114 HG21 THR 114 18.197 -7.681 -16.756 403 HG22 THR 114 HG22 THR 114 17.322 -8.173 -15.305 404 HG23 THR 114 HG23 THR 114 17.708 -9.362 -16.549 405 H SER 115 H SER 115 19.649 -7.916 -18.578 406 HA SER 115 HA SER 115 18.952 -10.477 -19.595 407 HB2 SER 115 HB2 SER 115 18.119 -8.042 -20.236 408 HB3 SER 115 HB3 SER 115 19.404 -8.168 -21.437 409 HG SER 115 HG SER 115 16.997 -9.139 -21.628 410 H ILE 116 H ILE 116 21.382 -8.158 -20.802 411 HA ILE 116 HA ILE 116 22.683 -9.876 -22.542 412 HB ILE 116 HB ILE 116 23.930 -7.630 -20.952 413 HG12 ILE 116 HG12 ILE 116 22.753 -7.577 -23.737 414 HG13 ILE 116 HG13 ILE 116 21.907 -7.016 -22.299 415 HG21 ILE 116 HG21 ILE 116 25.726 -8.804 -21.847 416 HG22 ILE 116 HG22 ILE 116 24.849 -9.216 -23.319 417 HG23 ILE 116 HG23 ILE 116 25.411 -7.565 -23.062 418 HD11 ILE 116 HD11 ILE 116 22.740 -5.053 -23.107 419 HD12 ILE 116 HD12 ILE 116 24.043 -5.526 -22.016 420 HD13 ILE 116 HD13 ILE 116 24.199 -5.806 -23.750 421 H LEU 117 H LEU 117 22.855 -9.693 -19.088 422 HA LEU 117 HA LEU 117 25.298 -11.222 -18.890 423 HB2 LEU 117 HB2 LEU 117 23.736 -9.607 -17.166 424 HB3 LEU 117 HB3 LEU 117 23.826 -11.214 -16.449 425 HG LEU 117 HG LEU 117 26.221 -9.573 -17.269 426 HD11 LEU 117 HD11 LEU 117 26.425 -9.590 -14.645 427 HD12 LEU 117 HD12 LEU 117 24.670 -9.729 -14.736 428 HD13 LEU 117 HD13 LEU 117 25.485 -8.355 -15.482 429 HD21 LEU 117 HD21 LEU 117 27.476 -11.344 -16.773 430 HD22 LEU 117 HD22 LEU 117 25.990 -12.294 -16.815 431 HD23 LEU 117 HD23 LEU 117 26.584 -11.653 -15.282 432 H LEU 118 H LEU 118 21.934 -11.796 -17.838 433 HA LEU 118 HA LEU 118 22.151 -14.445 -17.139 434 HB2 LEU 118 HB2 LEU 118 19.900 -12.850 -18.303 435 HB3 LEU 118 HB3 LEU 118 19.701 -14.569 -17.967 436 HG LEU 118 HG LEU 118 20.200 -12.342 -16.003 437 HD11 LEU 118 HD11 LEU 118 17.947 -12.393 -16.187 438 HD12 LEU 118 HD12 LEU 118 18.124 -13.731 -15.052 439 HD13 LEU 118 HD13 LEU 118 17.918 -14.057 -16.773 440 HD21 LEU 118 HD21 LEU 118 19.853 -14.598 -14.505 441 HD22 LEU 118 HD22 LEU 118 21.404 -13.824 -14.833 442 HD23 LEU 118 HD23 LEU 118 20.869 -15.184 -15.822 443 H ILE 119 H ILE 119 21.790 -13.055 -20.350 444 HA ILE 119 HA ILE 119 21.244 -15.399 -21.779 445 HB ILE 119 HB ILE 119 22.722 -12.918 -22.660 446 HG12 ILE 119 HG12 ILE 119 19.941 -13.651 -23.481 447 HG13 ILE 119 HG13 ILE 119 20.200 -12.961 -21.883 448 HG21 ILE 119 HG21 ILE 119 22.179 -13.671 -24.959 449 HG22 ILE 119 HG22 ILE 119 23.324 -14.723 -24.129 450 HG23 ILE 119 HG23 ILE 119 21.636 -15.209 -24.289 451 HD11 ILE 119 HD11 ILE 119 20.108 -10.961 -22.817 452 HD12 ILE 119 HD12 ILE 119 21.622 -11.328 -23.645 453 HD13 ILE 119 HD13 ILE 119 20.080 -11.663 -24.434 454 H PHE 120 H PHE 120 24.391 -13.721 -21.626 455 HA PHE 120 HA PHE 120 25.867 -15.874 -22.664 456 HB2 PHE 120 HB2 PHE 120 26.587 -13.447 -22.526 457 HB3 PHE 120 HB3 PHE 120 26.951 -13.736 -20.828 458 HD1 PHE 120 HD1 PHE 120 27.593 -15.529 -24.042 459 HD2 PHE 120 HD2 PHE 120 29.183 -13.986 -20.407 460 HE1 PHE 120 HE1 PHE 120 29.823 -16.361 -24.668 461 HE2 PHE 120 HE2 PHE 120 31.415 -14.815 -21.028 462 HZ PHE 120 HZ PHE 120 31.737 -16.003 -23.160 463 H ILE 121 H ILE 121 24.684 -15.214 -19.492 464 HA ILE 121 HA ILE 121 26.514 -16.880 -18.067 465 HB ILE 121 HB ILE 121 24.004 -15.442 -17.414 466 HG12 ILE 121 HG12 ILE 121 26.561 -15.808 -15.844 467 HG13 ILE 121 HG13 ILE 121 26.344 -14.563 -17.070 468 HG21 ILE 121 HG21 ILE 121 23.353 -17.536 -16.541 469 HG22 ILE 121 HG22 ILE 121 24.968 -17.860 -15.912 470 HG23 ILE 121 HG23 ILE 121 23.967 -16.612 -15.171 471 HD11 ILE 121 HD11 ILE 121 25.992 -13.614 -14.900 472 HD12 ILE 121 HD12 ILE 121 24.450 -13.670 -15.756 473 HD13 ILE 121 HD13 ILE 121 24.807 -14.858 -14.502 474 H PHE 122 H PHE 122 23.216 -17.312 -19.303 475 HA PHE 122 HA PHE 122 23.088 -20.047 -18.403 476 HB2 PHE 122 HB2 PHE 122 21.250 -18.461 -20.209 477 HB3 PHE 122 HB3 PHE 122 20.914 -20.079 -19.601 478 HD1 PHE 122 HD2 PHE 122 21.925 -19.761 -16.808 479 HD2 PHE 122 HD1 PHE 122 19.533 -17.213 -19.237 480 HE1 PHE 122 HE2 PHE 122 20.912 -18.791 -14.787 481 HE2 PHE 122 HE1 PHE 122 18.517 -16.238 -17.220 482 HZ PHE 122 HZ PHE 122 19.205 -17.027 -14.991 483 H ILE 123 H ILE 123 24.054 -18.363 -21.263 484 HA ILE 123 HA ILE 123 23.870 -20.651 -23.004 485 HB ILE 123 HB ILE 123 24.719 -17.832 -23.284 486 HG12 ILE 123 HG12 ILE 123 23.604 -18.525 -25.627 487 HG13 ILE 123 HG13 ILE 123 22.935 -19.800 -24.615 488 HG21 ILE 123 HG21 ILE 123 25.909 -20.059 -24.912 489 HG22 ILE 123 HG22 ILE 123 25.781 -18.409 -25.519 490 HG23 ILE 123 HG23 ILE 123 26.738 -18.746 -24.076 491 HD11 ILE 123 HD11 ILE 123 21.886 -18.210 -23.187 492 HD12 ILE 123 HD12 ILE 123 22.717 -16.871 -23.980 493 HD13 ILE 123 HD13 ILE 123 21.492 -17.791 -24.854 494 H VAL 124 H VAL 124 26.322 -19.110 -21.037 495 HA VAL 124 HA VAL 124 28.484 -20.671 -22.143 496 HB VAL 124 HB VAL 124 28.294 -18.735 -19.850 497 HG11 VAL 124 HG11 VAL 124 29.805 -20.351 -19.014 498 HG12 VAL 124 HG12 VAL 124 30.593 -20.531 -20.583 499 HG13 VAL 124 HG13 VAL 124 30.795 -19.042 -19.659 500 HG21 VAL 124 HG21 VAL 124 28.443 -18.014 -22.289 501 HG22 VAL 124 HG22 VAL 124 29.626 -17.324 -21.178 502 HG23 VAL 124 HG23 VAL 124 30.091 -18.640 -22.256 503 H LEU 125 H LEU 125 26.388 -20.775 -19.328 504 HA LEU 125 HA LEU 125 27.805 -22.723 -17.863 505 HB2 LEU 125 HB2 LEU 125 25.005 -21.703 -17.872 506 HB3 LEU 125 HB3 LEU 125 25.374 -23.170 -16.968 507 HG LEU 125 HG LEU 125 26.565 -20.434 -16.525 508 HD11 LEU 125 HD11 LEU 125 24.350 -20.522 -15.662 509 HD12 LEU 125 HD12 LEU 125 25.452 -20.710 -14.298 510 HD13 LEU 125 HD13 LEU 125 24.621 -22.118 -14.960 511 HD21 LEU 125 HD21 LEU 125 27.410 -23.119 -15.679 512 HD22 LEU 125 HD22 LEU 125 27.301 -21.923 -14.387 513 HD23 LEU 125 HD23 LEU 125 28.329 -21.617 -15.788 514 H LEU 126 H LEU 126 25.527 -22.936 -20.503 515 HA LEU 126 HA LEU 126 24.785 -25.619 -20.293 516 HB2 LEU 126 HB2 LEU 126 24.766 -23.551 -22.358 517 HB3 LEU 126 HB3 LEU 126 24.905 -25.187 -22.998 518 HG LEU 126 HG LEU 126 22.821 -25.824 -22.028 519 HD11 LEU 126 HD11 LEU 126 23.341 -23.590 -20.276 520 HD12 LEU 126 HD12 LEU 126 22.246 -24.956 -20.067 521 HD13 LEU 126 HD13 LEU 126 21.708 -23.521 -20.940 522 HD21 LEU 126 HD21 LEU 126 22.789 -24.504 -24.144 523 HD22 LEU 126 HD22 LEU 126 22.452 -23.064 -23.183 524 HD23 LEU 126 HD23 LEU 126 21.300 -24.400 -23.205 525 H ILE 127 H ILE 127 27.540 -24.135 -21.964 526 HA ILE 127 HA ILE 127 28.566 -26.570 -23.001 527 HB ILE 127 HB ILE 127 29.548 -23.783 -22.777 528 HG12 ILE 127 HG12 ILE 127 30.322 -24.855 -25.196 529 HG13 ILE 127 HG13 ILE 127 28.856 -25.757 -24.829 530 HG21 ILE 127 HG21 ILE 127 31.481 -24.809 -21.898 531 HG22 ILE 127 HG22 ILE 127 31.368 -26.161 -23.025 532 HG23 ILE 127 HG23 ILE 127 31.811 -24.558 -23.612 533 HD11 ILE 127 HD11 ILE 127 27.546 -24.004 -25.246 534 HD12 ILE 127 HD12 ILE 127 28.607 -22.886 -24.388 535 HD13 ILE 127 HD13 ILE 127 28.959 -23.330 -26.058 536 H HIS 128 H HIS 128 29.542 -24.559 -20.228 537 HA HIS 128 HA HIS 128 31.651 -26.043 -19.280 538 HB2 HIS 128 HB2 HIS 128 30.993 -23.893 -18.314 539 HB3 HIS 128 HB3 HIS 128 29.535 -24.622 -17.649 540 HD1 HIS 128 HD1 HIS 128 33.259 -25.420 -17.426 541 HD2 HIS 128 HD2 HIS 128 29.880 -25.124 -15.028 542 HE1 HIS 128 HE1 HIS 128 34.041 -25.949 -15.095 543 H PHE 129 H PHE 129 28.227 -26.713 -19.021 544 HA PHE 129 HA PHE 129 28.746 -29.029 -17.310 545 HB2 PHE 129 HB2 PHE 129 26.279 -27.511 -18.085 546 HB3 PHE 129 HB3 PHE 129 26.138 -29.158 -17.480 547 HD1 PHE 129 HD1 PHE 129 27.688 -29.546 -15.288 548 HD2 PHE 129 HD2 PHE 129 25.980 -25.854 -16.542 549 HE1 PHE 129 HE1 PHE 129 27.810 -28.708 -12.978 550 HE2 PHE 129 HE2 PHE 129 26.100 -25.010 -14.234 551 HZ PHE 129 HZ PHE 129 27.017 -26.437 -12.449 552 H GLU 130 H GLU 130 28.088 -28.189 -20.578 553 HA GLU 130 HA GLU 130 26.985 -30.676 -21.418 554 HB2 GLU 130 HB2 GLU 130 27.947 -28.203 -22.708 555 HB3 GLU 130 HB3 GLU 130 28.076 -29.657 -23.688 556 HG2 GLU 130 HG2 GLU 130 25.514 -29.013 -22.300 557 HG3 GLU 130 HG3 GLU 130 25.936 -28.206 -23.809 558 H GLY 131 H GLY 131 29.973 -29.987 -20.244 559 HA2 GLY 131 HA2 GLY 131 31.399 -32.057 -20.168 560 HA3 GLY 131 HA3 GLY 131 31.266 -32.049 -21.921 561 H TRP 132 H TRP 132 31.926 -29.483 -19.541 562 HA TRP 132 HA TRP 132 34.508 -29.031 -20.878 563 HB2 TRP 132 HB2 TRP 132 32.266 -27.292 -20.922 564 HB3 TRP 132 HB3 TRP 132 33.478 -26.551 -19.880 565 HD1 TRP 132 HD1 TRP 132 35.273 -25.178 -21.086 566 HE1 TRP 132 HE1 TRP 132 36.107 -24.965 -23.512 567 HE3 TRP 132 HE3 TRP 132 32.525 -28.924 -23.220 568 HZ2 TRP 132 HZ2 TRP 132 35.659 -26.219 -26.001 569 HZ3 TRP 132 HZ3 TRP 132 32.786 -29.352 -25.629 570 HH2 TRP 132 HH2 TRP 132 34.321 -28.027 -26.989 571 H ARG 133 H ARG 133 33.539 -30.304 -18.294 572 HA ARG 133 HA ARG 133 34.998 -28.607 -16.387 573 HB2 ARG 133 HB2 ARG 133 32.637 -29.298 -15.846 574 HB3 ARG 133 HB3 ARG 133 33.210 -30.958 -15.760 575 HG2 ARG 133 HG2 ARG 133 33.390 -30.468 -13.571 576 HG3 ARG 133 HG3 ARG 133 34.947 -29.810 -14.079 577 HD2 ARG 133 HD2 ARG 133 34.193 -27.618 -13.990 578 HD3 ARG 133 HD3 ARG 133 32.500 -28.091 -14.118 579 HE ARG 133 HE ARG 133 34.085 -27.928 -11.716 580 HH11 ARG 133 HH11 ARG 133 31.256 -29.290 -13.220 581 HH12 ARG 133 HH12 ARG 133 30.428 -29.558 -11.722 582 HH21 ARG 133 HH21 ARG 133 33.005 -28.276 -9.737 583 HH22 ARG 133 HH22 ARG 133 31.424 -28.980 -9.741 584 H ILE 134 H ILE 134 36.565 -29.958 -18.183 585 HA ILE 134 HA ILE 134 37.392 -32.527 -17.457 586 HB ILE 134 HB ILE 134 39.070 -30.317 -18.651 587 HG12 ILE 134 HG12 ILE 134 37.696 -32.573 -20.106 588 HG13 ILE 134 HG13 ILE 134 36.922 -31.012 -19.853 589 HG21 ILE 134 HG21 ILE 134 40.773 -31.731 -18.493 590 HG22 ILE 134 HG22 ILE 134 39.729 -32.976 -17.810 591 HG23 ILE 134 HG23 ILE 134 39.906 -32.836 -19.559 592 HD11 ILE 134 HD11 ILE 134 38.457 -31.692 -21.998 593 HD12 ILE 134 HD12 ILE 134 38.100 -30.045 -21.478 594 HD13 ILE 134 HD13 ILE 134 39.604 -30.820 -20.981 Start of MODEL 6 1 H1 MET 1 H MET 1 9.453 -1.477 5.631 2 HA MET 1 HA MET 1 9.859 0.620 3.605 3 HB2 MET 1 HB2 MET 1 10.860 0.345 6.430 4 HB3 MET 1 HB3 MET 1 11.621 1.441 5.284 5 HG2 MET 1 HG2 MET 1 8.912 2.010 5.096 6 HG3 MET 1 HG3 MET 1 9.198 1.758 6.817 7 HE1 MET 1 HE1 MET 1 8.878 4.880 7.386 8 HE2 MET 1 HE2 MET 1 8.942 5.543 5.752 9 HE3 MET 1 HE3 MET 1 8.031 4.066 6.070 10 H ASP 2 H ASP 2 10.389 -2.275 3.335 11 HA ASP 2 HA ASP 2 13.055 -2.046 2.263 12 HB2 ASP 2 HB2 ASP 2 12.455 -3.843 4.605 13 HB3 ASP 2 HB3 ASP 2 13.769 -4.192 3.484 14 H SER 3 H SER 3 12.852 -2.880 0.303 15 HA SER 3 HA SER 3 10.961 -5.089 -0.117 16 HB2 SER 3 HB2 SER 3 12.053 -2.943 -1.915 17 HB3 SER 3 HB3 SER 3 11.380 -4.422 -2.600 18 HG SER 3 HG SER 3 9.471 -3.935 -1.294 19 H ALA 4 H ALA 4 13.503 -5.603 1.045 20 HA ALA 4 HA ALA 4 15.376 -6.510 -0.887 21 HB1 ALA 4 HB1 ALA 4 16.546 -6.375 1.012 22 HB2 ALA 4 HB2 ALA 4 15.109 -6.560 2.018 23 HB3 ALA 4 HB3 ALA 4 15.914 -7.984 1.360 24 HA PRO 5 HA PRO 5 13.619 -10.912 0.030 25 HB2 PRO 5 HB2 PRO 5 11.345 -11.074 1.503 26 HB3 PRO 5 HB3 PRO 5 12.959 -11.082 2.224 27 HG2 PRO 5 HG2 PRO 5 11.017 -8.820 1.952 28 HG3 PRO 5 HG3 PRO 5 12.025 -9.269 3.340 29 HD2 PRO 5 HD2 PRO 5 12.687 -7.262 1.646 30 HD3 PRO 5 HD3 PRO 5 13.904 -8.267 2.458 31 H PHE 6 H PHE 6 11.545 -8.204 -0.604 32 HA PHE 6 HA PHE 6 9.561 -9.733 -2.035 33 HB2 PHE 6 HB2 PHE 6 10.009 -6.829 -1.466 34 HB3 PHE 6 HB3 PHE 6 8.913 -7.289 -2.764 35 HD1 PHE 6 HD2 PHE 6 7.015 -8.906 -2.180 36 HD2 PHE 6 HD1 PHE 6 9.276 -6.781 0.734 37 HE1 PHE 6 HE2 PHE 6 5.216 -9.249 -0.538 38 HE2 PHE 6 HE1 PHE 6 7.481 -7.122 2.381 39 HZ PHE 6 HZ PHE 6 5.446 -8.356 1.745 40 H GLU 7 H GLU 7 12.344 -7.724 -2.817 41 HA GLU 7 HA GLU 7 11.959 -7.502 -5.577 42 HB2 GLU 7 HB2 GLU 7 14.100 -7.027 -3.687 43 HB3 GLU 7 HB3 GLU 7 14.725 -7.693 -5.190 44 HG2 GLU 7 HG2 GLU 7 12.982 -5.251 -4.939 45 HG3 GLU 7 HG3 GLU 7 14.725 -5.257 -5.207 46 H LEU 8 H LEU 8 13.437 -10.053 -3.647 47 HA LEU 8 HA LEU 8 14.655 -11.567 -5.602 48 HB2 LEU 8 HB2 LEU 8 13.455 -12.112 -2.965 49 HB3 LEU 8 HB3 LEU 8 13.658 -13.511 -4.018 50 HG LEU 8 HG LEU 8 15.541 -13.305 -2.510 51 HD11 LEU 8 HD11 LEU 8 15.687 -13.669 -5.214 52 HD12 LEU 8 HD12 LEU 8 17.002 -13.950 -4.073 53 HD13 LEU 8 HD13 LEU 8 16.899 -12.417 -4.939 54 HD21 LEU 8 HD21 LEU 8 15.734 -10.530 -3.648 55 HD22 LEU 8 HD22 LEU 8 17.091 -11.322 -2.847 56 HD23 LEU 8 HD23 LEU 8 15.597 -11.017 -1.958 57 H PHE 9 H PHE 9 11.245 -11.387 -4.754 58 HA PHE 9 HA PHE 9 10.213 -13.560 -6.080 59 HB2 PHE 9 HB2 PHE 9 8.907 -11.933 -4.709 60 HB3 PHE 9 HB3 PHE 9 8.978 -10.799 -6.054 61 HD1 PHE 9 HD2 PHE 9 7.860 -14.239 -5.191 62 HD2 PHE 9 HD1 PHE 9 7.326 -10.822 -7.672 63 HE1 PHE 9 HE2 PHE 9 5.834 -15.254 -6.147 64 HE2 PHE 9 HE1 PHE 9 5.298 -11.832 -8.632 65 HZ PHE 9 HZ PHE 9 4.550 -14.051 -7.870 66 H PHE 10 H PHE 10 10.875 -10.344 -7.449 67 HA PHE 10 HA PHE 10 10.091 -11.032 -10.086 68 HB2 PHE 10 HB2 PHE 10 10.106 -8.717 -9.466 69 HB3 PHE 10 HB3 PHE 10 11.803 -8.792 -9.005 70 HD1 PHE 10 HD1 PHE 10 13.551 -8.888 -10.710 71 HD2 PHE 10 HD2 PHE 10 9.444 -8.480 -11.751 72 HE1 PHE 10 HE1 PHE 10 14.199 -8.178 -12.975 73 HE2 PHE 10 HE2 PHE 10 10.085 -7.770 -14.017 74 HZ PHE 10 HZ PHE 10 12.465 -7.619 -14.633 75 H MET 11 H MET 11 13.033 -11.400 -8.284 76 HA MET 11 HA MET 11 14.774 -11.755 -10.510 77 HB2 MET 11 HB2 MET 11 14.938 -12.149 -7.571 78 HB3 MET 11 HB3 MET 11 16.082 -13.048 -8.559 79 HG2 MET 11 HG2 MET 11 17.066 -10.976 -7.834 80 HG3 MET 11 HG3 MET 11 16.833 -10.954 -9.580 81 HE1 MET 11 HE1 MET 11 16.129 -7.416 -7.395 82 HE2 MET 11 HE2 MET 11 16.681 -8.862 -6.549 83 HE3 MET 11 HE3 MET 11 17.483 -8.348 -8.034 84 H ILE 12 H ILE 12 13.456 -14.107 -8.170 85 HA ILE 12 HA ILE 12 14.327 -16.426 -9.376 86 HB ILE 12 HB ILE 12 11.746 -15.956 -7.884 87 HG12 ILE 12 HG12 ILE 12 13.623 -17.511 -6.434 88 HG13 ILE 12 HG13 ILE 12 14.493 -16.126 -7.083 89 HG21 ILE 12 HG21 ILE 12 12.907 -18.395 -9.094 90 HG22 ILE 12 HG22 ILE 12 12.209 -18.551 -7.483 91 HG23 ILE 12 HG23 ILE 12 11.221 -17.957 -8.818 92 HD11 ILE 12 HD11 ILE 12 13.627 -14.807 -5.538 93 HD12 ILE 12 HD12 ILE 12 11.988 -15.278 -5.987 94 HD13 ILE 12 HD13 ILE 12 12.885 -16.227 -4.801 95 H ASN 13 H ASN 13 11.089 -14.981 -9.795 96 HA ASN 13 HA ASN 13 10.127 -16.658 -11.751 97 HB2 ASN 13 HB2 ASN 13 9.631 -13.757 -11.152 98 HB3 ASN 13 HB3 ASN 13 8.854 -14.521 -12.536 99 HD21 ASN 13 HD21 ASN 13 7.650 -16.537 -12.063 100 HD22 ASN 13 HD22 ASN 13 6.772 -16.619 -10.578 101 H THR 14 H THR 14 11.718 -13.516 -12.331 102 HA THR 14 HA THR 14 11.850 -13.667 -15.098 103 HB THR 14 HB THR 14 13.814 -12.350 -13.212 104 HG1 THR 14 HG1 THR 14 12.287 -10.909 -13.021 105 HG21 THR 14 HG21 THR 14 14.763 -12.670 -15.459 106 HG22 THR 14 HG22 THR 14 14.457 -10.967 -15.116 107 HG23 THR 14 HG23 THR 14 13.357 -11.868 -16.159 108 H SER 15 H SER 15 13.875 -15.160 -12.672 109 HA SER 15 HA SER 15 16.010 -15.882 -14.405 110 HB2 SER 15 HB2 SER 15 15.862 -15.822 -11.771 111 HB3 SER 15 HB3 SER 15 15.356 -17.499 -11.972 112 HG SER 15 HG SER 15 17.558 -17.513 -11.792 113 H ILE 16 H ILE 16 13.537 -17.953 -12.877 114 HA ILE 16 HA ILE 16 13.997 -20.265 -14.286 115 HB ILE 16 HB ILE 16 11.310 -19.212 -13.395 116 HG12 ILE 16 HG12 ILE 16 12.958 -21.250 -11.936 117 HG13 ILE 16 HG13 ILE 16 13.297 -19.535 -11.725 118 HG21 ILE 16 HG21 ILE 16 10.674 -20.952 -14.728 119 HG22 ILE 16 HG22 ILE 16 12.197 -21.815 -14.517 120 HG23 ILE 16 HG23 ILE 16 10.989 -21.830 -13.232 121 HD11 ILE 16 HD11 ILE 16 10.673 -20.900 -11.177 122 HD12 ILE 16 HD12 ILE 16 11.843 -20.359 -9.973 123 HD13 ILE 16 HD13 ILE 16 11.001 -19.179 -10.977 124 H LEU 17 H LEU 17 12.383 -17.367 -15.352 125 HA LEU 17 HA LEU 17 11.288 -18.593 -17.727 126 HB2 LEU 17 HB2 LEU 17 10.856 -16.217 -16.275 127 HB3 LEU 17 HB3 LEU 17 11.395 -15.735 -17.882 128 HG LEU 17 HG LEU 17 9.053 -17.552 -17.319 129 HD11 LEU 17 HD11 LEU 17 8.143 -15.589 -16.657 130 HD12 LEU 17 HD12 LEU 17 7.955 -15.369 -18.396 131 HD13 LEU 17 HD13 LEU 17 9.309 -14.616 -17.554 132 HD21 LEU 17 HD21 LEU 17 10.568 -17.218 -19.636 133 HD22 LEU 17 HD22 LEU 17 9.118 -16.247 -19.889 134 HD23 LEU 17 HD23 LEU 17 8.975 -17.962 -19.502 135 H LEU 18 H LEU 18 13.655 -15.978 -17.173 136 HA LEU 18 HA LEU 18 14.597 -15.707 -19.742 137 HB2 LEU 18 HB2 LEU 18 15.901 -15.369 -17.070 138 HB3 LEU 18 HB3 LEU 18 16.825 -15.127 -18.552 139 HG LEU 18 HG LEU 18 14.508 -13.525 -17.509 140 HD11 LEU 18 HD11 LEU 18 16.298 -12.428 -16.703 141 HD12 LEU 18 HD12 LEU 18 16.399 -11.791 -18.344 142 HD13 LEU 18 HD13 LEU 18 17.405 -13.159 -17.866 143 HD21 LEU 18 HD21 LEU 18 15.113 -12.281 -19.812 144 HD22 LEU 18 HD22 LEU 18 13.805 -13.453 -19.653 145 HD23 LEU 18 HD23 LEU 18 15.368 -13.957 -20.297 146 H ILE 19 H ILE 19 15.548 -18.074 -17.304 147 HA ILE 19 HA ILE 19 17.745 -19.188 -18.627 148 HB ILE 19 HB ILE 19 15.772 -20.521 -16.769 149 HG12 ILE 19 HG12 ILE 19 18.554 -19.703 -16.028 150 HG13 ILE 19 HG13 ILE 19 17.292 -18.477 -16.087 151 HG21 ILE 19 HG21 ILE 19 16.928 -22.205 -18.054 152 HG22 ILE 19 HG22 ILE 19 18.481 -21.444 -17.716 153 HG23 ILE 19 HG23 ILE 19 17.561 -22.188 -16.409 154 HD11 ILE 19 HD11 ILE 19 16.169 -20.557 -14.640 155 HD12 ILE 19 HD12 ILE 19 17.838 -20.465 -14.076 156 HD13 ILE 19 HD13 ILE 19 16.803 -19.039 -14.005 157 H PHE 20 H PHE 20 14.496 -20.650 -18.418 158 HA PHE 20 HA PHE 20 14.891 -22.533 -20.436 159 HB2 PHE 20 HB2 PHE 20 12.899 -22.045 -18.670 160 HB3 PHE 20 HB3 PHE 20 12.148 -21.464 -20.153 161 HD1 PHE 20 HD2 PHE 20 12.451 -23.119 -22.215 162 HD2 PHE 20 HD1 PHE 20 12.594 -24.243 -18.113 163 HE1 PHE 20 HE2 PHE 20 11.881 -25.431 -22.833 164 HE2 PHE 20 HE1 PHE 20 12.025 -26.558 -18.724 165 HZ PHE 20 HZ PHE 20 11.667 -27.154 -21.086 166 H ILE 21 H ILE 21 14.123 -19.160 -20.613 167 HA ILE 21 HA ILE 21 13.084 -19.143 -23.260 168 HB ILE 21 HB ILE 21 14.044 -17.072 -21.354 169 HG12 ILE 21 HG12 ILE 21 11.597 -17.164 -23.124 170 HG13 ILE 21 HG13 ILE 21 11.667 -17.911 -21.532 171 HG21 ILE 21 HG21 ILE 21 13.706 -15.349 -23.180 172 HG22 ILE 21 HG22 ILE 21 15.196 -16.287 -23.255 173 HG23 ILE 21 HG23 ILE 21 13.852 -16.680 -24.327 174 HD11 ILE 21 HD11 ILE 21 12.028 -14.983 -22.120 175 HD12 ILE 21 HD12 ILE 21 10.586 -15.741 -21.445 176 HD13 ILE 21 HD13 ILE 21 12.091 -15.733 -20.526 177 H PHE 22 H PHE 22 16.274 -18.242 -21.947 178 HA PHE 22 HA PHE 22 17.440 -17.894 -24.527 179 HB2 PHE 22 HB2 PHE 22 18.795 -18.278 -21.849 180 HB3 PHE 22 HB3 PHE 22 19.558 -17.673 -23.316 181 HD1 PHE 22 HD1 PHE 22 17.464 -15.836 -24.305 182 HD2 PHE 22 HD2 PHE 22 18.952 -16.492 -20.372 183 HE1 PHE 22 HE1 PHE 22 16.833 -13.539 -23.687 184 HE2 PHE 22 HE2 PHE 22 18.323 -14.197 -19.747 185 HZ PHE 22 HZ PHE 22 17.262 -12.718 -21.405 186 H ILE 23 H ILE 23 16.974 -20.584 -22.408 187 HA ILE 23 HA ILE 23 19.013 -22.253 -23.522 188 HB ILE 23 HB ILE 23 16.845 -22.573 -21.549 189 HG12 ILE 23 HG12 ILE 23 18.709 -23.999 -20.510 190 HG13 ILE 23 HG13 ILE 23 19.719 -23.436 -21.837 191 HG21 ILE 23 HG21 ILE 23 16.121 -24.342 -22.931 192 HG22 ILE 23 HG22 ILE 23 17.774 -24.851 -23.274 193 HG23 ILE 23 HG23 ILE 23 17.093 -25.090 -21.665 194 HD11 ILE 23 HD11 ILE 23 20.144 -22.060 -19.949 195 HD12 ILE 23 HD12 ILE 23 19.226 -21.102 -21.111 196 HD13 ILE 23 HD13 ILE 23 18.423 -21.777 -19.694 197 H VAL 24 H VAL 24 15.628 -21.654 -24.196 198 HA VAL 24 HA VAL 24 15.353 -23.879 -25.999 199 HB VAL 24 HB VAL 24 13.591 -21.519 -25.372 200 HG11 VAL 24 HG11 VAL 24 11.961 -23.125 -26.787 201 HG12 VAL 24 HG12 VAL 24 12.833 -21.760 -27.487 202 HG13 VAL 24 HG13 VAL 24 13.477 -23.394 -27.646 203 HG21 VAL 24 HG21 VAL 24 12.234 -23.041 -24.232 204 HG22 VAL 24 HG22 VAL 24 12.964 -24.434 -25.031 205 HG23 VAL 24 HG23 VAL 24 13.873 -23.539 -23.813 206 H LEU 25 H LEU 25 15.845 -20.390 -26.296 207 HA LEU 25 HA LEU 25 15.563 -20.137 -29.053 208 HB2 LEU 25 HB2 LEU 25 17.217 -18.647 -27.041 209 HB3 LEU 25 HB3 LEU 25 17.228 -18.211 -28.748 210 HG LEU 25 HG LEU 25 14.866 -18.127 -26.874 211 HD11 LEU 25 HD11 LEU 25 16.638 -16.056 -28.118 212 HD12 LEU 25 HD12 LEU 25 16.159 -16.243 -26.432 213 HD13 LEU 25 HD13 LEU 25 14.990 -15.673 -27.622 214 HD21 LEU 25 HD21 LEU 25 13.725 -18.575 -28.771 215 HD22 LEU 25 HD22 LEU 25 15.060 -18.095 -29.820 216 HD23 LEU 25 HD23 LEU 25 14.024 -16.867 -29.091 217 H LEU 26 H LEU 26 18.266 -21.279 -27.137 218 HA LEU 26 HA LEU 26 20.306 -21.167 -29.021 219 HB2 LEU 26 HB2 LEU 26 19.766 -22.625 -26.552 220 HB3 LEU 26 HB3 LEU 26 20.803 -23.508 -27.669 221 HG LEU 26 HG LEU 26 22.445 -21.772 -27.629 222 HD11 LEU 26 HD11 LEU 26 21.756 -19.668 -27.436 223 HD12 LEU 26 HD12 LEU 26 21.637 -19.949 -25.699 224 HD13 LEU 26 HD13 LEU 26 20.219 -20.163 -26.726 225 HD21 LEU 26 HD21 LEU 26 22.564 -23.337 -25.791 226 HD22 LEU 26 HD22 LEU 26 21.429 -22.367 -24.852 227 HD23 LEU 26 HD23 LEU 26 23.030 -21.729 -25.234 228 H ILE 27 H ILE 27 17.894 -23.706 -28.463 229 HA ILE 27 HA ILE 27 18.887 -25.456 -30.470 230 HB ILE 27 HB ILE 27 16.448 -25.328 -28.789 231 HG12 ILE 27 HG12 ILE 27 17.706 -27.901 -29.440 232 HG13 ILE 27 HG13 ILE 27 18.809 -26.727 -28.732 233 HG21 ILE 27 HG21 ILE 27 16.569 -26.723 -31.442 234 HG22 ILE 27 HG22 ILE 27 15.535 -27.300 -30.137 235 HG23 ILE 27 HG23 ILE 27 15.300 -25.682 -30.797 236 HD11 ILE 27 HD11 ILE 27 18.052 -27.674 -26.829 237 HD12 ILE 27 HD12 ILE 27 16.783 -26.466 -27.028 238 HD13 ILE 27 HD13 ILE 27 16.503 -28.130 -27.539 239 H HIS 28 H HIS 28 16.077 -23.264 -30.391 240 HA HIS 28 HA HIS 28 15.093 -23.669 -32.924 241 HB2 HIS 28 HB2 HIS 28 13.920 -22.257 -31.365 242 HB3 HIS 28 HB3 HIS 28 15.250 -21.103 -31.336 243 HD1 HIS 28 HD1 HIS 28 15.602 -19.687 -33.562 244 HD2 HIS 28 HD2 HIS 28 12.065 -21.856 -33.347 245 HE1 HIS 28 HE1 HIS 28 14.110 -18.718 -35.339 246 H PHE 29 H PHE 29 17.940 -21.894 -31.956 247 HA PHE 29 HA PHE 29 18.354 -20.913 -34.677 248 HB2 PHE 29 HB2 PHE 29 19.544 -20.277 -32.007 249 HB3 PHE 29 HB3 PHE 29 20.474 -19.926 -33.460 250 HD1 PHE 29 HD1 PHE 29 18.936 -18.745 -35.359 251 HD2 PHE 29 HD2 PHE 29 18.347 -18.532 -31.149 252 HE1 PHE 29 HE1 PHE 29 17.699 -16.637 -35.642 253 HE2 PHE 29 HE2 PHE 29 17.108 -16.424 -31.425 254 HZ PHE 29 HZ PHE 29 16.783 -15.474 -33.674 255 H GLU 30 H GLU 30 19.462 -23.345 -32.483 256 HA GLU 30 HA GLU 30 21.937 -23.897 -33.796 257 HB2 GLU 30 HB2 GLU 30 20.332 -25.122 -31.628 258 HB3 GLU 30 HB3 GLU 30 21.416 -26.200 -32.495 259 HG2 GLU 30 HG2 GLU 30 23.292 -25.182 -31.710 260 HG3 GLU 30 HG3 GLU 30 22.508 -23.612 -31.549 261 H GLY 31 H GLY 31 18.894 -24.204 -34.905 262 HA2 GLY 31 HA2 GLY 31 18.881 -25.221 -37.206 263 HA3 GLY 31 HA3 GLY 31 19.511 -26.663 -36.424 264 H TRP 32 H TRP 32 16.881 -24.418 -35.573 265 HA TRP 32 HA TRP 32 14.924 -26.531 -35.979 266 HB2 TRP 32 HB2 TRP 32 15.837 -25.613 -33.329 267 HB3 TRP 32 HB3 TRP 32 14.088 -25.657 -33.537 268 HD1 TRP 32 HD1 TRP 32 12.931 -28.028 -33.709 269 HE1 TRP 32 HE1 TRP 32 13.764 -30.421 -33.256 270 HE3 TRP 32 HE3 TRP 32 17.957 -27.115 -33.522 271 HZ2 TRP 32 HZ2 TRP 32 16.227 -31.746 -32.870 272 HZ3 TRP 32 HZ3 TRP 32 19.484 -29.000 -33.106 273 HH2 TRP 32 HH2 TRP 32 18.634 -31.266 -32.786 274 H ARG 33 H ARG 33 14.085 -25.184 -37.596 275 HA ARG 33 HA ARG 33 12.409 -23.026 -36.570 276 HB2 ARG 33 HB2 ARG 33 13.069 -21.649 -38.624 277 HB3 ARG 33 HB3 ARG 33 14.222 -21.719 -37.297 278 HG2 ARG 33 HG2 ARG 33 15.569 -23.315 -38.472 279 HG3 ARG 33 HG3 ARG 33 14.361 -23.454 -39.752 280 HD2 ARG 33 HD2 ARG 33 16.327 -22.011 -40.314 281 HD3 ARG 33 HD3 ARG 33 14.759 -21.221 -40.475 282 HE ARG 33 HE ARG 33 15.948 -20.787 -37.912 283 HH11 ARG 33 HH11 ARG 33 15.924 -19.727 -41.228 284 HH12 ARG 33 HH12 ARG 33 16.479 -18.128 -40.857 285 HH21 ARG 33 HH21 ARG 33 16.679 -18.685 -37.411 286 HH22 ARG 33 HH22 ARG 33 16.909 -17.537 -38.686 287 H ILE 34 H ILE 34 10.780 -24.658 -36.930 288 HA ILE 34 HA ILE 34 10.217 -25.984 -39.274 289 HB ILE 34 HB ILE 34 8.214 -24.783 -37.358 290 HG12 ILE 34 HG12 ILE 34 9.097 -27.652 -37.416 291 HG13 ILE 34 HG13 ILE 34 10.047 -26.451 -36.550 292 HG21 ILE 34 HG21 ILE 34 6.876 -26.831 -38.247 293 HG22 ILE 34 HG22 ILE 34 6.919 -25.338 -39.184 294 HG23 ILE 34 HG23 ILE 34 7.952 -26.693 -39.638 295 HD11 ILE 34 HD11 ILE 34 7.395 -27.589 -35.922 296 HD12 ILE 34 HD12 ILE 34 8.723 -27.134 -34.854 297 HD13 ILE 34 HD13 ILE 34 7.663 -25.893 -35.520 298 H1 MET 101 H MET 101 6.965 10.527 -12.441 299 HA MET 101 HA MET 101 6.436 8.896 -10.048 300 HB2 MET 101 HB2 MET 101 4.580 10.445 -11.850 301 HB3 MET 101 HB3 MET 101 4.000 9.246 -10.702 302 HG2 MET 101 HG2 MET 101 5.672 10.875 -9.208 303 HG3 MET 101 HG3 MET 101 4.807 11.983 -10.271 304 HE1 MET 101 HE1 MET 101 3.076 13.084 -7.851 305 HE2 MET 101 HE2 MET 101 3.410 11.897 -6.590 306 HE3 MET 101 HE3 MET 101 4.716 12.476 -7.625 307 H ASP 102 H ASP 102 7.804 8.082 -12.552 308 HA ASP 102 HA ASP 102 6.328 5.638 -12.967 309 HB2 ASP 102 HB2 ASP 102 6.695 7.651 -15.181 310 HB3 ASP 102 HB3 ASP 102 6.449 5.937 -15.506 311 H SER 103 H SER 103 7.836 4.133 -12.763 312 HA SER 103 HA SER 103 10.559 4.712 -13.706 313 HB2 SER 103 HB2 SER 103 9.471 2.931 -11.547 314 HB3 SER 103 HB3 SER 103 11.059 2.609 -12.243 315 HG SER 103 HG SER 103 11.538 4.863 -11.721 316 H ALA 104 H ALA 104 8.486 3.942 -15.521 317 HA ALA 104 HA ALA 104 8.639 1.169 -16.128 318 HB1 ALA 104 HB1 ALA 104 6.809 1.877 -17.197 319 HB2 ALA 104 HB2 ALA 104 7.389 3.541 -17.276 320 HB3 ALA 104 HB3 ALA 104 7.913 2.367 -18.483 321 HA PRO 105 HA PRO 105 11.695 2.506 -19.617 322 HB2 PRO 105 HB2 PRO 105 12.604 5.064 -19.578 323 HB3 PRO 105 HB3 PRO 105 11.137 4.579 -20.436 324 HG2 PRO 105 HG2 PRO 105 11.422 5.862 -17.746 325 HG3 PRO 105 HG3 PRO 105 10.267 6.224 -19.042 326 HD2 PRO 105 HD2 PRO 105 9.610 4.732 -16.880 327 HD3 PRO 105 HD3 PRO 105 8.892 4.461 -18.481 328 H PHE 106 H PHE 106 12.005 3.581 -16.346 329 HA PHE 106 HA PHE 106 14.892 3.630 -16.363 330 HB2 PHE 106 HB2 PHE 106 12.771 4.040 -14.289 331 HB3 PHE 106 HB3 PHE 106 14.427 3.727 -13.780 332 HD1 PHE 106 HD2 PHE 106 16.253 5.252 -14.733 333 HD2 PHE 106 HD1 PHE 106 12.102 6.183 -14.863 334 HE1 PHE 106 HE2 PHE 106 16.800 7.629 -15.054 335 HE2 PHE 106 HE1 PHE 106 12.642 8.562 -15.185 336 HZ PHE 106 HZ PHE 106 14.994 9.288 -15.280 337 H GLU 107 H GLU 107 12.332 1.462 -15.270 338 HA GLU 107 HA GLU 107 13.911 -0.383 -13.882 339 HB2 GLU 107 HB2 GLU 107 11.202 -0.226 -14.857 340 HB3 GLU 107 HB3 GLU 107 11.848 -1.840 -15.121 341 HG2 GLU 107 HG2 GLU 107 11.780 -0.376 -12.492 342 HG3 GLU 107 HG3 GLU 107 10.696 -1.675 -12.986 343 H LEU 108 H LEU 108 13.202 -0.055 -17.308 344 HA LEU 108 HA LEU 108 14.033 -2.487 -18.292 345 HB2 LEU 108 HB2 LEU 108 13.931 0.270 -19.327 346 HB3 LEU 108 HB3 LEU 108 15.005 -0.829 -20.190 347 HG LEU 108 HG LEU 108 12.840 -0.735 -21.271 348 HD11 LEU 108 HD11 LEU 108 14.199 -3.010 -20.602 349 HD12 LEU 108 HD12 LEU 108 12.868 -2.917 -21.754 350 HD13 LEU 108 HD13 LEU 108 12.556 -3.388 -20.083 351 HD21 LEU 108 HD21 LEU 108 11.808 -1.473 -18.546 352 HD22 LEU 108 HD22 LEU 108 10.869 -1.729 -20.017 353 HD23 LEU 108 HD23 LEU 108 11.359 -0.098 -19.556 354 H PHE 109 H PHE 109 15.992 0.242 -17.241 355 HA PHE 109 HA PHE 109 18.471 -0.428 -18.212 356 HB2 PHE 109 HB2 PHE 109 17.940 1.613 -16.886 357 HB3 PHE 109 HB3 PHE 109 17.919 0.623 -15.431 358 HD1 PHE 109 HD2 PHE 109 20.113 1.598 -18.269 359 HD2 PHE 109 HD1 PHE 109 19.866 0.302 -14.222 360 HE1 PHE 109 HE2 PHE 109 22.539 1.924 -18.020 361 HE2 PHE 109 HE1 PHE 109 22.291 0.627 -13.967 362 HZ PHE 109 HZ PHE 109 23.632 1.437 -15.867 363 H PHE 110 H PHE 110 16.977 -1.587 -15.201 364 HA PHE 110 HA PHE 110 19.138 -3.292 -14.503 365 HB2 PHE 110 HB2 PHE 110 17.661 -2.555 -12.765 366 HB3 PHE 110 HB3 PHE 110 16.256 -3.204 -13.604 367 HD1 PHE 110 HD1 PHE 110 15.841 -5.611 -13.654 368 HD2 PHE 110 HD2 PHE 110 19.094 -3.958 -11.463 369 HE1 PHE 110 HE1 PHE 110 16.076 -7.724 -12.416 370 HE2 PHE 110 HE2 PHE 110 19.335 -6.069 -10.223 371 HZ PHE 110 HZ PHE 110 17.826 -7.956 -10.699 372 H MET 111 H MET 111 16.365 -3.634 -16.555 373 HA MET 111 HA MET 111 16.320 -6.481 -16.627 374 HB2 MET 111 HB2 MET 111 15.036 -4.275 -18.146 375 HB3 MET 111 HB3 MET 111 15.124 -5.842 -18.938 376 HG2 MET 111 HG2 MET 111 13.019 -5.610 -17.797 377 HG3 MET 111 HG3 MET 111 13.988 -6.864 -17.025 378 HE1 MET 111 HE1 MET 111 11.680 -4.323 -14.586 379 HE2 MET 111 HE2 MET 111 11.614 -4.132 -16.338 380 HE3 MET 111 HE3 MET 111 11.478 -5.738 -15.620 381 H ILE 112 H ILE 112 17.437 -4.066 -19.006 382 HA ILE 112 HA ILE 112 18.519 -5.772 -20.878 383 HB ILE 112 HB ILE 112 19.518 -3.053 -20.029 384 HG12 ILE 112 HG12 ILE 112 18.313 -3.082 -22.602 385 HG13 ILE 112 HG13 ILE 112 17.238 -3.949 -21.510 386 HG21 ILE 112 HG21 ILE 112 20.472 -4.940 -22.100 387 HG22 ILE 112 HG22 ILE 112 20.351 -3.242 -22.558 388 HG23 ILE 112 HG23 ILE 112 21.353 -3.716 -21.186 389 HD11 ILE 112 HD11 ILE 112 16.516 -2.043 -20.662 390 HD12 ILE 112 HD12 ILE 112 18.160 -1.563 -20.241 391 HD13 ILE 112 HD13 ILE 112 17.510 -1.179 -21.834 392 H ASN 113 H ASN 113 20.328 -4.185 -18.239 393 HA ASN 113 HA ASN 113 22.765 -5.419 -18.605 394 HB2 ASN 113 HB2 ASN 113 21.373 -4.362 -16.164 395 HB3 ASN 113 HB3 ASN 113 22.943 -5.146 -16.017 396 HD21 ASN 113 HD21 ASN 113 24.666 -4.287 -17.440 397 HD22 ASN 113 HD22 ASN 113 24.709 -2.581 -17.711 398 H THR 114 H THR 114 20.212 -6.479 -16.349 399 HA THR 114 HA THR 114 21.411 -8.852 -15.534 400 HB THR 114 HB THR 114 18.451 -8.300 -15.825 401 HG1 THR 114 HG1 THR 114 18.730 -7.078 -14.129 402 HG21 THR 114 HG21 THR 114 19.009 -10.699 -15.557 403 HG22 THR 114 HG22 THR 114 18.132 -10.044 -14.174 404 HG23 THR 114 HG23 THR 114 19.873 -10.306 -14.072 405 H SER 115 H SER 115 19.690 -8.092 -18.463 406 HA SER 115 HA SER 115 19.156 -10.765 -19.272 407 HB2 SER 115 HB2 SER 115 18.192 -8.463 -20.136 408 HB3 SER 115 HB3 SER 115 19.532 -8.575 -21.276 409 HG SER 115 HG SER 115 17.808 -9.589 -22.216 410 H ILE 116 H ILE 116 21.499 -8.420 -20.596 411 HA ILE 116 HA ILE 116 22.934 -10.120 -22.206 412 HB ILE 116 HB ILE 116 24.039 -7.829 -20.577 413 HG12 ILE 116 HG12 ILE 116 23.308 -7.714 -23.484 414 HG13 ILE 116 HG13 ILE 116 22.061 -7.511 -22.258 415 HG21 ILE 116 HG21 ILE 116 25.966 -8.822 -21.290 416 HG22 ILE 116 HG22 ILE 116 25.200 -9.548 -22.702 417 HG23 ILE 116 HG23 ILE 116 25.606 -7.832 -22.704 418 HD11 ILE 116 HD11 ILE 116 24.535 -5.827 -22.563 419 HD12 ILE 116 HD12 ILE 116 22.893 -5.368 -23.013 420 HD13 ILE 116 HD13 ILE 116 23.302 -5.629 -21.318 421 H LEU 117 H LEU 117 23.037 -9.828 -18.735 422 HA LEU 117 HA LEU 117 25.446 -11.400 -18.464 423 HB2 LEU 117 HB2 LEU 117 23.950 -9.662 -16.825 424 HB3 LEU 117 HB3 LEU 117 23.931 -11.240 -16.040 425 HG LEU 117 HG LEU 117 26.426 -9.756 -16.864 426 HD11 LEU 117 HD11 LEU 117 25.815 -8.468 -15.105 427 HD12 LEU 117 HD12 LEU 117 26.538 -9.797 -14.199 428 HD13 LEU 117 HD13 LEU 117 24.788 -9.717 -14.401 429 HD21 LEU 117 HD21 LEU 117 26.027 -12.457 -16.318 430 HD22 LEU 117 HD22 LEU 117 26.698 -11.786 -14.831 431 HD23 LEU 117 HD23 LEU 117 27.565 -11.595 -16.356 432 H LEU 118 H LEU 118 22.064 -11.854 -17.414 433 HA LEU 118 HA LEU 118 22.228 -14.484 -16.611 434 HB2 LEU 118 HB2 LEU 118 20.009 -12.869 -17.803 435 HB3 LEU 118 HB3 LEU 118 19.768 -14.573 -17.423 436 HG LEU 118 HG LEU 118 20.269 -12.286 -15.542 437 HD11 LEU 118 HD11 LEU 118 18.025 -12.435 -15.606 438 HD12 LEU 118 HD12 LEU 118 18.285 -13.784 -14.501 439 HD13 LEU 118 HD13 LEU 118 18.044 -14.088 -16.221 440 HD21 LEU 118 HD21 LEU 118 20.105 -14.387 -13.882 441 HD22 LEU 118 HD22 LEU 118 21.635 -13.707 -14.437 442 HD23 LEU 118 HD23 LEU 118 20.967 -15.137 -15.226 443 H ILE 119 H ILE 119 21.783 -13.204 -19.868 444 HA ILE 119 HA ILE 119 21.207 -15.588 -21.200 445 HB ILE 119 HB ILE 119 22.696 -13.160 -22.202 446 HG12 ILE 119 HG12 ILE 119 19.882 -13.884 -22.921 447 HG13 ILE 119 HG13 ILE 119 20.198 -13.126 -21.364 448 HG21 ILE 119 HG21 ILE 119 23.227 -15.050 -23.606 449 HG22 ILE 119 HG22 ILE 119 21.520 -15.474 -23.733 450 HG23 ILE 119 HG23 ILE 119 22.114 -13.979 -24.457 451 HD11 ILE 119 HD11 ILE 119 21.593 -11.576 -23.195 452 HD12 ILE 119 HD12 ILE 119 20.064 -11.953 -23.988 453 HD13 ILE 119 HD13 ILE 119 20.068 -11.179 -22.404 454 H PHE 120 H PHE 120 24.373 -13.939 -21.201 455 HA PHE 120 HA PHE 120 25.818 -16.112 -22.202 456 HB2 PHE 120 HB2 PHE 120 26.558 -13.683 -22.053 457 HB3 PHE 120 HB3 PHE 120 26.953 -14.002 -20.367 458 HD1 PHE 120 HD1 PHE 120 27.689 -15.110 -23.830 459 HD2 PHE 120 HD2 PHE 120 29.006 -14.932 -19.787 460 HE1 PHE 120 HE1 PHE 120 29.894 -15.960 -24.515 461 HE2 PHE 120 HE2 PHE 120 31.214 -15.781 -20.465 462 HZ PHE 120 HZ PHE 120 31.660 -16.295 -22.832 463 H ILE 121 H ILE 121 24.697 -15.407 -19.007 464 HA ILE 121 HA ILE 121 26.504 -17.093 -17.591 465 HB ILE 121 HB ILE 121 23.975 -15.677 -16.936 466 HG12 ILE 121 HG12 ILE 121 26.555 -15.963 -15.390 467 HG13 ILE 121 HG13 ILE 121 26.303 -14.745 -16.636 468 HG21 ILE 121 HG21 ILE 121 23.993 -16.817 -14.678 469 HG22 ILE 121 HG22 ILE 121 23.385 -17.774 -16.027 470 HG23 ILE 121 HG23 ILE 121 25.015 -18.052 -15.414 471 HD11 ILE 121 HD11 ILE 121 24.707 -15.024 -14.100 472 HD12 ILE 121 HD12 ILE 121 25.967 -13.829 -14.412 473 HD13 ILE 121 HD13 ILE 121 24.470 -13.797 -15.344 474 H PHE 122 H PHE 122 23.131 -17.513 -18.654 475 HA PHE 122 HA PHE 122 23.036 -20.249 -17.811 476 HB2 PHE 122 HB2 PHE 122 21.173 -18.727 -19.646 477 HB3 PHE 122 HB3 PHE 122 20.840 -20.290 -18.905 478 HD1 PHE 122 HD1 PHE 122 21.863 -19.823 -16.169 479 HD2 PHE 122 HD2 PHE 122 19.551 -17.335 -18.734 480 HE1 PHE 122 HE1 PHE 122 20.910 -18.690 -14.204 481 HE2 PHE 122 HE2 PHE 122 18.594 -16.198 -16.774 482 HZ PHE 122 HZ PHE 122 19.274 -16.874 -14.505 483 H ILE 123 H ILE 123 23.972 -18.576 -20.687 484 HA ILE 123 HA ILE 123 23.728 -20.823 -22.453 485 HB ILE 123 HB ILE 123 24.725 -18.051 -22.664 486 HG12 ILE 123 HG12 ILE 123 23.596 -18.429 -24.969 487 HG13 ILE 123 HG13 ILE 123 23.024 -19.940 -24.271 488 HG21 ILE 123 HG21 ILE 123 26.721 -19.056 -23.418 489 HG22 ILE 123 HG22 ILE 123 25.847 -20.295 -24.317 490 HG23 ILE 123 HG23 ILE 123 25.826 -18.622 -24.874 491 HD11 ILE 123 HD11 ILE 123 21.326 -18.268 -24.049 492 HD12 ILE 123 HD12 ILE 123 21.971 -18.642 -22.450 493 HD13 ILE 123 HD13 ILE 123 22.458 -17.160 -23.274 494 H VAL 124 H VAL 124 26.224 -19.490 -20.401 495 HA VAL 124 HA VAL 124 28.341 -21.081 -21.526 496 HB VAL 124 HB VAL 124 28.141 -19.324 -19.094 497 HG11 VAL 124 HG11 VAL 124 30.762 -19.851 -19.157 498 HG12 VAL 124 HG12 VAL 124 29.626 -20.756 -18.154 499 HG13 VAL 124 HG13 VAL 124 30.147 -21.409 -19.708 500 HG21 VAL 124 HG21 VAL 124 29.563 -17.872 -20.253 501 HG22 VAL 124 HG22 VAL 124 30.073 -19.126 -21.383 502 HG23 VAL 124 HG23 VAL 124 28.446 -18.455 -21.487 503 H LEU 125 H LEU 125 26.235 -21.253 -18.697 504 HA LEU 125 HA LEU 125 27.468 -23.375 -17.369 505 HB2 LEU 125 HB2 LEU 125 24.627 -22.418 -17.482 506 HB3 LEU 125 HB3 LEU 125 25.089 -23.816 -16.514 507 HG LEU 125 HG LEU 125 26.049 -20.978 -16.163 508 HD11 LEU 125 HD11 LEU 125 24.147 -22.747 -14.666 509 HD12 LEU 125 HD12 LEU 125 23.899 -21.107 -15.265 510 HD13 LEU 125 HD13 LEU 125 24.960 -21.390 -13.885 511 HD21 LEU 125 HD21 LEU 125 27.903 -22.022 -15.404 512 HD22 LEU 125 HD22 LEU 125 27.073 -23.559 -15.160 513 HD23 LEU 125 HD23 LEU 125 26.907 -22.267 -13.969 514 H LEU 126 H LEU 126 25.221 -23.345 -20.065 515 HA LEU 126 HA LEU 126 24.440 -26.006 -20.109 516 HB2 LEU 126 HB2 LEU 126 24.565 -23.796 -22.010 517 HB3 LEU 126 HB3 LEU 126 24.718 -25.378 -22.771 518 HG LEU 126 HG LEU 126 22.576 -26.053 -21.988 519 HD11 LEU 126 HD11 LEU 126 21.980 -25.379 -19.949 520 HD12 LEU 126 HD12 LEU 126 21.393 -23.910 -20.728 521 HD13 LEU 126 HD13 LEU 126 23.012 -23.950 -20.028 522 HD21 LEU 126 HD21 LEU 126 22.529 -24.665 -23.970 523 HD22 LEU 126 HD22 LEU 126 22.470 -23.206 -22.980 524 HD23 LEU 126 HD23 LEU 126 21.113 -24.333 -22.972 525 H ILE 127 H ILE 127 27.322 -24.496 -21.518 526 HA ILE 127 HA ILE 127 28.327 -26.883 -22.686 527 HB ILE 127 HB ILE 127 29.384 -24.154 -22.201 528 HG12 ILE 127 HG12 ILE 127 30.054 -25.618 -24.657 529 HG13 ILE 127 HG13 ILE 127 28.325 -25.510 -24.344 530 HG21 ILE 127 HG21 ILE 127 31.119 -26.583 -22.505 531 HG22 ILE 127 HG22 ILE 127 31.649 -24.990 -23.043 532 HG23 ILE 127 HG23 ILE 127 31.258 -25.262 -21.345 533 HD11 ILE 127 HD11 ILE 127 28.586 -23.599 -25.517 534 HD12 ILE 127 HD12 ILE 127 28.973 -22.968 -23.916 535 HD13 ILE 127 HD13 ILE 127 30.269 -23.397 -25.032 536 H HIS 128 H HIS 128 29.264 -25.094 -19.748 537 HA HIS 128 HA HIS 128 31.257 -26.735 -18.811 538 HB2 HIS 128 HB2 HIS 128 30.741 -24.654 -17.703 539 HB3 HIS 128 HB3 HIS 128 29.147 -25.242 -17.243 540 HD1 HIS 128 HD1 HIS 128 29.102 -27.140 -15.385 541 HD2 HIS 128 HD2 HIS 128 32.772 -25.281 -15.964 542 HE1 HIS 128 HE1 HIS 128 30.480 -27.728 -13.365 543 H PHE 129 H PHE 129 27.803 -27.263 -18.756 544 HA PHE 129 HA PHE 129 28.114 -29.673 -17.132 545 HB2 PHE 129 HB2 PHE 129 25.784 -28.010 -18.006 546 HB3 PHE 129 HB3 PHE 129 25.515 -29.690 -17.552 547 HD1 PHE 129 HD1 PHE 129 26.831 -30.329 -15.272 548 HD2 PHE 129 HD2 PHE 129 25.432 -26.461 -16.366 549 HE1 PHE 129 HE1 PHE 129 26.781 -29.680 -12.899 550 HE2 PHE 129 HE2 PHE 129 25.381 -25.805 -13.995 551 HZ PHE 129 HZ PHE 129 26.056 -27.415 -12.258 552 H GLU 130 H GLU 130 27.628 -28.666 -20.406 553 HA GLU 130 HA GLU 130 26.610 -31.145 -21.389 554 HB2 GLU 130 HB2 GLU 130 27.555 -28.593 -22.560 555 HB3 GLU 130 HB3 GLU 130 27.659 -30.008 -23.597 556 HG2 GLU 130 HG2 GLU 130 25.403 -30.239 -23.752 557 HG3 GLU 130 HG3 GLU 130 25.109 -29.535 -22.163 558 H GLY 131 H GLY 131 29.505 -30.484 -20.059 559 HA2 GLY 131 HA2 GLY 131 30.994 -32.509 -20.101 560 HA3 GLY 131 HA3 GLY 131 30.945 -32.342 -21.850 561 H TRP 132 H TRP 132 31.408 -29.996 -19.210 562 HA TRP 132 HA TRP 132 34.133 -29.506 -20.099 563 HB2 TRP 132 HB2 TRP 132 31.878 -27.664 -20.596 564 HB3 TRP 132 HB3 TRP 132 33.321 -26.922 -19.910 565 HD1 TRP 132 HD1 TRP 132 35.457 -26.732 -21.457 566 HE1 TRP 132 HE1 TRP 132 35.826 -27.065 -23.982 567 HE3 TRP 132 HE3 TRP 132 31.083 -29.115 -22.608 568 HZ2 TRP 132 HZ2 TRP 132 34.445 -28.190 -26.172 569 HZ3 TRP 132 HZ3 TRP 132 30.685 -29.786 -24.942 570 HH2 TRP 132 HH2 TRP 132 32.332 -29.331 -26.685 571 H ARG 133 H ARG 133 34.709 -30.291 -18.046 572 HA ARG 133 HA ARG 133 34.448 -28.299 -15.928 573 HB2 ARG 133 HB2 ARG 133 34.048 -30.214 -14.282 574 HB3 ARG 133 HB3 ARG 133 32.686 -29.715 -15.276 575 HG2 ARG 133 HG2 ARG 133 32.984 -31.600 -16.731 576 HG3 ARG 133 HG3 ARG 133 34.468 -32.059 -15.894 577 HD2 ARG 133 HD2 ARG 133 32.460 -33.399 -15.255 578 HD3 ARG 133 HD3 ARG 133 33.265 -32.599 -13.906 579 HE ARG 133 HE ARG 133 31.136 -31.029 -14.979 580 HH11 ARG 133 HH11 ARG 133 31.875 -33.697 -12.868 581 HH12 ARG 133 HH12 ARG 133 30.449 -33.500 -11.905 582 HH21 ARG 133 HH21 ARG 133 29.255 -30.759 -13.718 583 HH22 ARG 133 HH22 ARG 133 28.958 -31.829 -12.389 584 H ILE 134 H ILE 134 36.679 -27.981 -16.637 585 HA ILE 134 HA ILE 134 38.698 -29.863 -16.608 586 HB ILE 134 HB ILE 134 38.901 -26.984 -15.718 587 HG12 ILE 134 HG12 ILE 134 39.627 -28.058 -18.429 588 HG13 ILE 134 HG13 ILE 134 37.970 -27.589 -18.065 589 HG21 ILE 134 HG21 ILE 134 41.295 -27.351 -16.619 590 HG22 ILE 134 HG22 ILE 134 40.890 -27.945 -15.009 591 HG23 ILE 134 HG23 ILE 134 40.951 -29.063 -16.371 592 HD11 ILE 134 HD11 ILE 134 40.369 -25.927 -18.467 593 HD12 ILE 134 HD12 ILE 134 38.684 -25.621 -18.890 594 HD13 ILE 134 HD13 ILE 134 39.232 -25.390 -17.230 Start of MODEL 7 1 H1 MET 1 H MET 1 1.480 2.648 -2.056 2 HA MET 1 HA MET 1 2.169 3.530 -4.722 3 HB2 MET 1 HB2 MET 1 2.251 4.739 -1.989 4 HB3 MET 1 HB3 MET 1 3.227 5.455 -3.265 5 HG2 MET 1 HG2 MET 1 1.215 6.655 -3.249 6 HG3 MET 1 HG3 MET 1 1.117 5.577 -4.640 7 HE1 MET 1 HE1 MET 1 -1.742 6.080 -1.305 8 HE2 MET 1 HE2 MET 1 -0.189 5.570 -0.643 9 HE3 MET 1 HE3 MET 1 -0.279 6.983 -1.696 10 H ASP 2 H ASP 2 3.500 1.158 -3.518 11 HA ASP 2 HA ASP 2 6.201 1.889 -4.248 12 HB2 ASP 2 HB2 ASP 2 5.546 0.873 -1.477 13 HB3 ASP 2 HB3 ASP 2 7.170 0.893 -2.159 14 H SER 3 H SER 3 6.784 0.363 -5.629 15 HA SER 3 HA SER 3 5.769 -2.370 -5.231 16 HB2 SER 3 HB2 SER 3 6.561 -0.845 -7.705 17 HB3 SER 3 HB3 SER 3 6.455 -2.606 -7.708 18 HG SER 3 HG SER 3 4.436 -0.693 -7.484 19 H ALA 4 H ALA 4 7.990 -1.454 -3.752 20 HA ALA 4 HA ALA 4 10.451 -2.207 -4.962 21 HB1 ALA 4 HB1 ALA 4 9.551 -1.273 -2.356 22 HB2 ALA 4 HB2 ALA 4 10.863 -2.447 -2.253 23 HB3 ALA 4 HB3 ALA 4 11.068 -0.977 -3.205 24 HA PRO 5 HA PRO 5 9.994 -6.286 -2.421 25 HB2 PRO 5 HB2 PRO 5 7.611 -6.750 -1.206 26 HB3 PRO 5 HB3 PRO 5 8.938 -5.884 -0.421 27 HG2 PRO 5 HG2 PRO 5 6.502 -4.792 -1.777 28 HG3 PRO 5 HG3 PRO 5 7.255 -4.287 -0.253 29 HD2 PRO 5 HD2 PRO 5 7.625 -2.945 -2.576 30 HD3 PRO 5 HD3 PRO 5 8.877 -3.044 -1.320 31 H PHE 6 H PHE 6 7.225 -5.037 -4.164 32 HA PHE 6 HA PHE 6 6.261 -7.597 -5.014 33 HB2 PHE 6 HB2 PHE 6 5.613 -4.751 -5.669 34 HB3 PHE 6 HB3 PHE 6 5.042 -6.024 -6.742 35 HD1 PHE 6 HD2 PHE 6 3.801 -8.004 -5.565 36 HD2 PHE 6 HD1 PHE 6 4.316 -4.132 -3.875 37 HE1 PHE 6 HE2 PHE 6 1.888 -8.406 -4.071 38 HE2 PHE 6 HE1 PHE 6 2.404 -4.528 -2.377 39 HZ PHE 6 HZ PHE 6 1.187 -6.667 -2.475 40 H GLU 7 H GLU 7 8.431 -5.165 -6.303 41 HA GLU 7 HA GLU 7 8.585 -6.028 -8.953 42 HB2 GLU 7 HB2 GLU 7 10.081 -4.277 -7.204 43 HB3 GLU 7 HB3 GLU 7 11.163 -5.176 -8.258 44 HG2 GLU 7 HG2 GLU 7 10.213 -4.285 -10.193 45 HG3 GLU 7 HG3 GLU 7 8.769 -3.742 -9.341 46 H LEU 8 H LEU 8 10.150 -7.227 -6.051 47 HA LEU 8 HA LEU 8 12.161 -8.792 -7.099 48 HB2 LEU 8 HB2 LEU 8 10.966 -8.457 -4.626 49 HB3 LEU 8 HB3 LEU 8 10.715 -10.164 -4.986 50 HG LEU 8 HG LEU 8 13.117 -10.483 -5.233 51 HD11 LEU 8 HD11 LEU 8 13.108 -7.613 -5.393 52 HD12 LEU 8 HD12 LEU 8 14.394 -8.755 -5.781 53 HD13 LEU 8 HD13 LEU 8 14.211 -8.160 -4.131 54 HD21 LEU 8 HD21 LEU 8 12.273 -10.861 -3.046 55 HD22 LEU 8 HD22 LEU 8 12.219 -9.133 -2.695 56 HD23 LEU 8 HD23 LEU 8 13.773 -9.951 -2.866 57 H PHE 9 H PHE 9 8.712 -9.479 -6.899 58 HA PHE 9 HA PHE 9 8.645 -12.159 -7.508 59 HB2 PHE 9 HB2 PHE 9 6.799 -9.906 -8.269 60 HB3 PHE 9 HB3 PHE 9 6.456 -11.570 -8.727 61 HD1 PHE 9 HD1 PHE 9 7.030 -13.190 -6.509 62 HD2 PHE 9 HD2 PHE 9 5.491 -9.222 -6.524 63 HE1 PHE 9 HE1 PHE 9 6.002 -13.584 -4.309 64 HE2 PHE 9 HE2 PHE 9 4.462 -9.609 -4.323 65 HZ PHE 9 HZ PHE 9 4.717 -11.792 -3.212 66 H PHE 10 H PHE 10 8.938 -9.428 -9.744 67 HA PHE 10 HA PHE 10 8.981 -11.080 -12.081 68 HB2 PHE 10 HB2 PHE 10 8.200 -8.829 -12.330 69 HB3 PHE 10 HB3 PHE 10 9.673 -8.177 -11.619 70 HD1 PHE 10 HD1 PHE 10 11.726 -8.057 -12.898 71 HD2 PHE 10 HD2 PHE 10 8.146 -9.591 -14.616 72 HE1 PHE 10 HE1 PHE 10 12.717 -7.848 -15.141 73 HE2 PHE 10 HE2 PHE 10 9.132 -9.386 -16.861 74 HZ PHE 10 HZ PHE 10 11.420 -8.514 -17.126 75 H MET 11 H MET 11 11.344 -9.895 -9.838 76 HA MET 11 HA MET 11 13.631 -10.223 -11.497 77 HB2 MET 11 HB2 MET 11 13.130 -9.761 -8.604 78 HB3 MET 11 HB3 MET 11 14.696 -10.423 -9.052 79 HG2 MET 11 HG2 MET 11 15.259 -8.539 -10.318 80 HG3 MET 11 HG3 MET 11 13.592 -7.970 -10.368 81 HE1 MET 11 HE1 MET 11 13.126 -6.144 -9.604 82 HE2 MET 11 HE2 MET 11 13.079 -5.688 -7.901 83 HE3 MET 11 HE3 MET 11 14.412 -5.147 -8.922 84 H ILE 12 H ILE 12 11.907 -12.311 -9.247 85 HA ILE 12 HA ILE 12 13.853 -14.437 -9.490 86 HB ILE 12 HB ILE 12 11.157 -14.341 -8.138 87 HG12 ILE 12 HG12 ILE 12 13.239 -14.844 -6.315 88 HG13 ILE 12 HG13 ILE 12 13.831 -13.565 -7.370 89 HG21 ILE 12 HG21 ILE 12 11.238 -16.579 -8.409 90 HG22 ILE 12 HG22 ILE 12 12.975 -16.586 -8.710 91 HG23 ILE 12 HG23 ILE 12 12.367 -16.491 -7.057 92 HD11 ILE 12 HD11 ILE 12 12.588 -12.069 -6.325 93 HD12 ILE 12 HD12 ILE 12 11.129 -13.023 -6.591 94 HD13 ILE 12 HD13 ILE 12 12.130 -13.321 -5.170 95 H ASN 13 H ASN 13 10.535 -13.808 -10.572 96 HA ASN 13 HA ASN 13 10.076 -16.265 -11.833 97 HB2 ASN 13 HB2 ASN 13 8.418 -14.363 -11.323 98 HB3 ASN 13 HB3 ASN 13 8.958 -13.657 -12.843 99 HD21 ASN 13 HD21 ASN 13 8.179 -16.944 -11.748 100 HD22 ASN 13 HD22 ASN 13 7.071 -17.289 -13.027 101 H THR 14 H THR 14 11.247 -13.194 -13.200 102 HA THR 14 HA THR 14 11.555 -13.979 -15.834 103 HB THR 14 HB THR 14 11.877 -11.650 -14.900 104 HG1 THR 14 HG1 THR 14 12.424 -11.716 -16.983 105 HG21 THR 14 HG21 THR 14 13.657 -12.593 -13.232 106 HG22 THR 14 HG22 THR 14 13.863 -10.983 -13.921 107 HG23 THR 14 HG23 THR 14 14.767 -12.347 -14.579 108 H SER 15 H SER 15 13.508 -14.747 -13.059 109 HA SER 15 HA SER 15 15.820 -15.605 -14.479 110 HB2 SER 15 HB2 SER 15 15.457 -15.021 -11.923 111 HB3 SER 15 HB3 SER 15 15.133 -16.750 -11.804 112 HG SER 15 HG SER 15 17.174 -17.164 -12.614 113 H ILE 16 H ILE 16 13.429 -17.540 -12.668 114 HA ILE 16 HA ILE 16 14.183 -20.029 -13.605 115 HB ILE 16 HB ILE 16 11.384 -19.134 -12.904 116 HG12 ILE 16 HG12 ILE 16 13.340 -20.569 -11.115 117 HG13 ILE 16 HG13 ILE 16 13.274 -18.812 -11.192 118 HG21 ILE 16 HG21 ILE 16 11.130 -21.582 -12.310 119 HG22 ILE 16 HG22 ILE 16 11.201 -21.200 -14.030 120 HG23 ILE 16 HG23 ILE 16 12.619 -21.858 -13.213 121 HD11 ILE 16 HD11 ILE 16 11.865 -19.119 -9.461 122 HD12 ILE 16 HD12 ILE 16 10.691 -19.313 -10.763 123 HD13 ILE 16 HD13 ILE 16 11.390 -20.734 -9.987 124 H LEU 17 H LEU 17 12.346 -17.546 -15.190 125 HA LEU 17 HA LEU 17 11.351 -19.291 -17.267 126 HB2 LEU 17 HB2 LEU 17 10.712 -16.736 -16.293 127 HB3 LEU 17 HB3 LEU 17 11.253 -16.504 -17.954 128 HG LEU 17 HG LEU 17 9.102 -18.469 -17.193 129 HD11 LEU 17 HD11 LEU 17 8.149 -16.453 -16.525 130 HD12 LEU 17 HD12 LEU 17 7.596 -16.642 -18.188 131 HD13 LEU 17 HD13 LEU 17 8.926 -15.544 -17.821 132 HD21 LEU 17 HD21 LEU 17 9.237 -17.176 -19.841 133 HD22 LEU 17 HD22 LEU 17 8.833 -18.836 -19.405 134 HD23 LEU 17 HD23 LEU 17 10.521 -18.327 -19.471 135 H LEU 18 H LEU 18 13.627 -16.548 -17.143 136 HA LEU 18 HA LEU 18 14.521 -16.615 -19.752 137 HB2 LEU 18 HB2 LEU 18 15.767 -15.798 -17.170 138 HB3 LEU 18 HB3 LEU 18 16.761 -15.840 -18.624 139 HG LEU 18 HG LEU 18 14.353 -14.114 -18.088 140 HD11 LEU 18 HD11 LEU 18 16.118 -12.361 -18.739 141 HD12 LEU 18 HD12 LEU 18 17.291 -13.639 -18.423 142 HD13 LEU 18 HD13 LEU 18 16.213 -13.094 -17.138 143 HD21 LEU 18 HD21 LEU 18 13.925 -14.237 -20.274 144 HD22 LEU 18 HD22 LEU 18 15.441 -15.074 -20.612 145 HD23 LEU 18 HD23 LEU 18 15.411 -13.314 -20.497 146 H ILE 19 H ILE 19 15.763 -18.434 -16.968 147 HA ILE 19 HA ILE 19 17.926 -19.688 -18.121 148 HB ILE 19 HB ILE 19 15.978 -20.911 -16.163 149 HG12 ILE 19 HG12 ILE 19 18.609 -19.795 -15.338 150 HG13 ILE 19 HG13 ILE 19 17.341 -18.644 -15.745 151 HG21 ILE 19 HG21 ILE 19 18.779 -21.679 -16.953 152 HG22 ILE 19 HG22 ILE 19 17.983 -22.266 -15.493 153 HG23 ILE 19 HG23 ILE 19 17.313 -22.652 -17.078 154 HD11 ILE 19 HD11 ILE 19 17.687 -20.249 -13.375 155 HD12 ILE 19 HD12 ILE 19 16.638 -18.860 -13.657 156 HD13 ILE 19 HD13 ILE 19 16.092 -20.479 -14.091 157 H PHE 20 H PHE 20 14.714 -21.211 -17.793 158 HA PHE 20 HA PHE 20 15.237 -23.333 -19.541 159 HB2 PHE 20 HB2 PHE 20 13.343 -23.171 -17.878 160 HB3 PHE 20 HB3 PHE 20 12.520 -22.120 -19.025 161 HD1 PHE 20 HD1 PHE 20 14.084 -25.488 -18.784 162 HD2 PHE 20 HD2 PHE 20 11.115 -23.042 -20.606 163 HE1 PHE 20 HE1 PHE 20 13.158 -27.465 -19.920 164 HE2 PHE 20 HE2 PHE 20 10.184 -25.015 -21.745 165 HZ PHE 20 HZ PHE 20 11.205 -27.230 -21.402 166 H ILE 21 H ILE 21 14.073 -20.083 -20.126 167 HA ILE 21 HA ILE 21 13.113 -20.409 -22.738 168 HB ILE 21 HB ILE 21 14.066 -18.100 -21.131 169 HG12 ILE 21 HG12 ILE 21 11.622 -18.394 -22.879 170 HG13 ILE 21 HG13 ILE 21 11.691 -19.008 -21.230 171 HG21 ILE 21 HG21 ILE 21 13.859 -18.085 -24.131 172 HG22 ILE 21 HG22 ILE 21 13.713 -16.623 -23.156 173 HG23 ILE 21 HG23 ILE 21 15.208 -17.558 -23.125 174 HD11 ILE 21 HD11 ILE 21 12.036 -16.136 -22.058 175 HD12 ILE 21 HD12 ILE 21 10.597 -16.845 -21.324 176 HD13 ILE 21 HD13 ILE 21 12.100 -16.751 -20.407 177 H PHE 22 H PHE 22 16.330 -19.372 -21.612 178 HA PHE 22 HA PHE 22 17.436 -19.299 -24.241 179 HB2 PHE 22 HB2 PHE 22 18.773 -19.342 -21.528 180 HB3 PHE 22 HB3 PHE 22 19.611 -19.060 -23.051 181 HD1 PHE 22 HD2 PHE 22 18.326 -17.166 -24.531 182 HD2 PHE 22 HD1 PHE 22 18.347 -17.476 -20.286 183 HE1 PHE 22 HE2 PHE 22 17.832 -14.763 -24.357 184 HE2 PHE 22 HE1 PHE 22 17.851 -15.073 -20.105 185 HZ PHE 22 HZ PHE 22 17.594 -13.712 -22.142 186 H ILE 23 H ILE 23 17.779 -21.554 -21.510 187 HA ILE 23 HA ILE 23 19.531 -23.371 -22.591 188 HB ILE 23 HB ILE 23 17.340 -23.573 -20.604 189 HG12 ILE 23 HG12 ILE 23 19.284 -24.633 -19.325 190 HG13 ILE 23 HG13 ILE 23 20.291 -24.190 -20.699 191 HG21 ILE 23 HG21 ILE 23 18.520 -25.938 -22.025 192 HG22 ILE 23 HG22 ILE 23 17.896 -26.057 -20.381 193 HG23 ILE 23 HG23 ILE 23 16.825 -25.580 -21.698 194 HD11 ILE 23 HD11 ILE 23 20.548 -22.499 -19.073 195 HD12 ILE 23 HD12 ILE 23 19.535 -21.823 -20.349 196 HD13 ILE 23 HD13 ILE 23 18.806 -22.364 -18.837 197 H VAL 24 H VAL 24 16.081 -23.044 -23.203 198 HA VAL 24 HA VAL 24 15.954 -25.431 -24.819 199 HB VAL 24 HB VAL 24 13.959 -23.220 -24.330 200 HG11 VAL 24 HG11 VAL 24 13.072 -23.869 -26.291 201 HG12 VAL 24 HG12 VAL 24 13.979 -25.383 -26.318 202 HG13 VAL 24 HG13 VAL 24 12.500 -25.256 -25.365 203 HG21 VAL 24 HG21 VAL 24 13.746 -26.100 -23.513 204 HG22 VAL 24 HG22 VAL 24 14.579 -24.913 -22.510 205 HG23 VAL 24 HG23 VAL 24 12.868 -24.705 -22.885 206 H LEU 25 H LEU 25 16.417 -22.010 -25.316 207 HA LEU 25 HA LEU 25 15.878 -21.996 -28.111 208 HB2 LEU 25 HB2 LEU 25 17.138 -20.128 -26.168 209 HB3 LEU 25 HB3 LEU 25 17.407 -19.857 -27.888 210 HG LEU 25 HG LEU 25 14.766 -19.847 -26.433 211 HD11 LEU 25 HD11 LEU 25 15.966 -17.811 -26.099 212 HD12 LEU 25 HD12 LEU 25 14.710 -17.508 -27.298 213 HD13 LEU 25 HD13 LEU 25 16.385 -17.712 -27.809 214 HD21 LEU 25 HD21 LEU 25 15.437 -20.024 -29.324 215 HD22 LEU 25 HD22 LEU 25 14.084 -19.002 -28.840 216 HD23 LEU 25 HD23 LEU 25 14.084 -20.718 -28.431 217 H LEU 26 H LEU 26 18.827 -22.286 -26.176 218 HA LEU 26 HA LEU 26 20.744 -22.154 -28.153 219 HB2 LEU 26 HB2 LEU 26 20.546 -23.541 -25.536 220 HB3 LEU 26 HB3 LEU 26 21.867 -24.002 -26.608 221 HG LEU 26 HG LEU 26 22.706 -22.380 -25.086 222 HD11 LEU 26 HD11 LEU 26 23.728 -21.000 -26.576 223 HD12 LEU 26 HD12 LEU 26 22.229 -20.614 -27.422 224 HD13 LEU 26 HD13 LEU 26 23.029 -22.160 -27.706 225 HD21 LEU 26 HD21 LEU 26 21.694 -20.132 -24.891 226 HD22 LEU 26 HD22 LEU 26 20.637 -21.417 -24.306 227 HD23 LEU 26 HD23 LEU 26 20.344 -20.683 -25.883 228 H ILE 27 H ILE 27 18.916 -25.005 -27.080 229 HA ILE 27 HA ILE 27 20.141 -26.811 -28.885 230 HB ILE 27 HB ILE 27 17.767 -26.877 -27.111 231 HG12 ILE 27 HG12 ILE 27 19.190 -29.325 -27.218 232 HG13 ILE 27 HG13 ILE 27 20.386 -28.035 -27.284 233 HG21 ILE 27 HG21 ILE 27 18.085 -28.652 -29.516 234 HG22 ILE 27 HG22 ILE 27 17.144 -29.124 -28.102 235 HG23 ILE 27 HG23 ILE 27 16.679 -27.701 -29.035 236 HD11 ILE 27 HD11 ILE 27 18.358 -27.552 -25.273 237 HD12 ILE 27 HD12 ILE 27 19.221 -29.069 -25.020 238 HD13 ILE 27 HD13 ILE 27 20.116 -27.554 -25.136 239 H HIS 28 H HIS 28 16.997 -25.139 -28.978 240 HA HIS 28 HA HIS 28 16.011 -26.095 -31.355 241 HB2 HIS 28 HB2 HIS 28 14.667 -24.651 -29.983 242 HB3 HIS 28 HB3 HIS 28 15.800 -23.318 -30.182 243 HD1 HIS 28 HD1 HIS 28 13.115 -25.200 -32.005 244 HD2 HIS 28 HD2 HIS 28 15.501 -21.838 -32.515 245 HE1 HIS 28 HE1 HIS 28 12.153 -23.987 -33.987 246 H PHE 29 H PHE 29 18.537 -23.728 -30.847 247 HA PHE 29 HA PHE 29 18.718 -23.213 -33.721 248 HB2 PHE 29 HB2 PHE 29 19.873 -21.882 -31.289 249 HB3 PHE 29 HB3 PHE 29 20.566 -21.590 -32.881 250 HD1 PHE 29 HD1 PHE 29 18.616 -21.132 -34.725 251 HD2 PHE 29 HD2 PHE 29 18.401 -20.298 -30.557 252 HE1 PHE 29 HE1 PHE 29 16.902 -19.421 -35.159 253 HE2 PHE 29 HE2 PHE 29 16.686 -18.587 -30.984 254 HZ PHE 29 HZ PHE 29 15.934 -18.147 -33.288 255 H GLU 30 H GLU 30 20.230 -25.000 -31.204 256 HA GLU 30 HA GLU 30 22.801 -25.274 -32.400 257 HB2 GLU 30 HB2 GLU 30 21.379 -26.375 -30.080 258 HB3 GLU 30 HB3 GLU 30 22.518 -27.495 -30.814 259 HG2 GLU 30 HG2 GLU 30 23.385 -24.707 -30.222 260 HG3 GLU 30 HG3 GLU 30 23.278 -25.884 -28.914 261 H GLY 31 H GLY 31 19.876 -26.309 -33.456 262 HA2 GLY 31 HA2 GLY 31 20.088 -27.562 -35.619 263 HA3 GLY 31 HA3 GLY 31 21.020 -28.734 -34.699 264 H TRP 32 H TRP 32 17.958 -27.043 -34.035 265 HA TRP 32 HA TRP 32 16.644 -29.672 -33.881 266 HB2 TRP 32 HB2 TRP 32 17.121 -27.873 -31.723 267 HB3 TRP 32 HB3 TRP 32 15.389 -27.887 -32.044 268 HD1 TRP 32 HD1 TRP 32 14.068 -29.818 -30.986 269 HE1 TRP 32 HE1 TRP 32 14.671 -32.050 -29.856 270 HE3 TRP 32 HE3 TRP 32 19.100 -29.852 -31.889 271 HZ2 TRP 32 HZ2 TRP 32 16.975 -33.618 -29.406 272 HZ3 TRP 32 HZ3 TRP 32 20.431 -31.754 -31.075 273 HH2 TRP 32 HH2 TRP 32 19.389 -33.597 -29.859 274 H ARG 33 H ARG 33 16.757 -27.407 -35.880 275 HA ARG 33 HA ARG 33 13.852 -26.940 -36.055 276 HB2 ARG 33 HB2 ARG 33 15.570 -24.950 -35.691 277 HB3 ARG 33 HB3 ARG 33 15.763 -25.112 -37.432 278 HG2 ARG 33 HG2 ARG 33 12.983 -25.027 -36.489 279 HG3 ARG 33 HG3 ARG 33 13.915 -23.550 -36.238 280 HD2 ARG 33 HD2 ARG 33 14.627 -24.048 -38.753 281 HD3 ARG 33 HD3 ARG 33 13.065 -24.865 -38.758 282 HE ARG 33 HE ARG 33 12.023 -22.822 -38.639 283 HH11 ARG 33 HH11 ARG 33 15.421 -22.441 -37.981 284 HH12 ARG 33 HH12 ARG 33 15.371 -20.710 -38.037 285 HH21 ARG 33 HH21 ARG 33 11.945 -20.543 -38.715 286 HH22 ARG 33 HH22 ARG 33 13.393 -19.632 -38.454 287 H ILE 34 H ILE 34 15.160 -29.229 -37.083 288 HA ILE 34 HA ILE 34 15.852 -29.017 -39.800 289 HB ILE 34 HB ILE 34 14.662 -31.392 -38.363 290 HG12 ILE 34 HG12 ILE 34 17.574 -30.865 -38.941 291 HG13 ILE 34 HG13 ILE 34 16.811 -30.362 -37.437 292 HG21 ILE 34 HG21 ILE 34 16.458 -32.089 -40.461 293 HG22 ILE 34 HG22 ILE 34 14.748 -32.481 -40.292 294 HG23 ILE 34 HG23 ILE 34 15.235 -30.991 -41.100 295 HD11 ILE 34 HD11 ILE 34 16.072 -32.920 -37.440 296 HD12 ILE 34 HD12 ILE 34 17.559 -33.055 -38.380 297 HD13 ILE 34 HD13 ILE 34 17.600 -32.362 -36.759 298 H1 MET 101 H MET 101 14.481 9.149 -2.269 299 HA MET 101 HA MET 101 14.635 6.592 -0.926 300 HB2 MET 101 HB2 MET 101 12.788 8.942 -0.829 301 HB3 MET 101 HB3 MET 101 12.234 7.396 -0.199 302 HG2 MET 101 HG2 MET 101 13.094 8.564 1.641 303 HG3 MET 101 HG3 MET 101 14.318 7.368 1.220 304 HE1 MET 101 HE1 MET 101 14.759 11.740 1.720 305 HE2 MET 101 HE2 MET 101 13.589 11.433 0.436 306 HE3 MET 101 HE3 MET 101 13.372 10.693 2.023 307 H ASP 102 H ASP 102 14.388 6.727 -3.880 308 HA ASP 102 HA ASP 102 12.302 4.742 -4.135 309 HB2 ASP 102 HB2 ASP 102 12.169 7.356 -5.647 310 HB3 ASP 102 HB3 ASP 102 11.236 5.924 -6.073 311 H SER 103 H SER 103 13.251 3.151 -5.204 312 HA SER 103 HA SER 103 15.263 3.820 -7.246 313 HB2 SER 103 HB2 SER 103 14.934 1.433 -5.438 314 HB3 SER 103 HB3 SER 103 15.932 1.353 -6.889 315 HG SER 103 HG SER 103 16.332 2.773 -4.521 316 H ALA 104 H ALA 104 12.514 3.941 -7.866 317 HA ALA 104 HA ALA 104 11.597 1.547 -9.093 318 HB1 ALA 104 HB1 ALA 104 10.677 4.297 -8.824 319 HB2 ALA 104 HB2 ALA 104 10.271 3.581 -10.384 320 HB3 ALA 104 HB3 ALA 104 9.756 2.794 -8.891 321 HA PRO 105 HA PRO 105 12.994 3.599 -13.233 322 HB2 PRO 105 HB2 PRO 105 14.492 5.858 -13.072 323 HB3 PRO 105 HB3 PRO 105 12.726 5.879 -13.141 324 HG2 PRO 105 HG2 PRO 105 14.533 6.128 -10.767 325 HG3 PRO 105 HG3 PRO 105 13.069 7.049 -11.160 326 HD2 PRO 105 HD2 PRO 105 13.072 5.005 -9.383 327 HD3 PRO 105 HD3 PRO 105 11.667 5.385 -10.400 328 H PHE 106 H PHE 106 15.132 3.720 -10.460 329 HA PHE 106 HA PHE 106 17.540 3.308 -11.956 330 HB2 PHE 106 HB2 PHE 106 16.813 3.345 -9.055 331 HB3 PHE 106 HB3 PHE 106 18.352 2.640 -9.539 332 HD1 PHE 106 HD2 PHE 106 19.809 4.126 -11.127 333 HD2 PHE 106 HD1 PHE 106 16.704 5.598 -8.616 334 HE1 PHE 106 HE2 PHE 106 20.812 6.371 -11.209 335 HE2 PHE 106 HE1 PHE 106 17.701 7.846 -8.695 336 HZ PHE 106 HZ PHE 106 19.758 8.235 -9.992 337 H GLU 107 H GLU 107 15.203 1.266 -10.329 338 HA GLU 107 HA GLU 107 16.654 -1.116 -10.217 339 HB2 GLU 107 HB2 GLU 107 13.892 -0.301 -9.938 340 HB3 GLU 107 HB3 GLU 107 14.007 -1.846 -10.770 341 HG2 GLU 107 HG2 GLU 107 15.070 -2.873 -8.961 342 HG3 GLU 107 HG3 GLU 107 15.476 -1.331 -8.211 343 H LEU 108 H LEU 108 14.899 0.384 -12.858 344 HA LEU 108 HA LEU 108 14.667 -1.705 -14.640 345 HB2 LEU 108 HB2 LEU 108 14.329 1.038 -14.719 346 HB3 LEU 108 HB3 LEU 108 15.564 0.735 -15.939 347 HG LEU 108 HG LEU 108 14.064 -0.791 -17.102 348 HD11 LEU 108 HD11 LEU 108 12.626 -0.684 -14.614 349 HD12 LEU 108 HD12 LEU 108 12.445 -1.798 -15.968 350 HD13 LEU 108 HD13 LEU 108 11.568 -0.269 -15.962 351 HD21 LEU 108 HD21 LEU 108 13.961 1.466 -17.830 352 HD22 LEU 108 HD22 LEU 108 12.947 1.932 -16.464 353 HD23 LEU 108 HD23 LEU 108 12.298 0.886 -17.729 354 H PHE 109 H PHE 109 17.496 0.265 -13.908 355 HA PHE 109 HA PHE 109 19.200 -0.442 -15.948 356 HB2 PHE 109 HB2 PHE 109 19.718 0.117 -13.034 357 HB3 PHE 109 HB3 PHE 109 21.033 -0.222 -14.155 358 HD1 PHE 109 HD1 PHE 109 20.481 1.181 -16.530 359 HD2 PHE 109 HD2 PHE 109 19.608 2.344 -12.530 360 HE1 PHE 109 HE1 PHE 109 20.506 3.544 -17.215 361 HE2 PHE 109 HE2 PHE 109 19.632 4.709 -13.208 362 HZ PHE 109 HZ PHE 109 20.080 5.312 -15.554 363 H PHE 110 H PHE 110 18.497 -2.234 -12.976 364 HA PHE 110 HA PHE 110 20.324 -4.355 -13.580 365 HB2 PHE 110 HB2 PHE 110 19.841 -3.956 -11.273 366 HB3 PHE 110 HB3 PHE 110 18.106 -4.076 -11.551 367 HD1 PHE 110 HD1 PHE 110 17.037 -6.233 -11.842 368 HD2 PHE 110 HD2 PHE 110 21.216 -5.924 -11.097 369 HE1 PHE 110 HE1 PHE 110 17.112 -8.629 -11.288 370 HE2 PHE 110 HE2 PHE 110 21.298 -8.319 -10.542 371 HZ PHE 110 HZ PHE 110 19.244 -9.675 -10.638 372 H MET 111 H MET 111 16.998 -3.661 -14.285 373 HA MET 111 HA MET 111 16.180 -6.311 -14.902 374 HB2 MET 111 HB2 MET 111 15.090 -3.578 -15.327 375 HB3 MET 111 HB3 MET 111 14.465 -4.861 -16.354 376 HG2 MET 111 HG2 MET 111 13.609 -6.056 -14.529 377 HG3 MET 111 HG3 MET 111 14.552 -5.122 -13.370 378 HE1 MET 111 HE1 MET 111 13.600 -4.056 -11.920 379 HE2 MET 111 HE2 MET 111 12.649 -2.586 -12.127 380 HE3 MET 111 HE3 MET 111 11.840 -4.127 -11.836 381 H ILE 112 H ILE 112 17.607 -3.691 -16.770 382 HA ILE 112 HA ILE 112 17.382 -5.146 -19.262 383 HB ILE 112 HB ILE 112 18.741 -2.537 -18.584 384 HG12 ILE 112 HG12 ILE 112 16.699 -2.203 -20.487 385 HG13 ILE 112 HG13 ILE 112 16.038 -3.293 -19.274 386 HG21 ILE 112 HG21 ILE 112 19.977 -3.022 -20.409 387 HG22 ILE 112 HG22 ILE 112 18.820 -4.207 -21.012 388 HG23 ILE 112 HG23 ILE 112 18.531 -2.485 -21.264 389 HD11 ILE 112 HD11 ILE 112 15.712 -1.610 -17.881 390 HD12 ILE 112 HD12 ILE 112 17.403 -1.123 -17.999 391 HD13 ILE 112 HD13 ILE 112 16.226 -0.508 -19.158 392 H ASN 113 H ASN 113 19.961 -4.178 -17.027 393 HA ASN 113 HA ASN 113 22.123 -5.204 -18.483 394 HB2 ASN 113 HB2 ASN 113 22.133 -3.693 -16.396 395 HB3 ASN 113 HB3 ASN 113 22.019 -5.188 -15.473 396 HD21 ASN 113 HD21 ASN 113 23.838 -4.140 -18.337 397 HD22 ASN 113 HD22 ASN 113 25.384 -4.632 -17.742 398 H THR 114 H THR 114 20.212 -6.694 -15.877 399 HA THR 114 HA THR 114 21.524 -9.126 -15.712 400 HB THR 114 HB THR 114 19.658 -8.303 -14.213 401 HG1 THR 114 HG1 THR 114 20.182 -10.339 -13.736 402 HG21 THR 114 HG21 THR 114 18.140 -7.989 -16.319 403 HG22 THR 114 HG22 THR 114 17.430 -8.522 -14.795 404 HG23 THR 114 HG23 THR 114 17.770 -9.694 -16.068 405 H SER 115 H SER 115 19.299 -7.966 -18.126 406 HA SER 115 HA SER 115 18.667 -10.495 -19.267 407 HB2 SER 115 HB2 SER 115 17.527 -8.121 -19.539 408 HB3 SER 115 HB3 SER 115 18.625 -8.000 -20.914 409 HG SER 115 HG SER 115 17.692 -9.829 -21.792 410 H ILE 116 H ILE 116 20.656 -7.850 -20.604 411 HA ILE 116 HA ILE 116 21.816 -9.264 -22.675 412 HB ILE 116 HB ILE 116 23.098 -7.067 -21.046 413 HG12 ILE 116 HG12 ILE 116 21.668 -6.781 -23.682 414 HG13 ILE 116 HG13 ILE 116 20.813 -6.655 -22.148 415 HG21 ILE 116 HG21 ILE 116 24.328 -6.655 -23.222 416 HG22 ILE 116 HG22 ILE 116 24.810 -8.084 -22.309 417 HG23 ILE 116 HG23 ILE 116 23.772 -8.251 -23.725 418 HD11 ILE 116 HD11 ILE 116 21.268 -4.469 -22.449 419 HD12 ILE 116 HD12 ILE 116 22.788 -4.924 -21.678 420 HD13 ILE 116 HD13 ILE 116 22.695 -4.786 -23.434 421 H LEU 117 H LEU 117 22.557 -9.336 -19.278 422 HA LEU 117 HA LEU 117 25.086 -10.685 -19.627 423 HB2 LEU 117 HB2 LEU 117 23.801 -9.292 -17.554 424 HB3 LEU 117 HB3 LEU 117 23.996 -10.948 -16.984 425 HG LEU 117 HG LEU 117 26.275 -9.301 -18.063 426 HD11 LEU 117 HD11 LEU 117 25.621 -8.063 -16.199 427 HD12 LEU 117 HD12 LEU 117 26.866 -9.146 -15.575 428 HD13 LEU 117 HD13 LEU 117 25.163 -9.502 -15.286 429 HD21 LEU 117 HD21 LEU 117 26.659 -11.470 -16.104 430 HD22 LEU 117 HD22 LEU 117 27.620 -11.028 -17.516 431 HD23 LEU 117 HD23 LEU 117 26.139 -11.966 -17.715 432 H LEU 118 H LEU 118 21.925 -11.577 -18.239 433 HA LEU 118 HA LEU 118 22.407 -14.238 -17.718 434 HB2 LEU 118 HB2 LEU 118 19.966 -12.700 -18.464 435 HB3 LEU 118 HB3 LEU 118 19.874 -14.458 -18.384 436 HG LEU 118 HG LEU 118 20.490 -12.539 -16.146 437 HD11 LEU 118 HD11 LEU 118 18.539 -13.907 -15.160 438 HD12 LEU 118 HD12 LEU 118 18.225 -14.373 -16.831 439 HD13 LEU 118 HD13 LEU 118 18.184 -12.672 -16.368 440 HD21 LEU 118 HD21 LEU 118 21.798 -14.137 -15.298 441 HD22 LEU 118 HD22 LEU 118 21.272 -15.324 -16.492 442 HD23 LEU 118 HD23 LEU 118 20.312 -15.049 -15.038 443 H ILE 119 H ILE 119 21.295 -12.785 -20.760 444 HA ILE 119 HA ILE 119 20.874 -15.061 -22.259 445 HB ILE 119 HB ILE 119 22.090 -12.468 -23.220 446 HG12 ILE 119 HG12 ILE 119 19.231 -13.149 -23.653 447 HG13 ILE 119 HG13 ILE 119 19.701 -12.705 -22.016 448 HG21 ILE 119 HG21 ILE 119 20.843 -14.775 -24.693 449 HG22 ILE 119 HG22 ILE 119 21.035 -13.173 -25.403 450 HG23 ILE 119 HG23 ILE 119 22.455 -14.091 -24.902 451 HD11 ILE 119 HD11 ILE 119 19.302 -11.044 -24.340 452 HD12 ILE 119 HD12 ILE 119 19.428 -10.598 -22.638 453 HD13 ILE 119 HD13 ILE 119 20.886 -10.779 -23.612 454 H PHE 120 H PHE 120 23.881 -13.140 -22.370 455 HA PHE 120 HA PHE 120 25.383 -15.072 -23.734 456 HB2 PHE 120 HB2 PHE 120 25.810 -12.488 -23.000 457 HB3 PHE 120 HB3 PHE 120 26.877 -13.329 -21.879 458 HD1 PHE 120 HD2 PHE 120 28.199 -15.355 -23.158 459 HD2 PHE 120 HD1 PHE 120 26.820 -11.723 -24.897 460 HE1 PHE 120 HE2 PHE 120 29.894 -15.563 -24.929 461 HE2 PHE 120 HE1 PHE 120 28.512 -11.926 -26.672 462 HZ PHE 120 HZ PHE 120 30.053 -13.847 -26.689 463 H ILE 121 H ILE 121 24.696 -14.640 -20.340 464 HA ILE 121 HA ILE 121 26.725 -16.268 -19.271 465 HB ILE 121 HB ILE 121 24.112 -15.253 -18.293 466 HG12 ILE 121 HG12 ILE 121 26.807 -15.371 -16.937 467 HG13 ILE 121 HG13 ILE 121 26.364 -14.098 -18.069 468 HG21 ILE 121 HG21 ILE 121 25.534 -17.623 -17.113 469 HG22 ILE 121 HG22 ILE 121 24.461 -16.592 -16.169 470 HG23 ILE 121 HG23 ILE 121 23.835 -17.476 -17.561 471 HD11 ILE 121 HD11 ILE 121 24.961 -14.726 -15.482 472 HD12 ILE 121 HD12 ILE 121 26.062 -13.379 -15.774 473 HD13 ILE 121 HD13 ILE 121 24.515 -13.452 -16.617 474 H PHE 122 H PHE 122 23.329 -17.043 -20.028 475 HA PHE 122 HA PHE 122 23.607 -19.811 -19.452 476 HB2 PHE 122 HB2 PHE 122 21.520 -18.306 -21.041 477 HB3 PHE 122 HB3 PHE 122 21.402 -20.012 -20.624 478 HD1 PHE 122 HD2 PHE 122 21.835 -20.452 -18.002 479 HD2 PHE 122 HD1 PHE 122 20.362 -16.847 -19.719 480 HE1 PHE 122 HE2 PHE 122 20.800 -19.854 -15.851 481 HE2 PHE 122 HE1 PHE 122 19.326 -16.242 -17.571 482 HZ PHE 122 HZ PHE 122 19.543 -17.747 -15.634 483 H ILE 123 H ILE 123 23.477 -17.983 -22.499 484 HA ILE 123 HA ILE 123 23.628 -20.026 -24.323 485 HB ILE 123 HB ILE 123 24.546 -17.211 -24.322 486 HG12 ILE 123 HG12 ILE 123 23.235 -17.314 -26.513 487 HG13 ILE 123 HG13 ILE 123 22.809 -18.961 -26.061 488 HG21 ILE 123 HG21 ILE 123 25.605 -19.287 -26.211 489 HG22 ILE 123 HG22 ILE 123 25.463 -17.593 -26.676 490 HG23 ILE 123 HG23 ILE 123 26.491 -18.051 -25.319 491 HD11 ILE 123 HD11 ILE 123 21.009 -17.609 -25.396 492 HD12 ILE 123 HD12 ILE 123 21.892 -17.990 -23.918 493 HD13 ILE 123 HD13 ILE 123 22.076 -16.406 -24.672 494 H VAL 124 H VAL 124 26.233 -18.641 -22.398 495 HA VAL 124 HA VAL 124 28.272 -20.218 -23.698 496 HB VAL 124 HB VAL 124 28.331 -18.436 -21.265 497 HG11 VAL 124 HG11 VAL 124 30.088 -19.690 -20.631 498 HG12 VAL 124 HG12 VAL 124 30.287 -20.406 -22.232 499 HG13 VAL 124 HG13 VAL 124 30.938 -18.802 -21.895 500 HG21 VAL 124 HG21 VAL 124 29.780 -18.068 -23.869 501 HG22 VAL 124 HG22 VAL 124 28.129 -17.494 -23.633 502 HG23 VAL 124 HG23 VAL 124 29.433 -16.871 -22.622 503 H LEU 125 H LEU 125 26.274 -20.436 -20.843 504 HA LEU 125 HA LEU 125 27.762 -22.466 -19.526 505 HB2 LEU 125 HB2 LEU 125 25.005 -21.354 -19.278 506 HB3 LEU 125 HB3 LEU 125 25.406 -22.856 -18.447 507 HG LEU 125 HG LEU 125 26.667 -20.150 -18.024 508 HD11 LEU 125 HD11 LEU 125 24.541 -20.308 -16.950 509 HD12 LEU 125 HD12 LEU 125 25.786 -20.500 -15.717 510 HD13 LEU 125 HD13 LEU 125 24.918 -21.911 -16.319 511 HD21 LEU 125 HD21 LEU 125 27.515 -22.885 -17.220 512 HD22 LEU 125 HD22 LEU 125 27.722 -21.567 -16.066 513 HD23 LEU 125 HD23 LEU 125 28.488 -21.480 -17.653 514 H LEU 126 H LEU 126 25.026 -22.504 -21.764 515 HA LEU 126 HA LEU 126 24.317 -25.167 -21.659 516 HB2 LEU 126 HB2 LEU 126 24.227 -23.067 -23.752 517 HB3 LEU 126 HB3 LEU 126 23.955 -24.733 -24.261 518 HG LEU 126 HG LEU 126 21.829 -23.727 -23.903 519 HD11 LEU 126 HD11 LEU 126 20.889 -25.362 -22.635 520 HD12 LEU 126 HD12 LEU 126 22.074 -25.197 -21.340 521 HD13 LEU 126 HD13 LEU 126 22.501 -26.054 -22.820 522 HD21 LEU 126 HD21 LEU 126 21.205 -22.751 -21.718 523 HD22 LEU 126 HD22 LEU 126 22.468 -21.841 -22.546 524 HD23 LEU 126 HD23 LEU 126 22.884 -22.903 -21.201 525 H ILE 127 H ILE 127 26.836 -23.662 -23.664 526 HA ILE 127 HA ILE 127 27.666 -26.067 -24.909 527 HB ILE 127 HB ILE 127 28.743 -23.311 -24.702 528 HG12 ILE 127 HG12 ILE 127 29.115 -24.500 -27.245 529 HG13 ILE 127 HG13 ILE 127 27.546 -25.038 -26.657 530 HG21 ILE 127 HG21 ILE 127 30.443 -25.711 -25.328 531 HG22 ILE 127 HG22 ILE 127 30.845 -24.084 -25.874 532 HG23 ILE 127 HG23 ILE 127 30.747 -24.435 -24.149 533 HD11 ILE 127 HD11 ILE 127 27.946 -22.208 -26.222 534 HD12 ILE 127 HD12 ILE 127 28.106 -22.653 -27.922 535 HD13 ILE 127 HD13 ILE 127 26.633 -23.055 -27.040 536 H HIS 128 H HIS 128 29.050 -24.200 -22.209 537 HA HIS 128 HA HIS 128 31.233 -25.763 -21.621 538 HB2 HIS 128 HB2 HIS 128 30.898 -23.696 -20.455 539 HB3 HIS 128 HB3 HIS 128 29.384 -24.267 -19.759 540 HD1 HIS 128 HD1 HIS 128 33.108 -24.672 -19.443 541 HD2 HIS 128 HD2 HIS 128 29.634 -25.772 -17.447 542 HE1 HIS 128 HE1 HIS 128 33.868 -25.606 -17.235 543 H PHE 129 H PHE 129 27.861 -26.384 -20.941 544 HA PHE 129 HA PHE 129 28.544 -28.775 -19.400 545 HB2 PHE 129 HB2 PHE 129 26.026 -27.192 -19.795 546 HB3 PHE 129 HB3 PHE 129 25.940 -28.855 -19.223 547 HD1 PHE 129 HD1 PHE 129 27.775 -29.321 -17.273 548 HD2 PHE 129 HD2 PHE 129 25.946 -25.585 -18.175 549 HE1 PHE 129 HE1 PHE 129 28.215 -28.554 -14.977 550 HE2 PHE 129 HE2 PHE 129 26.384 -24.812 -15.881 551 HZ PHE 129 HZ PHE 129 27.521 -26.297 -14.279 552 H GLU 130 H GLU 130 27.487 -27.792 -22.520 553 HA GLU 130 HA GLU 130 26.253 -30.249 -23.291 554 HB2 GLU 130 HB2 GLU 130 26.956 -27.698 -24.574 555 HB3 GLU 130 HB3 GLU 130 27.021 -29.089 -25.646 556 HG2 GLU 130 HG2 GLU 130 24.629 -28.705 -23.917 557 HG3 GLU 130 HG3 GLU 130 24.820 -27.714 -25.362 558 H GLY 131 H GLY 131 29.363 -29.620 -22.513 559 HA2 GLY 131 HA2 GLY 131 30.784 -31.678 -22.772 560 HA3 GLY 131 HA3 GLY 131 30.415 -31.552 -24.486 561 H TRP 132 H TRP 132 31.376 -29.126 -22.065 562 HA TRP 132 HA TRP 132 33.818 -28.636 -23.616 563 HB2 TRP 132 HB2 TRP 132 31.552 -26.878 -23.446 564 HB3 TRP 132 HB3 TRP 132 32.938 -26.123 -22.662 565 HD1 TRP 132 HD1 TRP 132 34.689 -25.023 -24.206 566 HE1 TRP 132 HE1 TRP 132 35.057 -24.912 -26.751 567 HE3 TRP 132 HE3 TRP 132 31.181 -28.435 -25.682 568 HZ2 TRP 132 HZ2 TRP 132 33.998 -26.112 -29.077 569 HZ3 TRP 132 HZ3 TRP 132 30.921 -28.896 -28.085 570 HH2 TRP 132 HH2 TRP 132 32.301 -27.757 -29.746 571 H ARG 133 H ARG 133 33.060 -29.880 -20.967 572 HA ARG 133 HA ARG 133 34.701 -28.160 -19.227 573 HB2 ARG 133 HB2 ARG 133 32.221 -28.849 -18.648 574 HB3 ARG 133 HB3 ARG 133 32.984 -30.347 -18.132 575 HG2 ARG 133 HG2 ARG 133 34.268 -27.911 -17.126 576 HG3 ARG 133 HG3 ARG 133 32.618 -28.175 -16.558 577 HD2 ARG 133 HD2 ARG 133 33.546 -30.633 -16.188 578 HD3 ARG 133 HD3 ARG 133 35.078 -29.768 -16.078 579 HE ARG 133 HE ARG 133 34.410 -28.891 -14.064 580 HH11 ARG 133 HH11 ARG 133 31.685 -30.354 -15.660 581 HH12 ARG 133 HH12 ARG 133 30.643 -30.229 -14.281 582 HH21 ARG 133 HH21 ARG 133 33.049 -28.720 -12.241 583 HH22 ARG 133 HH22 ARG 133 31.420 -29.298 -12.337 584 H ILE 134 H ILE 134 35.924 -29.845 -21.092 585 HA ILE 134 HA ILE 134 36.606 -32.391 -20.181 586 HB ILE 134 HB ILE 134 38.346 -30.489 -21.756 587 HG12 ILE 134 HG12 ILE 134 36.574 -32.683 -22.829 588 HG13 ILE 134 HG13 ILE 134 36.023 -31.019 -22.669 589 HG21 ILE 134 HG21 ILE 134 38.733 -33.226 -22.430 590 HG22 ILE 134 HG22 ILE 134 39.892 -32.078 -21.762 591 HG23 ILE 134 HG23 ILE 134 38.892 -33.049 -20.683 592 HD11 ILE 134 HD11 ILE 134 38.257 -30.571 -24.037 593 HD12 ILE 134 HD12 ILE 134 37.925 -32.215 -24.585 594 HD13 ILE 134 HD13 ILE 134 36.720 -30.949 -24.815 Start of MODEL 8 1 H1 MET 1 H MET 1 5.676 0.914 1.358 2 HA MET 1 HA MET 1 6.254 2.549 -1.024 3 HB2 MET 1 HB2 MET 1 7.635 3.469 1.352 4 HB3 MET 1 HB3 MET 1 6.636 4.370 0.220 5 HG2 MET 1 HG2 MET 1 4.630 3.628 1.406 6 HG3 MET 1 HG3 MET 1 5.640 2.743 2.546 7 HE1 MET 1 HE1 MET 1 7.449 4.446 4.447 8 HE2 MET 1 HE2 MET 1 5.980 4.960 5.275 9 HE3 MET 1 HE3 MET 1 6.055 3.367 4.520 10 H ASP 2 H ASP 2 6.985 -0.234 -0.296 11 HA ASP 2 HA ASP 2 9.809 -0.005 -0.887 12 HB2 ASP 2 HB2 ASP 2 8.797 -1.262 1.661 13 HB3 ASP 2 HB3 ASP 2 10.360 -1.677 0.964 14 H SER 3 H SER 3 10.083 -1.312 -2.558 15 HA SER 3 HA SER 3 8.578 -3.846 -2.626 16 HB2 SER 3 HB2 SER 3 9.488 -2.096 -4.922 17 HB3 SER 3 HB3 SER 3 8.776 -3.697 -5.116 18 HG SER 3 HG SER 3 7.497 -1.437 -4.937 19 H ALA 4 H ALA 4 11.078 -3.542 -1.314 20 HA ALA 4 HA ALA 4 13.235 -4.382 -2.960 21 HB1 ALA 4 HB1 ALA 4 12.777 -3.896 -0.121 22 HB2 ALA 4 HB2 ALA 4 13.908 -5.213 -0.435 23 HB3 ALA 4 HB3 ALA 4 14.213 -3.610 -1.105 24 HA PRO 5 HA PRO 5 12.385 -8.783 -1.167 25 HB2 PRO 5 HB2 PRO 5 10.094 -9.142 0.245 26 HB3 PRO 5 HB3 PRO 5 11.616 -8.645 0.994 27 HG2 PRO 5 HG2 PRO 5 9.266 -6.974 0.190 28 HG3 PRO 5 HG3 PRO 5 10.242 -6.895 1.669 29 HD2 PRO 5 HD2 PRO 5 10.588 -5.180 -0.398 30 HD3 PRO 5 HD3 PRO 5 11.927 -5.703 0.644 31 H PHE 6 H PHE 6 9.733 -6.820 -2.316 32 HA PHE 6 HA PHE 6 8.255 -8.993 -3.462 33 HB2 PHE 6 HB2 PHE 6 8.082 -5.995 -3.752 34 HB3 PHE 6 HB3 PHE 6 7.037 -7.091 -4.650 35 HD1 PHE 6 HD2 PHE 6 6.262 -9.109 -2.799 36 HD2 PHE 6 HD1 PHE 6 6.880 -4.955 -2.102 37 HE1 PHE 6 HE2 PHE 6 4.718 -9.204 -0.886 38 HE2 PHE 6 HE1 PHE 6 5.337 -5.044 -0.187 39 HZ PHE 6 HZ PHE 6 4.253 -7.170 0.422 40 H GLU 7 H GLU 7 10.617 -6.650 -4.615 41 HA GLU 7 HA GLU 7 10.390 -7.058 -7.357 42 HB2 GLU 7 HB2 GLU 7 12.276 -5.835 -5.556 43 HB3 GLU 7 HB3 GLU 7 13.134 -6.710 -6.817 44 HG2 GLU 7 HG2 GLU 7 11.970 -5.474 -8.528 45 HG3 GLU 7 HG3 GLU 7 10.985 -4.663 -7.312 46 H LEU 8 H LEU 8 12.094 -8.928 -4.913 47 HA LEU 8 HA LEU 8 13.678 -10.551 -6.488 48 HB2 LEU 8 HB2 LEU 8 12.579 -10.623 -3.817 49 HB3 LEU 8 HB3 LEU 8 12.659 -12.239 -4.516 50 HG LEU 8 HG LEU 8 14.643 -11.784 -3.207 51 HD11 LEU 8 HD11 LEU 8 15.840 -12.965 -4.653 52 HD12 LEU 8 HD12 LEU 8 16.000 -11.582 -5.734 53 HD13 LEU 8 HD13 LEU 8 14.599 -12.645 -5.865 54 HD21 LEU 8 HD21 LEU 8 14.541 -9.298 -3.501 55 HD22 LEU 8 HD22 LEU 8 15.235 -9.523 -5.107 56 HD23 LEU 8 HD23 LEU 8 16.150 -9.999 -3.676 57 H PHE 9 H PHE 9 10.231 -10.802 -5.807 58 HA PHE 9 HA PHE 9 9.658 -13.321 -6.743 59 HB2 PHE 9 HB2 PHE 9 8.078 -11.547 -5.757 60 HB3 PHE 9 HB3 PHE 9 7.911 -10.961 -7.408 61 HD1 PHE 9 HD2 PHE 9 7.626 -14.086 -5.405 62 HD2 PHE 9 HD1 PHE 9 6.270 -11.847 -8.762 63 HE1 PHE 9 HE2 PHE 9 5.884 -15.773 -5.823 64 HE2 PHE 9 HE1 PHE 9 4.525 -13.530 -9.184 65 HZ PHE 9 HZ PHE 9 4.332 -15.497 -7.714 66 H PHE 10 H PHE 10 10.045 -10.345 -8.625 67 HA PHE 10 HA PHE 10 9.504 -11.620 -11.131 68 HB2 PHE 10 HB2 PHE 10 9.035 -9.281 -10.971 69 HB3 PHE 10 HB3 PHE 10 10.666 -8.928 -10.410 70 HD1 PHE 10 HD1 PHE 10 12.535 -8.890 -11.957 71 HD2 PHE 10 HD2 PHE 10 8.570 -9.656 -13.301 72 HE1 PHE 10 HE1 PHE 10 13.243 -8.469 -14.276 73 HE2 PHE 10 HE2 PHE 10 9.271 -9.236 -15.622 74 HZ PHE 10 HZ PHE 10 11.611 -8.643 -16.112 75 H MET 11 H MET 11 12.313 -11.094 -9.168 76 HA MET 11 HA MET 11 14.268 -11.448 -11.201 77 HB2 MET 11 HB2 MET 11 14.253 -11.391 -8.228 78 HB3 MET 11 HB3 MET 11 15.626 -12.161 -9.012 79 HG2 MET 11 HG2 MET 11 16.251 -10.179 -10.106 80 HG3 MET 11 HG3 MET 11 14.709 -9.404 -9.748 81 HE1 MET 11 HE1 MET 11 14.575 -7.741 -8.551 82 HE2 MET 11 HE2 MET 11 15.068 -7.511 -6.874 83 HE3 MET 11 HE3 MET 11 16.138 -7.011 -8.185 84 H ILE 12 H ILE 12 12.450 -13.622 -9.156 85 HA ILE 12 HA ILE 12 14.063 -15.924 -9.811 86 HB ILE 12 HB ILE 12 11.415 -15.679 -8.384 87 HG12 ILE 12 HG12 ILE 12 13.529 -16.766 -6.802 88 HG13 ILE 12 HG13 ILE 12 14.117 -15.296 -7.569 89 HG21 ILE 12 HG21 ILE 12 11.235 -17.826 -9.147 90 HG22 ILE 12 HG22 ILE 12 12.980 -18.055 -9.244 91 HG23 ILE 12 HG23 ILE 12 12.170 -18.105 -7.678 92 HD11 ILE 12 HD11 ILE 12 11.540 -14.729 -6.597 93 HD12 ILE 12 HD12 ILE 12 12.402 -15.585 -5.318 94 HD13 ILE 12 HD13 ILE 12 13.088 -14.117 -6.015 95 H ASN 13 H ASN 13 10.660 -15.033 -10.426 96 HA ASN 13 HA ASN 13 10.001 -17.073 -12.158 97 HB2 ASN 13 HB2 ASN 13 8.870 -14.582 -11.369 98 HB3 ASN 13 HB3 ASN 13 8.772 -14.684 -13.125 99 HD21 ASN 13 HD21 ASN 13 7.843 -16.172 -10.111 100 HD22 ASN 13 HD22 ASN 13 6.554 -17.127 -10.754 101 H THR 14 H THR 14 11.225 -13.847 -13.056 102 HA THR 14 HA THR 14 11.387 -14.249 -15.801 103 HB THR 14 HB THR 14 11.781 -12.089 -14.419 104 HG1 THR 14 HG1 THR 14 13.591 -12.409 -16.567 105 HG21 THR 14 HG21 THR 14 14.077 -11.503 -14.003 106 HG22 THR 14 HG22 THR 14 14.637 -13.025 -14.697 107 HG23 THR 14 HG23 THR 14 13.735 -13.025 -13.182 108 H SER 15 H SER 15 13.408 -15.440 -13.258 109 HA SER 15 HA SER 15 15.715 -15.993 -14.829 110 HB2 SER 15 HB2 SER 15 15.357 -15.906 -12.202 111 HB3 SER 15 HB3 SER 15 15.072 -17.633 -12.415 112 HG SER 15 HG SER 15 17.403 -16.259 -12.463 113 H ILE 16 H ILE 16 13.360 -18.261 -13.397 114 HA ILE 16 HA ILE 16 14.135 -20.521 -14.790 115 HB ILE 16 HB ILE 16 11.327 -19.822 -13.923 116 HG12 ILE 16 HG12 ILE 16 13.513 -21.317 -12.457 117 HG13 ILE 16 HG13 ILE 16 12.983 -19.678 -12.096 118 HG21 ILE 16 HG21 ILE 16 11.390 -21.686 -15.492 119 HG22 ILE 16 HG22 ILE 16 12.596 -22.497 -14.495 120 HG23 ILE 16 HG23 ILE 16 10.966 -22.241 -13.873 121 HD11 ILE 16 HD11 ILE 16 10.654 -21.156 -12.015 122 HD12 ILE 16 HD12 ILE 16 11.861 -22.211 -11.278 123 HD13 ILE 16 HD13 ILE 16 11.593 -20.592 -10.634 124 H LEU 17 H LEU 17 12.283 -17.799 -15.874 125 HA LEU 17 HA LEU 17 11.262 -19.136 -18.224 126 HB2 LEU 17 HB2 LEU 17 10.659 -16.782 -16.796 127 HB3 LEU 17 HB3 LEU 17 11.143 -16.282 -18.415 128 HG LEU 17 HG LEU 17 8.985 -18.312 -17.855 129 HD11 LEU 17 HD11 LEU 17 7.575 -16.278 -18.721 130 HD12 LEU 17 HD12 LEU 17 8.910 -15.342 -18.049 131 HD13 LEU 17 HD13 LEU 17 7.988 -16.431 -17.013 132 HD21 LEU 17 HD21 LEU 17 9.026 -16.788 -20.360 133 HD22 LEU 17 HD22 LEU 17 8.730 -18.504 -20.076 134 HD23 LEU 17 HD23 LEU 17 10.384 -17.894 -20.148 135 H LEU 18 H LEU 18 13.462 -16.377 -17.684 136 HA LEU 18 HA LEU 18 14.352 -16.040 -20.271 137 HB2 LEU 18 HB2 LEU 18 15.633 -15.591 -17.607 138 HB3 LEU 18 HB3 LEU 18 16.548 -15.312 -19.087 139 HG LEU 18 HG LEU 18 14.099 -13.858 -18.117 140 HD11 LEU 18 HD11 LEU 18 15.799 -12.689 -17.201 141 HD12 LEU 18 HD12 LEU 18 15.883 -11.984 -18.815 142 HD13 LEU 18 HD13 LEU 18 16.984 -13.285 -18.363 143 HD21 LEU 18 HD21 LEU 18 14.845 -12.595 -20.418 144 HD22 LEU 18 HD22 LEU 18 13.490 -13.714 -20.267 145 HD23 LEU 18 HD23 LEU 18 15.051 -14.292 -20.849 146 H ILE 19 H ILE 19 15.376 -18.397 -17.876 147 HA ILE 19 HA ILE 19 17.682 -19.340 -19.164 148 HB ILE 19 HB ILE 19 15.759 -20.806 -17.356 149 HG12 ILE 19 HG12 ILE 19 18.491 -19.881 -16.568 150 HG13 ILE 19 HG13 ILE 19 17.184 -18.703 -16.634 151 HG21 ILE 19 HG21 ILE 19 16.994 -22.422 -18.643 152 HG22 ILE 19 HG22 ILE 19 18.510 -21.587 -18.305 153 HG23 ILE 19 HG23 ILE 19 17.634 -22.386 -17.000 154 HD11 ILE 19 HD11 ILE 19 16.671 -19.308 -14.570 155 HD12 ILE 19 HD12 ILE 19 16.132 -20.854 -15.226 156 HD13 ILE 19 HD13 ILE 19 17.782 -20.676 -14.629 157 H PHE 20 H PHE 20 14.490 -20.938 -19.069 158 HA PHE 20 HA PHE 20 15.065 -22.754 -21.137 159 HB2 PHE 20 HB2 PHE 20 13.226 -22.988 -19.446 160 HB3 PHE 20 HB3 PHE 20 12.330 -21.754 -20.326 161 HD1 PHE 20 HD1 PHE 20 14.189 -24.886 -21.156 162 HD2 PHE 20 HD2 PHE 20 10.669 -22.550 -21.678 163 HE1 PHE 20 HE1 PHE 20 13.260 -26.622 -22.633 164 HE2 PHE 20 HE2 PHE 20 9.734 -24.282 -23.154 165 HZ PHE 20 HZ PHE 20 11.029 -26.321 -23.633 166 H ILE 21 H ILE 21 14.078 -19.449 -21.181 167 HA ILE 21 HA ILE 21 12.980 -19.422 -23.814 168 HB ILE 21 HB ILE 21 13.767 -17.360 -21.825 169 HG12 ILE 21 HG12 ILE 21 11.347 -17.613 -23.619 170 HG13 ILE 21 HG13 ILE 21 11.470 -18.352 -22.027 171 HG21 ILE 21 HG21 ILE 21 13.302 -15.591 -23.580 172 HG22 ILE 21 HG22 ILE 21 14.865 -16.399 -23.674 173 HG23 ILE 21 HG23 ILE 21 13.569 -16.855 -24.780 174 HD11 ILE 21 HD11 ILE 21 11.556 -15.407 -22.634 175 HD12 ILE 21 HD12 ILE 21 10.213 -16.296 -21.913 176 HD13 ILE 21 HD13 ILE 21 11.733 -16.127 -21.034 177 H PHE 22 H PHE 22 16.093 -18.290 -22.493 178 HA PHE 22 HA PHE 22 17.211 -17.695 -25.030 179 HB2 PHE 22 HB2 PHE 22 18.568 -18.215 -22.377 180 HB3 PHE 22 HB3 PHE 22 19.357 -17.543 -23.800 181 HD1 PHE 22 HD2 PHE 22 17.176 -15.721 -24.732 182 HD2 PHE 22 HD1 PHE 22 18.760 -16.458 -20.850 183 HE1 PHE 22 HE2 PHE 22 16.506 -13.459 -24.033 184 HE2 PHE 22 HE1 PHE 22 18.091 -14.197 -20.144 185 HZ PHE 22 HZ PHE 22 16.964 -12.694 -21.737 186 H ILE 23 H ILE 23 17.757 -20.399 -22.776 187 HA ILE 23 HA ILE 23 19.580 -21.859 -24.223 188 HB ILE 23 HB ILE 23 17.480 -22.584 -22.254 189 HG12 ILE 23 HG12 ILE 23 19.776 -23.844 -21.530 190 HG13 ILE 23 HG13 ILE 23 20.426 -22.513 -22.480 191 HG21 ILE 23 HG21 ILE 23 18.779 -24.539 -24.119 192 HG22 ILE 23 HG22 ILE 23 18.263 -25.013 -22.501 193 HG23 ILE 23 HG23 ILE 23 17.082 -24.404 -23.660 194 HD11 ILE 23 HD11 ILE 23 18.451 -22.094 -20.262 195 HD12 ILE 23 HD12 ILE 23 20.195 -22.130 -19.999 196 HD13 ILE 23 HD13 ILE 23 19.486 -20.903 -21.050 197 H VAL 24 H VAL 24 16.032 -22.115 -24.415 198 HA VAL 24 HA VAL 24 16.009 -24.029 -26.494 199 HB VAL 24 HB VAL 24 13.916 -22.081 -25.539 200 HG11 VAL 24 HG11 VAL 24 13.768 -24.123 -27.740 201 HG12 VAL 24 HG12 VAL 24 12.336 -23.536 -26.892 202 HG13 VAL 24 HG13 VAL 24 13.347 -22.412 -27.803 203 HG21 VAL 24 HG21 VAL 24 14.830 -24.325 -24.353 204 HG22 VAL 24 HG22 VAL 24 13.180 -23.727 -24.182 205 HG23 VAL 24 HG23 VAL 24 13.541 -24.997 -25.351 206 H LEU 25 H LEU 25 15.850 -20.496 -26.487 207 HA LEU 25 HA LEU 25 15.266 -20.063 -29.169 208 HB2 LEU 25 HB2 LEU 25 16.616 -18.521 -27.029 209 HB3 LEU 25 HB3 LEU 25 16.846 -17.967 -28.686 210 HG LEU 25 HG LEU 25 14.214 -18.248 -27.238 211 HD11 LEU 25 HD11 LEU 25 14.137 -15.805 -27.469 212 HD12 LEU 25 HD12 LEU 25 15.762 -15.829 -28.154 213 HD13 LEU 25 HD13 LEU 25 15.501 -16.338 -26.486 214 HD21 LEU 25 HD21 LEU 25 13.209 -18.262 -29.214 215 HD22 LEU 25 HD22 LEU 25 14.779 -18.313 -30.017 216 HD23 LEU 25 HD23 LEU 25 14.025 -16.761 -29.650 217 H LEU 26 H LEU 26 18.348 -20.734 -27.599 218 HA LEU 26 HA LEU 26 20.101 -20.165 -29.665 219 HB2 LEU 26 HB2 LEU 26 20.111 -21.945 -27.315 220 HB3 LEU 26 HB3 LEU 26 21.265 -22.349 -28.585 221 HG LEU 26 HG LEU 26 22.334 -20.996 -26.895 222 HD11 LEU 26 HD11 LEU 26 22.249 -18.857 -28.802 223 HD12 LEU 26 HD12 LEU 26 22.263 -20.411 -29.634 224 HD13 LEU 26 HD13 LEU 26 23.537 -20.019 -28.480 225 HD21 LEU 26 HD21 LEU 26 20.540 -19.830 -25.895 226 HD22 LEU 26 HD22 LEU 26 20.071 -19.086 -27.424 227 HD23 LEU 26 HD23 LEU 26 21.570 -18.601 -26.630 228 H ILE 27 H ILE 27 18.452 -23.246 -28.985 229 HA ILE 27 HA ILE 27 19.469 -24.598 -31.252 230 HB ILE 27 HB ILE 27 17.336 -25.116 -29.261 231 HG12 ILE 27 HG12 ILE 27 18.650 -27.465 -29.839 232 HG13 ILE 27 HG13 ILE 27 19.883 -26.254 -30.169 233 HG21 ILE 27 HG21 ILE 27 17.374 -26.360 -31.998 234 HG22 ILE 27 HG22 ILE 27 16.620 -27.136 -30.607 235 HG23 ILE 27 HG23 ILE 27 16.028 -25.575 -31.173 236 HD11 ILE 27 HD11 ILE 27 19.326 -27.340 -27.729 237 HD12 ILE 27 HD12 ILE 27 20.190 -25.828 -28.006 238 HD13 ILE 27 HD13 ILE 27 18.460 -25.805 -27.668 239 H HIS 28 H HIS 28 16.328 -23.038 -30.643 240 HA HIS 28 HA HIS 28 15.050 -23.554 -33.015 241 HB2 HIS 28 HB2 HIS 28 13.887 -22.418 -31.250 242 HB3 HIS 28 HB3 HIS 28 14.997 -21.052 -31.322 243 HD1 HIS 28 HD1 HIS 28 11.871 -22.344 -32.744 244 HD2 HIS 28 HD2 HIS 28 14.663 -19.411 -33.675 245 HE1 HIS 28 HE1 HIS 28 10.745 -20.854 -34.428 246 H PHE 29 H PHE 29 17.594 -21.226 -32.384 247 HA PHE 29 HA PHE 29 17.420 -20.190 -35.109 248 HB2 PHE 29 HB2 PHE 29 18.823 -19.320 -32.613 249 HB3 PHE 29 HB3 PHE 29 19.432 -18.776 -34.173 250 HD1 PHE 29 HD1 PHE 29 17.443 -17.921 -35.788 251 HD2 PHE 29 HD2 PHE 29 17.397 -17.901 -31.532 252 HE1 PHE 29 HE1 PHE 29 15.762 -16.124 -35.818 253 HE2 PHE 29 HE2 PHE 29 15.716 -16.105 -31.555 254 HZ PHE 29 HZ PHE 29 14.895 -15.215 -33.699 255 H GLU 30 H GLU 30 19.323 -22.312 -33.141 256 HA GLU 30 HA GLU 30 21.586 -22.366 -34.924 257 HB2 GLU 30 HB2 GLU 30 20.800 -23.828 -32.436 258 HB3 GLU 30 HB3 GLU 30 22.076 -24.488 -33.449 259 HG2 GLU 30 HG2 GLU 30 23.491 -22.698 -33.062 260 HG3 GLU 30 HG3 GLU 30 22.174 -21.637 -32.564 261 H GLY 31 H GLY 31 18.642 -23.268 -35.567 262 HA2 GLY 31 HA2 GLY 31 18.511 -24.598 -37.687 263 HA3 GLY 31 HA3 GLY 31 19.418 -25.829 -36.821 264 H TRP 32 H TRP 32 16.524 -23.847 -36.165 265 HA TRP 32 HA TRP 32 15.208 -25.558 -34.483 266 HB2 TRP 32 HB2 TRP 32 14.192 -23.476 -34.748 267 HB3 TRP 32 HB3 TRP 32 14.224 -23.574 -36.507 268 HD1 TRP 32 HD1 TRP 32 11.994 -24.176 -37.611 269 HE1 TRP 32 HE1 TRP 32 9.765 -25.195 -36.824 270 HE3 TRP 32 HE3 TRP 32 13.279 -25.318 -32.797 271 HZ2 TRP 32 HZ2 TRP 32 8.693 -26.331 -34.472 272 HZ3 TRP 32 HZ3 TRP 32 11.594 -26.368 -31.344 273 HH2 TRP 32 HH2 TRP 32 9.349 -26.863 -32.166 274 H ARG 33 H ARG 33 15.632 -25.851 -37.919 275 HA ARG 33 HA ARG 33 13.672 -27.993 -38.127 276 HB2 ARG 33 HB2 ARG 33 15.536 -26.855 -40.219 277 HB3 ARG 33 HB3 ARG 33 14.228 -27.993 -40.512 278 HG2 ARG 33 HG2 ARG 33 12.583 -26.362 -39.936 279 HG3 ARG 33 HG3 ARG 33 13.824 -25.236 -39.381 280 HD2 ARG 33 HD2 ARG 33 13.970 -26.231 -42.179 281 HD3 ARG 33 HD3 ARG 33 12.735 -25.037 -41.783 282 HE ARG 33 HE ARG 33 15.544 -24.585 -42.028 283 HH11 ARG 33 HH11 ARG 33 12.655 -23.527 -40.399 284 HH12 ARG 33 HH12 ARG 33 13.244 -21.922 -40.120 285 HH21 ARG 33 HH21 ARG 33 16.330 -22.475 -41.667 286 HH22 ARG 33 HH22 ARG 33 15.334 -21.324 -40.843 287 H ILE 34 H ILE 34 15.479 -28.796 -36.346 288 HA ILE 34 HA ILE 34 16.786 -30.998 -37.720 289 HB ILE 34 HB ILE 34 18.340 -29.156 -35.899 290 HG12 ILE 34 HG12 ILE 34 18.603 -29.712 -38.862 291 HG13 ILE 34 HG13 ILE 34 18.044 -28.210 -38.135 292 HG21 ILE 34 HG21 ILE 34 20.244 -30.612 -36.387 293 HG22 ILE 34 HG22 ILE 34 18.944 -31.495 -35.587 294 HG23 ILE 34 HG23 ILE 34 19.192 -31.674 -37.323 295 HD11 ILE 34 HD11 ILE 34 20.407 -28.351 -36.948 296 HD12 ILE 34 HD12 ILE 34 20.783 -29.293 -38.391 297 HD13 ILE 34 HD13 ILE 34 20.193 -27.638 -38.547 298 H1 MET 101 H MET 101 12.927 10.625 -6.405 299 HA MET 101 HA MET 101 11.901 8.551 -4.581 300 HB2 MET 101 HB2 MET 101 9.733 10.051 -4.783 301 HB3 MET 101 HB3 MET 101 10.977 10.400 -3.590 302 HG2 MET 101 HG2 MET 101 11.935 12.083 -5.069 303 HG3 MET 101 HG3 MET 101 10.704 11.725 -6.278 304 HE1 MET 101 HE1 MET 101 7.743 12.472 -5.524 305 HE2 MET 101 HE2 MET 101 8.210 14.160 -5.730 306 HE3 MET 101 HE3 MET 101 9.000 12.903 -6.683 307 H ASP 102 H ASP 102 12.720 8.487 -7.451 308 HA ASP 102 HA ASP 102 10.387 7.082 -8.422 309 HB2 ASP 102 HB2 ASP 102 11.436 9.560 -9.787 310 HB3 ASP 102 HB3 ASP 102 10.486 8.343 -10.635 311 H SER 103 H SER 103 11.193 5.211 -9.076 312 HA SER 103 HA SER 103 13.793 5.208 -10.466 313 HB2 SER 103 HB2 SER 103 12.585 3.109 -8.651 314 HB3 SER 103 HB3 SER 103 14.041 2.860 -9.615 315 HG SER 103 HG SER 103 13.912 3.889 -7.227 316 H ALA 104 H ALA 104 11.311 5.616 -11.778 317 HA ALA 104 HA ALA 104 10.315 3.203 -12.903 318 HB1 ALA 104 HB1 ALA 104 9.849 6.067 -13.230 319 HB2 ALA 104 HB2 ALA 104 9.664 5.143 -14.721 320 HB3 ALA 104 HB3 ALA 104 8.717 4.716 -13.296 321 HA PRO 105 HA PRO 105 12.959 4.379 -16.767 322 HB2 PRO 105 HB2 PRO 105 14.734 6.416 -16.502 323 HB3 PRO 105 HB3 PRO 105 13.061 6.660 -17.018 324 HG2 PRO 105 HG2 PRO 105 14.283 7.035 -14.311 325 HG3 PRO 105 HG3 PRO 105 13.125 8.069 -15.169 326 HD2 PRO 105 HD2 PRO 105 12.374 6.346 -13.219 327 HD3 PRO 105 HD3 PRO 105 11.327 6.745 -14.597 328 H PHE 106 H PHE 106 14.376 4.636 -13.575 329 HA PHE 106 HA PHE 106 16.969 3.697 -14.345 330 HB2 PHE 106 HB2 PHE 106 15.606 4.025 -11.674 331 HB3 PHE 106 HB3 PHE 106 17.238 3.386 -11.831 332 HD1 PHE 106 HD2 PHE 106 18.487 5.022 -13.819 333 HD2 PHE 106 HD1 PHE 106 15.714 6.139 -10.789 334 HE1 PHE 106 HE2 PHE 106 19.381 7.313 -13.851 335 HE2 PHE 106 HE1 PHE 106 16.603 8.433 -10.817 336 HZ PHE 106 HZ PHE 106 18.440 9.023 -12.348 337 H GLU 107 H GLU 107 14.021 2.231 -13.125 338 HA GLU 107 HA GLU 107 14.998 -0.280 -12.415 339 HB2 GLU 107 HB2 GLU 107 12.426 0.928 -12.886 340 HB3 GLU 107 HB3 GLU 107 12.461 -0.695 -13.562 341 HG2 GLU 107 HG2 GLU 107 13.089 -1.621 -11.432 342 HG3 GLU 107 HG3 GLU 107 13.220 -0.008 -10.732 343 H LEU 108 H LEU 108 14.011 0.981 -15.559 344 HA LEU 108 HA LEU 108 14.049 -1.384 -17.027 345 HB2 LEU 108 HB2 LEU 108 14.105 1.463 -17.576 346 HB3 LEU 108 HB3 LEU 108 15.038 0.545 -18.755 347 HG LEU 108 HG LEU 108 12.763 0.923 -19.532 348 HD11 LEU 108 HD11 LEU 108 12.818 -1.048 -20.550 349 HD12 LEU 108 HD12 LEU 108 12.428 -1.899 -19.055 350 HD13 LEU 108 HD13 LEU 108 14.106 -1.517 -19.439 351 HD21 LEU 108 HD21 LEU 108 11.773 1.020 -17.223 352 HD22 LEU 108 HD22 LEU 108 11.829 -0.743 -17.204 353 HD23 LEU 108 HD23 LEU 108 10.844 0.096 -18.404 354 H PHE 109 H PHE 109 16.679 0.769 -16.101 355 HA PHE 109 HA PHE 109 18.729 -0.149 -17.686 356 HB2 PHE 109 HB2 PHE 109 18.753 1.707 -15.909 357 HB3 PHE 109 HB3 PHE 109 19.131 0.431 -14.757 358 HD1 PHE 109 HD2 PHE 109 20.296 1.849 -17.996 359 HD2 PHE 109 HD1 PHE 109 21.333 -0.137 -14.377 360 HE1 PHE 109 HE2 PHE 109 22.678 2.034 -18.582 361 HE2 PHE 109 HE1 PHE 109 23.717 0.046 -14.956 362 HZ PHE 109 HZ PHE 109 24.393 1.132 -17.061 363 H PHE 110 H PHE 110 17.586 -1.516 -14.618 364 HA PHE 110 HA PHE 110 19.492 -3.641 -14.604 365 HB2 PHE 110 HB2 PHE 110 18.589 -2.938 -12.500 366 HB3 PHE 110 HB3 PHE 110 16.938 -3.183 -13.060 367 HD1 PHE 110 HD1 PHE 110 16.006 -5.423 -13.246 368 HD2 PHE 110 HD2 PHE 110 19.946 -4.779 -11.771 369 HE1 PHE 110 HE1 PHE 110 16.038 -7.712 -12.344 370 HE2 PHE 110 HE2 PHE 110 19.985 -7.066 -10.867 371 HZ PHE 110 HZ PHE 110 18.030 -8.537 -11.154 372 H MET 111 H MET 111 16.351 -3.173 -15.993 373 HA MET 111 HA MET 111 15.681 -5.911 -16.354 374 HB2 MET 111 HB2 MET 111 14.669 -3.305 -17.362 375 HB3 MET 111 HB3 MET 111 14.258 -4.739 -18.293 376 HG2 MET 111 HG2 MET 111 13.082 -5.697 -16.509 377 HG3 MET 111 HG3 MET 111 13.785 -4.583 -15.339 378 HE1 MET 111 HE1 MET 111 12.648 -3.240 -14.289 379 HE2 MET 111 HE2 MET 111 11.612 -1.938 -14.874 380 HE3 MET 111 HE3 MET 111 10.910 -3.498 -14.441 381 H ILE 112 H ILE 112 17.538 -3.589 -18.197 382 HA ILE 112 HA ILE 112 17.711 -5.293 -20.526 383 HB ILE 112 HB ILE 112 19.111 -2.710 -19.833 384 HG12 ILE 112 HG12 ILE 112 17.466 -2.555 -22.150 385 HG13 ILE 112 HG13 ILE 112 16.524 -3.327 -20.878 386 HG21 ILE 112 HG21 ILE 112 20.636 -3.573 -21.294 387 HG22 ILE 112 HG22 ILE 112 19.447 -4.589 -22.107 388 HG23 ILE 112 HG23 ILE 112 19.504 -2.859 -22.443 389 HD11 ILE 112 HD11 ILE 112 17.815 -1.153 -19.675 390 HD12 ILE 112 HD12 ILE 112 17.194 -0.571 -21.220 391 HD13 ILE 112 HD13 ILE 112 16.102 -1.322 -20.058 392 H ASN 113 H ASN 113 20.048 -4.025 -18.147 393 HA ASN 113 HA ASN 113 22.283 -5.421 -18.969 394 HB2 ASN 113 HB2 ASN 113 21.473 -3.953 -16.629 395 HB3 ASN 113 HB3 ASN 113 22.384 -5.381 -16.147 396 HD21 ASN 113 HD21 ASN 113 22.473 -2.353 -17.829 397 HD22 ASN 113 HD22 ASN 113 24.190 -2.264 -18.001 398 H THR 114 H THR 114 19.935 -6.422 -16.481 399 HA THR 114 HA THR 114 21.005 -8.881 -15.832 400 HB THR 114 HB THR 114 18.154 -7.924 -15.898 401 HG1 THR 114 HG1 THR 114 19.651 -8.752 -13.648 402 HG21 THR 114 HG21 THR 114 17.606 -9.985 -14.577 403 HG22 THR 114 HG22 THR 114 19.173 -10.636 -15.059 404 HG23 THR 114 HG23 THR 114 17.953 -10.278 -16.281 405 H SER 115 H SER 115 19.164 -7.957 -18.654 406 HA SER 115 HA SER 115 18.550 -10.585 -19.543 407 HB2 SER 115 HB2 SER 115 17.599 -8.218 -20.264 408 HB3 SER 115 HB3 SER 115 18.859 -8.340 -21.491 409 HG SER 115 HG SER 115 16.473 -9.601 -21.357 410 H ILE 116 H ILE 116 20.849 -8.222 -20.911 411 HA ILE 116 HA ILE 116 22.179 -9.950 -22.615 412 HB ILE 116 HB ILE 116 23.384 -7.610 -21.134 413 HG12 ILE 116 HG12 ILE 116 22.026 -7.734 -23.836 414 HG13 ILE 116 HG13 ILE 116 21.343 -7.016 -22.382 415 HG21 ILE 116 HG21 ILE 116 25.077 -9.041 -22.131 416 HG22 ILE 116 HG22 ILE 116 24.238 -8.980 -23.680 417 HG23 ILE 116 HG23 ILE 116 24.959 -7.517 -23.011 418 HD11 ILE 116 HD11 ILE 116 23.780 -5.752 -22.655 419 HD12 ILE 116 HD12 ILE 116 23.186 -5.904 -24.309 420 HD13 ILE 116 HD13 ILE 116 22.200 -5.100 -23.089 421 H LEU 117 H LEU 117 22.416 -9.646 -19.175 422 HA LEU 117 HA LEU 117 24.922 -11.073 -18.983 423 HB2 LEU 117 HB2 LEU 117 23.365 -9.441 -17.286 424 HB3 LEU 117 HB3 LEU 117 23.483 -11.020 -16.514 425 HG LEU 117 HG LEU 117 25.859 -9.407 -17.434 426 HD11 LEU 117 HD11 LEU 117 26.088 -9.241 -14.827 427 HD12 LEU 117 HD12 LEU 117 24.335 -9.422 -14.875 428 HD13 LEU 117 HD13 LEU 117 25.107 -8.082 -15.723 429 HD21 LEU 117 HD21 LEU 117 26.122 -11.433 -15.330 430 HD22 LEU 117 HD22 LEU 117 27.159 -11.089 -16.714 431 HD23 LEU 117 HD23 LEU 117 25.709 -12.072 -16.921 432 H LEU 118 H LEU 118 21.574 -11.728 -17.937 433 HA LEU 118 HA LEU 118 21.904 -14.341 -17.107 434 HB2 LEU 118 HB2 LEU 118 19.595 -12.851 -18.284 435 HB3 LEU 118 HB3 LEU 118 19.449 -14.573 -17.939 436 HG LEU 118 HG LEU 118 19.872 -12.318 -15.993 437 HD11 LEU 118 HD11 LEU 118 17.621 -12.478 -16.171 438 HD12 LEU 118 HD12 LEU 118 17.871 -13.781 -15.009 439 HD13 LEU 118 HD13 LEU 118 17.669 -14.153 -16.721 440 HD21 LEU 118 HD21 LEU 118 19.646 -14.566 -14.467 441 HD22 LEU 118 HD22 LEU 118 21.159 -13.735 -14.829 442 HD23 LEU 118 HD23 LEU 118 20.666 -15.128 -15.792 443 H ILE 119 H ILE 119 21.453 -13.089 -20.365 444 HA ILE 119 HA ILE 119 20.993 -15.509 -21.695 445 HB ILE 119 HB ILE 119 22.386 -13.035 -22.725 446 HG12 ILE 119 HG12 ILE 119 19.574 -13.774 -23.398 447 HG13 ILE 119 HG13 ILE 119 19.892 -13.073 -21.816 448 HG21 ILE 119 HG21 ILE 119 22.903 -14.916 -24.139 449 HG22 ILE 119 HG22 ILE 119 21.204 -15.382 -24.199 450 HG23 ILE 119 HG23 ILE 119 21.734 -13.880 -24.957 451 HD11 ILE 119 HD11 ILE 119 19.757 -11.082 -22.764 452 HD12 ILE 119 HD12 ILE 119 21.250 -11.449 -23.630 453 HD13 ILE 119 HD13 ILE 119 19.689 -11.796 -24.375 454 H PHE 120 H PHE 120 24.062 -13.687 -21.613 455 HA PHE 120 HA PHE 120 25.627 -15.800 -22.609 456 HB2 PHE 120 HB2 PHE 120 26.271 -13.374 -22.591 457 HB3 PHE 120 HB3 PHE 120 26.580 -13.523 -20.864 458 HD1 PHE 120 HD1 PHE 120 27.449 -15.426 -23.959 459 HD2 PHE 120 HD2 PHE 120 28.785 -13.713 -20.299 460 HE1 PHE 120 HE1 PHE 120 29.738 -16.191 -24.441 461 HE2 PHE 120 HE2 PHE 120 31.076 -14.474 -20.776 462 HZ PHE 120 HZ PHE 120 31.555 -15.714 -22.849 463 H ILE 121 H ILE 121 24.441 -15.099 -19.446 464 HA ILE 121 HA ILE 121 26.353 -16.627 -17.981 465 HB ILE 121 HB ILE 121 23.750 -15.338 -17.363 466 HG12 ILE 121 HG12 ILE 121 26.363 -15.446 -15.846 467 HG13 ILE 121 HG13 ILE 121 25.988 -14.244 -17.076 468 HG21 ILE 121 HG21 ILE 121 23.836 -16.421 -15.072 469 HG22 ILE 121 HG22 ILE 121 23.260 -17.430 -16.398 470 HG23 ILE 121 HG23 ILE 121 24.905 -17.624 -15.792 471 HD11 ILE 121 HD11 ILE 121 24.528 -14.651 -14.477 472 HD12 ILE 121 HD12 ILE 121 25.634 -13.334 -14.872 473 HD13 ILE 121 HD13 ILE 121 24.095 -13.477 -15.720 474 H PHE 122 H PHE 122 22.974 -17.266 -18.924 475 HA PHE 122 HA PHE 122 22.989 -19.950 -18.010 476 HB2 PHE 122 HB2 PHE 122 21.177 -18.580 -20.008 477 HB3 PHE 122 HB3 PHE 122 20.879 -20.162 -19.296 478 HD1 PHE 122 HD2 PHE 122 21.703 -19.635 -16.492 479 HD2 PHE 122 HD1 PHE 122 19.401 -17.304 -19.210 480 HE1 PHE 122 HE2 PHE 122 20.554 -18.566 -14.598 481 HE2 PHE 122 HE1 PHE 122 18.249 -16.231 -17.320 482 HZ PHE 122 HZ PHE 122 18.824 -16.862 -15.010 483 H ILE 123 H ILE 123 23.173 -18.560 -21.284 484 HA ILE 123 HA ILE 123 23.398 -20.869 -22.760 485 HB ILE 123 HB ILE 123 24.374 -18.092 -23.141 486 HG12 ILE 123 HG12 ILE 123 23.197 -18.909 -25.458 487 HG13 ILE 123 HG13 ILE 123 22.402 -19.962 -24.293 488 HG21 ILE 123 HG21 ILE 123 25.434 -20.463 -24.639 489 HG22 ILE 123 HG22 ILE 123 25.342 -18.868 -25.383 490 HG23 ILE 123 HG23 ILE 123 26.320 -19.110 -23.936 491 HD11 ILE 123 HD11 ILE 123 22.560 -16.993 -23.911 492 HD12 ILE 123 HD12 ILE 123 21.267 -17.765 -24.829 493 HD13 ILE 123 HD13 ILE 123 21.488 -18.150 -23.123 494 H VAL 124 H VAL 124 26.058 -19.005 -21.299 495 HA VAL 124 HA VAL 124 28.103 -20.792 -22.100 496 HB VAL 124 HB VAL 124 28.003 -18.695 -19.937 497 HG11 VAL 124 HG11 VAL 124 30.256 -20.518 -20.735 498 HG12 VAL 124 HG12 VAL 124 30.526 -18.968 -19.936 499 HG13 VAL 124 HG13 VAL 124 29.598 -20.230 -19.125 500 HG21 VAL 124 HG21 VAL 124 28.124 -18.384 -22.615 501 HG22 VAL 124 HG22 VAL 124 28.837 -17.256 -21.461 502 HG23 VAL 124 HG23 VAL 124 29.841 -18.487 -22.228 503 H LEU 125 H LEU 125 26.200 -20.480 -19.133 504 HA LEU 125 HA LEU 125 27.547 -22.305 -17.531 505 HB2 LEU 125 HB2 LEU 125 24.780 -21.252 -17.658 506 HB3 LEU 125 HB3 LEU 125 25.043 -22.703 -16.693 507 HG LEU 125 HG LEU 125 26.374 -20.024 -16.297 508 HD11 LEU 125 HD11 LEU 125 25.123 -20.021 -14.183 509 HD12 LEU 125 HD12 LEU 125 24.319 -21.513 -14.669 510 HD13 LEU 125 HD13 LEU 125 24.058 -20.031 -15.589 511 HD21 LEU 125 HD21 LEU 125 27.944 -21.059 -15.124 512 HD22 LEU 125 HD22 LEU 125 27.252 -22.619 -15.568 513 HD23 LEU 125 HD23 LEU 125 26.711 -21.799 -14.103 514 H LEU 126 H LEU 126 25.127 -22.846 -20.032 515 HA LEU 126 HA LEU 126 24.502 -25.502 -19.574 516 HB2 LEU 126 HB2 LEU 126 24.493 -23.700 -21.901 517 HB3 LEU 126 HB3 LEU 126 24.522 -25.421 -22.279 518 HG LEU 126 HG LEU 126 22.250 -24.605 -22.305 519 HD11 LEU 126 HD11 LEU 126 21.909 -26.007 -19.826 520 HD12 LEU 126 HD12 LEU 126 23.181 -26.765 -20.784 521 HD13 LEU 126 HD13 LEU 126 21.572 -26.544 -21.472 522 HD21 LEU 126 HD21 LEU 126 22.320 -22.697 -20.917 523 HD22 LEU 126 HD22 LEU 126 22.896 -23.628 -19.534 524 HD23 LEU 126 HD23 LEU 126 21.243 -23.838 -20.113 525 H ILE 127 H ILE 127 27.140 -24.193 -21.572 526 HA ILE 127 HA ILE 127 28.222 -26.714 -22.268 527 HB ILE 127 HB ILE 127 29.113 -23.897 -22.483 528 HG12 ILE 127 HG12 ILE 127 29.851 -25.267 -24.751 529 HG13 ILE 127 HG13 ILE 127 28.450 -26.181 -24.203 530 HG21 ILE 127 HG21 ILE 127 31.013 -26.226 -22.452 531 HG22 ILE 127 HG22 ILE 127 31.376 -24.710 -23.277 532 HG23 ILE 127 HG23 ILE 127 31.109 -24.723 -21.534 533 HD11 ILE 127 HD11 ILE 127 28.389 -23.936 -25.756 534 HD12 ILE 127 HD12 ILE 127 27.036 -24.580 -24.826 535 HD13 ILE 127 HD13 ILE 127 28.041 -23.299 -24.149 536 H HIS 128 H HIS 128 29.180 -24.319 -19.816 537 HA HIS 128 HA HIS 128 31.393 -25.550 -18.758 538 HB2 HIS 128 HB2 HIS 128 30.754 -23.375 -17.981 539 HB3 HIS 128 HB3 HIS 128 29.222 -23.983 -17.359 540 HD1 HIS 128 HD1 HIS 128 32.726 -23.428 -16.431 541 HD2 HIS 128 HD2 HIS 128 29.504 -25.623 -14.996 542 HE1 HIS 128 HE1 HIS 128 33.345 -24.070 -14.080 543 H PHE 129 H PHE 129 28.015 -26.354 -18.265 544 HA PHE 129 HA PHE 129 28.718 -28.417 -16.320 545 HB2 PHE 129 HB2 PHE 129 26.165 -27.122 -17.187 546 HB3 PHE 129 HB3 PHE 129 26.103 -28.719 -16.449 547 HD1 PHE 129 HD1 PHE 129 27.641 -28.882 -14.243 548 HD2 PHE 129 HD2 PHE 129 25.859 -25.340 -15.790 549 HE1 PHE 129 HE1 PHE 129 27.750 -27.856 -12.010 550 HE2 PHE 129 HE2 PHE 129 25.966 -24.308 -13.559 551 HZ PHE 129 HZ PHE 129 26.913 -25.566 -11.665 552 H GLU 130 H GLU 130 27.803 -28.032 -19.638 553 HA GLU 130 HA GLU 130 27.061 -30.786 -20.032 554 HB2 GLU 130 HB2 GLU 130 27.383 -28.393 -21.796 555 HB3 GLU 130 HB3 GLU 130 27.343 -29.992 -22.526 556 HG2 GLU 130 HG2 GLU 130 25.155 -30.378 -21.877 557 HG3 GLU 130 HG3 GLU 130 25.209 -29.152 -20.612 558 H GLY 131 H GLY 131 29.883 -29.681 -19.183 559 HA2 GLY 131 HA2 GLY 131 31.672 -31.425 -19.384 560 HA3 GLY 131 HA3 GLY 131 31.400 -31.322 -21.117 561 H TRP 132 H TRP 132 31.933 -28.993 -18.467 562 HA TRP 132 HA TRP 132 33.109 -26.979 -19.899 563 HB2 TRP 132 HB2 TRP 132 32.687 -26.486 -17.655 564 HB3 TRP 132 HB3 TRP 132 33.511 -27.934 -17.082 565 HD1 TRP 132 HD1 TRP 132 35.861 -27.551 -16.143 566 HE1 TRP 132 HE1 TRP 132 37.616 -25.672 -16.278 567 HE3 TRP 132 HE3 TRP 132 33.516 -24.490 -19.499 568 HZ2 TRP 132 HZ2 TRP 132 37.960 -23.218 -17.629 569 HZ3 TRP 132 HZ3 TRP 132 34.624 -22.395 -20.160 570 HH2 TRP 132 HH2 TRP 132 36.800 -21.774 -19.242 571 H ARG 133 H ARG 133 34.477 -30.047 -19.014 572 HA ARG 133 HA ARG 133 37.164 -29.232 -19.790 573 HB2 ARG 133 HB2 ARG 133 36.135 -31.926 -18.876 574 HB3 ARG 133 HB3 ARG 133 37.824 -31.493 -19.111 575 HG2 ARG 133 HG2 ARG 133 37.761 -29.956 -17.289 576 HG3 ARG 133 HG3 ARG 133 36.010 -30.124 -17.141 577 HD2 ARG 133 HD2 ARG 133 37.694 -32.566 -16.917 578 HD3 ARG 133 HD3 ARG 133 37.670 -31.439 -15.561 579 HE ARG 133 HE ARG 133 35.585 -33.225 -16.348 580 HH11 ARG 133 HH11 ARG 133 36.241 -30.150 -14.854 581 HH12 ARG 133 HH12 ARG 133 34.774 -30.137 -13.932 582 HH21 ARG 133 HH21 ARG 133 33.650 -33.220 -15.140 583 HH22 ARG 133 HH22 ARG 133 33.302 -31.885 -14.095 584 H ILE 134 H ILE 134 35.632 -28.890 -21.932 585 HA ILE 134 HA ILE 134 36.613 -30.933 -23.752 586 HB ILE 134 HB ILE 134 33.684 -30.200 -23.663 587 HG12 ILE 134 HG12 ILE 134 35.104 -32.807 -23.080 588 HG13 ILE 134 HG13 ILE 134 34.295 -31.781 -21.901 589 HG21 ILE 134 HG21 ILE 134 33.439 -31.807 -25.494 590 HG22 ILE 134 HG22 ILE 134 34.492 -30.467 -25.942 591 HG23 ILE 134 HG23 ILE 134 35.188 -32.033 -25.526 592 HD11 ILE 134 HD11 ILE 134 32.248 -32.185 -23.539 593 HD12 ILE 134 HD12 ILE 134 33.162 -33.653 -23.885 594 HD13 ILE 134 HD13 ILE 134 32.655 -33.298 -22.234 Start of MODEL 9 1 H1 MET 1 H MET 1 3.816 -1.215 3.442 2 HA MET 1 HA MET 1 5.611 0.369 1.995 3 HB2 MET 1 HB2 MET 1 6.429 1.120 4.214 4 HB3 MET 1 HB3 MET 1 4.676 1.145 4.084 5 HG2 MET 1 HG2 MET 1 4.700 -1.121 5.213 6 HG3 MET 1 HG3 MET 1 6.399 -0.812 5.567 7 HE1 MET 1 HE1 MET 1 3.549 -0.484 8.416 8 HE2 MET 1 HE2 MET 1 4.425 -1.645 7.419 9 HE3 MET 1 HE3 MET 1 5.253 -0.809 8.733 10 H ASP 2 H ASP 2 6.054 -2.563 1.767 11 HA ASP 2 HA ASP 2 8.938 -2.478 1.963 12 HB2 ASP 2 HB2 ASP 2 7.285 -4.411 3.584 13 HB3 ASP 2 HB3 ASP 2 8.962 -4.737 3.155 14 H SER 3 H SER 3 9.594 -3.158 0.044 15 HA SER 3 HA SER 3 8.063 -5.291 -1.295 16 HB2 SER 3 HB2 SER 3 9.532 -2.906 -2.403 17 HB3 SER 3 HB3 SER 3 9.163 -4.305 -3.411 18 HG SER 3 HG SER 3 7.106 -3.168 -1.891 19 H ALA 4 H ALA 4 10.142 -5.762 0.618 20 HA ALA 4 HA ALA 4 12.594 -6.361 -0.706 21 HB1 ALA 4 HB1 ALA 4 12.611 -7.935 1.525 22 HB2 ALA 4 HB2 ALA 4 13.125 -6.249 1.466 23 HB3 ALA 4 HB3 ALA 4 11.489 -6.654 1.985 24 HA PRO 5 HA PRO 5 11.067 -10.935 -0.541 25 HB2 PRO 5 HB2 PRO 5 8.497 -11.378 0.212 26 HB3 PRO 5 HB3 PRO 5 9.837 -11.312 1.362 27 HG2 PRO 5 HG2 PRO 5 7.844 -9.194 0.652 28 HG3 PRO 5 HG3 PRO 5 8.460 -9.660 2.248 29 HD2 PRO 5 HD2 PRO 5 9.378 -7.493 0.908 30 HD3 PRO 5 HD3 PRO 5 10.408 -8.456 1.987 31 H PHE 6 H PHE 6 8.552 -8.580 -1.368 32 HA PHE 6 HA PHE 6 7.391 -10.099 -3.458 33 HB2 PHE 6 HB2 PHE 6 7.307 -7.199 -2.681 34 HB3 PHE 6 HB3 PHE 6 6.569 -7.741 -4.185 35 HD1 PHE 6 HD2 PHE 6 4.700 -9.367 -4.122 36 HD2 PHE 6 HD1 PHE 6 6.283 -7.598 -0.589 37 HE1 PHE 6 HE2 PHE 6 2.671 -10.018 -2.891 38 HE2 PHE 6 HE1 PHE 6 4.257 -8.247 0.648 39 HZ PHE 6 HZ PHE 6 2.448 -9.458 -0.503 40 H GLU 7 H GLU 7 10.199 -8.095 -3.258 41 HA GLU 7 HA GLU 7 10.463 -7.484 -6.016 42 HB2 GLU 7 HB2 GLU 7 12.065 -7.185 -3.587 43 HB3 GLU 7 HB3 GLU 7 13.035 -7.494 -5.020 44 HG2 GLU 7 HG2 GLU 7 10.910 -5.402 -5.089 45 HG3 GLU 7 HG3 GLU 7 12.465 -5.059 -4.333 46 H LEU 8 H LEU 8 11.905 -10.003 -3.965 47 HA LEU 8 HA LEU 8 13.524 -11.238 -5.832 48 HB2 LEU 8 HB2 LEU 8 12.520 -11.816 -3.248 49 HB3 LEU 8 HB3 LEU 8 12.280 -13.251 -4.242 50 HG LEU 8 HG LEU 8 14.632 -13.401 -4.699 51 HD11 LEU 8 HD11 LEU 8 16.155 -11.756 -3.437 52 HD12 LEU 8 HD12 LEU 8 14.733 -10.713 -3.381 53 HD13 LEU 8 HD13 LEU 8 15.395 -11.218 -4.936 54 HD21 LEU 8 HD21 LEU 8 13.815 -13.060 -1.842 55 HD22 LEU 8 HD22 LEU 8 15.489 -13.441 -2.249 56 HD23 LEU 8 HD23 LEU 8 14.193 -14.536 -2.732 57 H PHE 9 H PHE 9 10.059 -11.602 -5.306 58 HA PHE 9 HA PHE 9 9.491 -13.826 -6.812 59 HB2 PHE 9 HB2 PHE 9 8.028 -11.428 -5.978 60 HB3 PHE 9 HB3 PHE 9 7.410 -12.145 -7.463 61 HD1 PHE 9 HD2 PHE 9 7.498 -14.918 -7.196 62 HD2 PHE 9 HD1 PHE 9 6.818 -12.036 -4.140 63 HE1 PHE 9 HE2 PHE 9 6.289 -16.607 -5.877 64 HE2 PHE 9 HE1 PHE 9 5.609 -13.720 -2.815 65 HZ PHE 9 HZ PHE 9 5.342 -16.009 -3.684 66 H PHE 10 H PHE 10 10.286 -10.596 -7.914 67 HA PHE 10 HA PHE 10 9.696 -11.215 -10.679 68 HB2 PHE 10 HB2 PHE 10 9.316 -8.943 -9.823 69 HB3 PHE 10 HB3 PHE 10 11.029 -8.793 -9.449 70 HD1 PHE 10 HD1 PHE 10 12.681 -8.960 -11.387 71 HD2 PHE 10 HD2 PHE 10 8.503 -8.340 -11.914 72 HE1 PHE 10 HE1 PHE 10 13.099 -8.086 -13.648 73 HE2 PHE 10 HE2 PHE 10 8.915 -7.466 -14.176 74 HZ PHE 10 HZ PHE 10 11.215 -7.338 -15.047 75 H MET 11 H MET 11 12.483 -11.043 -8.572 76 HA MET 11 HA MET 11 14.455 -11.123 -10.618 77 HB2 MET 11 HB2 MET 11 14.405 -11.422 -7.669 78 HB3 MET 11 HB3 MET 11 15.768 -12.153 -8.507 79 HG2 MET 11 HG2 MET 11 16.213 -9.863 -7.714 80 HG3 MET 11 HG3 MET 11 16.394 -10.049 -9.456 81 HE1 MET 11 HE1 MET 11 14.952 -7.399 -6.948 82 HE2 MET 11 HE2 MET 11 13.234 -7.749 -7.137 83 HE3 MET 11 HE3 MET 11 14.330 -9.002 -6.553 84 H ILE 12 H ILE 12 12.676 -13.562 -8.834 85 HA ILE 12 HA ILE 12 14.268 -15.736 -9.890 86 HB ILE 12 HB ILE 12 11.754 -15.710 -8.223 87 HG12 ILE 12 HG12 ILE 12 13.939 -17.021 -6.975 88 HG13 ILE 12 HG13 ILE 12 14.549 -15.503 -7.627 89 HG21 ILE 12 HG21 ILE 12 11.525 -17.707 -9.374 90 HG22 ILE 12 HG22 ILE 12 13.265 -17.975 -9.458 91 HG23 ILE 12 HG23 ILE 12 12.413 -18.197 -7.931 92 HD11 ILE 12 HD11 ILE 12 13.506 -14.302 -6.073 93 HD12 ILE 12 HD12 ILE 12 12.007 -15.216 -6.243 94 HD13 ILE 12 HD13 ILE 12 13.303 -15.830 -5.216 95 H ASN 13 H ASN 13 10.972 -14.481 -10.307 96 HA ASN 13 HA ASN 13 9.962 -16.348 -12.065 97 HB2 ASN 13 HB2 ASN 13 8.641 -14.501 -11.099 98 HB3 ASN 13 HB3 ASN 13 9.491 -13.359 -12.136 99 HD21 ASN 13 HD21 ASN 13 7.765 -16.447 -12.452 100 HD22 ASN 13 HD22 ASN 13 6.861 -15.990 -13.852 101 H THR 14 H THR 14 11.475 -13.257 -13.012 102 HA THR 14 HA THR 14 11.589 -13.752 -15.747 103 HB THR 14 HB THR 14 12.033 -11.544 -14.639 104 HG1 THR 14 HG1 THR 14 13.349 -10.908 -16.306 105 HG21 THR 14 HG21 THR 14 14.889 -12.406 -14.371 106 HG22 THR 14 HG22 THR 14 13.754 -12.665 -13.046 107 HG23 THR 14 HG23 THR 14 14.064 -11.032 -13.636 108 H SER 15 H SER 15 13.560 -14.969 -13.176 109 HA SER 15 HA SER 15 15.819 -15.700 -14.744 110 HB2 SER 15 HB2 SER 15 15.498 -15.496 -12.121 111 HB3 SER 15 HB3 SER 15 15.111 -17.210 -12.264 112 HG SER 15 HG SER 15 17.525 -15.890 -12.638 113 H ILE 16 H ILE 16 13.365 -17.785 -13.205 114 HA ILE 16 HA ILE 16 13.994 -20.139 -14.500 115 HB ILE 16 HB ILE 16 11.244 -19.212 -13.664 116 HG12 ILE 16 HG12 ILE 16 13.041 -21.060 -12.118 117 HG13 ILE 16 HG13 ILE 16 13.204 -19.314 -11.960 118 HG21 ILE 16 HG21 ILE 16 11.153 -21.868 -13.375 119 HG22 ILE 16 HG22 ILE 16 10.674 -21.048 -14.861 120 HG23 ILE 16 HG23 ILE 16 12.278 -21.769 -14.730 121 HD11 ILE 16 HD11 ILE 16 11.105 -19.087 -10.993 122 HD12 ILE 16 HD12 ILE 16 10.564 -20.664 -11.569 123 HD13 ILE 16 HD13 ILE 16 11.750 -20.559 -10.268 124 H LEU 17 H LEU 17 12.280 -17.369 -15.708 125 HA LEU 17 HA LEU 17 11.229 -18.750 -18.019 126 HB2 LEU 17 HB2 LEU 17 10.703 -16.327 -16.685 127 HB3 LEU 17 HB3 LEU 17 11.238 -15.898 -18.308 128 HG LEU 17 HG LEU 17 8.935 -17.733 -17.642 129 HD11 LEU 17 HD11 LEU 17 8.924 -15.061 -17.355 130 HD12 LEU 17 HD12 LEU 17 7.517 -15.995 -17.861 131 HD13 LEU 17 HD13 LEU 17 8.518 -15.186 -19.067 132 HD21 LEU 17 HD21 LEU 17 8.921 -18.366 -19.770 133 HD22 LEU 17 HD22 LEU 17 10.486 -17.575 -19.965 134 HD23 LEU 17 HD23 LEU 17 9.001 -16.692 -20.322 135 H LEU 18 H LEU 18 13.527 -16.055 -17.567 136 HA LEU 18 HA LEU 18 14.459 -15.832 -20.139 137 HB2 LEU 18 HB2 LEU 18 15.741 -15.400 -17.476 138 HB3 LEU 18 HB3 LEU 18 16.695 -15.223 -18.946 139 HG LEU 18 HG LEU 18 14.322 -13.590 -18.071 140 HD11 LEU 18 HD11 LEU 18 16.211 -11.831 -18.716 141 HD12 LEU 18 HD12 LEU 18 17.249 -13.188 -18.281 142 HD13 LEU 18 HD13 LEU 18 16.094 -12.551 -17.110 143 HD21 LEU 18 HD21 LEU 18 13.789 -13.418 -20.233 144 HD22 LEU 18 HD22 LEU 18 15.295 -14.169 -20.759 145 HD23 LEU 18 HD23 LEU 18 15.252 -12.446 -20.384 146 H ILE 19 H ILE 19 15.343 -18.201 -17.701 147 HA ILE 19 HA ILE 19 17.589 -19.295 -18.988 148 HB ILE 19 HB ILE 19 15.621 -20.629 -17.126 149 HG12 ILE 19 HG12 ILE 19 18.376 -19.770 -16.351 150 HG13 ILE 19 HG13 ILE 19 17.116 -18.546 -16.469 151 HG21 ILE 19 HG21 ILE 19 18.362 -21.513 -18.018 152 HG22 ILE 19 HG22 ILE 19 17.424 -22.263 -16.728 153 HG23 ILE 19 HG23 ILE 19 16.829 -22.302 -18.388 154 HD11 ILE 19 HD11 ILE 19 17.617 -20.479 -14.396 155 HD12 ILE 19 HD12 ILE 19 16.569 -19.060 -14.389 156 HD13 ILE 19 HD13 ILE 19 15.964 -20.600 -15.000 157 H PHE 20 H PHE 20 14.319 -20.717 -18.798 158 HA PHE 20 HA PHE 20 14.749 -22.635 -20.797 159 HB2 PHE 20 HB2 PHE 20 12.740 -22.115 -19.021 160 HB3 PHE 20 HB3 PHE 20 11.985 -21.655 -20.543 161 HD1 PHE 20 HD1 PHE 20 13.561 -23.707 -22.224 162 HD2 PHE 20 HD2 PHE 20 11.332 -23.996 -18.609 163 HE1 PHE 20 HE1 PHE 20 13.092 -26.074 -22.706 164 HE2 PHE 20 HE2 PHE 20 10.860 -26.363 -19.085 165 HZ PHE 20 HZ PHE 20 11.741 -27.406 -21.136 166 H ILE 21 H ILE 21 13.986 -19.272 -20.980 167 HA ILE 21 HA ILE 21 12.927 -19.299 -23.636 168 HB ILE 21 HB ILE 21 13.793 -17.179 -21.729 169 HG12 ILE 21 HG12 ILE 21 11.320 -17.494 -23.442 170 HG13 ILE 21 HG13 ILE 21 11.472 -18.098 -21.796 171 HG21 ILE 21 HG21 ILE 21 13.308 -15.496 -23.575 172 HG22 ILE 21 HG22 ILE 21 14.863 -16.324 -23.637 173 HG23 ILE 21 HG23 ILE 21 13.552 -16.830 -24.702 174 HD11 ILE 21 HD11 ILE 21 10.270 -16.030 -21.772 175 HD12 ILE 21 HD12 ILE 21 11.852 -15.775 -21.035 176 HD13 ILE 21 HD13 ILE 21 11.547 -15.226 -22.683 177 H PHE 22 H PHE 22 16.022 -18.108 -22.314 178 HA PHE 22 HA PHE 22 17.236 -17.663 -24.808 179 HB2 PHE 22 HB2 PHE 22 18.484 -18.227 -22.111 180 HB3 PHE 22 HB3 PHE 22 19.371 -17.655 -23.521 181 HD1 PHE 22 HD1 PHE 22 17.367 -15.705 -24.580 182 HD2 PHE 22 HD2 PHE 22 18.755 -16.444 -20.625 183 HE1 PHE 22 HE1 PHE 22 16.845 -13.381 -23.966 184 HE2 PHE 22 HE2 PHE 22 18.235 -14.121 -20.005 185 HZ PHE 22 HZ PHE 22 17.277 -12.586 -21.676 186 H ILE 23 H ILE 23 17.622 -20.381 -22.537 187 HA ILE 23 HA ILE 23 19.386 -21.936 -23.956 188 HB ILE 23 HB ILE 23 17.224 -22.552 -22.016 189 HG12 ILE 23 HG12 ILE 23 19.442 -23.914 -21.247 190 HG13 ILE 23 HG13 ILE 23 20.174 -22.627 -22.198 191 HG21 ILE 23 HG21 ILE 23 16.769 -24.350 -23.444 192 HG22 ILE 23 HG22 ILE 23 18.472 -24.580 -23.840 193 HG23 ILE 23 HG23 ILE 23 17.873 -25.014 -22.239 194 HD11 ILE 23 HD11 ILE 23 19.931 -22.203 -19.728 195 HD12 ILE 23 HD12 ILE 23 19.283 -20.958 -20.797 196 HD13 ILE 23 HD13 ILE 23 18.193 -22.098 -20.007 197 H VAL 24 H VAL 24 15.830 -22.059 -24.177 198 HA VAL 24 HA VAL 24 15.776 -23.947 -26.287 199 HB VAL 24 HB VAL 24 13.715 -21.996 -25.273 200 HG11 VAL 24 HG11 VAL 24 12.283 -23.783 -26.726 201 HG12 VAL 24 HG12 VAL 24 12.765 -22.186 -27.302 202 HG13 VAL 24 HG13 VAL 24 13.721 -23.605 -27.730 203 HG21 VAL 24 HG21 VAL 24 12.820 -23.757 -24.097 204 HG22 VAL 24 HG22 VAL 24 13.482 -24.969 -25.193 205 HG23 VAL 24 HG23 VAL 24 14.536 -24.157 -24.036 206 H LEU 25 H LEU 25 15.895 -20.441 -26.188 207 HA LEU 25 HA LEU 25 15.233 -19.920 -28.867 208 HB2 LEU 25 HB2 LEU 25 16.626 -18.468 -26.694 209 HB3 LEU 25 HB3 LEU 25 16.883 -17.886 -28.338 210 HG LEU 25 HG LEU 25 14.232 -18.116 -26.914 211 HD11 LEU 25 HD11 LEU 25 14.249 -15.650 -27.125 212 HD12 LEU 25 HD12 LEU 25 15.908 -15.743 -27.716 213 HD13 LEU 25 HD13 LEU 25 15.525 -16.270 -26.077 214 HD21 LEU 25 HD21 LEU 25 13.447 -18.333 -29.008 215 HD22 LEU 25 HD22 LEU 25 14.951 -17.776 -29.742 216 HD23 LEU 25 HD23 LEU 25 13.786 -16.606 -29.121 217 H LEU 26 H LEU 26 18.232 -20.886 -27.341 218 HA LEU 26 HA LEU 26 20.030 -20.273 -29.386 219 HB2 LEU 26 HB2 LEU 26 19.967 -22.128 -27.093 220 HB3 LEU 26 HB3 LEU 26 21.111 -22.523 -28.374 221 HG LEU 26 HG LEU 26 22.183 -21.258 -26.593 222 HD11 LEU 26 HD11 LEU 26 22.233 -19.129 -28.543 223 HD12 LEU 26 HD12 LEU 26 22.297 -20.713 -29.314 224 HD13 LEU 26 HD13 LEU 26 23.494 -20.278 -28.094 225 HD21 LEU 26 HD21 LEU 26 21.487 -18.759 -26.499 226 HD22 LEU 26 HD22 LEU 26 20.564 -19.952 -25.584 227 HD23 LEU 26 HD23 LEU 26 19.945 -19.347 -27.122 228 H ILE 27 H ILE 27 18.090 -23.193 -28.849 229 HA ILE 27 HA ILE 27 19.100 -24.606 -31.095 230 HB ILE 27 HB ILE 27 16.844 -24.969 -29.205 231 HG12 ILE 27 HG12 ILE 27 18.139 -27.380 -29.974 232 HG13 ILE 27 HG13 ILE 27 19.383 -26.148 -29.793 233 HG21 ILE 27 HG21 ILE 27 16.069 -26.932 -30.637 234 HG22 ILE 27 HG22 ILE 27 15.574 -25.318 -31.145 235 HG23 ILE 27 HG23 ILE 27 16.901 -26.133 -31.971 236 HD11 ILE 27 HD11 ILE 27 19.015 -27.398 -27.730 237 HD12 ILE 27 HD12 ILE 27 18.622 -25.689 -27.537 238 HD13 ILE 27 HD13 ILE 27 17.331 -26.877 -27.716 239 H HIS 28 H HIS 28 16.038 -22.859 -30.567 240 HA HIS 28 HA HIS 28 14.867 -23.198 -33.028 241 HB2 HIS 28 HB2 HIS 28 13.692 -22.086 -31.236 242 HB3 HIS 28 HB3 HIS 28 14.845 -20.754 -31.247 243 HD1 HIS 28 HD1 HIS 28 11.693 -21.867 -32.721 244 HD2 HIS 28 HD2 HIS 28 14.661 -19.107 -33.638 245 HE1 HIS 28 HE1 HIS 28 10.672 -20.321 -34.422 246 H PHE 29 H PHE 29 17.524 -21.099 -32.158 247 HA PHE 29 HA PHE 29 17.531 -19.876 -34.812 248 HB2 PHE 29 HB2 PHE 29 18.879 -19.271 -32.211 249 HB3 PHE 29 HB3 PHE 29 19.606 -18.685 -33.703 250 HD1 PHE 29 HD1 PHE 29 17.713 -17.628 -35.356 251 HD2 PHE 29 HD2 PHE 29 17.575 -17.760 -31.104 252 HE1 PHE 29 HE1 PHE 29 16.178 -15.705 -35.349 253 HE2 PHE 29 HE2 PHE 29 16.039 -15.838 -31.091 254 HZ PHE 29 HZ PHE 29 15.338 -14.808 -33.215 255 H GLU 30 H GLU 30 19.166 -22.283 -32.947 256 HA GLU 30 HA GLU 30 21.557 -22.372 -34.509 257 HB2 GLU 30 HB2 GLU 30 20.354 -23.963 -32.322 258 HB3 GLU 30 HB3 GLU 30 21.467 -24.823 -33.377 259 HG2 GLU 30 HG2 GLU 30 23.273 -23.570 -32.729 260 HG3 GLU 30 HG3 GLU 30 22.284 -22.189 -32.260 261 H GLY 31 H GLY 31 18.490 -23.028 -35.378 262 HA2 GLY 31 HA2 GLY 31 18.391 -23.856 -37.749 263 HA3 GLY 31 HA3 GLY 31 19.287 -25.247 -37.158 264 H TRP 32 H TRP 32 16.475 -23.484 -35.869 265 HA TRP 32 HA TRP 32 14.796 -25.822 -36.297 266 HB2 TRP 32 HB2 TRP 32 15.834 -24.989 -33.668 267 HB3 TRP 32 HB3 TRP 32 14.095 -25.261 -33.722 268 HD1 TRP 32 HD1 TRP 32 13.249 -27.750 -33.989 269 HE1 TRP 32 HE1 TRP 32 14.432 -30.030 -33.832 270 HE3 TRP 32 HE3 TRP 32 18.104 -26.162 -34.197 271 HZ2 TRP 32 HZ2 TRP 32 17.074 -31.024 -33.799 272 HZ3 TRP 32 HZ3 TRP 32 19.900 -27.841 -34.096 273 HH2 TRP 32 HH2 TRP 32 19.393 -30.221 -33.901 274 H ARG 33 H ARG 33 13.685 -24.434 -37.733 275 HA ARG 33 HA ARG 33 12.309 -22.143 -36.526 276 HB2 ARG 33 HB2 ARG 33 12.346 -22.926 -39.441 277 HB3 ARG 33 HB3 ARG 33 11.868 -21.381 -38.751 278 HG2 ARG 33 HG2 ARG 33 14.116 -20.860 -38.161 279 HG3 ARG 33 HG3 ARG 33 14.658 -22.489 -38.573 280 HD2 ARG 33 HD2 ARG 33 14.468 -22.115 -40.851 281 HD3 ARG 33 HD3 ARG 33 13.328 -20.787 -40.639 282 HE ARG 33 HE ARG 33 15.939 -20.242 -39.574 283 HH11 ARG 33 HH11 ARG 33 13.942 -20.176 -42.425 284 HH12 ARG 33 HH12 ARG 33 14.871 -18.939 -43.205 285 HH21 ARG 33 HH21 ARG 33 17.171 -18.614 -40.592 286 HH22 ARG 33 HH22 ARG 33 16.708 -18.052 -42.162 287 H ILE 34 H ILE 34 11.489 -24.754 -35.789 288 HA ILE 34 HA ILE 34 9.120 -25.412 -37.304 289 HB ILE 34 HB ILE 34 10.006 -26.502 -34.631 290 HG12 ILE 34 HG12 ILE 34 10.487 -27.594 -37.412 291 HG13 ILE 34 HG13 ILE 34 11.707 -26.843 -36.390 292 HG21 ILE 34 HG21 ILE 34 8.170 -27.750 -34.651 293 HG22 ILE 34 HG22 ILE 34 7.603 -26.802 -36.025 294 HG23 ILE 34 HG23 ILE 34 8.499 -28.297 -36.295 295 HD11 ILE 34 HD11 ILE 34 10.807 -28.767 -34.736 296 HD12 ILE 34 HD12 ILE 34 10.565 -29.543 -36.302 297 HD13 ILE 34 HD13 ILE 34 12.166 -28.965 -35.841 298 H1 MET 101 H MET 101 12.046 11.785 -8.843 299 HA MET 101 HA MET 101 10.307 9.776 -7.976 300 HB2 MET 101 HB2 MET 101 8.493 11.360 -8.575 301 HB3 MET 101 HB3 MET 101 9.776 12.106 -7.632 302 HG2 MET 101 HG2 MET 101 10.741 12.893 -9.840 303 HG3 MET 101 HG3 MET 101 9.210 12.404 -10.562 304 HE1 MET 101 HE1 MET 101 10.083 16.291 -9.887 305 HE2 MET 101 HE2 MET 101 10.487 14.904 -10.899 306 HE3 MET 101 HE3 MET 101 8.934 15.718 -11.097 307 H ASP 102 H ASP 102 11.848 9.153 -10.456 308 HA ASP 102 HA ASP 102 9.680 7.878 -11.874 309 HB2 ASP 102 HB2 ASP 102 11.377 10.007 -13.169 310 HB3 ASP 102 HB3 ASP 102 10.543 8.770 -14.106 311 H SER 103 H SER 103 10.355 5.857 -12.065 312 HA SER 103 HA SER 103 13.211 5.373 -12.614 313 HB2 SER 103 HB2 SER 103 11.218 3.825 -10.970 314 HB3 SER 103 HB3 SER 103 12.680 3.061 -11.593 315 HG SER 103 HG SER 103 12.909 5.496 -10.231 316 H ALA 104 H ALA 104 11.232 5.891 -14.625 317 HA ALA 104 HA ALA 104 10.343 3.451 -15.798 318 HB1 ALA 104 HB1 ALA 104 10.370 5.243 -17.860 319 HB2 ALA 104 HB2 ALA 104 9.048 5.031 -16.711 320 HB3 ALA 104 HB3 ALA 104 10.247 6.298 -16.452 321 HA PRO 105 HA PRO 105 14.014 4.083 -18.866 322 HB2 PRO 105 HB2 PRO 105 15.821 6.025 -18.284 323 HB3 PRO 105 HB3 PRO 105 14.372 6.319 -19.254 324 HG2 PRO 105 HG2 PRO 105 14.856 6.880 -16.353 325 HG3 PRO 105 HG3 PRO 105 14.061 7.894 -17.571 326 HD2 PRO 105 HD2 PRO 105 12.674 6.417 -15.775 327 HD3 PRO 105 HD3 PRO 105 12.070 6.743 -17.412 328 H PHE 106 H PHE 106 14.776 4.825 -15.486 329 HA PHE 106 HA PHE 106 17.303 3.543 -15.459 330 HB2 PHE 106 HB2 PHE 106 15.385 4.436 -13.327 331 HB3 PHE 106 HB3 PHE 106 16.815 3.500 -12.905 332 HD1 PHE 106 HD2 PHE 106 19.069 4.417 -13.379 333 HD2 PHE 106 HD1 PHE 106 15.530 6.726 -13.891 334 HE1 PHE 106 HE2 PHE 106 20.417 6.475 -13.385 335 HE2 PHE 106 HE1 PHE 106 16.873 8.788 -13.899 336 HZ PHE 106 HZ PHE 106 19.320 8.664 -13.644 337 H GLU 107 H GLU 107 14.051 2.396 -15.198 338 HA GLU 107 HA GLU 107 14.576 -0.053 -13.872 339 HB2 GLU 107 HB2 GLU 107 12.319 1.211 -15.233 340 HB3 GLU 107 HB3 GLU 107 12.363 -0.533 -15.454 341 HG2 GLU 107 HG2 GLU 107 12.682 0.625 -12.723 342 HG3 GLU 107 HG3 GLU 107 11.080 0.494 -13.447 343 H LEU 108 H LEU 108 14.184 0.756 -17.315 344 HA LEU 108 HA LEU 108 14.512 -1.768 -18.397 345 HB2 LEU 108 HB2 LEU 108 14.493 0.912 -19.330 346 HB3 LEU 108 HB3 LEU 108 15.876 0.097 -20.057 347 HG LEU 108 HG LEU 108 14.456 -1.544 -21.072 348 HD11 LEU 108 HD11 LEU 108 11.922 -1.203 -20.817 349 HD12 LEU 108 HD12 LEU 108 12.335 -0.322 -19.347 350 HD13 LEU 108 HD13 LEU 108 12.792 -2.017 -19.517 351 HD21 LEU 108 HD21 LEU 108 13.642 1.317 -21.404 352 HD22 LEU 108 HD22 LEU 108 12.853 0.045 -22.337 353 HD23 LEU 108 HD23 LEU 108 14.594 0.293 -22.480 354 H PHE 109 H PHE 109 16.952 0.531 -17.315 355 HA PHE 109 HA PHE 109 19.253 -0.546 -18.347 356 HB2 PHE 109 HB2 PHE 109 18.563 1.084 -16.021 357 HB3 PHE 109 HB3 PHE 109 20.009 0.111 -15.771 358 HD1 PHE 109 HD2 PHE 109 21.482 0.097 -18.132 359 HD2 PHE 109 HD1 PHE 109 19.035 3.235 -16.621 360 HE1 PHE 109 HE2 PHE 109 22.804 1.736 -19.405 361 HE2 PHE 109 HE1 PHE 109 20.353 4.879 -17.892 362 HZ PHE 109 HZ PHE 109 22.241 4.131 -19.285 363 H PHE 110 H PHE 110 17.303 -1.738 -15.690 364 HA PHE 110 HA PHE 110 19.229 -3.779 -14.977 365 HB2 PHE 110 HB2 PHE 110 17.903 -2.790 -13.201 366 HB3 PHE 110 HB3 PHE 110 16.411 -3.251 -14.014 367 HD1 PHE 110 HD1 PHE 110 19.345 -5.447 -13.821 368 HD2 PHE 110 HD2 PHE 110 15.527 -4.513 -12.189 369 HE1 PHE 110 HE1 PHE 110 19.347 -7.585 -12.602 370 HE2 PHE 110 HE2 PHE 110 15.523 -6.648 -10.967 371 HZ PHE 110 HZ PHE 110 17.434 -8.187 -11.172 372 H MET 111 H MET 111 16.161 -3.542 -16.692 373 HA MET 111 HA MET 111 15.684 -6.300 -16.993 374 HB2 MET 111 HB2 MET 111 14.701 -3.811 -18.269 375 HB3 MET 111 HB3 MET 111 14.484 -5.298 -19.182 376 HG2 MET 111 HG2 MET 111 12.530 -4.725 -17.814 377 HG3 MET 111 HG3 MET 111 13.235 -6.280 -17.379 378 HE1 MET 111 HE1 MET 111 11.636 -3.232 -15.495 379 HE2 MET 111 HE2 MET 111 13.121 -2.409 -15.017 380 HE3 MET 111 HE3 MET 111 12.772 -2.678 -16.725 381 H ILE 112 H ILE 112 17.595 -4.009 -18.848 382 HA ILE 112 HA ILE 112 18.150 -5.926 -20.944 383 HB ILE 112 HB ILE 112 19.230 -3.156 -20.426 384 HG12 ILE 112 HG12 ILE 112 17.862 -3.413 -22.903 385 HG13 ILE 112 HG13 ILE 112 16.853 -4.157 -21.667 386 HG21 ILE 112 HG21 ILE 112 20.986 -4.121 -21.576 387 HG22 ILE 112 HG22 ILE 112 19.931 -5.192 -22.497 388 HG23 ILE 112 HG23 ILE 112 20.001 -3.474 -22.888 389 HD11 ILE 112 HD11 ILE 112 16.320 -2.190 -20.766 390 HD12 ILE 112 HD12 ILE 112 17.971 -1.581 -20.879 391 HD13 ILE 112 HD13 ILE 112 16.906 -1.507 -22.282 392 H ASN 113 H ASN 113 19.987 -4.308 -18.363 393 HA ASN 113 HA ASN 113 22.479 -5.398 -18.804 394 HB2 ASN 113 HB2 ASN 113 22.023 -3.668 -17.113 395 HB3 ASN 113 HB3 ASN 113 21.181 -4.857 -16.124 396 HD21 ASN 113 HD21 ASN 113 24.286 -4.582 -17.827 397 HD22 ASN 113 HD22 ASN 113 25.247 -5.173 -16.519 398 H THR 114 H THR 114 20.040 -6.691 -16.541 399 HA THR 114 HA THR 114 21.371 -9.058 -15.922 400 HB THR 114 HB THR 114 19.360 -8.158 -14.724 401 HG1 THR 114 HG1 THR 114 18.743 -10.195 -14.105 402 HG21 THR 114 HG21 THR 114 17.678 -9.615 -16.729 403 HG22 THR 114 HG22 THR 114 18.094 -7.921 -16.983 404 HG23 THR 114 HG23 THR 114 17.200 -8.402 -15.542 405 H SER 115 H SER 115 19.628 -8.159 -18.761 406 HA SER 115 HA SER 115 19.004 -10.769 -19.697 407 HB2 SER 115 HB2 SER 115 18.160 -8.368 -20.458 408 HB3 SER 115 HB3 SER 115 19.475 -8.534 -21.622 409 HG SER 115 HG SER 115 17.081 -9.925 -21.426 410 H ILE 116 H ILE 116 21.421 -8.458 -20.944 411 HA ILE 116 HA ILE 116 22.804 -10.197 -22.580 412 HB ILE 116 HB ILE 116 23.959 -7.900 -20.995 413 HG12 ILE 116 HG12 ILE 116 23.135 -7.828 -23.884 414 HG13 ILE 116 HG13 ILE 116 21.956 -7.540 -22.610 415 HG21 ILE 116 HG21 ILE 116 25.443 -7.976 -23.218 416 HG22 ILE 116 HG22 ILE 116 25.878 -8.838 -21.743 417 HG23 ILE 116 HG23 ILE 116 25.077 -9.694 -23.060 418 HD11 ILE 116 HD11 ILE 116 22.998 -5.580 -21.926 419 HD12 ILE 116 HD12 ILE 116 24.512 -5.991 -22.734 420 HD13 ILE 116 HD13 ILE 116 23.102 -5.526 -23.685 421 H LEU 117 H LEU 117 22.876 -9.930 -19.123 422 HA LEU 117 HA LEU 117 25.309 -11.463 -18.828 423 HB2 LEU 117 HB2 LEU 117 23.771 -9.759 -17.198 424 HB3 LEU 117 HB3 LEU 117 23.745 -11.345 -16.430 425 HG LEU 117 HG LEU 117 26.226 -9.792 -17.163 426 HD11 LEU 117 HD11 LEU 117 24.570 -9.175 -15.146 427 HD12 LEU 117 HD12 LEU 117 26.320 -8.983 -15.059 428 HD13 LEU 117 HD13 LEU 117 25.554 -10.408 -14.358 429 HD21 LEU 117 HD21 LEU 117 27.401 -11.637 -16.779 430 HD22 LEU 117 HD22 LEU 117 25.884 -12.537 -16.760 431 HD23 LEU 117 HD23 LEU 117 26.561 -11.918 -15.253 432 H LEU 118 H LEU 118 21.939 -11.985 -17.770 433 HA LEU 118 HA LEU 118 22.131 -14.618 -17.016 434 HB2 LEU 118 HB2 LEU 118 19.888 -13.049 -18.236 435 HB3 LEU 118 HB3 LEU 118 19.684 -14.749 -17.818 436 HG LEU 118 HG LEU 118 20.202 -12.436 -15.963 437 HD11 LEU 118 HD11 LEU 118 18.116 -13.792 -14.955 438 HD12 LEU 118 HD12 LEU 118 17.901 -14.137 -16.671 439 HD13 LEU 118 HD13 LEU 118 17.952 -12.467 -16.107 440 HD21 LEU 118 HD21 LEU 118 21.382 -13.864 -14.711 441 HD22 LEU 118 HD22 LEU 118 20.870 -15.261 -15.657 442 HD23 LEU 118 HD23 LEU 118 19.833 -14.637 -14.374 443 H ILE 119 H ILE 119 21.822 -13.297 -20.256 444 HA ILE 119 HA ILE 119 21.277 -15.708 -21.608 445 HB ILE 119 HB ILE 119 22.650 -13.210 -22.603 446 HG12 ILE 119 HG12 ILE 119 19.856 -14.046 -23.285 447 HG13 ILE 119 HG13 ILE 119 20.167 -13.267 -21.738 448 HG21 ILE 119 HG21 ILE 119 21.554 -15.565 -24.133 449 HG22 ILE 119 HG22 ILE 119 22.064 -14.041 -24.857 450 HG23 ILE 119 HG23 ILE 119 23.241 -15.061 -24.030 451 HD11 ILE 119 HD11 ILE 119 19.973 -12.123 -24.381 452 HD12 ILE 119 HD12 ILE 119 19.919 -11.340 -22.801 453 HD13 ILE 119 HD13 ILE 119 21.471 -11.663 -23.573 454 H PHE 120 H PHE 120 24.358 -13.907 -21.555 455 HA PHE 120 HA PHE 120 25.917 -15.973 -22.606 456 HB2 PHE 120 HB2 PHE 120 26.366 -13.362 -21.925 457 HB3 PHE 120 HB3 PHE 120 27.298 -14.211 -20.697 458 HD1 PHE 120 HD1 PHE 120 27.977 -16.618 -22.484 459 HD2 PHE 120 HD2 PHE 120 28.221 -12.409 -23.069 460 HE1 PHE 120 HE1 PHE 120 29.802 -16.952 -24.099 461 HE2 PHE 120 HE2 PHE 120 30.046 -12.736 -24.686 462 HZ PHE 120 HZ PHE 120 30.838 -15.010 -25.204 463 H ILE 121 H ILE 121 24.727 -15.436 -19.404 464 HA ILE 121 HA ILE 121 26.598 -17.088 -18.029 465 HB ILE 121 HB ILE 121 23.963 -15.868 -17.337 466 HG12 ILE 121 HG12 ILE 121 26.645 -15.871 -15.937 467 HG13 ILE 121 HG13 ILE 121 26.120 -14.644 -17.085 468 HG21 ILE 121 HG21 ILE 121 24.181 -16.996 -15.074 469 HG22 ILE 121 HG22 ILE 121 23.608 -18.000 -16.404 470 HG23 ILE 121 HG23 ILE 121 25.280 -18.129 -15.860 471 HD11 ILE 121 HD11 ILE 121 25.810 -13.813 -14.870 472 HD12 ILE 121 HD12 ILE 121 24.223 -14.131 -15.572 473 HD13 ILE 121 HD13 ILE 121 24.911 -15.257 -14.402 474 H PHE 122 H PHE 122 23.164 -17.620 -18.851 475 HA PHE 122 HA PHE 122 23.134 -20.340 -18.150 476 HB2 PHE 122 HB2 PHE 122 21.382 -18.915 -20.164 477 HB3 PHE 122 HB3 PHE 122 21.026 -20.455 -19.388 478 HD1 PHE 122 HD1 PHE 122 22.059 -19.627 -16.621 479 HD2 PHE 122 HD2 PHE 122 19.447 -17.759 -19.415 480 HE1 PHE 122 HE1 PHE 122 20.941 -18.440 -14.778 481 HE2 PHE 122 HE2 PHE 122 18.326 -16.569 -17.576 482 HZ PHE 122 HZ PHE 122 19.073 -16.908 -15.254 483 H ILE 123 H ILE 123 23.334 -18.829 -21.373 484 HA ILE 123 HA ILE 123 23.547 -21.049 -22.953 485 HB ILE 123 HB ILE 123 24.646 -18.298 -23.165 486 HG12 ILE 123 HG12 ILE 123 23.468 -18.776 -25.503 487 HG13 ILE 123 HG13 ILE 123 22.698 -20.060 -24.578 488 HG21 ILE 123 HG21 ILE 123 26.559 -19.381 -23.976 489 HG22 ILE 123 HG22 ILE 123 25.615 -20.627 -24.790 490 HG23 ILE 123 HG23 ILE 123 25.631 -18.981 -25.421 491 HD11 ILE 123 HD11 ILE 123 21.411 -17.936 -24.691 492 HD12 ILE 123 HD12 ILE 123 21.759 -18.490 -23.053 493 HD13 ILE 123 HD13 ILE 123 22.693 -17.169 -23.755 494 H VAL 124 H VAL 124 26.277 -19.341 -21.421 495 HA VAL 124 HA VAL 124 28.225 -21.236 -22.235 496 HB VAL 124 HB VAL 124 28.245 -19.108 -20.101 497 HG11 VAL 124 HG11 VAL 124 30.862 -19.692 -20.459 498 HG12 VAL 124 HG12 VAL 124 29.877 -20.328 -19.141 499 HG13 VAL 124 HG13 VAL 124 30.147 -21.298 -20.589 500 HG21 VAL 124 HG21 VAL 124 29.381 -17.793 -21.611 501 HG22 VAL 124 HG22 VAL 124 29.990 -19.174 -22.523 502 HG23 VAL 124 HG23 VAL 124 28.302 -18.687 -22.683 503 H LEU 125 H LEU 125 26.155 -20.942 -19.425 504 HA LEU 125 HA LEU 125 27.480 -22.794 -17.760 505 HB2 LEU 125 HB2 LEU 125 24.793 -21.552 -17.865 506 HB3 LEU 125 HB3 LEU 125 24.958 -23.024 -16.911 507 HG LEU 125 HG LEU 125 26.485 -20.453 -16.506 508 HD11 LEU 125 HD11 LEU 125 25.239 -20.399 -14.369 509 HD12 LEU 125 HD12 LEU 125 24.288 -21.776 -14.923 510 HD13 LEU 125 HD13 LEU 125 24.201 -20.240 -15.785 511 HD21 LEU 125 HD21 LEU 125 28.020 -21.832 -15.620 512 HD22 LEU 125 HD22 LEU 125 26.900 -23.192 -15.536 513 HD23 LEU 125 HD23 LEU 125 26.882 -21.954 -14.278 514 H LEU 126 H LEU 126 25.180 -23.164 -20.365 515 HA LEU 126 HA LEU 126 24.314 -25.774 -19.881 516 HB2 LEU 126 HB2 LEU 126 24.455 -23.972 -22.208 517 HB3 LEU 126 HB3 LEU 126 24.350 -25.692 -22.580 518 HG LEU 126 HG LEU 126 22.150 -24.681 -22.617 519 HD11 LEU 126 HD11 LEU 126 21.766 -26.107 -20.129 520 HD12 LEU 126 HD12 LEU 126 22.872 -26.954 -21.209 521 HD13 LEU 126 HD13 LEU 126 21.254 -26.527 -21.763 522 HD21 LEU 126 HD21 LEU 126 21.282 -23.987 -20.244 523 HD22 LEU 126 HD22 LEU 126 22.145 -22.831 -21.260 524 HD23 LEU 126 HD23 LEU 126 22.989 -23.655 -19.947 525 H ILE 127 H ILE 127 27.142 -24.590 -21.656 526 HA ILE 127 HA ILE 127 28.042 -27.155 -22.479 527 HB ILE 127 HB ILE 127 29.179 -24.415 -22.470 528 HG12 ILE 127 HG12 ILE 127 29.851 -25.917 -24.771 529 HG13 ILE 127 HG13 ILE 127 28.203 -26.363 -24.344 530 HG21 ILE 127 HG21 ILE 127 31.386 -25.404 -23.255 531 HG22 ILE 127 HG22 ILE 127 31.057 -25.462 -21.524 532 HG23 ILE 127 HG23 ILE 127 30.850 -26.910 -22.509 533 HD11 ILE 127 HD11 ILE 127 28.243 -24.519 -25.921 534 HD12 ILE 127 HD12 ILE 127 27.560 -24.012 -24.376 535 HD13 ILE 127 HD13 ILE 127 29.212 -23.565 -24.799 536 H HIS 128 H HIS 128 29.148 -24.963 -19.894 537 HA HIS 128 HA HIS 128 31.152 -26.491 -18.804 538 HB2 HIS 128 HB2 HIS 128 30.737 -24.258 -18.001 539 HB3 HIS 128 HB3 HIS 128 29.145 -24.717 -17.404 540 HD1 HIS 128 HD1 HIS 128 32.650 -24.485 -16.411 541 HD2 HIS 128 HD2 HIS 128 29.262 -26.510 -15.113 542 HE1 HIS 128 HE1 HIS 128 33.186 -25.267 -14.082 543 H PHE 129 H PHE 129 27.694 -26.912 -18.509 544 HA PHE 129 HA PHE 129 28.040 -29.058 -16.557 545 HB2 PHE 129 HB2 PHE 129 25.707 -27.478 -17.559 546 HB3 PHE 129 HB3 PHE 129 25.420 -29.068 -16.859 547 HD1 PHE 129 HD1 PHE 129 26.864 -29.406 -14.577 548 HD2 PHE 129 HD2 PHE 129 25.428 -25.715 -16.136 549 HE1 PHE 129 HE1 PHE 129 26.939 -28.428 -12.320 550 HE2 PHE 129 HE2 PHE 129 25.502 -24.730 -13.883 551 HZ PHE 129 HZ PHE 129 26.259 -26.086 -11.971 552 H GLU 130 H GLU 130 27.431 -28.547 -19.920 553 HA GLU 130 HA GLU 130 26.311 -31.115 -20.470 554 HB2 GLU 130 HB2 GLU 130 27.254 -28.796 -22.053 555 HB3 GLU 130 HB3 GLU 130 27.284 -30.354 -22.867 556 HG2 GLU 130 HG2 GLU 130 25.004 -30.580 -22.825 557 HG3 GLU 130 HG3 GLU 130 24.817 -29.528 -21.423 558 H GLY 131 H GLY 131 29.283 -30.336 -19.387 559 HA2 GLY 131 HA2 GLY 131 30.722 -32.389 -19.181 560 HA3 GLY 131 HA3 GLY 131 30.596 -32.486 -20.931 561 H TRP 132 H TRP 132 31.209 -29.757 -18.730 562 HA TRP 132 HA TRP 132 33.907 -29.491 -19.793 563 HB2 TRP 132 HB2 TRP 132 31.666 -27.692 -20.465 564 HB3 TRP 132 HB3 TRP 132 33.145 -26.885 -19.951 565 HD1 TRP 132 HD1 TRP 132 35.202 -26.930 -21.599 566 HE1 TRP 132 HE1 TRP 132 35.473 -27.651 -24.055 567 HE3 TRP 132 HE3 TRP 132 30.798 -29.457 -22.193 568 HZ2 TRP 132 HZ2 TRP 132 34.013 -29.100 -25.988 569 HZ3 TRP 132 HZ3 TRP 132 30.311 -30.481 -24.377 570 HH2 TRP 132 HH2 TRP 132 31.886 -30.304 -26.234 571 H ARG 133 H ARG 133 34.517 -30.010 -17.651 572 HA ARG 133 HA ARG 133 33.861 -27.998 -15.613 573 HB2 ARG 133 HB2 ARG 133 35.212 -30.660 -15.172 574 HB3 ARG 133 HB3 ARG 133 34.494 -29.607 -13.960 575 HG2 ARG 133 HG2 ARG 133 32.295 -30.089 -14.729 576 HG3 ARG 133 HG3 ARG 133 32.916 -30.934 -16.148 577 HD2 ARG 133 HD2 ARG 133 33.590 -32.774 -14.917 578 HD3 ARG 133 HD3 ARG 133 33.671 -31.862 -13.410 579 HE ARG 133 HE ARG 133 31.014 -32.083 -14.479 580 HH11 ARG 133 HH11 ARG 133 33.443 -33.620 -12.515 581 HH12 ARG 133 HH12 ARG 133 32.303 -34.560 -11.610 582 HH21 ARG 133 HH21 ARG 133 29.503 -33.314 -13.295 583 HH22 ARG 133 HH22 ARG 133 30.062 -34.385 -12.055 584 H ILE 134 H ILE 134 35.682 -27.302 -17.641 585 HA ILE 134 HA ILE 134 38.377 -27.674 -16.778 586 HB ILE 134 HB ILE 134 37.285 -25.560 -18.638 587 HG12 ILE 134 HG12 ILE 134 38.399 -28.306 -19.253 588 HG13 ILE 134 HG13 ILE 134 36.710 -27.832 -19.388 589 HG21 ILE 134 HG21 ILE 134 39.376 -24.860 -18.940 590 HG22 ILE 134 HG22 ILE 134 39.812 -25.817 -17.525 591 HG23 ILE 134 HG23 ILE 134 39.972 -26.507 -19.140 592 HD11 ILE 134 HD11 ILE 134 37.896 -25.967 -20.948 593 HD12 ILE 134 HD12 ILE 134 38.954 -27.355 -21.202 594 HD13 ILE 134 HD13 ILE 134 37.228 -27.490 -21.533 Start of MODEL 10 1 H1 MET 1 H MET 1 7.513 0.374 4.141 2 HA MET 1 HA MET 1 8.117 2.008 1.897 3 HB2 MET 1 HB2 MET 1 9.014 2.009 4.769 4 HB3 MET 1 HB3 MET 1 9.673 3.148 3.602 5 HG2 MET 1 HG2 MET 1 7.316 3.861 3.121 6 HG3 MET 1 HG3 MET 1 6.820 2.880 4.498 7 HE1 MET 1 HE1 MET 1 6.927 4.270 7.230 8 HE2 MET 1 HE2 MET 1 7.936 2.948 6.642 9 HE3 MET 1 HE3 MET 1 8.679 4.348 7.416 10 H ASP 2 H ASP 2 9.107 -0.815 1.883 11 HA ASP 2 HA ASP 2 11.748 -0.220 0.864 12 HB2 ASP 2 HB2 ASP 2 11.376 -2.183 3.136 13 HB3 ASP 2 HB3 ASP 2 12.859 -1.976 2.209 14 H SER 3 H SER 3 11.725 -1.140 -1.068 15 HA SER 3 HA SER 3 10.172 -3.590 -1.476 16 HB2 SER 3 HB2 SER 3 10.750 -3.021 -3.956 17 HB3 SER 3 HB3 SER 3 9.543 -2.051 -3.113 18 HG SER 3 HG SER 3 10.774 -0.445 -3.679 19 H ALA 4 H ALA 4 12.663 -3.733 -0.084 20 HA ALA 4 HA ALA 4 14.757 -4.577 -1.811 21 HB1 ALA 4 HB1 ALA 4 15.173 -5.803 0.658 22 HB2 ALA 4 HB2 ALA 4 15.840 -4.267 0.104 23 HB3 ALA 4 HB3 ALA 4 14.337 -4.294 1.026 24 HA PRO 5 HA PRO 5 13.412 -9.055 -0.611 25 HB2 PRO 5 HB2 PRO 5 11.070 -9.345 0.732 26 HB3 PRO 5 HB3 PRO 5 12.622 -9.115 1.546 27 HG2 PRO 5 HG2 PRO 5 10.477 -7.112 0.956 28 HG3 PRO 5 HG3 PRO 5 11.428 -7.329 2.437 29 HD2 PRO 5 HD2 PRO 5 11.991 -5.410 0.612 30 HD3 PRO 5 HD3 PRO 5 13.248 -6.203 1.583 31 H PHE 6 H PHE 6 11.020 -6.682 -1.522 32 HA PHE 6 HA PHE 6 9.340 -8.523 -2.947 33 HB2 PHE 6 HB2 PHE 6 8.790 -6.156 -1.924 34 HB3 PHE 6 HB3 PHE 6 9.325 -5.583 -3.500 35 HD1 PHE 6 HD2 PHE 6 6.784 -7.511 -1.704 36 HD2 PHE 6 HD1 PHE 6 8.033 -5.999 -5.482 37 HE1 PHE 6 HE2 PHE 6 4.558 -8.000 -2.632 38 HE2 PHE 6 HE1 PHE 6 5.809 -6.485 -6.415 39 HZ PHE 6 HZ PHE 6 4.068 -7.488 -4.990 40 H GLU 7 H GLU 7 11.985 -6.353 -3.745 41 HA GLU 7 HA GLU 7 11.750 -6.383 -6.535 42 HB2 GLU 7 HB2 GLU 7 13.712 -5.555 -4.579 43 HB3 GLU 7 HB3 GLU 7 14.494 -6.296 -5.968 44 HG2 GLU 7 HG2 GLU 7 12.454 -4.105 -6.207 45 HG3 GLU 7 HG3 GLU 7 14.187 -3.808 -6.078 46 H LEU 8 H LEU 8 13.535 -8.532 -4.350 47 HA LEU 8 HA LEU 8 14.806 -10.114 -6.249 48 HB2 LEU 8 HB2 LEU 8 13.942 -10.487 -3.437 49 HB3 LEU 8 HB3 LEU 8 14.386 -11.930 -4.346 50 HG LEU 8 HG LEU 8 16.218 -10.974 -2.952 51 HD11 LEU 8 HD11 LEU 8 16.305 -11.689 -5.764 52 HD12 LEU 8 HD12 LEU 8 17.342 -12.199 -4.433 53 HD13 LEU 8 HD13 LEU 8 17.672 -10.687 -5.277 54 HD21 LEU 8 HD21 LEU 8 15.421 -8.565 -3.674 55 HD22 LEU 8 HD22 LEU 8 16.586 -8.823 -4.973 56 HD23 LEU 8 HD23 LEU 8 17.110 -8.898 -3.290 57 H PHE 9 H PHE 9 11.531 -10.302 -4.965 58 HA PHE 9 HA PHE 9 10.722 -12.766 -5.884 59 HB2 PHE 9 HB2 PHE 9 9.359 -11.164 -4.513 60 HB3 PHE 9 HB3 PHE 9 9.033 -10.262 -5.989 61 HD1 PHE 9 HD2 PHE 9 7.780 -11.386 -7.848 62 HD2 PHE 9 HD1 PHE 9 8.127 -13.081 -3.959 63 HE1 PHE 9 HE2 PHE 9 5.862 -12.852 -8.319 64 HE2 PHE 9 HE1 PHE 9 6.210 -14.551 -4.424 65 HZ PHE 9 HZ PHE 9 5.073 -14.437 -6.607 66 H PHE 10 H PHE 10 10.914 -9.722 -7.672 67 HA PHE 10 HA PHE 10 9.855 -10.854 -10.089 68 HB2 PHE 10 HB2 PHE 10 9.490 -8.517 -9.743 69 HB3 PHE 10 HB3 PHE 10 11.205 -8.225 -9.473 70 HD1 PHE 10 HD1 PHE 10 12.766 -8.160 -11.334 71 HD2 PHE 10 HD2 PHE 10 8.598 -8.754 -11.962 72 HE1 PHE 10 HE1 PHE 10 13.055 -7.639 -13.721 73 HE2 PHE 10 HE2 PHE 10 8.881 -8.235 -14.350 74 HZ PHE 10 HZ PHE 10 11.111 -7.676 -15.233 75 H MET 11 H MET 11 12.983 -10.509 -8.646 76 HA MET 11 HA MET 11 14.490 -10.854 -11.055 77 HB2 MET 11 HB2 MET 11 15.090 -10.738 -8.145 78 HB3 MET 11 HB3 MET 11 16.269 -11.531 -9.180 79 HG2 MET 11 HG2 MET 11 16.619 -9.564 -10.445 80 HG3 MET 11 HG3 MET 11 15.225 -8.769 -9.718 81 HE1 MET 11 HE1 MET 11 16.540 -6.884 -6.907 82 HE2 MET 11 HE2 MET 11 16.465 -6.496 -8.626 83 HE3 MET 11 HE3 MET 11 15.170 -7.430 -7.875 84 H ILE 12 H ILE 12 12.950 -12.958 -8.786 85 HA ILE 12 HA ILE 12 14.461 -15.300 -9.517 86 HB ILE 12 HB ILE 12 11.947 -14.943 -7.891 87 HG12 ILE 12 HG12 ILE 12 14.215 -16.163 -6.576 88 HG13 ILE 12 HG13 ILE 12 14.672 -14.621 -7.291 89 HG21 ILE 12 HG21 ILE 12 12.580 -17.406 -7.246 90 HG22 ILE 12 HG22 ILE 12 11.585 -17.072 -8.663 91 HG23 ILE 12 HG23 ILE 12 13.305 -17.413 -8.854 92 HD11 ILE 12 HD11 ILE 12 13.960 -13.863 -5.291 93 HD12 ILE 12 HD12 ILE 12 12.401 -13.878 -6.115 94 HD13 ILE 12 HD13 ILE 12 12.848 -15.210 -5.050 95 H ASN 13 H ASN 13 11.065 -14.297 -9.963 96 HA ASN 13 HA ASN 13 10.225 -16.372 -11.576 97 HB2 ASN 13 HB2 ASN 13 8.858 -14.439 -10.596 98 HB3 ASN 13 HB3 ASN 13 9.344 -13.523 -12.019 99 HD21 ASN 13 HD21 ASN 13 8.325 -16.881 -11.496 100 HD22 ASN 13 HD22 ASN 13 7.054 -16.855 -12.666 101 H THR 14 H THR 14 11.675 -13.286 -12.586 102 HA THR 14 HA THR 14 11.622 -13.801 -15.352 103 HB THR 14 HB THR 14 11.985 -11.548 -14.361 104 HG1 THR 14 HG1 THR 14 13.234 -10.919 -16.054 105 HG21 THR 14 HG21 THR 14 14.875 -12.254 -14.015 106 HG22 THR 14 HG22 THR 14 13.732 -12.529 -12.700 107 HG23 THR 14 HG23 THR 14 13.966 -10.903 -13.340 108 H SER 15 H SER 15 13.672 -14.957 -12.843 109 HA SER 15 HA SER 15 15.954 -15.563 -14.431 110 HB2 SER 15 HB2 SER 15 15.614 -15.442 -11.798 111 HB3 SER 15 HB3 SER 15 15.323 -17.170 -11.995 112 HG SER 15 HG SER 15 17.659 -15.699 -12.355 113 H ILE 16 H ILE 16 13.578 -17.773 -12.945 114 HA ILE 16 HA ILE 16 14.300 -20.067 -14.306 115 HB ILE 16 HB ILE 16 11.510 -19.300 -13.442 116 HG12 ILE 16 HG12 ILE 16 12.506 -21.072 -11.591 117 HG13 ILE 16 HG13 ILE 16 13.923 -20.101 -11.976 118 HG21 ILE 16 HG21 ILE 16 11.604 -21.963 -13.158 119 HG22 ILE 16 HG22 ILE 16 11.045 -21.167 -14.629 120 HG23 ILE 16 HG23 ILE 16 12.697 -21.775 -14.529 121 HD11 ILE 16 HD11 ILE 16 13.186 -18.479 -10.674 122 HD12 ILE 16 HD12 ILE 16 11.691 -18.372 -11.603 123 HD13 ILE 16 HD13 ILE 16 11.803 -19.482 -10.237 124 H LEU 17 H LEU 17 12.471 -17.336 -15.421 125 HA LEU 17 HA LEU 17 11.437 -18.693 -17.753 126 HB2 LEU 17 HB2 LEU 17 10.902 -16.276 -16.364 127 HB3 LEU 17 HB3 LEU 17 11.314 -15.864 -18.027 128 HG LEU 17 HG LEU 17 9.171 -17.843 -17.262 129 HD11 LEU 17 HD11 LEU 17 8.105 -15.990 -16.542 130 HD12 LEU 17 HD12 LEU 17 7.822 -15.751 -18.266 131 HD13 LEU 17 HD13 LEU 17 9.142 -14.900 -17.463 132 HD21 LEU 17 HD21 LEU 17 10.481 -17.371 -19.679 133 HD22 LEU 17 HD22 LEU 17 8.931 -16.540 -19.823 134 HD23 LEU 17 HD23 LEU 17 8.977 -18.261 -19.436 135 H LEU 18 H LEU 18 13.635 -15.921 -17.274 136 HA LEU 18 HA LEU 18 14.529 -15.614 -19.849 137 HB2 LEU 18 HB2 LEU 18 15.831 -15.190 -17.193 138 HB3 LEU 18 HB3 LEU 18 16.755 -14.943 -18.673 139 HG LEU 18 HG LEU 18 14.350 -13.417 -17.706 140 HD11 LEU 18 HD11 LEU 18 16.148 -11.582 -18.402 141 HD12 LEU 18 HD12 LEU 18 17.248 -12.906 -18.019 142 HD13 LEU 18 HD13 LEU 18 16.116 -12.321 -16.801 143 HD21 LEU 18 HD21 LEU 18 13.732 -13.315 -19.862 144 HD22 LEU 18 HD22 LEU 18 15.300 -13.875 -20.446 145 HD23 LEU 18 HD23 LEU 18 15.074 -12.180 -20.010 146 H ILE 19 H ILE 19 15.598 -17.955 -17.444 147 HA ILE 19 HA ILE 19 17.843 -18.949 -18.790 148 HB ILE 19 HB ILE 19 15.956 -20.386 -16.922 149 HG12 ILE 19 HG12 ILE 19 18.698 -19.439 -16.195 150 HG13 ILE 19 HG13 ILE 19 17.383 -18.271 -16.245 151 HG21 ILE 19 HG21 ILE 19 17.179 -22.007 -18.220 152 HG22 ILE 19 HG22 ILE 19 18.696 -21.168 -17.903 153 HG23 ILE 19 HG23 ILE 19 17.835 -21.960 -16.584 154 HD11 ILE 19 HD11 ILE 19 18.040 -20.202 -14.227 155 HD12 ILE 19 HD12 ILE 19 16.890 -18.865 -14.175 156 HD13 ILE 19 HD13 ILE 19 16.388 -20.436 -14.800 157 H PHE 20 H PHE 20 14.670 -20.565 -18.557 158 HA PHE 20 HA PHE 20 15.139 -22.411 -20.598 159 HB2 PHE 20 HB2 PHE 20 13.168 -22.087 -18.792 160 HB3 PHE 20 HB3 PHE 20 12.349 -21.477 -20.226 161 HD1 PHE 20 HD1 PHE 20 12.670 -23.029 -22.368 162 HD2 PHE 20 HD2 PHE 20 12.964 -24.318 -18.322 163 HE1 PHE 20 HE1 PHE 20 12.180 -25.336 -23.071 164 HE2 PHE 20 HE2 PHE 20 12.476 -26.627 -19.018 165 HZ PHE 20 HZ PHE 20 12.084 -27.138 -21.395 166 H ILE 21 H ILE 21 14.103 -19.094 -20.716 167 HA ILE 21 HA ILE 21 13.030 -19.095 -23.334 168 HB ILE 21 HB ILE 21 13.940 -17.009 -21.427 169 HG12 ILE 21 HG12 ILE 21 11.490 -17.128 -23.187 170 HG13 ILE 21 HG13 ILE 21 11.588 -17.948 -21.632 171 HG21 ILE 21 HG21 ILE 21 13.534 -15.272 -23.223 172 HG22 ILE 21 HG22 ILE 21 15.053 -16.162 -23.326 173 HG23 ILE 21 HG23 ILE 21 13.712 -16.579 -24.393 174 HD11 ILE 21 HD11 ILE 21 10.441 -15.836 -21.411 175 HD12 ILE 21 HD12 ILE 21 11.973 -15.790 -20.539 176 HD13 ILE 21 HD13 ILE 21 11.824 -14.986 -22.101 177 H PHE 22 H PHE 22 16.230 -18.125 -22.104 178 HA PHE 22 HA PHE 22 17.296 -17.690 -24.719 179 HB2 PHE 22 HB2 PHE 22 18.723 -18.025 -22.072 180 HB3 PHE 22 HB3 PHE 22 19.452 -17.427 -23.559 181 HD1 PHE 22 HD1 PHE 22 17.260 -15.664 -24.526 182 HD2 PHE 22 HD2 PHE 22 18.912 -16.198 -20.639 183 HE1 PHE 22 HE1 PHE 22 16.593 -13.372 -23.931 184 HE2 PHE 22 HE2 PHE 22 18.245 -13.907 -20.038 185 HZ PHE 22 HZ PHE 22 17.084 -12.491 -21.684 186 H ILE 23 H ILE 23 17.152 -20.384 -22.511 187 HA ILE 23 HA ILE 23 19.174 -21.970 -23.698 188 HB ILE 23 HB ILE 23 17.012 -22.404 -21.741 189 HG12 ILE 23 HG12 ILE 23 18.904 -23.739 -20.682 190 HG13 ILE 23 HG13 ILE 23 19.910 -23.202 -22.023 191 HG21 ILE 23 HG21 ILE 23 16.362 -24.179 -23.152 192 HG22 ILE 23 HG22 ILE 23 18.034 -24.619 -23.496 193 HG23 ILE 23 HG23 ILE 23 17.359 -24.908 -21.893 194 HD11 ILE 23 HD11 ILE 23 18.628 -21.526 -19.890 195 HD12 ILE 23 HD12 ILE 23 20.346 -21.752 -20.218 196 HD13 ILE 23 HD13 ILE 23 19.343 -20.847 -21.351 197 H VAL 24 H VAL 24 15.737 -21.574 -24.327 198 HA VAL 24 HA VAL 24 15.509 -23.770 -26.128 199 HB VAL 24 HB VAL 24 13.781 -21.349 -25.648 200 HG11 VAL 24 HG11 VAL 24 13.686 -23.335 -27.830 201 HG12 VAL 24 HG12 VAL 24 12.153 -22.977 -27.031 202 HG13 VAL 24 HG13 VAL 24 13.086 -21.677 -27.774 203 HG21 VAL 24 HG21 VAL 24 12.436 -22.725 -24.387 204 HG22 VAL 24 HG22 VAL 24 12.964 -24.187 -25.220 205 HG23 VAL 24 HG23 VAL 24 14.027 -23.408 -24.047 206 H LEU 25 H LEU 25 15.940 -20.274 -26.566 207 HA LEU 25 HA LEU 25 15.783 -20.102 -29.311 208 HB2 LEU 25 HB2 LEU 25 17.485 -18.618 -27.331 209 HB3 LEU 25 HB3 LEU 25 17.485 -18.218 -29.048 210 HG LEU 25 HG LEU 25 15.213 -17.963 -27.088 211 HD11 LEU 25 HD11 LEU 25 16.912 -16.064 -28.660 212 HD12 LEU 25 HD12 LEU 25 16.543 -16.063 -26.936 213 HD13 LEU 25 HD13 LEU 25 15.304 -15.601 -28.103 214 HD21 LEU 25 HD21 LEU 25 15.203 -18.019 -30.077 215 HD22 LEU 25 HD22 LEU 25 14.065 -16.990 -29.207 216 HD23 LEU 25 HD23 LEU 25 14.062 -18.733 -28.937 217 H LEU 26 H LEU 26 18.469 -21.199 -27.323 218 HA LEU 26 HA LEU 26 20.512 -21.236 -29.190 219 HB2 LEU 26 HB2 LEU 26 19.888 -22.683 -26.708 220 HB3 LEU 26 HB3 LEU 26 21.019 -23.499 -27.785 221 HG LEU 26 HG LEU 26 22.221 -22.224 -26.120 222 HD11 LEU 26 HD11 LEU 26 22.592 -22.054 -28.870 223 HD12 LEU 26 HD12 LEU 26 23.782 -21.714 -27.614 224 HD13 LEU 26 HD13 LEU 26 22.806 -20.405 -28.281 225 HD21 LEU 26 HD21 LEU 26 20.855 -20.516 -25.392 226 HD22 LEU 26 HD22 LEU 26 20.418 -20.023 -27.029 227 HD23 LEU 26 HD23 LEU 26 22.018 -19.641 -26.389 228 H ILE 27 H ILE 27 18.352 -23.957 -28.372 229 HA ILE 27 HA ILE 27 19.223 -25.677 -30.395 230 HB ILE 27 HB ILE 27 16.816 -25.522 -28.672 231 HG12 ILE 27 HG12 ILE 27 17.737 -28.150 -28.951 232 HG13 ILE 27 HG13 ILE 27 19.186 -27.154 -29.019 233 HG21 ILE 27 HG21 ILE 27 15.849 -27.506 -29.912 234 HG22 ILE 27 HG22 ILE 27 15.667 -25.935 -30.691 235 HG23 ILE 27 HG23 ILE 27 16.903 -27.060 -31.253 236 HD11 ILE 27 HD11 ILE 27 17.842 -28.010 -26.750 237 HD12 ILE 27 HD12 ILE 27 19.127 -26.804 -26.835 238 HD13 ILE 27 HD13 ILE 27 17.439 -26.299 -26.895 239 H HIS 28 H HIS 28 16.441 -23.456 -30.355 240 HA HIS 28 HA HIS 28 15.359 -23.979 -32.823 241 HB2 HIS 28 HB2 HIS 28 14.268 -22.443 -31.338 242 HB3 HIS 28 HB3 HIS 28 15.641 -21.340 -31.378 243 HD1 HIS 28 HD1 HIS 28 13.705 -22.902 -34.258 244 HD2 HIS 28 HD2 HIS 28 14.716 -19.179 -32.716 245 HE1 HIS 28 HE1 HIS 28 12.810 -21.226 -35.906 246 H PHE 29 H PHE 29 18.277 -22.207 -32.063 247 HA PHE 29 HA PHE 29 18.631 -21.472 -34.874 248 HB2 PHE 29 HB2 PHE 29 19.900 -20.582 -32.307 249 HB3 PHE 29 HB3 PHE 29 20.738 -20.324 -33.833 250 HD1 PHE 29 HD1 PHE 29 19.095 -19.321 -35.729 251 HD2 PHE 29 HD2 PHE 29 18.667 -18.826 -31.523 252 HE1 PHE 29 HE1 PHE 29 17.781 -17.276 -36.107 253 HE2 PHE 29 HE2 PHE 29 17.351 -16.781 -31.894 254 HZ PHE 29 HZ PHE 29 16.906 -16.003 -34.188 255 H GLU 30 H GLU 30 19.670 -23.757 -32.544 256 HA GLU 30 HA GLU 30 22.212 -24.384 -33.638 257 HB2 GLU 30 HB2 GLU 30 22.348 -25.931 -31.987 258 HB3 GLU 30 HB3 GLU 30 20.965 -25.053 -31.348 259 HG2 GLU 30 HG2 GLU 30 20.151 -27.162 -31.216 260 HG3 GLU 30 HG3 GLU 30 19.633 -26.764 -32.853 261 H GLY 31 H GLY 31 19.176 -24.754 -34.917 262 HA2 GLY 31 HA2 GLY 31 19.323 -25.672 -37.260 263 HA3 GLY 31 HA3 GLY 31 19.997 -27.108 -36.503 264 H TRP 32 H TRP 32 17.236 -25.061 -35.592 265 HA TRP 32 HA TRP 32 15.541 -27.467 -35.760 266 HB2 TRP 32 HB2 TRP 32 16.093 -25.988 -33.501 267 HB3 TRP 32 HB3 TRP 32 14.554 -25.317 -34.033 268 HD1 TRP 32 HD1 TRP 32 12.441 -26.638 -33.384 269 HE1 TRP 32 HE1 TRP 32 11.979 -28.947 -32.345 270 HE3 TRP 32 HE3 TRP 32 17.188 -28.534 -33.479 271 HZ2 TRP 32 HZ2 TRP 32 13.435 -31.266 -31.656 272 HZ3 TRP 32 HZ3 TRP 32 17.568 -30.805 -32.611 273 HH2 TRP 32 HH2 TRP 32 15.730 -32.140 -31.718 274 H ARG 33 H ARG 33 16.174 -25.164 -37.674 275 HA ARG 33 HA ARG 33 13.413 -24.229 -38.092 276 HB2 ARG 33 HB2 ARG 33 14.384 -22.404 -39.414 277 HB3 ARG 33 HB3 ARG 33 15.020 -22.419 -37.775 278 HG2 ARG 33 HG2 ARG 33 17.059 -23.504 -38.575 279 HG3 ARG 33 HG3 ARG 33 16.420 -23.482 -40.220 280 HD2 ARG 33 HD2 ARG 33 16.897 -21.034 -38.525 281 HD3 ARG 33 HD3 ARG 33 18.011 -21.639 -39.751 282 HE ARG 33 HE ARG 33 15.591 -21.325 -41.025 283 HH11 ARG 33 HH11 ARG 33 17.822 -19.288 -39.295 284 HH12 ARG 33 HH12 ARG 33 17.420 -17.862 -40.194 285 HH21 ARG 33 HH21 ARG 33 15.053 -19.456 -42.216 286 HH22 ARG 33 HH22 ARG 33 15.844 -17.959 -41.854 287 H ILE 34 H ILE 34 14.193 -26.831 -38.872 288 HA ILE 34 HA ILE 34 14.928 -26.949 -41.610 289 HB ILE 34 HB ILE 34 13.462 -29.000 -39.946 290 HG12 ILE 34 HG12 ILE 34 16.388 -29.008 -40.658 291 HG13 ILE 34 HG13 ILE 34 15.798 -28.189 -39.216 292 HG21 ILE 34 HG21 ILE 34 13.249 -30.168 -41.820 293 HG22 ILE 34 HG22 ILE 34 14.088 -28.917 -42.735 294 HG23 ILE 34 HG23 ILE 34 15.006 -30.209 -41.963 295 HD11 ILE 34 HD11 ILE 34 16.379 -30.231 -38.371 296 HD12 ILE 34 HD12 ILE 34 14.674 -30.495 -38.733 297 HD13 ILE 34 HD13 ILE 34 15.912 -31.094 -39.836 298 H1 MET 101 H MET 101 9.302 11.155 -8.511 299 HA MET 101 HA MET 101 8.875 9.059 -6.640 300 HB2 MET 101 HB2 MET 101 7.063 11.070 -7.954 301 HB3 MET 101 HB3 MET 101 6.432 9.831 -6.877 302 HG2 MET 101 HG2 MET 101 8.029 10.673 -5.136 303 HG3 MET 101 HG3 MET 101 8.376 12.022 -6.216 304 HE1 MET 101 HE1 MET 101 6.501 14.432 -5.977 305 HE2 MET 101 HE2 MET 101 6.653 13.306 -7.326 306 HE3 MET 101 HE3 MET 101 5.057 13.720 -6.697 307 H ASP 102 H ASP 102 9.605 8.320 -9.449 308 HA ASP 102 HA ASP 102 7.708 6.152 -9.707 309 HB2 ASP 102 HB2 ASP 102 8.099 8.135 -11.959 310 HB3 ASP 102 HB3 ASP 102 7.240 6.603 -12.096 311 H SER 103 H SER 103 8.973 4.433 -9.861 312 HA SER 103 HA SER 103 11.581 4.680 -11.174 313 HB2 SER 103 HB2 SER 103 11.839 2.303 -10.127 314 HB3 SER 103 HB3 SER 103 11.918 3.717 -9.076 315 HG SER 103 HG SER 103 10.380 2.739 -8.030 316 H ALA 104 H ALA 104 9.213 4.594 -12.771 317 HA ALA 104 HA ALA 104 8.768 1.980 -13.797 318 HB1 ALA 104 HB1 ALA 104 8.076 3.786 -15.804 319 HB2 ALA 104 HB2 ALA 104 7.010 3.087 -14.585 320 HB3 ALA 104 HB3 ALA 104 7.783 4.644 -14.291 321 HA PRO 105 HA PRO 105 11.598 3.372 -17.452 322 HB2 PRO 105 HB2 PRO 105 12.967 5.698 -17.165 323 HB3 PRO 105 HB3 PRO 105 11.346 5.618 -17.865 324 HG2 PRO 105 HG2 PRO 105 12.174 6.355 -15.084 325 HG3 PRO 105 HG3 PRO 105 10.965 7.121 -16.132 326 HD2 PRO 105 HD2 PRO 105 10.295 5.409 -14.144 327 HD3 PRO 105 HD3 PRO 105 9.359 5.540 -15.647 328 H PHE 106 H PHE 106 12.563 4.013 -14.156 329 HA PHE 106 HA PHE 106 15.354 3.513 -14.582 330 HB2 PHE 106 HB2 PHE 106 14.129 4.835 -12.658 331 HB3 PHE 106 HB3 PHE 106 14.078 3.252 -11.890 332 HD1 PHE 106 HD2 PHE 106 16.247 5.959 -13.063 333 HD2 PHE 106 HD1 PHE 106 16.078 2.196 -11.082 334 HE1 PHE 106 HE2 PHE 106 18.554 6.277 -12.271 335 HE2 PHE 106 HE1 PHE 106 18.385 2.507 -10.286 336 HZ PHE 106 HZ PHE 106 19.627 4.549 -10.882 337 H GLU 107 H GLU 107 12.571 1.625 -13.567 338 HA GLU 107 HA GLU 107 13.900 -0.642 -12.608 339 HB2 GLU 107 HB2 GLU 107 11.202 0.084 -13.333 340 HB3 GLU 107 HB3 GLU 107 11.561 -1.551 -13.870 341 HG2 GLU 107 HG2 GLU 107 12.060 -0.594 -11.067 342 HG3 GLU 107 HG3 GLU 107 10.550 -1.343 -11.584 343 H LEU 108 H LEU 108 12.775 0.148 -15.880 344 HA LEU 108 HA LEU 108 13.438 -2.239 -17.142 345 HB2 LEU 108 HB2 LEU 108 13.093 0.576 -18.008 346 HB3 LEU 108 HB3 LEU 108 13.889 -0.526 -19.130 347 HG LEU 108 HG LEU 108 11.445 -0.243 -19.518 348 HD11 LEU 108 HD11 LEU 108 12.925 -2.726 -19.241 349 HD12 LEU 108 HD12 LEU 108 11.862 -2.178 -20.537 350 HD13 LEU 108 HD13 LEU 108 11.181 -2.957 -19.108 351 HD21 LEU 108 HD21 LEU 108 11.095 -0.260 -16.902 352 HD22 LEU 108 HD22 LEU 108 10.900 -1.992 -17.174 353 HD23 LEU 108 HD23 LEU 108 9.846 -0.844 -18.002 354 H PHE 109 H PHE 109 15.439 0.562 -16.385 355 HA PHE 109 HA PHE 109 17.700 0.035 -17.859 356 HB2 PHE 109 HB2 PHE 109 17.312 2.026 -16.378 357 HB3 PHE 109 HB3 PHE 109 17.715 1.009 -14.997 358 HD1 PHE 109 HD2 PHE 109 20.014 0.007 -14.861 359 HD2 PHE 109 HD1 PHE 109 18.983 3.023 -17.682 360 HE1 PHE 109 HE2 PHE 109 22.399 0.517 -15.182 361 HE2 PHE 109 HE1 PHE 109 21.367 3.537 -18.008 362 HZ PHE 109 HZ PHE 109 23.079 2.284 -16.756 363 H PHE 110 H PHE 110 16.741 -1.367 -14.757 364 HA PHE 110 HA PHE 110 19.132 -2.937 -14.511 365 HB2 PHE 110 HB2 PHE 110 18.045 -2.282 -12.481 366 HB3 PHE 110 HB3 PHE 110 16.508 -2.951 -13.017 367 HD1 PHE 110 HD1 PHE 110 16.095 -5.335 -12.950 368 HD2 PHE 110 HD2 PHE 110 19.800 -3.704 -11.634 369 HE1 PHE 110 HE1 PHE 110 16.635 -7.465 -11.842 370 HE2 PHE 110 HE2 PHE 110 20.347 -5.831 -10.525 371 HZ PHE 110 HZ PHE 110 18.764 -7.715 -10.629 372 H MET 111 H MET 111 16.011 -3.338 -15.956 373 HA MET 111 HA MET 111 16.047 -6.190 -16.074 374 HB2 MET 111 HB2 MET 111 14.380 -4.015 -17.227 375 HB3 MET 111 HB3 MET 111 14.341 -5.575 -18.037 376 HG2 MET 111 HG2 MET 111 13.497 -6.663 -16.132 377 HG3 MET 111 HG3 MET 111 13.873 -5.293 -15.089 378 HE1 MET 111 HE1 MET 111 10.824 -3.334 -14.921 379 HE2 MET 111 HE2 MET 111 11.313 -4.774 -14.029 380 HE3 MET 111 HE3 MET 111 12.518 -3.571 -14.491 381 H ILE 112 H ILE 112 17.458 -3.661 -17.945 382 HA ILE 112 HA ILE 112 17.870 -5.277 -20.303 383 HB ILE 112 HB ILE 112 18.898 -2.552 -19.518 384 HG12 ILE 112 HG12 ILE 112 17.333 -2.695 -21.933 385 HG13 ILE 112 HG13 ILE 112 16.456 -3.448 -20.606 386 HG21 ILE 112 HG21 ILE 112 19.472 -2.555 -22.076 387 HG22 ILE 112 HG22 ILE 112 20.606 -3.216 -20.899 388 HG23 ILE 112 HG23 ILE 112 19.575 -4.299 -21.834 389 HD11 ILE 112 HD11 ILE 112 15.755 -1.329 -20.303 390 HD12 ILE 112 HD12 ILE 112 17.251 -1.221 -19.376 391 HD13 ILE 112 HD13 ILE 112 17.197 -0.627 -21.035 392 H ASN 113 H ASN 113 20.038 -3.768 -17.901 393 HA ASN 113 HA ASN 113 22.419 -4.891 -18.722 394 HB2 ASN 113 HB2 ASN 113 22.009 -3.157 -16.882 395 HB3 ASN 113 HB3 ASN 113 21.726 -4.526 -15.811 396 HD21 ASN 113 HD21 ASN 113 24.073 -3.868 -18.389 397 HD22 ASN 113 HD22 ASN 113 25.473 -4.190 -17.428 398 H THR 114 H THR 114 20.101 -6.208 -16.368 399 HA THR 114 HA THR 114 21.524 -8.565 -15.797 400 HB THR 114 HB THR 114 19.633 -7.694 -14.425 401 HG1 THR 114 HG1 THR 114 19.069 -9.720 -13.796 402 HG21 THR 114 HG21 THR 114 17.758 -9.030 -16.343 403 HG22 THR 114 HG22 THR 114 18.200 -7.337 -16.562 404 HG23 THR 114 HG23 THR 114 17.408 -7.856 -15.075 405 H SER 115 H SER 115 19.615 -7.643 -18.509 406 HA SER 115 HA SER 115 18.898 -10.248 -19.403 407 HB2 SER 115 HB2 SER 115 18.022 -7.835 -20.095 408 HB3 SER 115 HB3 SER 115 19.246 -8.014 -21.352 409 HG SER 115 HG SER 115 16.872 -9.413 -20.959 410 H ILE 116 H ILE 116 21.242 -7.946 -20.797 411 HA ILE 116 HA ILE 116 22.495 -9.704 -22.527 412 HB ILE 116 HB ILE 116 23.795 -7.408 -21.056 413 HG12 ILE 116 HG12 ILE 116 23.241 -6.551 -23.605 414 HG13 ILE 116 HG13 ILE 116 21.835 -7.546 -23.240 415 HG21 ILE 116 HG21 ILE 116 25.024 -7.478 -23.435 416 HG22 ILE 116 HG22 ILE 116 25.617 -8.341 -22.017 417 HG23 ILE 116 HG23 ILE 116 24.673 -9.195 -23.237 418 HD11 ILE 116 HD11 ILE 116 20.970 -5.914 -22.033 419 HD12 ILE 116 HD12 ILE 116 22.399 -5.881 -20.999 420 HD13 ILE 116 HD13 ILE 116 22.344 -4.895 -22.460 421 H LEU 117 H LEU 117 22.811 -9.405 -19.089 422 HA LEU 117 HA LEU 117 25.268 -10.922 -18.951 423 HB2 LEU 117 HB2 LEU 117 23.789 -9.240 -17.216 424 HB3 LEU 117 HB3 LEU 117 23.919 -10.818 -16.442 425 HG LEU 117 HG LEU 117 26.273 -9.225 -17.452 426 HD11 LEU 117 HD11 LEU 117 25.750 -7.900 -15.701 427 HD12 LEU 117 HD12 LEU 117 26.533 -9.187 -14.784 428 HD13 LEU 117 HD13 LEU 117 24.775 -9.139 -14.911 429 HD21 LEU 117 HD21 LEU 117 26.027 -11.920 -16.782 430 HD22 LEU 117 HD22 LEU 117 26.767 -11.161 -15.373 431 HD23 LEU 117 HD23 LEU 117 27.520 -10.997 -16.960 432 H LEU 118 H LEU 118 21.955 -11.450 -17.730 433 HA LEU 118 HA LEU 118 22.203 -14.067 -16.927 434 HB2 LEU 118 HB2 LEU 118 19.913 -12.505 -18.049 435 HB3 LEU 118 HB3 LEU 118 19.718 -14.216 -17.676 436 HG LEU 118 HG LEU 118 20.271 -11.950 -15.778 437 HD11 LEU 118 HD11 LEU 118 18.268 -13.326 -14.699 438 HD12 LEU 118 HD12 LEU 118 18.003 -13.753 -16.389 439 HD13 LEU 118 HD13 LEU 118 18.009 -12.059 -15.899 440 HD21 LEU 118 HD21 LEU 118 21.572 -13.389 -14.651 441 HD22 LEU 118 HD22 LEU 118 20.985 -14.785 -15.555 442 HD23 LEU 118 HD23 LEU 118 20.047 -14.153 -14.200 443 H ILE 119 H ILE 119 21.660 -12.823 -20.179 444 HA ILE 119 HA ILE 119 21.080 -15.225 -21.480 445 HB ILE 119 HB ILE 119 22.519 -12.790 -22.537 446 HG12 ILE 119 HG12 ILE 119 19.696 -13.533 -23.187 447 HG13 ILE 119 HG13 ILE 119 20.038 -12.782 -21.632 448 HG21 ILE 119 HG21 ILE 119 23.028 -14.681 -23.944 449 HG22 ILE 119 HG22 ILE 119 21.325 -15.130 -24.014 450 HG23 ILE 119 HG23 ILE 119 21.874 -13.635 -24.770 451 HD11 ILE 119 HD11 ILE 119 19.813 -11.588 -24.231 452 HD12 ILE 119 HD12 ILE 119 19.904 -10.822 -22.645 453 HD13 ILE 119 HD13 ILE 119 21.383 -11.227 -23.515 454 H PHE 120 H PHE 120 24.224 -13.537 -21.565 455 HA PHE 120 HA PHE 120 25.669 -15.709 -22.577 456 HB2 PHE 120 HB2 PHE 120 26.414 -13.306 -22.540 457 HB3 PHE 120 HB3 PHE 120 26.777 -13.508 -20.829 458 HD1 PHE 120 HD2 PHE 120 27.608 -14.816 -24.198 459 HD2 PHE 120 HD1 PHE 120 28.828 -14.371 -20.145 460 HE1 PHE 120 HE2 PHE 120 29.841 -15.671 -24.780 461 HE2 PHE 120 HE1 PHE 120 31.063 -15.225 -20.720 462 HZ PHE 120 HZ PHE 120 31.571 -15.877 -23.040 463 H ILE 121 H ILE 121 24.660 -14.936 -19.352 464 HA ILE 121 HA ILE 121 26.515 -16.569 -17.956 465 HB ILE 121 HB ILE 121 23.967 -15.203 -17.273 466 HG12 ILE 121 HG12 ILE 121 26.560 -15.410 -15.739 467 HG13 ILE 121 HG13 ILE 121 26.307 -14.243 -17.032 468 HG21 ILE 121 HG21 ILE 121 24.048 -16.308 -15.000 469 HG22 ILE 121 HG22 ILE 121 23.442 -17.301 -16.324 470 HG23 ILE 121 HG23 ILE 121 25.087 -17.530 -15.733 471 HD11 ILE 121 HD11 ILE 121 25.952 -13.222 -14.871 472 HD12 ILE 121 HD12 ILE 121 24.440 -13.279 -15.776 473 HD13 ILE 121 HD13 ILE 121 24.733 -14.433 -14.475 474 H PHE 122 H PHE 122 23.145 -17.096 -18.970 475 HA PHE 122 HA PHE 122 23.121 -19.813 -18.062 476 HB2 PHE 122 HB2 PHE 122 21.212 -18.369 -19.913 477 HB3 PHE 122 HB3 PHE 122 20.922 -19.932 -19.156 478 HD1 PHE 122 HD1 PHE 122 21.991 -19.364 -16.431 479 HD2 PHE 122 HD2 PHE 122 19.511 -17.055 -19.007 480 HE1 PHE 122 HE1 PHE 122 21.016 -18.235 -14.475 481 HE2 PHE 122 HE2 PHE 122 18.533 -15.922 -17.055 482 HZ PHE 122 HZ PHE 122 19.285 -16.510 -14.785 483 H ILE 123 H ILE 123 23.768 -18.178 -21.085 484 HA ILE 123 HA ILE 123 23.624 -20.447 -22.773 485 HB ILE 123 HB ILE 123 24.644 -17.685 -23.016 486 HG12 ILE 123 HG12 ILE 123 23.485 -18.042 -25.294 487 HG13 ILE 123 HG13 ILE 123 22.931 -19.571 -24.620 488 HG21 ILE 123 HG21 ILE 123 26.623 -18.722 -23.774 489 HG22 ILE 123 HG22 ILE 123 25.728 -19.955 -24.660 490 HG23 ILE 123 HG23 ILE 123 25.724 -18.285 -25.226 491 HD11 ILE 123 HD11 ILE 123 22.333 -16.809 -23.598 492 HD12 ILE 123 HD12 ILE 123 21.210 -17.949 -24.340 493 HD13 ILE 123 HD13 ILE 123 21.900 -18.296 -22.754 494 H VAL 124 H VAL 124 26.222 -18.996 -20.890 495 HA VAL 124 HA VAL 124 28.305 -20.613 -21.965 496 HB VAL 124 HB VAL 124 28.092 -18.934 -19.477 497 HG11 VAL 124 HG11 VAL 124 30.132 -20.954 -20.196 498 HG12 VAL 124 HG12 VAL 124 30.717 -19.408 -19.577 499 HG13 VAL 124 HG13 VAL 124 29.608 -20.383 -18.612 500 HG21 VAL 124 HG21 VAL 124 29.327 -17.365 -20.611 501 HG22 VAL 124 HG22 VAL 124 30.084 -18.560 -21.664 502 HG23 VAL 124 HG23 VAL 124 28.410 -18.078 -21.938 503 H LEU 125 H LEU 125 26.295 -20.818 -19.052 504 HA LEU 125 HA LEU 125 27.502 -22.965 -17.794 505 HB2 LEU 125 HB2 LEU 125 24.650 -22.050 -17.927 506 HB3 LEU 125 HB3 LEU 125 25.110 -23.472 -16.992 507 HG LEU 125 HG LEU 125 25.942 -20.615 -16.531 508 HD11 LEU 125 HD11 LEU 125 24.247 -22.607 -15.068 509 HD12 LEU 125 HD12 LEU 125 23.853 -20.959 -15.557 510 HD13 LEU 125 HD13 LEU 125 24.988 -21.239 -14.236 511 HD21 LEU 125 HD21 LEU 125 27.106 -23.175 -15.523 512 HD22 LEU 125 HD22 LEU 125 27.083 -21.749 -14.485 513 HD23 LEU 125 HD23 LEU 125 27.920 -21.697 -16.037 514 H LEU 126 H LEU 126 25.255 -22.941 -20.498 515 HA LEU 126 HA LEU 126 24.543 -25.614 -20.604 516 HB2 LEU 126 HB2 LEU 126 24.708 -23.389 -22.512 517 HB3 LEU 126 HB3 LEU 126 24.782 -24.992 -23.241 518 HG LEU 126 HG LEU 126 22.511 -24.190 -23.275 519 HD11 LEU 126 HD11 LEU 126 23.335 -26.615 -22.196 520 HD12 LEU 126 HD12 LEU 126 21.744 -26.230 -22.852 521 HD13 LEU 126 HD13 LEU 126 22.050 -26.059 -21.123 522 HD21 LEU 126 HD21 LEU 126 22.284 -22.610 -21.609 523 HD22 LEU 126 HD22 LEU 126 23.035 -23.635 -20.385 524 HD23 LEU 126 HD23 LEU 126 21.393 -23.974 -20.934 525 H ILE 127 H ILE 127 27.246 -24.064 -22.344 526 HA ILE 127 HA ILE 127 28.348 -26.422 -23.375 527 HB ILE 127 HB ILE 127 29.326 -23.654 -22.968 528 HG12 ILE 127 HG12 ILE 127 30.148 -24.721 -25.427 529 HG13 ILE 127 HG13 ILE 127 28.568 -25.434 -25.122 530 HG21 ILE 127 HG21 ILE 127 31.607 -24.382 -23.795 531 HG22 ILE 127 HG22 ILE 127 31.238 -24.731 -22.107 532 HG23 ILE 127 HG23 ILE 127 31.152 -26.016 -23.312 533 HD11 ILE 127 HD11 ILE 127 29.108 -22.928 -26.186 534 HD12 ILE 127 HD12 ILE 127 27.545 -23.544 -25.647 535 HD13 ILE 127 HD13 ILE 127 28.556 -22.615 -24.541 536 H HIS 128 H HIS 128 29.212 -24.594 -20.445 537 HA HIS 128 HA HIS 128 31.320 -26.105 -19.536 538 HB2 HIS 128 HB2 HIS 128 30.718 -24.088 -18.390 539 HB3 HIS 128 HB3 HIS 128 29.131 -24.728 -17.976 540 HD1 HIS 128 HD1 HIS 128 32.588 -26.228 -17.437 541 HD2 HIS 128 HD2 HIS 128 29.213 -25.090 -15.299 542 HE1 HIS 128 HE1 HIS 128 33.041 -26.901 -15.057 543 H PHE 129 H PHE 129 27.917 -26.872 -19.496 544 HA PHE 129 HA PHE 129 28.416 -29.285 -17.913 545 HB2 PHE 129 HB2 PHE 129 25.952 -27.754 -18.664 546 HB3 PHE 129 HB3 PHE 129 25.817 -29.446 -18.196 547 HD1 PHE 129 HD1 PHE 129 27.278 -29.989 -15.982 548 HD2 PHE 129 HD2 PHE 129 25.578 -26.224 -17.010 549 HE1 PHE 129 HE1 PHE 129 27.299 -29.335 -13.610 550 HE2 PHE 129 HE2 PHE 129 25.598 -25.564 -14.640 551 HZ PHE 129 HZ PHE 129 26.460 -27.120 -12.936 552 H GLU 130 H GLU 130 27.887 -28.229 -21.136 553 HA GLU 130 HA GLU 130 26.823 -30.629 -22.214 554 HB2 GLU 130 HB2 GLU 130 26.870 -29.555 -24.217 555 HB3 GLU 130 HB3 GLU 130 27.087 -28.147 -23.186 556 HG2 GLU 130 HG2 GLU 130 28.759 -27.794 -24.679 557 HG3 GLU 130 HG3 GLU 130 29.632 -28.742 -23.476 558 H GLY 131 H GLY 131 29.787 -30.018 -20.861 559 HA2 GLY 131 HA2 GLY 131 31.161 -32.131 -20.787 560 HA3 GLY 131 HA3 GLY 131 31.112 -32.054 -22.542 561 H TRP 132 H TRP 132 31.643 -29.505 -20.124 562 HA TRP 132 HA TRP 132 34.268 -29.016 -21.373 563 HB2 TRP 132 HB2 TRP 132 32.090 -27.284 -21.295 564 HB3 TRP 132 HB3 TRP 132 33.143 -26.707 -20.006 565 HD1 TRP 132 HD1 TRP 132 35.120 -25.219 -20.719 566 HE1 TRP 132 HE1 TRP 132 36.178 -24.542 -22.966 567 HE3 TRP 132 HE3 TRP 132 32.526 -28.353 -23.815 568 HZ2 TRP 132 HZ2 TRP 132 35.943 -25.243 -25.690 569 HZ3 TRP 132 HZ3 TRP 132 33.002 -28.287 -26.228 570 HH2 TRP 132 HH2 TRP 132 34.675 -26.763 -27.144 571 H ARG 133 H ARG 133 33.293 -30.557 -18.911 572 HA ARG 133 HA ARG 133 34.923 -29.158 -16.898 573 HB2 ARG 133 HB2 ARG 133 33.744 -30.524 -15.223 574 HB3 ARG 133 HB3 ARG 133 32.631 -29.552 -16.177 575 HG2 ARG 133 HG2 ARG 133 32.075 -31.508 -17.529 576 HG3 ARG 133 HG3 ARG 133 33.194 -32.483 -16.574 577 HD2 ARG 133 HD2 ARG 133 30.804 -31.021 -15.460 578 HD3 ARG 133 HD3 ARG 133 30.823 -32.731 -15.887 579 HE ARG 133 HE ARG 133 32.926 -32.371 -14.148 580 HH11 ARG 133 HH11 ARG 133 29.475 -31.913 -14.072 581 HH12 ARG 133 HH12 ARG 133 29.341 -32.215 -12.371 582 HH21 ARG 133 HH21 ARG 133 32.762 -32.771 -11.908 583 HH22 ARG 133 HH22 ARG 133 31.212 -32.702 -11.141 584 H ILE 134 H ILE 134 36.182 -30.597 -18.955 585 HA ILE 134 HA ILE 134 36.818 -33.254 -18.268 586 HB ILE 134 HB ILE 134 38.494 -31.267 -19.807 587 HG12 ILE 134 HG12 ILE 134 36.731 -33.422 -20.956 588 HG13 ILE 134 HG13 ILE 134 36.110 -31.811 -20.616 589 HG21 ILE 134 HG21 ILE 134 40.056 -32.841 -19.862 590 HG22 ILE 134 HG22 ILE 134 39.030 -33.938 -18.938 591 HG23 ILE 134 HG23 ILE 134 38.920 -33.900 -20.698 592 HD11 ILE 134 HD11 ILE 134 36.676 -31.623 -22.823 593 HD12 ILE 134 HD12 ILE 134 38.155 -31.050 -22.050 594 HD13 ILE 134 HD13 ILE 134 38.067 -32.697 -22.672
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